USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 967 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 NoAdj-H: A 52 HIS HE2 : A 52 HIS NE2 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 58 HIS HD1 : A 58 HIS ND1 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 113 HIS HE2 : A 113 HIS NE2 : A 130 ZNZN :(H bumps) USER MOD NoAdj-H: A 119 HIS HD1 : A 119 HIS ND1 : A 130 ZNZN :(H bumps) USER MOD Set 1.1: A 47 SER OG : rot 180:sc= 0.296 USER MOD Set 1.2: A 48 GLN : amide:sc= 0.295 X(o=0.59,f=0.47) USER MOD Single : A 7 ASN : amide:sc= 0.405 X(o=0.41,f=-0.041) USER MOD Single : A 17 LYS NZ :NH3+ 161:sc= 1.27 (180deg=0.884) USER MOD Single : A 21 ASN : amide:sc= 1.54 K(o=1.5,f=-7!) USER MOD Single : A 22 SER OG : rot 74:sc= 0.357 USER MOD Single : A 27 ASN : amide:sc= 0.689 K(o=0.69,f=-0.035) USER MOD Single : A 28 SER OG : rot -12:sc= 0.767 USER MOD Single : A 29 HIS : no HD1:sc= 0.287 K(o=0.29,f=-2.5!) USER MOD Single : A 32 SER OG : rot -47:sc= 0.896 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 37 LYS NZ :NH3+ 176:sc= 0.875 (180deg=0.864) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 14:sc= 0.386 USER MOD Single : A 49 LYS NZ :NH3+ -138:sc= 2.5 (180deg=1.24) USER MOD Single : A 53 TYR OH : rot -164:sc= 1.13 USER MOD Single : A 54 GLN : amide:sc= 1.52 K(o=1.5,f=-3.9!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 164:sc= 1.23 (180deg=1.2) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ -171:sc= 1.23 (180deg=1.17) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= 0.863 K(o=0.86,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot -82:sc= 0.604 USER MOD Single : A 94 SER OG : rot -97:sc= 1.29 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0.407 X(o=0.41,f=-0.057) USER MOD Single : A 102 MET CE :methyl -158:sc= -0.0022 (180deg=-0.0286) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0.00202 USER MOD Single : A 106 SER OG : rot 30:sc= 0.469 USER MOD Single : A 112 SER OG : rot -42:sc= 0.352 USER MOD Single : A 114 TYR OH : rot 177:sc= 1.11 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00169 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0.878 K(o=0.88,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.465 X(o=-0.46,f=-0.76) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -2.514 21.542 1.617 1.00 1.00 N ATOM 2 CA ALA A 2 -3.170 21.861 0.341 1.00 1.00 C ATOM 3 C ALA A 2 -2.542 21.206 -0.912 1.00 1.00 C ATOM 4 O ALA A 2 -3.231 20.993 -1.909 1.00 1.00 O ATOM 5 CB ALA A 2 -3.220 23.388 0.202 1.00 1.00 C ATOM 0 HA ALA A 2 -4.170 21.428 0.380 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -3.703 23.652 -0.739 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -3.786 23.811 1.032 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -2.206 23.788 0.214 1.00 1.00 H new ATOM 11 N ASP A 3 -1.254 20.853 -0.868 1.00 1.00 N ATOM 12 CA ASP A 3 -0.528 20.166 -1.947 1.00 1.00 C ATOM 13 C ASP A 3 -0.836 18.650 -2.040 1.00 1.00 C ATOM 14 O ASP A 3 -0.443 17.995 -3.008 1.00 1.00 O ATOM 15 CB ASP A 3 0.978 20.421 -1.777 1.00 1.00 C ATOM 16 CG ASP A 3 1.562 19.795 -0.497 1.00 1.00 C ATOM 17 OD1 ASP A 3 1.194 20.242 0.616 1.00 1.00 O ATOM 18 OD2 ASP A 3 2.416 18.884 -0.607 1.00 1.00 O ATOM 0 H ASP A 3 -0.667 21.042 -0.056 1.00 1.00 H new ATOM 0 HA ASP A 3 -0.875 20.582 -2.893 1.00 1.00 H new ATOM 0 HB2 ASP A 3 1.507 20.021 -2.642 1.00 1.00 H new ATOM 0 HB3 ASP A 3 1.158 21.496 -1.762 1.00 1.00 H new ATOM 23 N GLU A 4 -1.545 18.087 -1.055 1.00 1.00 N ATOM 24 CA GLU A 4 -1.946 16.671 -0.965 1.00 1.00 C ATOM 25 C GLU A 4 -3.364 16.484 -0.368 1.00 1.00 C ATOM 26 O GLU A 4 -3.696 15.430 0.181 1.00 1.00 O ATOM 27 CB GLU A 4 -0.860 15.864 -0.222 1.00 1.00 C ATOM 28 CG GLU A 4 -0.592 16.318 1.220 1.00 1.00 C ATOM 29 CD GLU A 4 0.443 15.396 1.893 1.00 1.00 C ATOM 30 OE1 GLU A 4 1.662 15.525 1.625 1.00 1.00 O ATOM 31 OE2 GLU A 4 0.035 14.534 2.708 1.00 1.00 O ATOM 0 H GLU A 4 -1.873 18.631 -0.257 1.00 1.00 H new ATOM 0 HA GLU A 4 -2.022 16.273 -1.977 1.00 1.00 H new ATOM 0 HB2 GLU A 4 -1.153 14.814 -0.209 1.00 1.00 H new ATOM 0 HB3 GLU A 4 0.070 15.928 -0.787 1.00 1.00 H new ATOM 0 HG2 GLU A 4 -0.228 17.345 1.222 1.00 1.00 H new ATOM 0 HG3 GLU A 4 -1.521 16.308 1.789 1.00 1.00 H new ATOM 38 N PHE A 5 -4.208 17.516 -0.478 1.00 1.00 N ATOM 39 CA PHE A 5 -5.594 17.573 0.010 1.00 1.00 C ATOM 40 C PHE A 5 -6.474 18.439 -0.926 1.00 1.00 C ATOM 41 O PHE A 5 -5.988 18.960 -1.934 1.00 1.00 O ATOM 42 CB PHE A 5 -5.568 18.090 1.463 1.00 1.00 C ATOM 43 CG PHE A 5 -6.880 18.028 2.226 1.00 1.00 C ATOM 44 CD1 PHE A 5 -7.620 16.830 2.282 1.00 1.00 C ATOM 45 CD2 PHE A 5 -7.364 19.174 2.887 1.00 1.00 C ATOM 46 CE1 PHE A 5 -8.839 16.783 2.980 1.00 1.00 C ATOM 47 CE2 PHE A 5 -8.580 19.125 3.593 1.00 1.00 C ATOM 48 CZ PHE A 5 -9.319 17.930 3.637 1.00 1.00 C ATOM 0 H PHE A 5 -3.928 18.384 -0.935 1.00 1.00 H new ATOM 0 HA PHE A 5 -6.048 16.582 0.003 1.00 1.00 H new ATOM 0 HB2 PHE A 5 -4.824 17.517 2.016 1.00 1.00 H new ATOM 0 HB3 PHE A 5 -5.228 19.126 1.451 1.00 1.00 H new ATOM 0 HD1 PHE A 5 -7.249 15.945 1.787 1.00 1.00 H new ATOM 0 HD2 PHE A 5 -6.799 20.094 2.852 1.00 1.00 H new ATOM 0 HE1 PHE A 5 -9.408 15.865 3.012 1.00 1.00 H new ATOM 0 HE2 PHE A 5 -8.946 20.005 4.101 1.00 1.00 H new ATOM 0 HZ PHE A 5 -10.255 17.893 4.175 1.00 1.00 H new ATOM 58 N GLY A 6 -7.768 18.597 -0.625 1.00 1.00 N ATOM 59 CA GLY A 6 -8.711 19.368 -1.446 1.00 1.00 C ATOM 60 C GLY A 6 -10.033 19.714 -0.751 1.00 1.00 C ATOM 61 O GLY A 6 -10.180 19.553 0.463 1.00 1.00 O ATOM 0 H GLY A 6 -8.196 18.188 0.206 1.00 1.00 H new ATOM 0 HA2 GLY A 6 -8.227 20.294 -1.758 1.00 1.00 H new ATOM 0 HA3 GLY A 6 -8.930 18.802 -2.352 1.00 1.00 H new ATOM 65 N ASN A 7 -10.996 20.214 -1.534 1.00 1.00 N ATOM 66 CA ASN A 7 -12.334 20.614 -1.078 1.00 1.00 C ATOM 67 C ASN A 7 -13.152 19.475 -0.429 1.00 1.00 C ATOM 68 O ASN A 7 -12.868 18.285 -0.606 1.00 1.00 O ATOM 69 CB ASN A 7 -13.100 21.242 -2.261 1.00 1.00 C ATOM 70 CG ASN A 7 -13.327 20.282 -3.423 1.00 1.00 C ATOM 71 OD1 ASN A 7 -12.557 20.242 -4.373 1.00 1.00 O ATOM 72 ND2 ASN A 7 -14.362 19.471 -3.397 1.00 1.00 N ATOM 0 H ASN A 7 -10.862 20.356 -2.535 1.00 1.00 H new ATOM 0 HA ASN A 7 -12.194 21.344 -0.281 1.00 1.00 H new ATOM 0 HB2 ASN A 7 -14.065 21.604 -1.906 1.00 1.00 H new ATOM 0 HB3 ASN A 7 -12.547 22.110 -2.621 1.00 1.00 H new ATOM 0 HD21 ASN A 7 -14.517 18.817 -4.164 1.00 1.00 H new ATOM 0 HD22 ASN A 7 -15.010 19.496 -2.610 1.00 1.00 H new ATOM 79 N GLY A 8 -14.213 19.856 0.290 1.00 1.00 N ATOM 80 CA GLY A 8 -15.148 18.930 0.939 1.00 1.00 C ATOM 81 C GLY A 8 -16.094 18.215 -0.039 1.00 1.00 C ATOM 82 O GLY A 8 -16.158 18.532 -1.231 1.00 1.00 O ATOM 0 H GLY A 8 -14.451 20.836 0.440 1.00 1.00 H new ATOM 0 HA2 GLY A 8 -14.579 18.182 1.492 1.00 1.00 H new ATOM 0 HA3 GLY A 8 -15.743 19.481 1.668 1.00 1.00 H new ATOM 86 N ASP A 9 -16.843 17.254 0.496 1.00 1.00 N ATOM 87 CA ASP A 9 -17.836 16.411 -0.192 1.00 1.00 C ATOM 88 C ASP A 9 -18.926 15.979 0.822 1.00 1.00 C ATOM 89 O ASP A 9 -18.855 16.338 2.002 1.00 1.00 O ATOM 90 CB ASP A 9 -17.093 15.205 -0.813 1.00 1.00 C ATOM 91 CG ASP A 9 -17.917 14.351 -1.798 1.00 1.00 C ATOM 92 OD1 ASP A 9 -18.999 14.794 -2.253 1.00 1.00 O ATOM 93 OD2 ASP A 9 -17.472 13.224 -2.126 1.00 1.00 O ATOM 0 H ASP A 9 -16.773 17.023 1.487 1.00 1.00 H new ATOM 0 HA ASP A 9 -18.339 16.952 -0.993 1.00 1.00 H new ATOM 0 HB2 ASP A 9 -16.208 15.574 -1.332 1.00 1.00 H new ATOM 0 HB3 ASP A 9 -16.744 14.561 -0.006 1.00 1.00 H new ATOM 98 N ALA A 10 -19.929 15.202 0.404 1.00 1.00 N ATOM 99 CA ALA A 10 -20.987 14.685 1.282 1.00 1.00 C ATOM 100 C ALA A 10 -20.424 13.916 2.503 1.00 1.00 C ATOM 101 O ALA A 10 -19.287 13.427 2.481 1.00 1.00 O ATOM 102 CB ALA A 10 -21.927 13.811 0.444 1.00 1.00 C ATOM 0 H ALA A 10 -20.032 14.909 -0.568 1.00 1.00 H new ATOM 0 HA ALA A 10 -21.540 15.525 1.701 1.00 1.00 H new ATOM 0 HB1 ALA A 10 -22.720 13.417 1.079 1.00 1.00 H new ATOM 0 HB2 ALA A 10 -22.365 14.410 -0.355 1.00 1.00 H new ATOM 0 HB3 ALA A 10 -21.365 12.984 0.011 1.00 1.00 H new ATOM 108 N LEU A 11 -21.209 13.807 3.583 1.00 1.00 N ATOM 109 CA LEU A 11 -20.809 13.110 4.812 1.00 1.00 C ATOM 110 C LEU A 11 -20.818 11.582 4.602 1.00 1.00 C ATOM 111 O LEU A 11 -21.831 10.901 4.767 1.00 1.00 O ATOM 112 CB LEU A 11 -21.659 13.593 6.006 1.00 1.00 C ATOM 113 CG LEU A 11 -20.963 13.427 7.376 1.00 1.00 C ATOM 114 CD1 LEU A 11 -21.829 14.059 8.467 1.00 1.00 C ATOM 115 CD2 LEU A 11 -20.699 11.974 7.777 1.00 1.00 C ATOM 0 H LEU A 11 -22.148 14.204 3.628 1.00 1.00 H new ATOM 0 HA LEU A 11 -19.778 13.362 5.060 1.00 1.00 H new ATOM 0 HB2 LEU A 11 -21.908 14.644 5.861 1.00 1.00 H new ATOM 0 HB3 LEU A 11 -22.599 13.041 6.017 1.00 1.00 H new ATOM 0 HG LEU A 11 -19.996 13.919 7.274 1.00 1.00 H new ATOM 0 HD11 LEU A 11 -21.339 13.942 9.434 1.00 1.00 H new ATOM 0 HD12 LEU A 11 -21.965 15.119 8.255 1.00 1.00 H new ATOM 0 HD13 LEU A 11 -22.801 13.566 8.491 1.00 1.00 H new ATOM 0 HD21 LEU A 11 -20.209 11.948 8.750 1.00 1.00 H new ATOM 0 HD22 LEU A 11 -21.644 11.434 7.833 1.00 1.00 H new ATOM 0 HD23 LEU A 11 -20.056 11.503 7.034 1.00 1.00 H new ATOM 127 N ASP A 12 -19.653 11.062 4.221 1.00 1.00 N ATOM 128 CA ASP A 12 -19.356 9.650 3.950 1.00 1.00 C ATOM 129 C ASP A 12 -18.090 9.259 4.740 1.00 1.00 C ATOM 130 O ASP A 12 -17.062 8.852 4.194 1.00 1.00 O ATOM 131 CB ASP A 12 -19.247 9.438 2.429 1.00 1.00 C ATOM 132 CG ASP A 12 -19.051 7.960 2.042 1.00 1.00 C ATOM 133 OD1 ASP A 12 -19.665 7.070 2.680 1.00 1.00 O ATOM 134 OD2 ASP A 12 -18.321 7.683 1.059 1.00 1.00 O ATOM 0 H ASP A 12 -18.833 11.653 4.083 1.00 1.00 H new ATOM 0 HA ASP A 12 -20.154 8.989 4.287 1.00 1.00 H new ATOM 0 HB2 ASP A 12 -20.149 9.817 1.949 1.00 1.00 H new ATOM 0 HB3 ASP A 12 -18.411 10.023 2.045 1.00 1.00 H new ATOM 139 N LEU A 13 -18.171 9.477 6.057 1.00 1.00 N ATOM 140 CA LEU A 13 -17.104 9.315 7.050 1.00 1.00 C ATOM 141 C LEU A 13 -17.599 8.495 8.260 1.00 1.00 C ATOM 142 O LEU A 13 -18.794 8.556 8.578 1.00 1.00 O ATOM 143 CB LEU A 13 -16.706 10.723 7.558 1.00 1.00 C ATOM 144 CG LEU A 13 -16.262 11.752 6.503 1.00 1.00 C ATOM 145 CD1 LEU A 13 -16.117 13.128 7.154 1.00 1.00 C ATOM 146 CD2 LEU A 13 -14.928 11.373 5.869 1.00 1.00 C ATOM 0 H LEU A 13 -19.041 9.792 6.486 1.00 1.00 H new ATOM 0 HA LEU A 13 -16.264 8.797 6.588 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -17.555 11.139 8.099 1.00 1.00 H new ATOM 0 HB3 LEU A 13 -15.896 10.606 8.278 1.00 1.00 H new ATOM 0 HG LEU A 13 -17.025 11.771 5.724 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -15.803 13.854 6.404 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -17.074 13.434 7.576 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -15.370 13.079 7.947 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -14.650 12.124 5.130 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -14.160 11.321 6.641 1.00 1.00 H new ATOM 0 HD23 LEU A 13 -15.019 10.402 5.382 1.00 1.00 H new ATOM 158 N PRO A 14 -16.716 7.771 8.976 1.00 1.00 N ATOM 159 CA PRO A 14 -17.097 7.070 10.202 1.00 1.00 C ATOM 160 C PRO A 14 -17.399 8.093 11.317 1.00 1.00 C ATOM 161 O PRO A 14 -16.889 9.217 11.296 1.00 1.00 O ATOM 162 CB PRO A 14 -15.902 6.170 10.541 1.00 1.00 C ATOM 163 CG PRO A 14 -14.714 6.923 9.954 1.00 1.00 C ATOM 164 CD PRO A 14 -15.290 7.616 8.719 1.00 1.00 C ATOM 0 HA PRO A 14 -18.003 6.474 10.089 1.00 1.00 H new ATOM 0 HB2 PRO A 14 -15.797 6.030 11.617 1.00 1.00 H new ATOM 0 HB3 PRO A 14 -16.007 5.179 10.099 1.00 1.00 H new ATOM 0 HG2 PRO A 14 -14.308 7.644 10.664 1.00 1.00 H new ATOM 0 HG3 PRO A 14 -13.903 6.245 9.689 1.00 1.00 H new ATOM 0 HD2 PRO A 14 -14.815 8.584 8.557 1.00 1.00 H new ATOM 0 HD3 PRO A 14 -15.117 7.022 7.822 1.00 1.00 H new ATOM 172 N VAL A 15 -18.221 7.707 12.298 1.00 1.00 N ATOM 173 CA VAL A 15 -18.626 8.568 13.426 1.00 1.00 C ATOM 174 C VAL A 15 -18.540 7.797 14.747 1.00 1.00 C ATOM 175 O VAL A 15 -19.268 6.827 14.966 1.00 1.00 O ATOM 176 CB VAL A 15 -20.046 9.146 13.219 1.00 1.00 C ATOM 177 CG1 VAL A 15 -20.430 10.102 14.359 1.00 1.00 C ATOM 178 CG2 VAL A 15 -20.171 9.935 11.907 1.00 1.00 C ATOM 0 H VAL A 15 -18.633 6.775 12.336 1.00 1.00 H new ATOM 0 HA VAL A 15 -17.934 9.409 13.468 1.00 1.00 H new ATOM 0 HB VAL A 15 -20.711 8.282 13.195 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -21.433 10.492 14.185 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -20.409 9.565 15.307 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -19.721 10.929 14.395 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -21.186 10.320 11.809 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -19.467 10.767 11.914 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -19.949 9.279 11.065 1.00 1.00 H new ATOM 188 N GLY A 16 -17.639 8.238 15.626 1.00 1.00 N ATOM 189 CA GLY A 16 -17.397 7.658 16.950 1.00 1.00 C ATOM 190 C GLY A 16 -16.517 6.401 16.948 1.00 1.00 C ATOM 191 O GLY A 16 -16.237 5.799 15.906 1.00 1.00 O ATOM 0 H GLY A 16 -17.036 9.037 15.430 1.00 1.00 H new ATOM 0 HA2 GLY A 16 -16.928 8.412 17.582 1.00 1.00 H new ATOM 0 HA3 GLY A 16 -18.357 7.413 17.405 1.00 1.00 H new ATOM 195 N LYS A 17 -16.079 5.993 18.147 1.00 1.00 N ATOM 196 CA LYS A 17 -15.211 4.823 18.367 1.00 1.00 C ATOM 197 C LYS A 17 -15.793 3.504 17.837 1.00 1.00 C ATOM 198 O LYS A 17 -15.029 2.634 17.422 1.00 1.00 O ATOM 199 CB LYS A 17 -14.819 4.757 19.857 1.00 1.00 C ATOM 200 CG LYS A 17 -13.864 3.588 20.155 1.00 1.00 C ATOM 201 CD LYS A 17 -13.013 3.765 21.418 1.00 1.00 C ATOM 202 CE LYS A 17 -13.831 4.007 22.693 1.00 1.00 C ATOM 203 NZ LYS A 17 -12.959 3.948 23.894 1.00 1.00 N ATOM 0 H LYS A 17 -16.323 6.477 19.011 1.00 1.00 H new ATOM 0 HA LYS A 17 -14.309 4.959 17.771 1.00 1.00 H new ATOM 0 HB2 LYS A 17 -14.345 5.694 20.148 1.00 1.00 H new ATOM 0 HB3 LYS A 17 -15.719 4.653 20.463 1.00 1.00 H new ATOM 0 HG2 LYS A 17 -14.449 2.674 20.252 1.00 1.00 H new ATOM 0 HG3 LYS A 17 -13.200 3.452 19.301 1.00 1.00 H new ATOM 0 HD2 LYS A 17 -12.398 2.876 21.557 1.00 1.00 H new ATOM 0 HD3 LYS A 17 -12.333 4.604 21.271 1.00 1.00 H new ATOM 0 HE2 LYS A 17 -14.319 4.980 22.639 1.00 1.00 H new ATOM 0 HE3 LYS A 17 -14.620 3.259 22.773 1.00 1.00 H new ATOM 0 HZ1 LYS A 17 -13.434 4.418 24.691 1.00 1.00 H new ATOM 0 HZ2 LYS A 17 -12.772 2.955 24.139 1.00 1.00 H new ATOM 0 HZ3 LYS A 17 -12.059 4.430 23.694 1.00 1.00 H new ATOM 217 N ASP A 18 -17.116 3.353 17.808 1.00 1.00 N ATOM 218 CA ASP A 18 -17.796 2.158 17.279 1.00 1.00 C ATOM 219 C ASP A 18 -17.584 1.995 15.763 1.00 1.00 C ATOM 220 O ASP A 18 -17.256 0.902 15.291 1.00 1.00 O ATOM 221 CB ASP A 18 -19.296 2.233 17.596 1.00 1.00 C ATOM 222 CG ASP A 18 -19.573 2.156 19.106 1.00 1.00 C ATOM 223 OD1 ASP A 18 -19.589 1.031 19.662 1.00 1.00 O ATOM 224 OD2 ASP A 18 -19.779 3.219 19.739 1.00 1.00 O ATOM 0 H ASP A 18 -17.760 4.064 18.155 1.00 1.00 H new ATOM 0 HA ASP A 18 -17.359 1.285 17.764 1.00 1.00 H new ATOM 0 HB2 ASP A 18 -19.704 3.163 17.200 1.00 1.00 H new ATOM 0 HB3 ASP A 18 -19.814 1.418 17.091 1.00 1.00 H new ATOM 229 N ALA A 19 -17.713 3.085 14.993 1.00 1.00 N ATOM 230 CA ALA A 19 -17.469 3.071 13.551 1.00 1.00 C ATOM 231 C ALA A 19 -15.980 2.845 13.248 1.00 1.00 C ATOM 232 O ALA A 19 -15.643 2.061 12.361 1.00 1.00 O ATOM 233 CB ALA A 19 -17.953 4.386 12.937 1.00 1.00 C ATOM 0 H ALA A 19 -17.989 3.998 15.355 1.00 1.00 H new ATOM 0 HA ALA A 19 -18.025 2.245 13.108 1.00 1.00 H new ATOM 0 HB1 ALA A 19 -17.771 4.375 11.862 1.00 1.00 H new ATOM 0 HB2 ALA A 19 -19.021 4.503 13.123 1.00 1.00 H new ATOM 0 HB3 ALA A 19 -17.413 5.219 13.388 1.00 1.00 H new ATOM 239 N VAL A 20 -15.086 3.490 14.010 1.00 1.00 N ATOM 240 CA VAL A 20 -13.630 3.308 13.874 1.00 1.00 C ATOM 241 C VAL A 20 -13.241 1.854 14.174 1.00 1.00 C ATOM 242 O VAL A 20 -12.460 1.266 13.428 1.00 1.00 O ATOM 243 CB VAL A 20 -12.861 4.321 14.746 1.00 1.00 C ATOM 244 CG1 VAL A 20 -11.351 4.060 14.725 1.00 1.00 C ATOM 245 CG2 VAL A 20 -13.096 5.749 14.230 1.00 1.00 C ATOM 0 H VAL A 20 -15.350 4.153 14.739 1.00 1.00 H new ATOM 0 HA VAL A 20 -13.345 3.510 12.842 1.00 1.00 H new ATOM 0 HB VAL A 20 -13.232 4.207 15.764 1.00 1.00 H new ATOM 0 HG11 VAL A 20 -10.846 4.795 15.352 1.00 1.00 H new ATOM 0 HG12 VAL A 20 -11.149 3.059 15.106 1.00 1.00 H new ATOM 0 HG13 VAL A 20 -10.982 4.140 13.702 1.00 1.00 H new ATOM 0 HG21 VAL A 20 -12.548 6.456 14.853 1.00 1.00 H new ATOM 0 HG22 VAL A 20 -12.746 5.826 13.201 1.00 1.00 H new ATOM 0 HG23 VAL A 20 -14.161 5.980 14.270 1.00 1.00 H new ATOM 255 N ASN A 21 -13.827 1.230 15.205 1.00 1.00 N ATOM 256 CA ASN A 21 -13.605 -0.190 15.508 1.00 1.00 C ATOM 257 C ASN A 21 -14.041 -1.075 14.334 1.00 1.00 C ATOM 258 O ASN A 21 -13.282 -1.946 13.917 1.00 1.00 O ATOM 259 CB ASN A 21 -14.376 -0.594 16.780 1.00 1.00 C ATOM 260 CG ASN A 21 -13.495 -0.576 18.008 1.00 1.00 C ATOM 261 OD1 ASN A 21 -12.899 -1.579 18.377 1.00 1.00 O ATOM 262 ND2 ASN A 21 -13.375 0.554 18.658 1.00 1.00 N ATOM 0 H ASN A 21 -14.466 1.694 15.850 1.00 1.00 H new ATOM 0 HA ASN A 21 -12.538 -0.335 15.675 1.00 1.00 H new ATOM 0 HB2 ASN A 21 -15.215 0.086 16.926 1.00 1.00 H new ATOM 0 HB3 ASN A 21 -14.794 -1.592 16.649 1.00 1.00 H new ATOM 0 HD21 ASN A 21 -12.779 0.606 19.484 1.00 1.00 H new ATOM 0 HD22 ASN A 21 -13.878 1.382 18.339 1.00 1.00 H new ATOM 269 N SER A 22 -15.234 -0.838 13.781 1.00 1.00 N ATOM 270 CA SER A 22 -15.749 -1.605 12.637 1.00 1.00 C ATOM 271 C SER A 22 -14.838 -1.460 11.410 1.00 1.00 C ATOM 272 O SER A 22 -14.484 -2.452 10.775 1.00 1.00 O ATOM 273 CB SER A 22 -17.173 -1.156 12.284 1.00 1.00 C ATOM 274 OG SER A 22 -18.056 -1.332 13.385 1.00 1.00 O ATOM 0 H SER A 22 -15.870 -0.112 14.111 1.00 1.00 H new ATOM 0 HA SER A 22 -15.767 -2.655 12.928 1.00 1.00 H new ATOM 0 HB2 SER A 22 -17.163 -0.107 11.986 1.00 1.00 H new ATOM 0 HB3 SER A 22 -17.536 -1.727 11.429 1.00 1.00 H new ATOM 0 HG SER A 22 -17.872 -0.650 14.064 1.00 1.00 H new ATOM 280 N LEU A 23 -14.392 -0.234 11.114 1.00 1.00 N ATOM 281 CA LEU A 23 -13.483 0.083 10.012 1.00 1.00 C ATOM 282 C LEU A 23 -12.133 -0.642 10.145 1.00 1.00 C ATOM 283 O LEU A 23 -11.661 -1.228 9.170 1.00 1.00 O ATOM 284 CB LEU A 23 -13.336 1.617 9.976 1.00 1.00 C ATOM 285 CG LEU A 23 -12.508 2.196 8.819 1.00 1.00 C ATOM 286 CD1 LEU A 23 -13.121 1.881 7.454 1.00 1.00 C ATOM 287 CD2 LEU A 23 -12.464 3.715 8.975 1.00 1.00 C ATOM 0 H LEU A 23 -14.663 0.589 11.653 1.00 1.00 H new ATOM 0 HA LEU A 23 -13.891 -0.273 9.066 1.00 1.00 H new ATOM 0 HB2 LEU A 23 -14.333 2.055 9.935 1.00 1.00 H new ATOM 0 HB3 LEU A 23 -12.884 1.939 10.914 1.00 1.00 H new ATOM 0 HG LEU A 23 -11.515 1.748 8.860 1.00 1.00 H new ATOM 0 HD11 LEU A 23 -12.500 2.311 6.668 1.00 1.00 H new ATOM 0 HD12 LEU A 23 -13.178 0.801 7.321 1.00 1.00 H new ATOM 0 HD13 LEU A 23 -14.123 2.306 7.398 1.00 1.00 H new ATOM 0 HD21 LEU A 23 -11.880 4.147 8.163 1.00 1.00 H new ATOM 0 HD22 LEU A 23 -13.478 4.113 8.945 1.00 1.00 H new ATOM 0 HD23 LEU A 23 -12.002 3.970 9.929 1.00 1.00 H new ATOM 299 N ILE A 24 -11.540 -0.648 11.346 1.00 1.00 N ATOM 300 CA ILE A 24 -10.281 -1.352 11.640 1.00 1.00 C ATOM 301 C ILE A 24 -10.468 -2.875 11.547 1.00 1.00 C ATOM 302 O ILE A 24 -9.644 -3.558 10.940 1.00 1.00 O ATOM 303 CB ILE A 24 -9.741 -0.934 13.032 1.00 1.00 C ATOM 304 CG1 ILE A 24 -9.271 0.541 13.025 1.00 1.00 C ATOM 305 CG2 ILE A 24 -8.577 -1.840 13.481 1.00 1.00 C ATOM 306 CD1 ILE A 24 -9.054 1.113 14.434 1.00 1.00 C ATOM 0 H ILE A 24 -11.925 -0.158 12.153 1.00 1.00 H new ATOM 0 HA ILE A 24 -9.542 -1.067 10.891 1.00 1.00 H new ATOM 0 HB ILE A 24 -10.563 -1.045 13.739 1.00 1.00 H new ATOM 0 HG12 ILE A 24 -8.341 0.617 12.462 1.00 1.00 H new ATOM 0 HG13 ILE A 24 -10.010 1.149 12.503 1.00 1.00 H new ATOM 0 HG21 ILE A 24 -8.223 -1.519 14.461 1.00 1.00 H new ATOM 0 HG22 ILE A 24 -8.922 -2.872 13.540 1.00 1.00 H new ATOM 0 HG23 ILE A 24 -7.763 -1.770 12.760 1.00 1.00 H new ATOM 0 HD11 ILE A 24 -8.725 2.150 14.359 1.00 1.00 H new ATOM 0 HD12 ILE A 24 -9.989 1.068 14.993 1.00 1.00 H new ATOM 0 HD13 ILE A 24 -8.294 0.528 14.951 1.00 1.00 H new ATOM 318 N ARG A 25 -11.539 -3.426 12.134 1.00 1.00 N ATOM 319 CA ARG A 25 -11.830 -4.876 12.155 1.00 1.00 C ATOM 320 C ARG A 25 -12.156 -5.456 10.772 1.00 1.00 C ATOM 321 O ARG A 25 -11.844 -6.617 10.508 1.00 1.00 O ATOM 322 CB ARG A 25 -12.945 -5.158 13.178 1.00 1.00 C ATOM 323 CG ARG A 25 -12.457 -4.923 14.613 1.00 1.00 C ATOM 324 CD ARG A 25 -13.609 -4.834 15.621 1.00 1.00 C ATOM 325 NE ARG A 25 -13.143 -4.303 16.919 1.00 1.00 N ATOM 326 CZ ARG A 25 -12.642 -4.969 17.943 1.00 1.00 C ATOM 327 NH1 ARG A 25 -12.495 -6.264 17.940 1.00 1.00 N ATOM 328 NH2 ARG A 25 -12.272 -4.311 19.002 1.00 1.00 N ATOM 0 H ARG A 25 -12.244 -2.870 12.618 1.00 1.00 H new ATOM 0 HA ARG A 25 -10.920 -5.391 12.463 1.00 1.00 H new ATOM 0 HB2 ARG A 25 -13.801 -4.515 12.973 1.00 1.00 H new ATOM 0 HB3 ARG A 25 -13.287 -6.187 13.072 1.00 1.00 H new ATOM 0 HG2 ARG A 25 -11.788 -5.733 14.902 1.00 1.00 H new ATOM 0 HG3 ARG A 25 -11.876 -4.002 14.649 1.00 1.00 H new ATOM 0 HD2 ARG A 25 -14.395 -4.192 15.223 1.00 1.00 H new ATOM 0 HD3 ARG A 25 -14.047 -5.822 15.765 1.00 1.00 H new ATOM 0 HE ARG A 25 -13.218 -3.293 17.039 1.00 1.00 H new ATOM 0 HH11 ARG A 25 -12.772 -6.807 17.122 1.00 1.00 H new ATOM 0 HH12 ARG A 25 -12.103 -6.735 18.756 1.00 1.00 H new ATOM 0 HH21 ARG A 25 -12.371 -3.296 19.032 1.00 1.00 H new ATOM 0 HH22 ARG A 25 -11.883 -4.810 19.802 1.00 1.00 H new ATOM 342 N GLU A 26 -12.747 -4.664 9.877 1.00 1.00 N ATOM 343 CA GLU A 26 -13.052 -5.072 8.494 1.00 1.00 C ATOM 344 C GLU A 26 -11.866 -4.868 7.525 1.00 1.00 C ATOM 345 O GLU A 26 -11.883 -5.408 6.418 1.00 1.00 O ATOM 346 CB GLU A 26 -14.288 -4.311 7.979 1.00 1.00 C ATOM 347 CG GLU A 26 -15.586 -4.806 8.634 1.00 1.00 C ATOM 348 CD GLU A 26 -16.816 -4.085 8.047 1.00 1.00 C ATOM 349 OE1 GLU A 26 -17.314 -4.508 6.974 1.00 1.00 O ATOM 350 OE2 GLU A 26 -17.310 -3.103 8.654 1.00 1.00 O ATOM 0 H GLU A 26 -13.033 -3.708 10.089 1.00 1.00 H new ATOM 0 HA GLU A 26 -13.256 -6.142 8.521 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -14.166 -3.246 8.177 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -14.361 -4.428 6.898 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -15.685 -5.881 8.484 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -15.541 -4.637 9.710 1.00 1.00 H new ATOM 357 N ASN A 27 -10.836 -4.105 7.922 1.00 1.00 N ATOM 358 CA ASN A 27 -9.656 -3.782 7.100 1.00 1.00 C ATOM 359 C ASN A 27 -8.328 -3.925 7.880 1.00 1.00 C ATOM 360 O ASN A 27 -7.405 -3.117 7.728 1.00 1.00 O ATOM 361 CB ASN A 27 -9.826 -2.370 6.512 1.00 1.00 C ATOM 362 CG ASN A 27 -11.091 -2.183 5.696 1.00 1.00 C ATOM 363 OD1 ASN A 27 -11.145 -2.467 4.507 1.00 1.00 O ATOM 364 ND2 ASN A 27 -12.141 -1.688 6.312 1.00 1.00 N ATOM 0 H ASN A 27 -10.798 -3.683 8.850 1.00 1.00 H new ATOM 0 HA ASN A 27 -9.593 -4.506 6.288 1.00 1.00 H new ATOM 0 HB2 ASN A 27 -9.823 -1.647 7.327 1.00 1.00 H new ATOM 0 HB3 ASN A 27 -8.965 -2.145 5.883 1.00 1.00 H new ATOM 0 HD21 ASN A 27 -13.010 -1.538 5.799 1.00 1.00 H new ATOM 0 HD22 ASN A 27 -12.087 -1.454 7.303 1.00 1.00 H new ATOM 371 N SER A 28 -8.229 -4.937 8.748 1.00 1.00 N ATOM 372 CA SER A 28 -7.063 -5.185 9.622 1.00 1.00 C ATOM 373 C SER A 28 -5.722 -5.371 8.890 1.00 1.00 C ATOM 374 O SER A 28 -4.657 -5.286 9.506 1.00 1.00 O ATOM 375 CB SER A 28 -7.327 -6.383 10.539 1.00 1.00 C ATOM 376 OG SER A 28 -8.552 -6.220 11.236 1.00 1.00 O ATOM 0 H SER A 28 -8.971 -5.626 8.870 1.00 1.00 H new ATOM 0 HA SER A 28 -6.951 -4.270 10.204 1.00 1.00 H new ATOM 0 HB2 SER A 28 -7.357 -7.299 9.949 1.00 1.00 H new ATOM 0 HB3 SER A 28 -6.509 -6.490 11.251 1.00 1.00 H new ATOM 0 HG SER A 28 -8.866 -5.297 11.135 1.00 1.00 H new ATOM 382 N HIS A 29 -5.751 -5.594 7.572 1.00 1.00 N ATOM 383 CA HIS A 29 -4.574 -5.707 6.704 1.00 1.00 C ATOM 384 C HIS A 29 -3.924 -4.345 6.389 1.00 1.00 C ATOM 385 O HIS A 29 -2.751 -4.316 6.007 1.00 1.00 O ATOM 386 CB HIS A 29 -4.977 -6.434 5.410 1.00 1.00 C ATOM 387 CG HIS A 29 -6.023 -5.728 4.572 1.00 1.00 C ATOM 388 ND1 HIS A 29 -7.307 -5.363 4.997 1.00 1.00 N ATOM 389 CD2 HIS A 29 -5.880 -5.373 3.263 1.00 1.00 C ATOM 390 CE1 HIS A 29 -7.899 -4.790 3.935 1.00 1.00 C ATOM 391 NE2 HIS A 29 -7.064 -4.780 2.883 1.00 1.00 N ATOM 0 H HIS A 29 -6.627 -5.705 7.062 1.00 1.00 H new ATOM 0 HA HIS A 29 -3.817 -6.281 7.238 1.00 1.00 H new ATOM 0 HB2 HIS A 29 -4.085 -6.580 4.801 1.00 1.00 H new ATOM 0 HB3 HIS A 29 -5.351 -7.424 5.670 1.00 1.00 H new ATOM 0 HD2 HIS A 29 -5.008 -5.527 2.645 1.00 1.00 H new ATOM 0 HE1 HIS A 29 -8.904 -4.394 3.928 1.00 1.00 H new ATOM 0 HE2 HIS A 29 -7.271 -4.398 1.960 1.00 1.00 H new ATOM 399 N ILE A 30 -4.652 -3.231 6.563 1.00 1.00 N ATOM 400 CA ILE A 30 -4.193 -1.853 6.283 1.00 1.00 C ATOM 401 C ILE A 30 -4.419 -0.847 7.425 1.00 1.00 C ATOM 402 O ILE A 30 -3.742 0.183 7.455 1.00 1.00 O ATOM 403 CB ILE A 30 -4.808 -1.313 4.971 1.00 1.00 C ATOM 404 CG1 ILE A 30 -6.353 -1.389 4.976 1.00 1.00 C ATOM 405 CG2 ILE A 30 -4.189 -2.031 3.761 1.00 1.00 C ATOM 406 CD1 ILE A 30 -7.030 -0.737 3.764 1.00 1.00 C ATOM 0 H ILE A 30 -5.609 -3.261 6.914 1.00 1.00 H new ATOM 0 HA ILE A 30 -3.112 -1.943 6.178 1.00 1.00 H new ATOM 0 HB ILE A 30 -4.565 -0.253 4.892 1.00 1.00 H new ATOM 0 HG12 ILE A 30 -6.652 -2.436 5.022 1.00 1.00 H new ATOM 0 HG13 ILE A 30 -6.724 -0.911 5.883 1.00 1.00 H new ATOM 0 HG21 ILE A 30 -4.630 -1.643 2.843 1.00 1.00 H new ATOM 0 HG22 ILE A 30 -3.113 -1.860 3.748 1.00 1.00 H new ATOM 0 HG23 ILE A 30 -4.385 -3.101 3.833 1.00 1.00 H new ATOM 0 HD11 ILE A 30 -8.112 -0.839 3.853 1.00 1.00 H new ATOM 0 HD12 ILE A 30 -6.767 0.320 3.725 1.00 1.00 H new ATOM 0 HD13 ILE A 30 -6.693 -1.228 2.851 1.00 1.00 H new ATOM 418 N PHE A 31 -5.309 -1.132 8.378 1.00 1.00 N ATOM 419 CA PHE A 31 -5.594 -0.285 9.544 1.00 1.00 C ATOM 420 C PHE A 31 -5.417 -1.092 10.838 1.00 1.00 C ATOM 421 O PHE A 31 -5.611 -2.309 10.858 1.00 1.00 O ATOM 422 CB PHE A 31 -7.039 0.248 9.483 1.00 1.00 C ATOM 423 CG PHE A 31 -7.504 0.936 8.210 1.00 1.00 C ATOM 424 CD1 PHE A 31 -6.636 1.708 7.413 1.00 1.00 C ATOM 425 CD2 PHE A 31 -8.850 0.795 7.824 1.00 1.00 C ATOM 426 CE1 PHE A 31 -7.092 2.256 6.200 1.00 1.00 C ATOM 427 CE2 PHE A 31 -9.306 1.338 6.612 1.00 1.00 C ATOM 428 CZ PHE A 31 -8.421 2.051 5.790 1.00 1.00 C ATOM 0 H PHE A 31 -5.870 -1.984 8.361 1.00 1.00 H new ATOM 0 HA PHE A 31 -4.898 0.553 9.533 1.00 1.00 H new ATOM 0 HB2 PHE A 31 -7.710 -0.590 9.671 1.00 1.00 H new ATOM 0 HB3 PHE A 31 -7.168 0.951 10.306 1.00 1.00 H new ATOM 0 HD1 PHE A 31 -5.619 1.879 7.734 1.00 1.00 H new ATOM 0 HD2 PHE A 31 -9.538 0.265 8.465 1.00 1.00 H new ATOM 0 HE1 PHE A 31 -6.420 2.835 5.583 1.00 1.00 H new ATOM 0 HE2 PHE A 31 -10.336 1.207 6.313 1.00 1.00 H new ATOM 0 HZ PHE A 31 -8.760 2.442 4.842 1.00 1.00 H new ATOM 438 N SER A 32 -5.068 -0.420 11.933 1.00 1.00 N ATOM 439 CA SER A 32 -4.885 -1.034 13.254 1.00 1.00 C ATOM 440 C SER A 32 -5.090 -0.032 14.395 1.00 1.00 C ATOM 441 O SER A 32 -5.175 1.180 14.184 1.00 1.00 O ATOM 442 CB SER A 32 -3.491 -1.673 13.353 1.00 1.00 C ATOM 443 OG SER A 32 -2.481 -0.685 13.402 1.00 1.00 O ATOM 0 H SER A 32 -4.900 0.586 11.931 1.00 1.00 H new ATOM 0 HA SER A 32 -5.648 -1.805 13.361 1.00 1.00 H new ATOM 0 HB2 SER A 32 -3.436 -2.298 14.244 1.00 1.00 H new ATOM 0 HB3 SER A 32 -3.325 -2.325 12.496 1.00 1.00 H new ATOM 0 HG SER A 32 -2.642 -0.017 12.703 1.00 1.00 H new ATOM 449 N ASP A 33 -5.144 -0.543 15.625 1.00 1.00 N ATOM 450 CA ASP A 33 -5.304 0.239 16.857 1.00 1.00 C ATOM 451 C ASP A 33 -4.192 1.290 17.087 1.00 1.00 C ATOM 452 O ASP A 33 -4.399 2.238 17.849 1.00 1.00 O ATOM 453 CB ASP A 33 -5.354 -0.758 18.025 1.00 1.00 C ATOM 454 CG ASP A 33 -5.709 -0.096 19.364 1.00 1.00 C ATOM 455 OD1 ASP A 33 -6.825 0.465 19.469 1.00 1.00 O ATOM 456 OD2 ASP A 33 -4.904 -0.181 20.323 1.00 1.00 O ATOM 0 H ASP A 33 -5.076 -1.546 15.800 1.00 1.00 H new ATOM 0 HA ASP A 33 -6.223 0.820 16.777 1.00 1.00 H new ATOM 0 HB2 ASP A 33 -6.088 -1.533 17.803 1.00 1.00 H new ATOM 0 HB3 ASP A 33 -4.387 -1.252 18.115 1.00 1.00 H new ATOM 461 N THR A 34 -3.024 1.136 16.446 1.00 1.00 N ATOM 462 CA THR A 34 -1.851 2.018 16.619 1.00 1.00 C ATOM 463 C THR A 34 -1.143 2.457 15.327 1.00 1.00 C ATOM 464 O THR A 34 -0.112 3.125 15.415 1.00 1.00 O ATOM 465 CB THR A 34 -0.821 1.387 17.581 1.00 1.00 C ATOM 466 OG1 THR A 34 -0.425 0.100 17.140 1.00 1.00 O ATOM 467 CG2 THR A 34 -1.364 1.228 19.003 1.00 1.00 C ATOM 0 H THR A 34 -2.861 0.382 15.779 1.00 1.00 H new ATOM 0 HA THR A 34 -2.274 2.929 17.042 1.00 1.00 H new ATOM 0 HB THR A 34 0.025 2.075 17.587 1.00 1.00 H new ATOM 0 HG1 THR A 34 0.228 -0.274 17.767 1.00 1.00 H new ATOM 0 HG21 THR A 34 -0.599 0.780 19.637 1.00 1.00 H new ATOM 0 HG22 THR A 34 -1.637 2.206 19.400 1.00 1.00 H new ATOM 0 HG23 THR A 34 -2.244 0.585 18.987 1.00 1.00 H new ATOM 475 N GLN A 35 -1.642 2.132 14.126 1.00 1.00 N ATOM 476 CA GLN A 35 -1.014 2.534 12.852 1.00 1.00 C ATOM 477 C GLN A 35 -1.961 2.414 11.639 1.00 1.00 C ATOM 478 O GLN A 35 -2.730 1.456 11.540 1.00 1.00 O ATOM 479 CB GLN A 35 0.227 1.638 12.618 1.00 1.00 C ATOM 480 CG GLN A 35 1.122 2.077 11.445 1.00 1.00 C ATOM 481 CD GLN A 35 2.364 1.197 11.285 1.00 1.00 C ATOM 482 OE1 GLN A 35 2.338 -0.018 11.434 1.00 1.00 O ATOM 483 NE2 GLN A 35 3.507 1.771 10.968 1.00 1.00 N ATOM 0 H GLN A 35 -2.493 1.583 14.007 1.00 1.00 H new ATOM 0 HA GLN A 35 -0.745 3.587 12.936 1.00 1.00 H new ATOM 0 HB2 GLN A 35 0.825 1.624 13.529 1.00 1.00 H new ATOM 0 HB3 GLN A 35 -0.107 0.616 12.440 1.00 1.00 H new ATOM 0 HG2 GLN A 35 0.542 2.051 10.522 1.00 1.00 H new ATOM 0 HG3 GLN A 35 1.432 3.111 11.598 1.00 1.00 H new ATOM 0 HE21 GLN A 35 3.552 2.782 10.839 1.00 1.00 H new ATOM 0 HE22 GLN A 35 4.347 1.204 10.852 1.00 1.00 H new ATOM 492 N CYS A 36 -1.833 3.335 10.678 1.00 1.00 N ATOM 493 CA CYS A 36 -2.554 3.330 9.395 1.00 1.00 C ATOM 494 C CYS A 36 -1.541 3.200 8.243 1.00 1.00 C ATOM 495 O CYS A 36 -0.702 4.085 8.059 1.00 1.00 O ATOM 496 CB CYS A 36 -3.365 4.625 9.233 1.00 1.00 C ATOM 497 SG CYS A 36 -4.255 4.735 7.655 1.00 1.00 S ATOM 0 H CYS A 36 -1.204 4.132 10.772 1.00 1.00 H new ATOM 0 HA CYS A 36 -3.242 2.485 9.375 1.00 1.00 H new ATOM 0 HB2 CYS A 36 -4.082 4.699 10.051 1.00 1.00 H new ATOM 0 HB3 CYS A 36 -2.692 5.478 9.321 1.00 1.00 H new ATOM 502 N LYS A 37 -1.603 2.115 7.460 1.00 1.00 N ATOM 503 CA LYS A 37 -0.680 1.865 6.332 1.00 1.00 C ATOM 504 C LYS A 37 -0.984 2.709 5.092 1.00 1.00 C ATOM 505 O LYS A 37 -0.047 3.173 4.446 1.00 1.00 O ATOM 506 CB LYS A 37 -0.690 0.382 5.937 1.00 1.00 C ATOM 507 CG LYS A 37 -0.302 -0.559 7.086 1.00 1.00 C ATOM 508 CD LYS A 37 -0.105 -1.973 6.528 1.00 1.00 C ATOM 509 CE LYS A 37 -0.007 -3.009 7.652 1.00 1.00 C ATOM 510 NZ LYS A 37 -0.072 -4.389 7.107 1.00 1.00 N ATOM 0 H LYS A 37 -2.297 1.378 7.588 1.00 1.00 H new ATOM 0 HA LYS A 37 0.306 2.157 6.694 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -1.685 0.116 5.580 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -0.002 0.231 5.105 1.00 1.00 H new ATOM 0 HG2 LYS A 37 0.614 -0.212 7.564 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -1.079 -0.561 7.850 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -0.937 -2.225 5.870 1.00 1.00 H new ATOM 0 HD3 LYS A 37 0.801 -2.004 5.923 1.00 1.00 H new ATOM 0 HE2 LYS A 37 0.927 -2.873 8.197 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -0.818 -2.856 8.365 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 0.064 -5.074 7.878 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -1.001 -4.545 6.666 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 0.675 -4.517 6.395 1.00 1.00 H new ATOM 524 N VAL A 38 -2.263 2.948 4.770 1.00 1.00 N ATOM 525 CA VAL A 38 -2.671 3.773 3.604 1.00 1.00 C ATOM 526 C VAL A 38 -2.092 5.187 3.697 1.00 1.00 C ATOM 527 O VAL A 38 -1.665 5.752 2.691 1.00 1.00 O ATOM 528 CB VAL A 38 -4.206 3.826 3.439 1.00 1.00 C ATOM 529 CG1 VAL A 38 -4.644 4.729 2.278 1.00 1.00 C ATOM 530 CG2 VAL A 38 -4.762 2.426 3.159 1.00 1.00 C ATOM 0 H VAL A 38 -3.050 2.579 5.304 1.00 1.00 H new ATOM 0 HA VAL A 38 -2.262 3.290 2.717 1.00 1.00 H new ATOM 0 HB VAL A 38 -4.594 4.230 4.374 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -5.732 4.729 2.208 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -4.291 5.745 2.454 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -4.220 4.355 1.346 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -5.845 2.481 3.045 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -4.320 2.036 2.242 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -4.517 1.764 3.990 1.00 1.00 H new ATOM 540 N CYS A 39 -2.035 5.743 4.908 1.00 1.00 N ATOM 541 CA CYS A 39 -1.487 7.063 5.207 1.00 1.00 C ATOM 542 C CYS A 39 -0.079 6.985 5.843 1.00 1.00 C ATOM 543 O CYS A 39 0.436 8.002 6.308 1.00 1.00 O ATOM 544 CB CYS A 39 -2.509 7.753 6.110 1.00 1.00 C ATOM 545 SG CYS A 39 -4.180 7.831 5.397 1.00 1.00 S ATOM 0 H CYS A 39 -2.384 5.265 5.739 1.00 1.00 H new ATOM 0 HA CYS A 39 -1.334 7.639 4.294 1.00 1.00 H new ATOM 0 HB2 CYS A 39 -2.554 7.225 7.062 1.00 1.00 H new ATOM 0 HB3 CYS A 39 -2.167 8.766 6.323 1.00 1.00 H new ATOM 550 N SER A 40 0.513 5.779 5.860 1.00 1.00 N ATOM 551 CA SER A 40 1.826 5.394 6.412 1.00 1.00 C ATOM 552 C SER A 40 2.254 6.199 7.652 1.00 1.00 C ATOM 553 O SER A 40 3.332 6.802 7.704 1.00 1.00 O ATOM 554 CB SER A 40 2.890 5.334 5.302 1.00 1.00 C ATOM 555 OG SER A 40 2.985 6.547 4.564 1.00 1.00 O ATOM 0 H SER A 40 0.042 4.973 5.450 1.00 1.00 H new ATOM 0 HA SER A 40 1.718 4.383 6.805 1.00 1.00 H new ATOM 0 HB2 SER A 40 3.859 5.107 5.746 1.00 1.00 H new ATOM 0 HB3 SER A 40 2.652 4.517 4.621 1.00 1.00 H new ATOM 0 HG SER A 40 3.675 6.457 3.874 1.00 1.00 H new ATOM 561 N ALA A 41 1.379 6.207 8.661 1.00 1.00 N ATOM 562 CA ALA A 41 1.549 6.958 9.907 1.00 1.00 C ATOM 563 C ALA A 41 1.159 6.157 11.160 1.00 1.00 C ATOM 564 O ALA A 41 0.225 5.349 11.146 1.00 1.00 O ATOM 565 CB ALA A 41 0.719 8.247 9.806 1.00 1.00 C ATOM 0 H ALA A 41 0.508 5.676 8.633 1.00 1.00 H new ATOM 0 HA ALA A 41 2.609 7.185 10.025 1.00 1.00 H new ATOM 0 HB1 ALA A 41 0.830 8.824 10.724 1.00 1.00 H new ATOM 0 HB2 ALA A 41 1.069 8.840 8.961 1.00 1.00 H new ATOM 0 HB3 ALA A 41 -0.331 7.993 9.662 1.00 1.00 H new ATOM 571 N VAL A 42 1.872 6.416 12.259 1.00 1.00 N ATOM 572 CA VAL A 42 1.655 5.796 13.577 1.00 1.00 C ATOM 573 C VAL A 42 0.618 6.610 14.365 1.00 1.00 C ATOM 574 O VAL A 42 0.495 7.826 14.205 1.00 1.00 O ATOM 575 CB VAL A 42 2.995 5.683 14.343 1.00 1.00 C ATOM 576 CG1 VAL A 42 2.860 5.025 15.723 1.00 1.00 C ATOM 577 CG2 VAL A 42 4.005 4.838 13.551 1.00 1.00 C ATOM 0 H VAL A 42 2.642 7.084 12.260 1.00 1.00 H new ATOM 0 HA VAL A 42 1.266 4.786 13.447 1.00 1.00 H new ATOM 0 HB VAL A 42 3.332 6.712 14.469 1.00 1.00 H new ATOM 0 HG11 VAL A 42 3.838 4.979 16.202 1.00 1.00 H new ATOM 0 HG12 VAL A 42 2.181 5.612 16.341 1.00 1.00 H new ATOM 0 HG13 VAL A 42 2.465 4.016 15.608 1.00 1.00 H new ATOM 0 HG21 VAL A 42 4.940 4.772 14.108 1.00 1.00 H new ATOM 0 HG22 VAL A 42 3.602 3.837 13.399 1.00 1.00 H new ATOM 0 HG23 VAL A 42 4.191 5.305 12.584 1.00 1.00 H new ATOM 587 N LEU A 43 -0.139 5.921 15.217 1.00 1.00 N ATOM 588 CA LEU A 43 -1.251 6.427 16.025 1.00 1.00 C ATOM 589 C LEU A 43 -0.985 6.082 17.501 1.00 1.00 C ATOM 590 O LEU A 43 -1.554 5.148 18.065 1.00 1.00 O ATOM 591 CB LEU A 43 -2.568 5.848 15.454 1.00 1.00 C ATOM 592 CG LEU A 43 -2.811 6.181 13.966 1.00 1.00 C ATOM 593 CD1 LEU A 43 -3.964 5.352 13.401 1.00 1.00 C ATOM 594 CD2 LEU A 43 -3.113 7.665 13.772 1.00 1.00 C ATOM 0 H LEU A 43 0.018 4.925 15.373 1.00 1.00 H new ATOM 0 HA LEU A 43 -1.344 7.512 15.981 1.00 1.00 H new ATOM 0 HB2 LEU A 43 -2.559 4.765 15.576 1.00 1.00 H new ATOM 0 HB3 LEU A 43 -3.404 6.228 16.041 1.00 1.00 H new ATOM 0 HG LEU A 43 -1.896 5.935 13.428 1.00 1.00 H new ATOM 0 HD11 LEU A 43 -4.114 5.606 12.352 1.00 1.00 H new ATOM 0 HD12 LEU A 43 -3.726 4.292 13.488 1.00 1.00 H new ATOM 0 HD13 LEU A 43 -4.875 5.567 13.960 1.00 1.00 H new ATOM 0 HD21 LEU A 43 -3.279 7.867 12.714 1.00 1.00 H new ATOM 0 HD22 LEU A 43 -4.006 7.931 14.337 1.00 1.00 H new ATOM 0 HD23 LEU A 43 -2.269 8.257 14.126 1.00 1.00 H new ATOM 606 N ILE A 44 -0.044 6.821 18.098 1.00 1.00 N ATOM 607 CA ILE A 44 0.490 6.651 19.467 1.00 1.00 C ATOM 608 C ILE A 44 -0.533 6.643 20.624 1.00 1.00 C ATOM 609 O ILE A 44 -0.181 6.254 21.738 1.00 1.00 O ATOM 610 CB ILE A 44 1.600 7.694 19.742 1.00 1.00 C ATOM 611 CG1 ILE A 44 1.062 9.146 19.687 1.00 1.00 C ATOM 612 CG2 ILE A 44 2.780 7.487 18.774 1.00 1.00 C ATOM 613 CD1 ILE A 44 2.080 10.202 20.130 1.00 1.00 C ATOM 0 H ILE A 44 0.397 7.604 17.614 1.00 1.00 H new ATOM 0 HA ILE A 44 0.887 5.636 19.465 1.00 1.00 H new ATOM 0 HB ILE A 44 1.960 7.538 20.759 1.00 1.00 H new ATOM 0 HG12 ILE A 44 0.744 9.367 18.668 1.00 1.00 H new ATOM 0 HG13 ILE A 44 0.178 9.220 20.320 1.00 1.00 H new ATOM 0 HG21 ILE A 44 3.553 8.228 18.979 1.00 1.00 H new ATOM 0 HG22 ILE A 44 3.191 6.487 18.910 1.00 1.00 H new ATOM 0 HG23 ILE A 44 2.432 7.600 17.747 1.00 1.00 H new ATOM 0 HD11 ILE A 44 1.629 11.192 20.064 1.00 1.00 H new ATOM 0 HD12 ILE A 44 2.381 10.008 21.160 1.00 1.00 H new ATOM 0 HD13 ILE A 44 2.955 10.158 19.482 1.00 1.00 H new ATOM 625 N SER A 45 -1.780 7.062 20.394 1.00 1.00 N ATOM 626 CA SER A 45 -2.870 7.090 21.387 1.00 1.00 C ATOM 627 C SER A 45 -4.237 7.008 20.705 1.00 1.00 C ATOM 628 O SER A 45 -4.382 7.357 19.531 1.00 1.00 O ATOM 629 CB SER A 45 -2.806 8.381 22.218 1.00 1.00 C ATOM 630 OG SER A 45 -1.758 8.325 23.172 1.00 1.00 O ATOM 0 H SER A 45 -2.074 7.405 19.480 1.00 1.00 H new ATOM 0 HA SER A 45 -2.743 6.225 22.038 1.00 1.00 H new ATOM 0 HB2 SER A 45 -2.655 9.235 21.557 1.00 1.00 H new ATOM 0 HB3 SER A 45 -3.757 8.536 22.727 1.00 1.00 H new ATOM 0 HG SER A 45 -1.157 7.582 22.955 1.00 1.00 H new ATOM 636 N GLU A 46 -5.262 6.578 21.447 1.00 1.00 N ATOM 637 CA GLU A 46 -6.637 6.452 20.942 1.00 1.00 C ATOM 638 C GLU A 46 -7.189 7.768 20.378 1.00 1.00 C ATOM 639 O GLU A 46 -7.845 7.745 19.342 1.00 1.00 O ATOM 640 CB GLU A 46 -7.537 5.875 22.046 1.00 1.00 C ATOM 641 CG GLU A 46 -8.977 5.667 21.561 1.00 1.00 C ATOM 642 CD GLU A 46 -9.695 4.600 22.395 1.00 1.00 C ATOM 643 OE1 GLU A 46 -9.562 3.402 22.049 1.00 1.00 O ATOM 644 OE2 GLU A 46 -10.418 4.949 23.359 1.00 1.00 O ATOM 0 H GLU A 46 -5.162 6.304 22.425 1.00 1.00 H new ATOM 0 HA GLU A 46 -6.625 5.762 20.098 1.00 1.00 H new ATOM 0 HB2 GLU A 46 -7.128 4.924 22.387 1.00 1.00 H new ATOM 0 HB3 GLU A 46 -7.537 6.548 22.903 1.00 1.00 H new ATOM 0 HG2 GLU A 46 -9.523 6.608 21.622 1.00 1.00 H new ATOM 0 HG3 GLU A 46 -8.971 5.369 20.512 1.00 1.00 H new ATOM 651 N SER A 47 -6.885 8.921 20.980 1.00 1.00 N ATOM 652 CA SER A 47 -7.314 10.224 20.446 1.00 1.00 C ATOM 653 C SER A 47 -6.772 10.484 19.036 1.00 1.00 C ATOM 654 O SER A 47 -7.491 11.008 18.182 1.00 1.00 O ATOM 655 CB SER A 47 -6.890 11.353 21.382 1.00 1.00 C ATOM 656 OG SER A 47 -5.474 11.376 21.543 1.00 1.00 O ATOM 0 H SER A 47 -6.341 8.982 21.841 1.00 1.00 H new ATOM 0 HA SER A 47 -8.402 10.196 20.380 1.00 1.00 H new ATOM 0 HB2 SER A 47 -7.230 12.309 20.983 1.00 1.00 H new ATOM 0 HB3 SER A 47 -7.368 11.225 22.353 1.00 1.00 H new ATOM 0 HG SER A 47 -5.225 12.108 22.145 1.00 1.00 H new ATOM 662 N GLN A 48 -5.530 10.065 18.764 1.00 1.00 N ATOM 663 CA GLN A 48 -4.914 10.184 17.440 1.00 1.00 C ATOM 664 C GLN A 48 -5.601 9.232 16.462 1.00 1.00 C ATOM 665 O GLN A 48 -5.936 9.638 15.352 1.00 1.00 O ATOM 666 CB GLN A 48 -3.404 9.889 17.483 1.00 1.00 C ATOM 667 CG GLN A 48 -2.627 10.654 18.565 1.00 1.00 C ATOM 668 CD GLN A 48 -2.865 12.165 18.533 1.00 1.00 C ATOM 669 OE1 GLN A 48 -2.334 12.887 17.699 1.00 1.00 O ATOM 670 NE2 GLN A 48 -3.673 12.705 19.423 1.00 1.00 N ATOM 0 H GLN A 48 -4.923 9.632 19.460 1.00 1.00 H new ATOM 0 HA GLN A 48 -5.042 11.213 17.105 1.00 1.00 H new ATOM 0 HB2 GLN A 48 -3.262 8.820 17.641 1.00 1.00 H new ATOM 0 HB3 GLN A 48 -2.974 10.127 16.510 1.00 1.00 H new ATOM 0 HG2 GLN A 48 -2.911 10.270 19.545 1.00 1.00 H new ATOM 0 HG3 GLN A 48 -1.562 10.459 18.442 1.00 1.00 H new ATOM 0 HE21 GLN A 48 -4.124 12.118 20.125 1.00 1.00 H new ATOM 0 HE22 GLN A 48 -3.848 13.710 19.410 1.00 1.00 H new ATOM 679 N LYS A 49 -5.858 7.982 16.880 1.00 1.00 N ATOM 680 CA LYS A 49 -6.553 6.978 16.056 1.00 1.00 C ATOM 681 C LYS A 49 -7.962 7.451 15.681 1.00 1.00 C ATOM 682 O LYS A 49 -8.329 7.432 14.509 1.00 1.00 O ATOM 683 CB LYS A 49 -6.486 5.593 16.759 1.00 1.00 C ATOM 684 CG LYS A 49 -7.818 4.972 17.222 1.00 1.00 C ATOM 685 CD LYS A 49 -7.626 3.690 18.045 1.00 1.00 C ATOM 686 CE LYS A 49 -9.007 3.200 18.498 1.00 1.00 C ATOM 687 NZ LYS A 49 -8.931 2.213 19.604 1.00 1.00 N ATOM 0 H LYS A 49 -5.589 7.638 17.802 1.00 1.00 H new ATOM 0 HA LYS A 49 -6.048 6.854 15.098 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -6.005 4.891 16.077 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -5.837 5.687 17.629 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -8.365 5.702 17.818 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -8.432 4.749 16.349 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -7.129 2.926 17.448 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -6.990 3.884 18.908 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -9.603 4.054 18.819 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -9.524 2.750 17.650 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -9.610 1.445 19.431 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -7.969 1.820 19.653 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -9.160 2.682 20.504 1.00 1.00 H new ATOM 701 N LEU A 50 -8.725 7.945 16.658 1.00 1.00 N ATOM 702 CA LEU A 50 -10.080 8.460 16.458 1.00 1.00 C ATOM 703 C LEU A 50 -10.095 9.675 15.523 1.00 1.00 C ATOM 704 O LEU A 50 -10.946 9.740 14.637 1.00 1.00 O ATOM 705 CB LEU A 50 -10.740 8.766 17.820 1.00 1.00 C ATOM 706 CG LEU A 50 -11.094 7.523 18.665 1.00 1.00 C ATOM 707 CD1 LEU A 50 -11.880 7.941 19.905 1.00 1.00 C ATOM 708 CD2 LEU A 50 -11.943 6.491 17.924 1.00 1.00 C ATOM 0 H LEU A 50 -8.412 7.999 17.627 1.00 1.00 H new ATOM 0 HA LEU A 50 -10.670 7.688 15.964 1.00 1.00 H new ATOM 0 HB2 LEU A 50 -10.069 9.401 18.398 1.00 1.00 H new ATOM 0 HB3 LEU A 50 -11.650 9.340 17.645 1.00 1.00 H new ATOM 0 HG LEU A 50 -10.137 7.064 18.915 1.00 1.00 H new ATOM 0 HD11 LEU A 50 -12.125 7.058 20.495 1.00 1.00 H new ATOM 0 HD12 LEU A 50 -11.277 8.622 20.505 1.00 1.00 H new ATOM 0 HD13 LEU A 50 -12.799 8.441 19.601 1.00 1.00 H new ATOM 0 HD21 LEU A 50 -12.149 5.648 18.584 1.00 1.00 H new ATOM 0 HD22 LEU A 50 -12.883 6.948 17.614 1.00 1.00 H new ATOM 0 HD23 LEU A 50 -11.403 6.139 17.045 1.00 1.00 H new ATOM 720 N ALA A 51 -9.163 10.617 15.671 1.00 1.00 N ATOM 721 CA ALA A 51 -9.088 11.775 14.780 1.00 1.00 C ATOM 722 C ALA A 51 -8.625 11.395 13.363 1.00 1.00 C ATOM 723 O ALA A 51 -9.189 11.883 12.383 1.00 1.00 O ATOM 724 CB ALA A 51 -8.162 12.822 15.414 1.00 1.00 C ATOM 0 H ALA A 51 -8.449 10.601 16.400 1.00 1.00 H new ATOM 0 HA ALA A 51 -10.088 12.193 14.662 1.00 1.00 H new ATOM 0 HB1 ALA A 51 -8.096 13.692 14.761 1.00 1.00 H new ATOM 0 HB2 ALA A 51 -8.563 13.124 16.382 1.00 1.00 H new ATOM 0 HB3 ALA A 51 -7.169 12.394 15.550 1.00 1.00 H new ATOM 730 N HIS A 52 -7.626 10.515 13.237 1.00 1.00 N ATOM 731 CA HIS A 52 -7.097 10.082 11.944 1.00 1.00 C ATOM 732 C HIS A 52 -8.134 9.302 11.125 1.00 1.00 C ATOM 733 O HIS A 52 -8.386 9.656 9.975 1.00 1.00 O ATOM 734 CB HIS A 52 -5.830 9.243 12.165 1.00 1.00 C ATOM 735 CG HIS A 52 -5.095 8.928 10.886 1.00 1.00 C ATOM 736 ND1 HIS A 52 -3.949 9.549 10.437 1.00 1.00 N ATOM 737 CD2 HIS A 52 -5.457 8.013 9.934 1.00 1.00 C ATOM 738 CE1 HIS A 52 -3.640 9.038 9.233 1.00 1.00 C ATOM 739 NE2 HIS A 52 -4.541 8.105 8.883 1.00 1.00 N ATOM 0 H HIS A 52 -7.161 10.082 14.035 1.00 1.00 H new ATOM 0 HA HIS A 52 -6.848 10.971 11.365 1.00 1.00 H new ATOM 0 HB2 HIS A 52 -5.161 9.778 12.839 1.00 1.00 H new ATOM 0 HB3 HIS A 52 -6.101 8.310 12.660 1.00 1.00 H new ATOM 0 HD1 HIS A 52 -3.426 10.271 10.933 1.00 1.00 H new ATOM 0 HD2 HIS A 52 -6.300 7.340 9.986 1.00 1.00 H new ATOM 0 HE1 HIS A 52 -2.791 9.334 8.634 1.00 1.00 H new ATOM 747 N TYR A 53 -8.772 8.275 11.699 1.00 1.00 N ATOM 748 CA TYR A 53 -9.757 7.462 10.974 1.00 1.00 C ATOM 749 C TYR A 53 -11.035 8.232 10.586 1.00 1.00 C ATOM 750 O TYR A 53 -11.670 7.884 9.589 1.00 1.00 O ATOM 751 CB TYR A 53 -10.049 6.167 11.753 1.00 1.00 C ATOM 752 CG TYR A 53 -8.878 5.191 11.780 1.00 1.00 C ATOM 753 CD1 TYR A 53 -8.336 4.718 10.570 1.00 1.00 C ATOM 754 CD2 TYR A 53 -8.322 4.755 12.999 1.00 1.00 C ATOM 755 CE1 TYR A 53 -7.218 3.864 10.569 1.00 1.00 C ATOM 756 CE2 TYR A 53 -7.210 3.890 13.007 1.00 1.00 C ATOM 757 CZ TYR A 53 -6.650 3.450 11.791 1.00 1.00 C ATOM 758 OH TYR A 53 -5.579 2.616 11.793 1.00 1.00 O ATOM 0 H TYR A 53 -8.623 7.986 12.666 1.00 1.00 H new ATOM 0 HA TYR A 53 -9.312 7.191 10.017 1.00 1.00 H new ATOM 0 HB2 TYR A 53 -10.321 6.423 12.777 1.00 1.00 H new ATOM 0 HB3 TYR A 53 -10.912 5.673 11.308 1.00 1.00 H new ATOM 0 HD1 TYR A 53 -8.783 5.014 9.632 1.00 1.00 H new ATOM 0 HD2 TYR A 53 -8.751 5.086 13.933 1.00 1.00 H new ATOM 0 HE1 TYR A 53 -6.796 3.526 9.634 1.00 1.00 H new ATOM 0 HE2 TYR A 53 -6.787 3.564 13.945 1.00 1.00 H new ATOM 0 HH TYR A 53 -5.467 2.230 12.687 1.00 1.00 H new ATOM 768 N GLN A 54 -11.397 9.297 11.314 1.00 1.00 N ATOM 769 CA GLN A 54 -12.554 10.152 10.993 1.00 1.00 C ATOM 770 C GLN A 54 -12.197 11.339 10.070 1.00 1.00 C ATOM 771 O GLN A 54 -13.098 12.014 9.566 1.00 1.00 O ATOM 772 CB GLN A 54 -13.213 10.649 12.295 1.00 1.00 C ATOM 773 CG GLN A 54 -13.812 9.507 13.134 1.00 1.00 C ATOM 774 CD GLN A 54 -14.437 10.015 14.432 1.00 1.00 C ATOM 775 OE1 GLN A 54 -15.646 10.102 14.594 1.00 1.00 O ATOM 776 NE2 GLN A 54 -13.632 10.361 15.410 1.00 1.00 N ATOM 0 H GLN A 54 -10.893 9.594 12.149 1.00 1.00 H new ATOM 0 HA GLN A 54 -13.261 9.539 10.434 1.00 1.00 H new ATOM 0 HB2 GLN A 54 -12.472 11.182 12.891 1.00 1.00 H new ATOM 0 HB3 GLN A 54 -13.998 11.364 12.049 1.00 1.00 H new ATOM 0 HG2 GLN A 54 -14.568 8.985 12.548 1.00 1.00 H new ATOM 0 HG3 GLN A 54 -13.033 8.781 13.367 1.00 1.00 H new ATOM 0 HE21 GLN A 54 -12.622 10.293 15.287 1.00 1.00 H new ATOM 0 HE22 GLN A 54 -14.017 10.698 16.292 1.00 1.00 H new ATOM 785 N SER A 55 -10.906 11.612 9.835 1.00 1.00 N ATOM 786 CA SER A 55 -10.429 12.715 8.986 1.00 1.00 C ATOM 787 C SER A 55 -10.827 12.578 7.511 1.00 1.00 C ATOM 788 O SER A 55 -10.745 11.498 6.917 1.00 1.00 O ATOM 789 CB SER A 55 -8.901 12.823 9.073 1.00 1.00 C ATOM 790 OG SER A 55 -8.427 13.861 8.226 1.00 1.00 O ATOM 0 H SER A 55 -10.148 11.061 10.238 1.00 1.00 H new ATOM 0 HA SER A 55 -10.911 13.614 9.370 1.00 1.00 H new ATOM 0 HB2 SER A 55 -8.602 13.021 10.103 1.00 1.00 H new ATOM 0 HB3 SER A 55 -8.446 11.875 8.786 1.00 1.00 H new ATOM 0 HG SER A 55 -7.451 13.919 8.294 1.00 1.00 H new ATOM 796 N ARG A 56 -11.182 13.709 6.885 1.00 1.00 N ATOM 797 CA ARG A 56 -11.482 13.797 5.445 1.00 1.00 C ATOM 798 C ARG A 56 -10.254 13.444 4.595 1.00 1.00 C ATOM 799 O ARG A 56 -10.410 12.833 3.540 1.00 1.00 O ATOM 800 CB ARG A 56 -12.015 15.209 5.132 1.00 1.00 C ATOM 801 CG ARG A 56 -12.466 15.422 3.675 1.00 1.00 C ATOM 802 CD ARG A 56 -13.739 14.647 3.313 1.00 1.00 C ATOM 803 NE ARG A 56 -14.936 15.230 3.952 1.00 1.00 N ATOM 804 CZ ARG A 56 -16.192 14.990 3.629 1.00 1.00 C ATOM 805 NH1 ARG A 56 -16.532 14.077 2.768 1.00 1.00 N ATOM 806 NH2 ARG A 56 -17.151 15.690 4.156 1.00 1.00 N ATOM 0 H ARG A 56 -11.271 14.602 7.370 1.00 1.00 H new ATOM 0 HA ARG A 56 -12.249 13.067 5.188 1.00 1.00 H new ATOM 0 HB2 ARG A 56 -12.857 15.419 5.792 1.00 1.00 H new ATOM 0 HB3 ARG A 56 -11.237 15.936 5.366 1.00 1.00 H new ATOM 0 HG2 ARG A 56 -12.636 16.485 3.507 1.00 1.00 H new ATOM 0 HG3 ARG A 56 -11.662 15.118 3.005 1.00 1.00 H new ATOM 0 HD2 ARG A 56 -13.869 14.646 2.231 1.00 1.00 H new ATOM 0 HD3 ARG A 56 -13.632 13.607 3.622 1.00 1.00 H new ATOM 0 HE ARG A 56 -14.775 15.883 4.719 1.00 1.00 H new ATOM 0 HH11 ARG A 56 -15.814 13.513 2.313 1.00 1.00 H new ATOM 0 HH12 ARG A 56 -17.516 13.925 2.548 1.00 1.00 H new ATOM 0 HH21 ARG A 56 -16.935 16.430 4.824 1.00 1.00 H new ATOM 0 HH22 ARG A 56 -18.120 15.500 3.902 1.00 1.00 H new ATOM 820 N LYS A 57 -9.040 13.781 5.054 1.00 1.00 N ATOM 821 CA LYS A 57 -7.775 13.468 4.359 1.00 1.00 C ATOM 822 C LYS A 57 -7.571 11.949 4.290 1.00 1.00 C ATOM 823 O LYS A 57 -7.302 11.410 3.217 1.00 1.00 O ATOM 824 CB LYS A 57 -6.619 14.192 5.088 1.00 1.00 C ATOM 825 CG LYS A 57 -5.357 14.484 4.256 1.00 1.00 C ATOM 826 CD LYS A 57 -4.650 13.250 3.672 1.00 1.00 C ATOM 827 CE LYS A 57 -3.288 13.597 3.057 1.00 1.00 C ATOM 828 NZ LYS A 57 -2.255 13.883 4.085 1.00 1.00 N ATOM 0 H LYS A 57 -8.903 14.286 5.930 1.00 1.00 H new ATOM 0 HA LYS A 57 -7.802 13.824 3.329 1.00 1.00 H new ATOM 0 HB2 LYS A 57 -6.999 15.138 5.475 1.00 1.00 H new ATOM 0 HB3 LYS A 57 -6.328 13.590 5.949 1.00 1.00 H new ATOM 0 HG2 LYS A 57 -5.629 15.148 3.435 1.00 1.00 H new ATOM 0 HG3 LYS A 57 -4.648 15.026 4.882 1.00 1.00 H new ATOM 0 HD2 LYS A 57 -4.513 12.507 4.457 1.00 1.00 H new ATOM 0 HD3 LYS A 57 -5.285 12.796 2.911 1.00 1.00 H new ATOM 0 HE2 LYS A 57 -2.954 12.769 2.432 1.00 1.00 H new ATOM 0 HE3 LYS A 57 -3.398 14.464 2.406 1.00 1.00 H new ATOM 0 HZ1 LYS A 57 -1.311 13.844 3.649 1.00 1.00 H new ATOM 0 HZ2 LYS A 57 -2.414 14.831 4.482 1.00 1.00 H new ATOM 0 HZ3 LYS A 57 -2.315 13.175 4.844 1.00 1.00 H new ATOM 842 N HIS A 58 -7.792 11.248 5.407 1.00 1.00 N ATOM 843 CA HIS A 58 -7.730 9.781 5.471 1.00 1.00 C ATOM 844 C HIS A 58 -8.787 9.158 4.555 1.00 1.00 C ATOM 845 O HIS A 58 -8.457 8.310 3.729 1.00 1.00 O ATOM 846 CB HIS A 58 -7.922 9.318 6.923 1.00 1.00 C ATOM 847 CG HIS A 58 -8.130 7.828 7.066 1.00 1.00 C ATOM 848 ND1 HIS A 58 -7.120 6.872 7.187 1.00 1.00 N ATOM 849 CD2 HIS A 58 -9.339 7.195 7.051 1.00 1.00 C ATOM 850 CE1 HIS A 58 -7.743 5.684 7.232 1.00 1.00 C ATOM 851 NE2 HIS A 58 -9.075 5.847 7.157 1.00 1.00 N ATOM 0 H HIS A 58 -8.021 11.685 6.300 1.00 1.00 H new ATOM 0 HA HIS A 58 -6.751 9.450 5.125 1.00 1.00 H new ATOM 0 HB2 HIS A 58 -7.049 9.611 7.506 1.00 1.00 H new ATOM 0 HB3 HIS A 58 -8.780 9.838 7.350 1.00 1.00 H new ATOM 0 HD2 HIS A 58 -10.311 7.659 6.972 1.00 1.00 H new ATOM 0 HE1 HIS A 58 -7.244 4.730 7.317 1.00 1.00 H new ATOM 0 HE2 HIS A 58 -9.771 5.101 7.175 1.00 1.00 H new ATOM 859 N ALA A 59 -10.042 9.613 4.648 1.00 1.00 N ATOM 860 CA ALA A 59 -11.132 9.115 3.810 1.00 1.00 C ATOM 861 C ALA A 59 -10.840 9.292 2.309 1.00 1.00 C ATOM 862 O ALA A 59 -11.027 8.353 1.536 1.00 1.00 O ATOM 863 CB ALA A 59 -12.427 9.814 4.229 1.00 1.00 C ATOM 0 H ALA A 59 -10.328 10.337 5.307 1.00 1.00 H new ATOM 0 HA ALA A 59 -11.236 8.041 3.961 1.00 1.00 H new ATOM 0 HB1 ALA A 59 -13.251 9.453 3.613 1.00 1.00 H new ATOM 0 HB2 ALA A 59 -12.635 9.597 5.277 1.00 1.00 H new ATOM 0 HB3 ALA A 59 -12.319 10.890 4.096 1.00 1.00 H new ATOM 869 N ASN A 60 -10.335 10.459 1.889 1.00 1.00 N ATOM 870 CA ASN A 60 -9.957 10.724 0.500 1.00 1.00 C ATOM 871 C ASN A 60 -8.836 9.777 0.029 1.00 1.00 C ATOM 872 O ASN A 60 -8.954 9.164 -1.036 1.00 1.00 O ATOM 873 CB ASN A 60 -9.556 12.205 0.376 1.00 1.00 C ATOM 874 CG ASN A 60 -9.161 12.572 -1.045 1.00 1.00 C ATOM 875 OD1 ASN A 60 -8.009 12.481 -1.439 1.00 1.00 O ATOM 876 ND2 ASN A 60 -10.102 12.993 -1.862 1.00 1.00 N ATOM 0 H ASN A 60 -10.177 11.251 2.512 1.00 1.00 H new ATOM 0 HA ASN A 60 -10.806 10.530 -0.155 1.00 1.00 H new ATOM 0 HB2 ASN A 60 -10.388 12.833 0.695 1.00 1.00 H new ATOM 0 HB3 ASN A 60 -8.724 12.413 1.049 1.00 1.00 H new ATOM 0 HD21 ASN A 60 -9.869 13.243 -2.823 1.00 1.00 H new ATOM 0 HD22 ASN A 60 -11.065 13.070 -1.535 1.00 1.00 H new ATOM 883 N LYS A 61 -7.772 9.604 0.829 1.00 1.00 N ATOM 884 CA LYS A 61 -6.663 8.697 0.508 1.00 1.00 C ATOM 885 C LYS A 61 -7.124 7.239 0.411 1.00 1.00 C ATOM 886 O LYS A 61 -6.742 6.540 -0.525 1.00 1.00 O ATOM 887 CB LYS A 61 -5.527 8.896 1.526 1.00 1.00 C ATOM 888 CG LYS A 61 -4.179 8.606 0.859 1.00 1.00 C ATOM 889 CD LYS A 61 -3.008 8.856 1.820 1.00 1.00 C ATOM 890 CE LYS A 61 -1.649 8.848 1.104 1.00 1.00 C ATOM 891 NZ LYS A 61 -1.308 7.519 0.532 1.00 1.00 N ATOM 0 H LYS A 61 -7.658 10.091 1.718 1.00 1.00 H new ATOM 0 HA LYS A 61 -6.278 8.945 -0.481 1.00 1.00 H new ATOM 0 HB2 LYS A 61 -5.543 9.917 1.908 1.00 1.00 H new ATOM 0 HB3 LYS A 61 -5.671 8.234 2.380 1.00 1.00 H new ATOM 0 HG2 LYS A 61 -4.156 7.571 0.518 1.00 1.00 H new ATOM 0 HG3 LYS A 61 -4.066 9.235 -0.024 1.00 1.00 H new ATOM 0 HD2 LYS A 61 -3.148 9.816 2.317 1.00 1.00 H new ATOM 0 HD3 LYS A 61 -3.010 8.092 2.597 1.00 1.00 H new ATOM 0 HE2 LYS A 61 -1.659 9.590 0.306 1.00 1.00 H new ATOM 0 HE3 LYS A 61 -0.871 9.147 1.807 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 -0.324 7.528 0.197 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 -1.418 6.788 1.263 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 -1.943 7.311 -0.265 1.00 1.00 H new ATOM 905 N VAL A 62 -7.990 6.790 1.325 1.00 1.00 N ATOM 906 CA VAL A 62 -8.586 5.441 1.302 1.00 1.00 C ATOM 907 C VAL A 62 -9.480 5.255 0.073 1.00 1.00 C ATOM 908 O VAL A 62 -9.384 4.223 -0.580 1.00 1.00 O ATOM 909 CB VAL A 62 -9.340 5.142 2.611 1.00 1.00 C ATOM 910 CG1 VAL A 62 -10.158 3.843 2.556 1.00 1.00 C ATOM 911 CG2 VAL A 62 -8.328 4.985 3.751 1.00 1.00 C ATOM 0 H VAL A 62 -8.304 7.356 2.113 1.00 1.00 H new ATOM 0 HA VAL A 62 -7.776 4.716 1.226 1.00 1.00 H new ATOM 0 HB VAL A 62 -10.023 5.976 2.768 1.00 1.00 H new ATOM 0 HG11 VAL A 62 -10.664 3.691 3.509 1.00 1.00 H new ATOM 0 HG12 VAL A 62 -10.898 3.913 1.759 1.00 1.00 H new ATOM 0 HG13 VAL A 62 -9.493 3.002 2.361 1.00 1.00 H new ATOM 0 HG21 VAL A 62 -8.857 4.773 4.680 1.00 1.00 H new ATOM 0 HG22 VAL A 62 -7.649 4.163 3.524 1.00 1.00 H new ATOM 0 HG23 VAL A 62 -7.757 5.907 3.860 1.00 1.00 H new ATOM 921 N ARG A 63 -10.304 6.244 -0.296 1.00 1.00 N ATOM 922 CA ARG A 63 -11.164 6.210 -1.497 1.00 1.00 C ATOM 923 C ARG A 63 -10.338 5.990 -2.772 1.00 1.00 C ATOM 924 O ARG A 63 -10.703 5.157 -3.602 1.00 1.00 O ATOM 925 CB ARG A 63 -11.996 7.501 -1.517 1.00 1.00 C ATOM 926 CG ARG A 63 -13.108 7.561 -2.575 1.00 1.00 C ATOM 927 CD ARG A 63 -13.922 8.831 -2.293 1.00 1.00 C ATOM 928 NE ARG A 63 -15.030 9.048 -3.245 1.00 1.00 N ATOM 929 CZ ARG A 63 -15.877 10.067 -3.212 1.00 1.00 C ATOM 930 NH1 ARG A 63 -15.800 11.003 -2.310 1.00 1.00 N ATOM 931 NH2 ARG A 63 -16.829 10.178 -4.092 1.00 1.00 N ATOM 0 H ARG A 63 -10.397 7.108 0.238 1.00 1.00 H new ATOM 0 HA ARG A 63 -11.846 5.361 -1.461 1.00 1.00 H new ATOM 0 HB2 ARG A 63 -12.447 7.636 -0.534 1.00 1.00 H new ATOM 0 HB3 ARG A 63 -11.322 8.343 -1.676 1.00 1.00 H new ATOM 0 HG2 ARG A 63 -12.685 7.588 -3.579 1.00 1.00 H new ATOM 0 HG3 ARG A 63 -13.742 6.676 -2.520 1.00 1.00 H new ATOM 0 HD2 ARG A 63 -14.328 8.775 -1.283 1.00 1.00 H new ATOM 0 HD3 ARG A 63 -13.256 9.693 -2.322 1.00 1.00 H new ATOM 0 HE ARG A 63 -15.153 8.359 -3.987 1.00 1.00 H new ATOM 0 HH11 ARG A 63 -15.070 10.967 -1.598 1.00 1.00 H new ATOM 0 HH12 ARG A 63 -16.469 11.773 -2.315 1.00 1.00 H new ATOM 0 HH21 ARG A 63 -16.933 9.474 -4.823 1.00 1.00 H new ATOM 0 HH22 ARG A 63 -17.472 10.969 -4.051 1.00 1.00 H new ATOM 945 N ARG A 64 -9.191 6.675 -2.895 1.00 1.00 N ATOM 946 CA ARG A 64 -8.228 6.483 -3.999 1.00 1.00 C ATOM 947 C ARG A 64 -7.569 5.100 -3.924 1.00 1.00 C ATOM 948 O ARG A 64 -7.565 4.372 -4.915 1.00 1.00 O ATOM 949 CB ARG A 64 -7.161 7.598 -3.979 1.00 1.00 C ATOM 950 CG ARG A 64 -7.702 9.001 -4.304 1.00 1.00 C ATOM 951 CD ARG A 64 -8.176 9.138 -5.758 1.00 1.00 C ATOM 952 NE ARG A 64 -8.587 10.524 -6.064 1.00 1.00 N ATOM 953 CZ ARG A 64 -9.783 11.063 -5.906 1.00 1.00 C ATOM 954 NH1 ARG A 64 -10.792 10.394 -5.423 1.00 1.00 N ATOM 955 NH2 ARG A 64 -9.991 12.305 -6.236 1.00 1.00 N ATOM 0 H ARG A 64 -8.899 7.387 -2.225 1.00 1.00 H new ATOM 0 HA ARG A 64 -8.774 6.540 -4.941 1.00 1.00 H new ATOM 0 HB2 ARG A 64 -6.695 7.621 -2.994 1.00 1.00 H new ATOM 0 HB3 ARG A 64 -6.379 7.348 -4.696 1.00 1.00 H new ATOM 0 HG2 ARG A 64 -8.531 9.229 -3.634 1.00 1.00 H new ATOM 0 HG3 ARG A 64 -6.923 9.739 -4.110 1.00 1.00 H new ATOM 0 HD2 ARG A 64 -7.375 8.837 -6.433 1.00 1.00 H new ATOM 0 HD3 ARG A 64 -9.012 8.462 -5.935 1.00 1.00 H new ATOM 0 HE ARG A 64 -7.863 11.136 -6.441 1.00 1.00 H new ATOM 0 HH11 ARG A 64 -10.674 9.418 -5.151 1.00 1.00 H new ATOM 0 HH12 ARG A 64 -11.700 10.847 -5.317 1.00 1.00 H new ATOM 0 HH21 ARG A 64 -9.229 12.866 -6.618 1.00 1.00 H new ATOM 0 HH22 ARG A 64 -10.916 12.717 -6.113 1.00 1.00 H new ATOM 969 N TYR A 65 -7.056 4.709 -2.756 1.00 1.00 N ATOM 970 CA TYR A 65 -6.427 3.401 -2.528 1.00 1.00 C ATOM 971 C TYR A 65 -7.361 2.228 -2.875 1.00 1.00 C ATOM 972 O TYR A 65 -6.946 1.292 -3.551 1.00 1.00 O ATOM 973 CB TYR A 65 -5.938 3.311 -1.076 1.00 1.00 C ATOM 974 CG TYR A 65 -5.282 1.986 -0.737 1.00 1.00 C ATOM 975 CD1 TYR A 65 -3.923 1.774 -1.040 1.00 1.00 C ATOM 976 CD2 TYR A 65 -6.044 0.949 -0.164 1.00 1.00 C ATOM 977 CE1 TYR A 65 -3.328 0.524 -0.780 1.00 1.00 C ATOM 978 CE2 TYR A 65 -5.456 -0.305 0.090 1.00 1.00 C ATOM 979 CZ TYR A 65 -4.096 -0.522 -0.220 1.00 1.00 C ATOM 980 OH TYR A 65 -3.537 -1.742 0.008 1.00 1.00 O ATOM 0 H TYR A 65 -7.065 5.301 -1.925 1.00 1.00 H new ATOM 0 HA TYR A 65 -5.574 3.318 -3.201 1.00 1.00 H new ATOM 0 HB2 TYR A 65 -5.228 4.117 -0.890 1.00 1.00 H new ATOM 0 HB3 TYR A 65 -6.783 3.470 -0.406 1.00 1.00 H new ATOM 0 HD1 TYR A 65 -3.336 2.571 -1.472 1.00 1.00 H new ATOM 0 HD2 TYR A 65 -7.082 1.116 0.081 1.00 1.00 H new ATOM 0 HE1 TYR A 65 -2.285 0.365 -1.009 1.00 1.00 H new ATOM 0 HE2 TYR A 65 -6.045 -1.100 0.522 1.00 1.00 H new ATOM 0 HH TYR A 65 -4.207 -2.341 0.397 1.00 1.00 H new ATOM 990 N MET A 66 -8.633 2.292 -2.464 1.00 1.00 N ATOM 991 CA MET A 66 -9.658 1.278 -2.748 1.00 1.00 C ATOM 992 C MET A 66 -9.876 1.065 -4.255 1.00 1.00 C ATOM 993 O MET A 66 -10.134 -0.063 -4.680 1.00 1.00 O ATOM 994 CB MET A 66 -10.977 1.663 -2.052 1.00 1.00 C ATOM 995 CG MET A 66 -10.914 1.351 -0.553 1.00 1.00 C ATOM 996 SD MET A 66 -10.924 -0.423 -0.166 1.00 1.00 S ATOM 997 CE MET A 66 -9.850 -0.417 1.291 1.00 1.00 C ATOM 0 H MET A 66 -8.988 3.071 -1.910 1.00 1.00 H new ATOM 0 HA MET A 66 -9.302 0.328 -2.351 1.00 1.00 H new ATOM 0 HB2 MET A 66 -11.174 2.725 -2.199 1.00 1.00 H new ATOM 0 HB3 MET A 66 -11.805 1.119 -2.506 1.00 1.00 H new ATOM 0 HG2 MET A 66 -10.011 1.798 -0.137 1.00 1.00 H new ATOM 0 HG3 MET A 66 -11.761 1.825 -0.058 1.00 1.00 H new ATOM 0 HE1 MET A 66 -9.742 -1.434 1.668 1.00 1.00 H new ATOM 0 HE2 MET A 66 -8.870 -0.025 1.019 1.00 1.00 H new ATOM 0 HE3 MET A 66 -10.290 0.211 2.065 1.00 1.00 H new ATOM 1007 N ALA A 67 -9.737 2.115 -5.073 1.00 1.00 N ATOM 1008 CA ALA A 67 -9.825 2.021 -6.532 1.00 1.00 C ATOM 1009 C ALA A 67 -8.527 1.437 -7.132 1.00 1.00 C ATOM 1010 O ALA A 67 -8.577 0.555 -7.990 1.00 1.00 O ATOM 1011 CB ALA A 67 -10.134 3.413 -7.098 1.00 1.00 C ATOM 0 H ALA A 67 -9.559 3.061 -4.736 1.00 1.00 H new ATOM 0 HA ALA A 67 -10.629 1.338 -6.807 1.00 1.00 H new ATOM 0 HB1 ALA A 67 -10.202 3.357 -8.184 1.00 1.00 H new ATOM 0 HB2 ALA A 67 -11.081 3.768 -6.693 1.00 1.00 H new ATOM 0 HB3 ALA A 67 -9.338 4.104 -6.820 1.00 1.00 H new ATOM 1017 N ILE A 68 -7.358 1.887 -6.654 1.00 1.00 N ATOM 1018 CA ILE A 68 -6.030 1.405 -7.085 1.00 1.00 C ATOM 1019 C ILE A 68 -5.860 -0.098 -6.787 1.00 1.00 C ATOM 1020 O ILE A 68 -5.354 -0.843 -7.627 1.00 1.00 O ATOM 1021 CB ILE A 68 -4.923 2.266 -6.426 1.00 1.00 C ATOM 1022 CG1 ILE A 68 -4.977 3.716 -6.968 1.00 1.00 C ATOM 1023 CG2 ILE A 68 -3.518 1.678 -6.665 1.00 1.00 C ATOM 1024 CD1 ILE A 68 -4.194 4.728 -6.120 1.00 1.00 C ATOM 0 H ILE A 68 -7.304 2.613 -5.940 1.00 1.00 H new ATOM 0 HA ILE A 68 -5.942 1.515 -8.166 1.00 1.00 H new ATOM 0 HB ILE A 68 -5.110 2.267 -5.352 1.00 1.00 H new ATOM 0 HG12 ILE A 68 -4.584 3.728 -7.985 1.00 1.00 H new ATOM 0 HG13 ILE A 68 -6.018 4.033 -7.025 1.00 1.00 H new ATOM 0 HG21 ILE A 68 -2.772 2.312 -6.186 1.00 1.00 H new ATOM 0 HG22 ILE A 68 -3.467 0.675 -6.242 1.00 1.00 H new ATOM 0 HG23 ILE A 68 -3.321 1.631 -7.736 1.00 1.00 H new ATOM 0 HD11 ILE A 68 -4.280 5.719 -6.565 1.00 1.00 H new ATOM 0 HD12 ILE A 68 -4.601 4.747 -5.109 1.00 1.00 H new ATOM 0 HD13 ILE A 68 -3.144 4.437 -6.084 1.00 1.00 H new ATOM 1036 N ASN A 69 -6.334 -0.561 -5.624 1.00 1.00 N ATOM 1037 CA ASN A 69 -6.304 -1.961 -5.172 1.00 1.00 C ATOM 1038 C ASN A 69 -7.013 -2.954 -6.129 1.00 1.00 C ATOM 1039 O ASN A 69 -6.758 -4.158 -6.070 1.00 1.00 O ATOM 1040 CB ASN A 69 -6.900 -1.989 -3.750 1.00 1.00 C ATOM 1041 CG ASN A 69 -6.812 -3.354 -3.086 1.00 1.00 C ATOM 1042 OD1 ASN A 69 -7.765 -4.121 -3.052 1.00 1.00 O ATOM 1043 ND2 ASN A 69 -5.677 -3.695 -2.517 1.00 1.00 N ATOM 0 H ASN A 69 -6.769 0.057 -4.939 1.00 1.00 H new ATOM 0 HA ASN A 69 -5.272 -2.311 -5.169 1.00 1.00 H new ATOM 0 HB2 ASN A 69 -6.380 -1.258 -3.131 1.00 1.00 H new ATOM 0 HB3 ASN A 69 -7.945 -1.682 -3.796 1.00 1.00 H new ATOM 0 HD21 ASN A 69 -5.592 -4.597 -2.049 1.00 1.00 H new ATOM 0 HD22 ASN A 69 -4.881 -3.057 -2.544 1.00 1.00 H new ATOM 1050 N GLN A 70 -7.866 -2.453 -7.030 1.00 1.00 N ATOM 1051 CA GLN A 70 -8.614 -3.212 -8.045 1.00 1.00 C ATOM 1052 C GLN A 70 -8.412 -2.648 -9.472 1.00 1.00 C ATOM 1053 O GLN A 70 -9.209 -2.907 -10.377 1.00 1.00 O ATOM 1054 CB GLN A 70 -10.092 -3.310 -7.616 1.00 1.00 C ATOM 1055 CG GLN A 70 -10.818 -1.956 -7.587 1.00 1.00 C ATOM 1056 CD GLN A 70 -12.203 -2.064 -6.953 1.00 1.00 C ATOM 1057 OE1 GLN A 70 -13.135 -2.636 -7.506 1.00 1.00 O ATOM 1058 NE2 GLN A 70 -12.393 -1.519 -5.770 1.00 1.00 N ATOM 0 H GLN A 70 -8.065 -1.454 -7.075 1.00 1.00 H new ATOM 0 HA GLN A 70 -8.217 -4.226 -8.102 1.00 1.00 H new ATOM 0 HB2 GLN A 70 -10.616 -3.979 -8.299 1.00 1.00 H new ATOM 0 HB3 GLN A 70 -10.144 -3.762 -6.625 1.00 1.00 H new ATOM 0 HG2 GLN A 70 -10.219 -1.235 -7.030 1.00 1.00 H new ATOM 0 HG3 GLN A 70 -10.913 -1.574 -8.603 1.00 1.00 H new ATOM 0 HE21 GLN A 70 -11.625 -1.040 -5.300 1.00 1.00 H new ATOM 0 HE22 GLN A 70 -13.308 -1.576 -5.324 1.00 1.00 H new ATOM 1067 N GLY A 71 -7.342 -1.868 -9.674 1.00 1.00 N ATOM 1068 CA GLY A 71 -6.981 -1.206 -10.934 1.00 1.00 C ATOM 1069 C GLY A 71 -5.478 -0.919 -11.038 1.00 1.00 C ATOM 1070 O GLY A 71 -5.078 0.164 -11.465 1.00 1.00 O ATOM 0 H GLY A 71 -6.674 -1.672 -8.929 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -7.286 -1.834 -11.771 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -7.533 -0.270 -11.020 1.00 1.00 H new ATOM 1074 N GLU A 72 -4.643 -1.878 -10.622 1.00 1.00 N ATOM 1075 CA GLU A 72 -3.167 -1.827 -10.594 1.00 1.00 C ATOM 1076 C GLU A 72 -2.515 -1.919 -12.003 1.00 1.00 C ATOM 1077 O GLU A 72 -1.542 -2.642 -12.231 1.00 1.00 O ATOM 1078 CB GLU A 72 -2.678 -2.910 -9.610 1.00 1.00 C ATOM 1079 CG GLU A 72 -1.238 -2.756 -9.090 1.00 1.00 C ATOM 1080 CD GLU A 72 -1.067 -1.523 -8.180 1.00 1.00 C ATOM 1081 OE1 GLU A 72 -0.751 -0.424 -8.696 1.00 1.00 O ATOM 1082 OE2 GLU A 72 -1.215 -1.655 -6.940 1.00 1.00 O ATOM 0 H GLU A 72 -4.997 -2.769 -10.273 1.00 1.00 H new ATOM 0 HA GLU A 72 -2.843 -0.848 -10.241 1.00 1.00 H new ATOM 0 HB2 GLU A 72 -3.352 -2.924 -8.753 1.00 1.00 H new ATOM 0 HB3 GLU A 72 -2.764 -3.881 -10.099 1.00 1.00 H new ATOM 0 HG2 GLU A 72 -0.957 -3.653 -8.538 1.00 1.00 H new ATOM 0 HG3 GLU A 72 -0.556 -2.676 -9.937 1.00 1.00 H new ATOM 1089 N ASP A 73 -3.073 -1.208 -12.985 1.00 1.00 N ATOM 1090 CA ASP A 73 -2.595 -1.144 -14.374 1.00 1.00 C ATOM 1091 C ASP A 73 -1.271 -0.348 -14.503 1.00 1.00 C ATOM 1092 O ASP A 73 -0.885 0.401 -13.597 1.00 1.00 O ATOM 1093 CB ASP A 73 -3.714 -0.525 -15.234 1.00 1.00 C ATOM 1094 CG ASP A 73 -3.446 -0.587 -16.750 1.00 1.00 C ATOM 1095 OD1 ASP A 73 -2.818 -1.565 -17.222 1.00 1.00 O ATOM 1096 OD2 ASP A 73 -3.881 0.338 -17.476 1.00 1.00 O ATOM 0 H ASP A 73 -3.904 -0.637 -12.831 1.00 1.00 H new ATOM 0 HA ASP A 73 -2.367 -2.151 -14.724 1.00 1.00 H new ATOM 0 HB2 ASP A 73 -4.650 -1.040 -15.020 1.00 1.00 H new ATOM 0 HB3 ASP A 73 -3.849 0.516 -14.942 1.00 1.00 H new ATOM 1101 N SER A 74 -0.574 -0.487 -15.636 1.00 1.00 N ATOM 1102 CA SER A 74 0.690 0.206 -15.936 1.00 1.00 C ATOM 1103 C SER A 74 0.572 1.734 -15.804 1.00 1.00 C ATOM 1104 O SER A 74 -0.389 2.344 -16.285 1.00 1.00 O ATOM 1105 CB SER A 74 1.165 -0.142 -17.353 1.00 1.00 C ATOM 1106 OG SER A 74 1.342 -1.545 -17.505 1.00 1.00 O ATOM 0 H SER A 74 -0.879 -1.100 -16.392 1.00 1.00 H new ATOM 0 HA SER A 74 1.417 -0.138 -15.200 1.00 1.00 H new ATOM 0 HB2 SER A 74 0.438 0.217 -18.082 1.00 1.00 H new ATOM 0 HB3 SER A 74 2.104 0.371 -17.561 1.00 1.00 H new ATOM 0 HG SER A 74 1.643 -1.740 -18.417 1.00 1.00 H new ATOM 1112 N VAL A 75 1.561 2.367 -15.163 1.00 1.00 N ATOM 1113 CA VAL A 75 1.596 3.823 -14.928 1.00 1.00 C ATOM 1114 C VAL A 75 1.943 4.573 -16.231 1.00 1.00 C ATOM 1115 O VAL A 75 2.941 4.221 -16.870 1.00 1.00 O ATOM 1116 CB VAL A 75 2.628 4.170 -13.829 1.00 1.00 C ATOM 1117 CG1 VAL A 75 2.673 5.673 -13.518 1.00 1.00 C ATOM 1118 CG2 VAL A 75 2.305 3.451 -12.510 1.00 1.00 C ATOM 0 H VAL A 75 2.373 1.879 -14.786 1.00 1.00 H new ATOM 0 HA VAL A 75 0.607 4.138 -14.594 1.00 1.00 H new ATOM 0 HB VAL A 75 3.590 3.845 -14.226 1.00 1.00 H new ATOM 0 HG11 VAL A 75 3.413 5.862 -12.740 1.00 1.00 H new ATOM 0 HG12 VAL A 75 2.945 6.223 -14.419 1.00 1.00 H new ATOM 0 HG13 VAL A 75 1.693 6.003 -13.174 1.00 1.00 H new ATOM 0 HG21 VAL A 75 3.049 3.717 -11.759 1.00 1.00 H new ATOM 0 HG22 VAL A 75 1.316 3.753 -12.164 1.00 1.00 H new ATOM 0 HG23 VAL A 75 2.320 2.373 -12.670 1.00 1.00 H new ATOM 1128 N PRO A 76 1.178 5.609 -16.638 1.00 1.00 N ATOM 1129 CA PRO A 76 1.424 6.414 -17.845 1.00 1.00 C ATOM 1130 C PRO A 76 2.571 7.436 -17.640 1.00 1.00 C ATOM 1131 O PRO A 76 2.412 8.639 -17.860 1.00 1.00 O ATOM 1132 CB PRO A 76 0.063 7.058 -18.149 1.00 1.00 C ATOM 1133 CG PRO A 76 -0.504 7.315 -16.756 1.00 1.00 C ATOM 1134 CD PRO A 76 -0.028 6.094 -15.970 1.00 1.00 C ATOM 0 HA PRO A 76 1.774 5.820 -18.689 1.00 1.00 H new ATOM 0 HB2 PRO A 76 0.170 7.981 -18.719 1.00 1.00 H new ATOM 0 HB3 PRO A 76 -0.578 6.396 -18.731 1.00 1.00 H new ATOM 0 HG2 PRO A 76 -0.125 8.244 -16.330 1.00 1.00 H new ATOM 0 HG3 PRO A 76 -1.591 7.390 -16.769 1.00 1.00 H new ATOM 0 HD2 PRO A 76 0.183 6.359 -14.934 1.00 1.00 H new ATOM 0 HD3 PRO A 76 -0.797 5.322 -15.951 1.00 1.00 H new ATOM 1142 N ALA A 77 3.728 6.963 -17.169 1.00 1.00 N ATOM 1143 CA ALA A 77 4.917 7.767 -16.872 1.00 1.00 C ATOM 1144 C ALA A 77 5.484 8.525 -18.096 1.00 1.00 C ATOM 1145 O ALA A 77 5.293 8.128 -19.252 1.00 1.00 O ATOM 1146 CB ALA A 77 5.970 6.840 -16.251 1.00 1.00 C ATOM 0 H ALA A 77 3.868 5.971 -16.977 1.00 1.00 H new ATOM 0 HA ALA A 77 4.630 8.553 -16.174 1.00 1.00 H new ATOM 0 HB1 ALA A 77 6.868 7.413 -16.019 1.00 1.00 H new ATOM 0 HB2 ALA A 77 5.574 6.401 -15.336 1.00 1.00 H new ATOM 0 HB3 ALA A 77 6.218 6.047 -16.956 1.00 1.00 H new ATOM 1152 N LYS A 78 6.208 9.620 -17.823 1.00 1.00 N ATOM 1153 CA LYS A 78 6.863 10.489 -18.822 1.00 1.00 C ATOM 1154 C LYS A 78 7.975 9.789 -19.625 1.00 1.00 C ATOM 1155 O LYS A 78 8.464 8.721 -19.248 1.00 1.00 O ATOM 1156 CB LYS A 78 7.364 11.773 -18.138 1.00 1.00 C ATOM 1157 CG LYS A 78 8.520 11.535 -17.156 1.00 1.00 C ATOM 1158 CD LYS A 78 8.929 12.856 -16.496 1.00 1.00 C ATOM 1159 CE LYS A 78 10.076 12.628 -15.504 1.00 1.00 C ATOM 1160 NZ LYS A 78 10.483 13.894 -14.838 1.00 1.00 N ATOM 0 H LYS A 78 6.362 9.940 -16.867 1.00 1.00 H new ATOM 0 HA LYS A 78 6.111 10.748 -19.568 1.00 1.00 H new ATOM 0 HB2 LYS A 78 7.687 12.480 -18.902 1.00 1.00 H new ATOM 0 HB3 LYS A 78 6.535 12.238 -17.604 1.00 1.00 H new ATOM 0 HG2 LYS A 78 8.218 10.817 -16.394 1.00 1.00 H new ATOM 0 HG3 LYS A 78 9.371 11.103 -17.682 1.00 1.00 H new ATOM 0 HD2 LYS A 78 9.237 13.571 -17.259 1.00 1.00 H new ATOM 0 HD3 LYS A 78 8.074 13.291 -15.979 1.00 1.00 H new ATOM 0 HE2 LYS A 78 9.768 11.903 -14.751 1.00 1.00 H new ATOM 0 HE3 LYS A 78 10.931 12.200 -16.027 1.00 1.00 H new ATOM 0 HZ1 LYS A 78 11.260 13.703 -14.174 1.00 1.00 H new ATOM 0 HZ2 LYS A 78 10.800 14.577 -15.555 1.00 1.00 H new ATOM 0 HZ3 LYS A 78 9.673 14.289 -14.318 1.00 1.00 H new ATOM 1174 N LYS A 79 8.410 10.431 -20.717 1.00 1.00 N ATOM 1175 CA LYS A 79 9.502 9.998 -21.618 1.00 1.00 C ATOM 1176 C LYS A 79 10.884 10.169 -20.961 1.00 1.00 C ATOM 1177 O LYS A 79 11.675 11.024 -21.357 1.00 1.00 O ATOM 1178 CB LYS A 79 9.397 10.741 -22.968 1.00 1.00 C ATOM 1179 CG LYS A 79 8.114 10.378 -23.739 1.00 1.00 C ATOM 1180 CD LYS A 79 7.974 11.133 -25.070 1.00 1.00 C ATOM 1181 CE LYS A 79 9.062 10.748 -26.082 1.00 1.00 C ATOM 1182 NZ LYS A 79 8.864 11.437 -27.385 1.00 1.00 N ATOM 0 H LYS A 79 7.993 11.312 -21.017 1.00 1.00 H new ATOM 0 HA LYS A 79 9.391 8.931 -21.812 1.00 1.00 H new ATOM 0 HB2 LYS A 79 9.419 11.816 -22.791 1.00 1.00 H new ATOM 0 HB3 LYS A 79 10.266 10.501 -23.580 1.00 1.00 H new ATOM 0 HG2 LYS A 79 8.106 9.306 -23.934 1.00 1.00 H new ATOM 0 HG3 LYS A 79 7.248 10.594 -23.113 1.00 1.00 H new ATOM 0 HD2 LYS A 79 6.994 10.927 -25.499 1.00 1.00 H new ATOM 0 HD3 LYS A 79 8.020 12.206 -24.882 1.00 1.00 H new ATOM 0 HE2 LYS A 79 10.042 11.004 -25.679 1.00 1.00 H new ATOM 0 HE3 LYS A 79 9.052 9.669 -26.235 1.00 1.00 H new ATOM 0 HZ1 LYS A 79 9.616 11.154 -28.045 1.00 1.00 H new ATOM 0 HZ2 LYS A 79 7.939 11.173 -27.780 1.00 1.00 H new ATOM 0 HZ3 LYS A 79 8.898 12.467 -27.242 1.00 1.00 H new ATOM 1196 N PHE A 80 11.161 9.368 -19.930 1.00 1.00 N ATOM 1197 CA PHE A 80 12.382 9.367 -19.104 1.00 1.00 C ATOM 1198 C PHE A 80 13.724 9.427 -19.869 1.00 1.00 C ATOM 1199 O PHE A 80 14.710 9.938 -19.334 1.00 1.00 O ATOM 1200 CB PHE A 80 12.341 8.142 -18.173 1.00 1.00 C ATOM 1201 CG PHE A 80 12.406 6.801 -18.889 1.00 1.00 C ATOM 1202 CD1 PHE A 80 13.652 6.217 -19.187 1.00 1.00 C ATOM 1203 CD2 PHE A 80 11.220 6.145 -19.279 1.00 1.00 C ATOM 1204 CE1 PHE A 80 13.715 4.997 -19.886 1.00 1.00 C ATOM 1205 CE2 PHE A 80 11.284 4.925 -19.977 1.00 1.00 C ATOM 1206 CZ PHE A 80 12.531 4.352 -20.283 1.00 1.00 C ATOM 0 H PHE A 80 10.499 8.654 -19.626 1.00 1.00 H new ATOM 0 HA PHE A 80 12.366 10.303 -18.546 1.00 1.00 H new ATOM 0 HB2 PHE A 80 13.174 8.206 -17.473 1.00 1.00 H new ATOM 0 HB3 PHE A 80 11.425 8.180 -17.583 1.00 1.00 H new ATOM 0 HD1 PHE A 80 14.563 6.707 -18.878 1.00 1.00 H new ATOM 0 HD2 PHE A 80 10.261 6.580 -19.041 1.00 1.00 H new ATOM 0 HE1 PHE A 80 14.673 4.556 -20.117 1.00 1.00 H new ATOM 0 HE2 PHE A 80 10.374 4.428 -20.278 1.00 1.00 H new ATOM 0 HZ PHE A 80 12.579 3.418 -20.822 1.00 1.00 H new ATOM 1216 N LYS A 81 13.773 8.922 -21.112 1.00 1.00 N ATOM 1217 CA LYS A 81 14.964 8.935 -21.983 1.00 1.00 C ATOM 1218 C LYS A 81 15.376 10.351 -22.434 1.00 1.00 C ATOM 1219 O LYS A 81 16.552 10.584 -22.718 1.00 1.00 O ATOM 1220 CB LYS A 81 14.685 8.007 -23.183 1.00 1.00 C ATOM 1221 CG LYS A 81 15.933 7.737 -24.043 1.00 1.00 C ATOM 1222 CD LYS A 81 15.706 6.661 -25.117 1.00 1.00 C ATOM 1223 CE LYS A 81 14.674 7.094 -26.168 1.00 1.00 C ATOM 1224 NZ LYS A 81 14.525 6.073 -27.238 1.00 1.00 N ATOM 0 H LYS A 81 12.965 8.481 -21.552 1.00 1.00 H new ATOM 0 HA LYS A 81 15.819 8.570 -21.414 1.00 1.00 H new ATOM 0 HB2 LYS A 81 14.292 7.059 -22.817 1.00 1.00 H new ATOM 0 HB3 LYS A 81 13.911 8.453 -23.807 1.00 1.00 H new ATOM 0 HG2 LYS A 81 16.241 8.664 -24.526 1.00 1.00 H new ATOM 0 HG3 LYS A 81 16.753 7.427 -23.395 1.00 1.00 H new ATOM 0 HD2 LYS A 81 16.652 6.438 -25.610 1.00 1.00 H new ATOM 0 HD3 LYS A 81 15.371 5.740 -24.640 1.00 1.00 H new ATOM 0 HE2 LYS A 81 13.711 7.261 -25.686 1.00 1.00 H new ATOM 0 HE3 LYS A 81 14.979 8.043 -26.609 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 13.821 6.397 -27.931 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 15.439 5.932 -27.713 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 14.211 5.174 -26.819 1.00 1.00 H new ATOM 1238 N ALA A 82 14.430 11.293 -22.495 1.00 1.00 N ATOM 1239 CA ALA A 82 14.667 12.682 -22.896 1.00 1.00 C ATOM 1240 C ALA A 82 15.475 13.491 -21.854 1.00 1.00 C ATOM 1241 O ALA A 82 15.541 13.137 -20.672 1.00 1.00 O ATOM 1242 CB ALA A 82 13.306 13.339 -23.169 1.00 1.00 C ATOM 0 H ALA A 82 13.455 11.106 -22.261 1.00 1.00 H new ATOM 0 HA ALA A 82 15.282 12.679 -23.796 1.00 1.00 H new ATOM 0 HB1 ALA A 82 13.456 14.376 -23.470 1.00 1.00 H new ATOM 0 HB2 ALA A 82 12.795 12.800 -23.967 1.00 1.00 H new ATOM 0 HB3 ALA A 82 12.699 13.308 -22.264 1.00 1.00 H new ATOM 1248 N ALA A 83 16.060 14.610 -22.296 1.00 1.00 N ATOM 1249 CA ALA A 83 16.843 15.544 -21.479 1.00 1.00 C ATOM 1250 C ALA A 83 16.750 16.984 -22.045 1.00 1.00 C ATOM 1251 O ALA A 83 16.558 17.146 -23.257 1.00 1.00 O ATOM 1252 CB ALA A 83 18.299 15.054 -21.460 1.00 1.00 C ATOM 0 H ALA A 83 15.998 14.901 -23.272 1.00 1.00 H new ATOM 0 HA ALA A 83 16.448 15.574 -20.464 1.00 1.00 H new ATOM 0 HB1 ALA A 83 18.903 15.733 -20.858 1.00 1.00 H new ATOM 0 HB2 ALA A 83 18.340 14.053 -21.031 1.00 1.00 H new ATOM 0 HB3 ALA A 83 18.688 15.028 -22.478 1.00 1.00 H new ATOM 1258 N PRO A 84 16.885 18.035 -21.210 1.00 1.00 N ATOM 1259 CA PRO A 84 16.816 19.427 -21.662 1.00 1.00 C ATOM 1260 C PRO A 84 18.030 19.821 -22.523 1.00 1.00 C ATOM 1261 O PRO A 84 19.160 19.392 -22.267 1.00 1.00 O ATOM 1262 CB PRO A 84 16.728 20.264 -20.381 1.00 1.00 C ATOM 1263 CG PRO A 84 17.446 19.406 -19.339 1.00 1.00 C ATOM 1264 CD PRO A 84 17.107 17.980 -19.770 1.00 1.00 C ATOM 0 HA PRO A 84 15.955 19.591 -22.310 1.00 1.00 H new ATOM 0 HB2 PRO A 84 17.210 21.234 -20.502 1.00 1.00 H new ATOM 0 HB3 PRO A 84 15.693 20.456 -20.098 1.00 1.00 H new ATOM 0 HG2 PRO A 84 18.521 19.583 -19.343 1.00 1.00 H new ATOM 0 HG3 PRO A 84 17.092 19.617 -18.330 1.00 1.00 H new ATOM 0 HD2 PRO A 84 17.920 17.296 -19.527 1.00 1.00 H new ATOM 0 HD3 PRO A 84 16.219 17.617 -19.252 1.00 1.00 H new ATOM 1272 N ALA A 85 17.794 20.666 -23.532 1.00 1.00 N ATOM 1273 CA ALA A 85 18.822 21.185 -24.448 1.00 1.00 C ATOM 1274 C ALA A 85 18.436 22.518 -25.120 1.00 1.00 C ATOM 1275 O ALA A 85 19.287 23.383 -25.336 1.00 1.00 O ATOM 1276 CB ALA A 85 19.107 20.119 -25.520 1.00 1.00 C ATOM 0 H ALA A 85 16.860 21.018 -23.742 1.00 1.00 H new ATOM 0 HA ALA A 85 19.711 21.396 -23.854 1.00 1.00 H new ATOM 0 HB1 ALA A 85 19.868 20.489 -26.208 1.00 1.00 H new ATOM 0 HB2 ALA A 85 19.463 19.207 -25.041 1.00 1.00 H new ATOM 0 HB3 ALA A 85 18.192 19.905 -26.072 1.00 1.00 H new ATOM 1282 N GLU A 86 17.151 22.689 -25.428 1.00 1.00 N ATOM 1283 CA GLU A 86 16.554 23.877 -26.063 1.00 1.00 C ATOM 1284 C GLU A 86 15.149 24.169 -25.499 1.00 1.00 C ATOM 1285 O GLU A 86 14.523 23.312 -24.869 1.00 1.00 O ATOM 1286 CB GLU A 86 16.458 23.662 -27.591 1.00 1.00 C ATOM 1287 CG GLU A 86 17.803 23.711 -28.334 1.00 1.00 C ATOM 1288 CD GLU A 86 18.519 25.080 -28.261 1.00 1.00 C ATOM 1289 OE1 GLU A 86 17.869 26.114 -27.969 1.00 1.00 O ATOM 1290 OE2 GLU A 86 19.742 25.136 -28.538 1.00 1.00 O ATOM 0 H GLU A 86 16.456 21.968 -25.233 1.00 1.00 H new ATOM 0 HA GLU A 86 17.196 24.731 -25.847 1.00 1.00 H new ATOM 0 HB2 GLU A 86 15.990 22.696 -27.779 1.00 1.00 H new ATOM 0 HB3 GLU A 86 15.799 24.423 -28.010 1.00 1.00 H new ATOM 0 HG2 GLU A 86 18.461 22.947 -27.921 1.00 1.00 H new ATOM 0 HG3 GLU A 86 17.636 23.456 -29.381 1.00 1.00 H new ATOM 1297 N ILE A 87 14.643 25.384 -25.745 1.00 1.00 N ATOM 1298 CA ILE A 87 13.311 25.851 -25.307 1.00 1.00 C ATOM 1299 C ILE A 87 12.160 25.050 -25.954 1.00 1.00 C ATOM 1300 O ILE A 87 11.077 24.935 -25.376 1.00 1.00 O ATOM 1301 CB ILE A 87 13.189 27.371 -25.587 1.00 1.00 C ATOM 1302 CG1 ILE A 87 14.311 28.202 -24.914 1.00 1.00 C ATOM 1303 CG2 ILE A 87 11.817 27.950 -25.196 1.00 1.00 C ATOM 1304 CD1 ILE A 87 14.396 28.090 -23.385 1.00 1.00 C ATOM 0 H ILE A 87 15.158 26.092 -26.268 1.00 1.00 H new ATOM 0 HA ILE A 87 13.219 25.677 -24.235 1.00 1.00 H new ATOM 0 HB ILE A 87 13.299 27.456 -26.668 1.00 1.00 H new ATOM 0 HG12 ILE A 87 15.268 27.895 -25.336 1.00 1.00 H new ATOM 0 HG13 ILE A 87 14.168 29.250 -25.176 1.00 1.00 H new ATOM 0 HG21 ILE A 87 11.796 29.017 -25.417 1.00 1.00 H new ATOM 0 HG22 ILE A 87 11.034 27.447 -25.764 1.00 1.00 H new ATOM 0 HG23 ILE A 87 11.648 27.797 -24.130 1.00 1.00 H new ATOM 0 HD11 ILE A 87 15.214 28.711 -23.020 1.00 1.00 H new ATOM 0 HD12 ILE A 87 13.459 28.428 -22.943 1.00 1.00 H new ATOM 0 HD13 ILE A 87 14.576 27.052 -23.106 1.00 1.00 H new ATOM 1316 N SER A 88 12.394 24.462 -27.133 1.00 1.00 N ATOM 1317 CA SER A 88 11.424 23.638 -27.877 1.00 1.00 C ATOM 1318 C SER A 88 12.116 22.502 -28.646 1.00 1.00 C ATOM 1319 O SER A 88 11.922 21.323 -28.347 1.00 1.00 O ATOM 1320 CB SER A 88 10.616 24.532 -28.832 1.00 1.00 C ATOM 1321 OG SER A 88 11.459 25.301 -29.688 1.00 1.00 O ATOM 0 H SER A 88 13.290 24.547 -27.613 1.00 1.00 H new ATOM 0 HA SER A 88 10.747 23.172 -27.161 1.00 1.00 H new ATOM 0 HB2 SER A 88 9.955 23.911 -29.437 1.00 1.00 H new ATOM 0 HB3 SER A 88 9.982 25.202 -28.251 1.00 1.00 H new ATOM 0 HG SER A 88 11.769 26.099 -29.211 1.00 1.00 H new ATOM 1327 N ASP A 89 12.950 22.869 -29.619 1.00 1.00 N ATOM 1328 CA ASP A 89 13.755 21.990 -30.481 1.00 1.00 C ATOM 1329 C ASP A 89 14.979 22.736 -31.056 1.00 1.00 C ATOM 1330 O ASP A 89 16.049 22.146 -31.220 1.00 1.00 O ATOM 1331 CB ASP A 89 12.869 21.467 -31.625 1.00 1.00 C ATOM 1332 CG ASP A 89 13.626 20.493 -32.545 1.00 1.00 C ATOM 1333 OD1 ASP A 89 13.893 19.342 -32.121 1.00 1.00 O ATOM 1334 OD2 ASP A 89 13.934 20.866 -33.703 1.00 1.00 O ATOM 0 H ASP A 89 13.094 23.853 -29.845 1.00 1.00 H new ATOM 0 HA ASP A 89 14.127 21.157 -29.885 1.00 1.00 H new ATOM 0 HB2 ASP A 89 11.996 20.966 -31.207 1.00 1.00 H new ATOM 0 HB3 ASP A 89 12.502 22.309 -32.212 1.00 1.00 H new ATOM 1339 N GLY A 90 14.829 24.037 -31.336 1.00 1.00 N ATOM 1340 CA GLY A 90 15.887 24.912 -31.863 1.00 1.00 C ATOM 1341 C GLY A 90 15.491 26.392 -31.987 1.00 1.00 C ATOM 1342 O GLY A 90 16.077 27.114 -32.795 1.00 1.00 O ATOM 0 H GLY A 90 13.944 24.525 -31.199 1.00 1.00 H new ATOM 0 HA2 GLY A 90 16.760 24.836 -31.214 1.00 1.00 H new ATOM 0 HA3 GLY A 90 16.187 24.546 -32.845 1.00 1.00 H new ATOM 1346 N GLU A 91 14.495 26.854 -31.220 1.00 1.00 N ATOM 1347 CA GLU A 91 13.978 28.231 -31.245 1.00 1.00 C ATOM 1348 C GLU A 91 13.403 28.634 -29.871 1.00 1.00 C ATOM 1349 O GLU A 91 12.834 27.804 -29.157 1.00 1.00 O ATOM 1350 CB GLU A 91 12.910 28.315 -32.355 1.00 1.00 C ATOM 1351 CG GLU A 91 12.336 29.721 -32.572 1.00 1.00 C ATOM 1352 CD GLU A 91 11.532 29.796 -33.885 1.00 1.00 C ATOM 1353 OE1 GLU A 91 10.575 29.001 -34.060 1.00 1.00 O ATOM 1354 OE2 GLU A 91 11.851 30.647 -34.752 1.00 1.00 O ATOM 0 H GLU A 91 14.011 26.263 -30.544 1.00 1.00 H new ATOM 0 HA GLU A 91 14.785 28.933 -31.457 1.00 1.00 H new ATOM 0 HB2 GLU A 91 13.346 27.965 -33.290 1.00 1.00 H new ATOM 0 HB3 GLU A 91 12.094 27.636 -32.110 1.00 1.00 H new ATOM 0 HG2 GLU A 91 11.694 29.988 -31.733 1.00 1.00 H new ATOM 0 HG3 GLU A 91 13.147 30.448 -32.597 1.00 1.00 H new ATOM 1361 N ASP A 92 13.547 29.911 -29.494 1.00 1.00 N ATOM 1362 CA ASP A 92 13.073 30.493 -28.224 1.00 1.00 C ATOM 1363 C ASP A 92 11.541 30.698 -28.187 1.00 1.00 C ATOM 1364 O ASP A 92 11.022 31.816 -28.126 1.00 1.00 O ATOM 1365 CB ASP A 92 13.856 31.785 -27.925 1.00 1.00 C ATOM 1366 CG ASP A 92 13.538 32.397 -26.545 1.00 1.00 C ATOM 1367 OD1 ASP A 92 12.936 31.716 -25.679 1.00 1.00 O ATOM 1368 OD2 ASP A 92 13.928 33.569 -26.316 1.00 1.00 O ATOM 0 H ASP A 92 14.015 30.597 -30.086 1.00 1.00 H new ATOM 0 HA ASP A 92 13.273 29.777 -27.427 1.00 1.00 H new ATOM 0 HB2 ASP A 92 14.924 31.574 -27.982 1.00 1.00 H new ATOM 0 HB3 ASP A 92 13.635 32.521 -28.699 1.00 1.00 H new ATOM 1373 N ARG A 93 10.799 29.589 -28.253 1.00 1.00 N ATOM 1374 CA ARG A 93 9.324 29.521 -28.251 1.00 1.00 C ATOM 1375 C ARG A 93 8.687 29.725 -26.860 1.00 1.00 C ATOM 1376 O ARG A 93 7.603 29.215 -26.574 1.00 1.00 O ATOM 1377 CB ARG A 93 8.889 28.217 -28.947 1.00 1.00 C ATOM 1378 CG ARG A 93 9.314 28.210 -30.422 1.00 1.00 C ATOM 1379 CD ARG A 93 8.735 27.018 -31.188 1.00 1.00 C ATOM 1380 NE ARG A 93 9.115 27.114 -32.605 1.00 1.00 N ATOM 1381 CZ ARG A 93 8.971 26.226 -33.562 1.00 1.00 C ATOM 1382 NH1 ARG A 93 8.396 25.070 -33.381 1.00 1.00 N ATOM 1383 NH2 ARG A 93 9.425 26.529 -34.739 1.00 1.00 N ATOM 0 H ARG A 93 11.226 28.665 -28.312 1.00 1.00 H new ATOM 0 HA ARG A 93 8.939 30.368 -28.819 1.00 1.00 H new ATOM 0 HB2 ARG A 93 9.330 27.363 -28.434 1.00 1.00 H new ATOM 0 HB3 ARG A 93 7.807 28.107 -28.877 1.00 1.00 H new ATOM 0 HG2 ARG A 93 8.989 29.136 -30.896 1.00 1.00 H new ATOM 0 HG3 ARG A 93 10.402 28.185 -30.484 1.00 1.00 H new ATOM 0 HD2 ARG A 93 9.105 26.085 -30.764 1.00 1.00 H new ATOM 0 HD3 ARG A 93 7.649 27.003 -31.092 1.00 1.00 H new ATOM 0 HE ARG A 93 9.551 27.993 -32.884 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.032 24.820 -32.461 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.310 24.416 -34.159 1.00 1.00 H new ATOM 0 HH21 ARG A 93 9.875 27.431 -34.895 1.00 1.00 H new ATOM 0 HH22 ARG A 93 9.332 25.865 -35.508 1.00 1.00 H new ATOM 1397 N SER A 94 9.344 30.483 -25.982 1.00 1.00 N ATOM 1398 CA SER A 94 8.874 30.826 -24.625 1.00 1.00 C ATOM 1399 C SER A 94 7.801 31.930 -24.596 1.00 1.00 C ATOM 1400 O SER A 94 7.153 32.133 -23.567 1.00 1.00 O ATOM 1401 CB SER A 94 10.067 31.273 -23.770 1.00 1.00 C ATOM 1402 OG SER A 94 10.703 32.407 -24.333 1.00 1.00 O ATOM 0 H SER A 94 10.252 30.894 -26.197 1.00 1.00 H new ATOM 0 HA SER A 94 8.410 29.924 -24.226 1.00 1.00 H new ATOM 0 HB2 SER A 94 9.728 31.506 -22.761 1.00 1.00 H new ATOM 0 HB3 SER A 94 10.783 30.456 -23.684 1.00 1.00 H new ATOM 0 HG SER A 94 11.473 32.119 -24.866 1.00 1.00 H new ATOM 1408 N LYS A 95 7.610 32.645 -25.715 1.00 1.00 N ATOM 1409 CA LYS A 95 6.648 33.756 -25.879 1.00 1.00 C ATOM 1410 C LYS A 95 5.786 33.672 -27.146 1.00 1.00 C ATOM 1411 O LYS A 95 4.815 34.415 -27.276 1.00 1.00 O ATOM 1412 CB LYS A 95 7.410 35.088 -25.845 1.00 1.00 C ATOM 1413 CG LYS A 95 7.906 35.427 -24.430 1.00 1.00 C ATOM 1414 CD LYS A 95 8.538 36.821 -24.394 1.00 1.00 C ATOM 1415 CE LYS A 95 9.043 37.135 -22.980 1.00 1.00 C ATOM 1416 NZ LYS A 95 9.672 38.480 -22.911 1.00 1.00 N ATOM 0 H LYS A 95 8.140 32.461 -26.567 1.00 1.00 H new ATOM 0 HA LYS A 95 5.946 33.682 -25.048 1.00 1.00 H new ATOM 0 HB2 LYS A 95 8.260 35.038 -26.526 1.00 1.00 H new ATOM 0 HB3 LYS A 95 6.761 35.887 -26.204 1.00 1.00 H new ATOM 0 HG2 LYS A 95 7.074 35.382 -23.728 1.00 1.00 H new ATOM 0 HG3 LYS A 95 8.635 34.684 -24.108 1.00 1.00 H new ATOM 0 HD2 LYS A 95 9.364 36.873 -25.103 1.00 1.00 H new ATOM 0 HD3 LYS A 95 7.807 37.568 -24.702 1.00 1.00 H new ATOM 0 HE2 LYS A 95 8.212 37.085 -22.276 1.00 1.00 H new ATOM 0 HE3 LYS A 95 9.766 36.378 -22.674 1.00 1.00 H new ATOM 0 HZ1 LYS A 95 10.002 38.660 -21.941 1.00 1.00 H new ATOM 0 HZ2 LYS A 95 10.480 38.519 -23.565 1.00 1.00 H new ATOM 0 HZ3 LYS A 95 8.975 39.204 -23.179 1.00 1.00 H new ATOM 1430 N CYS A 96 6.104 32.761 -28.062 1.00 1.00 N ATOM 1431 CA CYS A 96 5.374 32.528 -29.311 1.00 1.00 C ATOM 1432 C CYS A 96 5.357 31.040 -29.709 1.00 1.00 C ATOM 1433 O CYS A 96 6.269 30.283 -29.378 1.00 1.00 O ATOM 1434 CB CYS A 96 5.978 33.409 -30.420 1.00 1.00 C ATOM 1435 SG CYS A 96 7.730 33.008 -30.710 1.00 1.00 S ATOM 0 H CYS A 96 6.906 32.141 -27.953 1.00 1.00 H new ATOM 0 HA CYS A 96 4.331 32.807 -29.161 1.00 1.00 H new ATOM 0 HB2 CYS A 96 5.415 33.271 -31.343 1.00 1.00 H new ATOM 0 HB3 CYS A 96 5.885 34.459 -30.143 1.00 1.00 H new ATOM 0 HG CYS A 96 8.199 33.771 -31.652 1.00 1.00 H new ATOM 1441 N CYS A 97 4.314 30.638 -30.436 1.00 1.00 N ATOM 1442 CA CYS A 97 4.077 29.283 -30.930 1.00 1.00 C ATOM 1443 C CYS A 97 3.603 29.352 -32.393 1.00 1.00 C ATOM 1444 O CYS A 97 2.395 29.440 -32.637 1.00 1.00 O ATOM 1445 CB CYS A 97 3.046 28.588 -30.024 1.00 1.00 C ATOM 1446 SG CYS A 97 2.447 26.973 -30.592 1.00 1.00 S ATOM 0 H CYS A 97 3.573 31.284 -30.710 1.00 1.00 H new ATOM 0 HA CYS A 97 4.996 28.697 -30.904 1.00 1.00 H new ATOM 0 HB2 CYS A 97 3.487 28.462 -29.035 1.00 1.00 H new ATOM 0 HB3 CYS A 97 2.189 29.251 -29.908 1.00 1.00 H new ATOM 1451 N PRO A 98 4.510 29.320 -33.391 1.00 1.00 N ATOM 1452 CA PRO A 98 4.129 29.382 -34.808 1.00 1.00 C ATOM 1453 C PRO A 98 3.353 28.135 -35.270 1.00 1.00 C ATOM 1454 O PRO A 98 2.561 28.215 -36.209 1.00 1.00 O ATOM 1455 CB PRO A 98 5.443 29.575 -35.571 1.00 1.00 C ATOM 1456 CG PRO A 98 6.492 28.944 -34.657 1.00 1.00 C ATOM 1457 CD PRO A 98 5.960 29.230 -33.255 1.00 1.00 C ATOM 0 HA PRO A 98 3.436 30.202 -34.996 1.00 1.00 H new ATOM 0 HB2 PRO A 98 5.415 29.086 -36.545 1.00 1.00 H new ATOM 0 HB3 PRO A 98 5.651 30.630 -35.749 1.00 1.00 H new ATOM 0 HG2 PRO A 98 6.591 27.874 -34.838 1.00 1.00 H new ATOM 0 HG3 PRO A 98 7.477 29.386 -34.811 1.00 1.00 H new ATOM 0 HD2 PRO A 98 6.239 28.437 -32.561 1.00 1.00 H new ATOM 0 HD3 PRO A 98 6.374 30.158 -32.861 1.00 1.00 H new ATOM 1465 N VAL A 99 3.518 26.998 -34.577 1.00 1.00 N ATOM 1466 CA VAL A 99 2.789 25.735 -34.825 1.00 1.00 C ATOM 1467 C VAL A 99 1.270 25.936 -34.706 1.00 1.00 C ATOM 1468 O VAL A 99 0.510 25.336 -35.464 1.00 1.00 O ATOM 1469 CB VAL A 99 3.284 24.642 -33.850 1.00 1.00 C ATOM 1470 CG1 VAL A 99 2.478 23.341 -33.922 1.00 1.00 C ATOM 1471 CG2 VAL A 99 4.753 24.294 -34.127 1.00 1.00 C ATOM 0 H VAL A 99 4.181 26.925 -33.805 1.00 1.00 H new ATOM 0 HA VAL A 99 2.993 25.411 -35.846 1.00 1.00 H new ATOM 0 HB VAL A 99 3.156 25.070 -32.856 1.00 1.00 H new ATOM 0 HG11 VAL A 99 2.883 22.622 -33.210 1.00 1.00 H new ATOM 0 HG12 VAL A 99 1.435 23.545 -33.678 1.00 1.00 H new ATOM 0 HG13 VAL A 99 2.541 22.929 -34.929 1.00 1.00 H new ATOM 0 HG21 VAL A 99 5.082 23.523 -33.430 1.00 1.00 H new ATOM 0 HG22 VAL A 99 4.854 23.927 -35.148 1.00 1.00 H new ATOM 0 HG23 VAL A 99 5.368 25.185 -33.999 1.00 1.00 H new ATOM 1481 N CYS A 100 0.828 26.813 -33.802 1.00 1.00 N ATOM 1482 CA CYS A 100 -0.584 27.135 -33.551 1.00 1.00 C ATOM 1483 C CYS A 100 -0.949 28.614 -33.807 1.00 1.00 C ATOM 1484 O CYS A 100 -2.089 29.028 -33.606 1.00 1.00 O ATOM 1485 CB CYS A 100 -0.876 26.777 -32.099 1.00 1.00 C ATOM 1486 SG CYS A 100 -0.643 25.029 -31.677 1.00 1.00 S ATOM 0 H CYS A 100 1.464 27.339 -33.202 1.00 1.00 H new ATOM 0 HA CYS A 100 -1.190 26.562 -34.253 1.00 1.00 H new ATOM 0 HB2 CYS A 100 -0.234 27.379 -31.456 1.00 1.00 H new ATOM 0 HB3 CYS A 100 -1.905 27.056 -31.872 1.00 1.00 H new ATOM 1491 N ASN A 101 0.045 29.401 -34.216 1.00 1.00 N ATOM 1492 CA ASN A 101 0.044 30.846 -34.474 1.00 1.00 C ATOM 1493 C ASN A 101 -0.531 31.694 -33.315 1.00 1.00 C ATOM 1494 O ASN A 101 -1.445 32.503 -33.493 1.00 1.00 O ATOM 1495 CB ASN A 101 -0.467 31.161 -35.897 1.00 1.00 C ATOM 1496 CG ASN A 101 -1.890 30.716 -36.209 1.00 1.00 C ATOM 1497 OD1 ASN A 101 -2.120 29.774 -36.957 1.00 1.00 O ATOM 1498 ND2 ASN A 101 -2.888 31.373 -35.664 1.00 1.00 N ATOM 0 H ASN A 101 0.968 29.004 -34.394 1.00 1.00 H new ATOM 0 HA ASN A 101 1.079 31.188 -34.479 1.00 1.00 H new ATOM 0 HB2 ASN A 101 -0.401 32.237 -36.055 1.00 1.00 H new ATOM 0 HB3 ASN A 101 0.205 30.691 -36.615 1.00 1.00 H new ATOM 0 HD21 ASN A 101 -3.850 31.098 -35.864 1.00 1.00 H new ATOM 0 HD22 ASN A 101 -2.702 32.158 -35.040 1.00 1.00 H new ATOM 1505 N MET A 102 0.040 31.505 -32.119 1.00 1.00 N ATOM 1506 CA MET A 102 -0.327 32.204 -30.872 1.00 1.00 C ATOM 1507 C MET A 102 0.901 32.731 -30.103 1.00 1.00 C ATOM 1508 O MET A 102 2.045 32.392 -30.420 1.00 1.00 O ATOM 1509 CB MET A 102 -1.148 31.266 -29.964 1.00 1.00 C ATOM 1510 CG MET A 102 -2.505 30.886 -30.565 1.00 1.00 C ATOM 1511 SD MET A 102 -3.662 30.095 -29.409 1.00 1.00 S ATOM 1512 CE MET A 102 -2.752 28.583 -28.986 1.00 1.00 C ATOM 0 H MET A 102 0.799 30.837 -31.984 1.00 1.00 H new ATOM 0 HA MET A 102 -0.926 33.069 -31.156 1.00 1.00 H new ATOM 0 HB2 MET A 102 -0.574 30.359 -29.775 1.00 1.00 H new ATOM 0 HB3 MET A 102 -1.307 31.750 -29.000 1.00 1.00 H new ATOM 0 HG2 MET A 102 -2.973 31.785 -30.965 1.00 1.00 H new ATOM 0 HG3 MET A 102 -2.337 30.213 -31.406 1.00 1.00 H new ATOM 0 HE1 MET A 102 -3.449 27.829 -28.621 1.00 1.00 H new ATOM 0 HE2 MET A 102 -2.241 28.206 -29.872 1.00 1.00 H new ATOM 0 HE3 MET A 102 -2.018 28.805 -28.211 1.00 1.00 H new ATOM 1522 N THR A 103 0.661 33.552 -29.076 1.00 1.00 N ATOM 1523 CA THR A 103 1.679 34.160 -28.195 1.00 1.00 C ATOM 1524 C THR A 103 1.331 34.001 -26.710 1.00 1.00 C ATOM 1525 O THR A 103 0.176 33.753 -26.349 1.00 1.00 O ATOM 1526 CB THR A 103 1.911 35.646 -28.526 1.00 1.00 C ATOM 1527 OG1 THR A 103 0.693 36.364 -28.494 1.00 1.00 O ATOM 1528 CG2 THR A 103 2.534 35.836 -29.911 1.00 1.00 C ATOM 0 H THR A 103 -0.287 33.827 -28.820 1.00 1.00 H new ATOM 0 HA THR A 103 2.604 33.616 -28.385 1.00 1.00 H new ATOM 0 HB THR A 103 2.598 36.024 -27.768 1.00 1.00 H new ATOM 0 HG1 THR A 103 0.863 37.306 -28.705 1.00 1.00 H new ATOM 0 HG21 THR A 103 2.680 36.899 -30.102 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.496 35.325 -29.950 1.00 1.00 H new ATOM 0 HG23 THR A 103 1.871 35.419 -30.669 1.00 1.00 H new ATOM 1536 N PHE A 104 2.343 34.122 -25.843 1.00 1.00 N ATOM 1537 CA PHE A 104 2.246 33.943 -24.388 1.00 1.00 C ATOM 1538 C PHE A 104 2.901 35.092 -23.607 1.00 1.00 C ATOM 1539 O PHE A 104 3.912 35.656 -24.036 1.00 1.00 O ATOM 1540 CB PHE A 104 2.895 32.606 -23.990 1.00 1.00 C ATOM 1541 CG PHE A 104 2.597 31.443 -24.916 1.00 1.00 C ATOM 1542 CD1 PHE A 104 1.305 30.886 -24.974 1.00 1.00 C ATOM 1543 CD2 PHE A 104 3.610 30.941 -25.752 1.00 1.00 C ATOM 1544 CE1 PHE A 104 1.032 29.825 -25.856 1.00 1.00 C ATOM 1545 CE2 PHE A 104 3.338 29.883 -26.632 1.00 1.00 C ATOM 1546 CZ PHE A 104 2.050 29.322 -26.684 1.00 1.00 C ATOM 0 H PHE A 104 3.288 34.356 -26.146 1.00 1.00 H new ATOM 0 HA PHE A 104 1.187 33.942 -24.130 1.00 1.00 H new ATOM 0 HB2 PHE A 104 3.975 32.745 -23.943 1.00 1.00 H new ATOM 0 HB3 PHE A 104 2.563 32.344 -22.985 1.00 1.00 H new ATOM 0 HD1 PHE A 104 0.522 31.274 -24.340 1.00 1.00 H new ATOM 0 HD2 PHE A 104 4.600 31.371 -25.717 1.00 1.00 H new ATOM 0 HE1 PHE A 104 0.041 29.397 -25.897 1.00 1.00 H new ATOM 0 HE2 PHE A 104 4.119 29.499 -27.271 1.00 1.00 H new ATOM 0 HZ PHE A 104 1.843 28.505 -27.360 1.00 1.00 H new ATOM 1556 N SER A 105 2.348 35.420 -22.437 1.00 1.00 N ATOM 1557 CA SER A 105 2.859 36.468 -21.538 1.00 1.00 C ATOM 1558 C SER A 105 4.086 36.050 -20.708 1.00 1.00 C ATOM 1559 O SER A 105 4.804 36.915 -20.202 1.00 1.00 O ATOM 1560 CB SER A 105 1.737 36.909 -20.590 1.00 1.00 C ATOM 1561 OG SER A 105 1.206 35.790 -19.891 1.00 1.00 O ATOM 0 H SER A 105 1.514 34.957 -22.077 1.00 1.00 H new ATOM 0 HA SER A 105 3.189 37.285 -22.180 1.00 1.00 H new ATOM 0 HB2 SER A 105 2.120 37.641 -19.879 1.00 1.00 H new ATOM 0 HB3 SER A 105 0.946 37.400 -21.157 1.00 1.00 H new ATOM 0 HG SER A 105 0.493 36.089 -19.289 1.00 1.00 H new ATOM 1567 N SER A 106 4.339 34.743 -20.551 1.00 1.00 N ATOM 1568 CA SER A 106 5.452 34.165 -19.775 1.00 1.00 C ATOM 1569 C SER A 106 5.745 32.708 -20.184 1.00 1.00 C ATOM 1570 O SER A 106 4.849 32.035 -20.707 1.00 1.00 O ATOM 1571 CB SER A 106 5.084 34.183 -18.279 1.00 1.00 C ATOM 1572 OG SER A 106 5.333 35.459 -17.712 1.00 1.00 O ATOM 0 H SER A 106 3.751 34.027 -20.978 1.00 1.00 H new ATOM 0 HA SER A 106 6.341 34.764 -19.974 1.00 1.00 H new ATOM 0 HB2 SER A 106 4.032 33.925 -18.156 1.00 1.00 H new ATOM 0 HB3 SER A 106 5.662 33.426 -17.749 1.00 1.00 H new ATOM 0 HG SER A 106 5.228 36.149 -18.400 1.00 1.00 H new ATOM 1578 N PRO A 107 6.960 32.177 -19.917 1.00 1.00 N ATOM 1579 CA PRO A 107 7.332 30.796 -20.253 1.00 1.00 C ATOM 1580 C PRO A 107 6.444 29.736 -19.586 1.00 1.00 C ATOM 1581 O PRO A 107 6.217 28.678 -20.169 1.00 1.00 O ATOM 1582 CB PRO A 107 8.804 30.642 -19.846 1.00 1.00 C ATOM 1583 CG PRO A 107 9.025 31.749 -18.818 1.00 1.00 C ATOM 1584 CD PRO A 107 8.088 32.856 -19.290 1.00 1.00 C ATOM 0 HA PRO A 107 7.186 30.625 -21.319 1.00 1.00 H new ATOM 0 HB2 PRO A 107 8.999 29.658 -19.420 1.00 1.00 H new ATOM 0 HB3 PRO A 107 9.468 30.755 -20.703 1.00 1.00 H new ATOM 0 HG2 PRO A 107 8.779 31.417 -17.809 1.00 1.00 H new ATOM 0 HG3 PRO A 107 10.063 32.081 -18.800 1.00 1.00 H new ATOM 0 HD2 PRO A 107 7.758 33.473 -18.454 1.00 1.00 H new ATOM 0 HD3 PRO A 107 8.589 33.518 -19.997 1.00 1.00 H new ATOM 1592 N VAL A 108 5.896 30.010 -18.396 1.00 1.00 N ATOM 1593 CA VAL A 108 4.974 29.089 -17.698 1.00 1.00 C ATOM 1594 C VAL A 108 3.697 28.870 -18.526 1.00 1.00 C ATOM 1595 O VAL A 108 3.197 27.749 -18.611 1.00 1.00 O ATOM 1596 CB VAL A 108 4.630 29.609 -16.286 1.00 1.00 C ATOM 1597 CG1 VAL A 108 3.743 28.625 -15.513 1.00 1.00 C ATOM 1598 CG2 VAL A 108 5.898 29.835 -15.449 1.00 1.00 C ATOM 0 H VAL A 108 6.075 30.874 -17.885 1.00 1.00 H new ATOM 0 HA VAL A 108 5.478 28.129 -17.585 1.00 1.00 H new ATOM 0 HB VAL A 108 4.099 30.549 -16.438 1.00 1.00 H new ATOM 0 HG11 VAL A 108 3.525 29.030 -14.525 1.00 1.00 H new ATOM 0 HG12 VAL A 108 2.810 28.472 -16.056 1.00 1.00 H new ATOM 0 HG13 VAL A 108 4.262 27.672 -15.408 1.00 1.00 H new ATOM 0 HG21 VAL A 108 5.621 30.201 -14.460 1.00 1.00 H new ATOM 0 HG22 VAL A 108 6.440 28.895 -15.349 1.00 1.00 H new ATOM 0 HG23 VAL A 108 6.534 30.570 -15.943 1.00 1.00 H new ATOM 1608 N VAL A 109 3.196 29.922 -19.186 1.00 1.00 N ATOM 1609 CA VAL A 109 2.018 29.863 -20.072 1.00 1.00 C ATOM 1610 C VAL A 109 2.363 29.152 -21.391 1.00 1.00 C ATOM 1611 O VAL A 109 1.544 28.404 -21.926 1.00 1.00 O ATOM 1612 CB VAL A 109 1.449 31.276 -20.324 1.00 1.00 C ATOM 1613 CG1 VAL A 109 0.146 31.240 -21.129 1.00 1.00 C ATOM 1614 CG2 VAL A 109 1.146 32.009 -19.008 1.00 1.00 C ATOM 0 H VAL A 109 3.602 30.855 -19.121 1.00 1.00 H new ATOM 0 HA VAL A 109 1.243 29.280 -19.574 1.00 1.00 H new ATOM 0 HB VAL A 109 2.221 31.801 -20.886 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -0.216 32.257 -21.281 1.00 1.00 H new ATOM 0 HG12 VAL A 109 0.329 30.771 -22.096 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -0.603 30.666 -20.583 1.00 1.00 H new ATOM 0 HG21 VAL A 109 0.747 33.000 -19.227 1.00 1.00 H new ATOM 0 HG22 VAL A 109 0.413 31.441 -18.436 1.00 1.00 H new ATOM 0 HG23 VAL A 109 2.063 32.107 -18.427 1.00 1.00 H new ATOM 1624 N ALA A 110 3.594 29.315 -21.896 1.00 1.00 N ATOM 1625 CA ALA A 110 4.063 28.576 -23.072 1.00 1.00 C ATOM 1626 C ALA A 110 4.075 27.064 -22.762 1.00 1.00 C ATOM 1627 O ALA A 110 3.486 26.262 -23.489 1.00 1.00 O ATOM 1628 CB ALA A 110 5.441 29.101 -23.486 1.00 1.00 C ATOM 0 H ALA A 110 4.284 29.956 -21.505 1.00 1.00 H new ATOM 0 HA ALA A 110 3.388 28.729 -23.914 1.00 1.00 H new ATOM 0 HB1 ALA A 110 5.792 28.553 -24.360 1.00 1.00 H new ATOM 0 HB2 ALA A 110 5.369 30.161 -23.728 1.00 1.00 H new ATOM 0 HB3 ALA A 110 6.145 28.963 -22.665 1.00 1.00 H new ATOM 1634 N GLU A 111 4.681 26.674 -21.635 1.00 1.00 N ATOM 1635 CA GLU A 111 4.724 25.286 -21.158 1.00 1.00 C ATOM 1636 C GLU A 111 3.322 24.707 -20.908 1.00 1.00 C ATOM 1637 O GLU A 111 3.060 23.574 -21.315 1.00 1.00 O ATOM 1638 CB GLU A 111 5.558 25.201 -19.867 1.00 1.00 C ATOM 1639 CG GLU A 111 7.067 25.363 -20.089 1.00 1.00 C ATOM 1640 CD GLU A 111 7.699 24.079 -20.661 1.00 1.00 C ATOM 1641 OE1 GLU A 111 7.719 23.905 -21.903 1.00 1.00 O ATOM 1642 OE2 GLU A 111 8.184 23.234 -19.869 1.00 1.00 O ATOM 0 H GLU A 111 5.164 27.326 -21.017 1.00 1.00 H new ATOM 0 HA GLU A 111 5.188 24.690 -21.944 1.00 1.00 H new ATOM 0 HB2 GLU A 111 5.218 25.972 -19.175 1.00 1.00 H new ATOM 0 HB3 GLU A 111 5.372 24.239 -19.389 1.00 1.00 H new ATOM 0 HG2 GLU A 111 7.247 26.193 -20.772 1.00 1.00 H new ATOM 0 HG3 GLU A 111 7.549 25.617 -19.145 1.00 1.00 H new ATOM 1649 N SER A 112 2.406 25.465 -20.286 1.00 1.00 N ATOM 1650 CA SER A 112 1.026 25.012 -20.029 1.00 1.00 C ATOM 1651 C SER A 112 0.274 24.677 -21.327 1.00 1.00 C ATOM 1652 O SER A 112 -0.493 23.712 -21.368 1.00 1.00 O ATOM 1653 CB SER A 112 0.244 25.995 -19.144 1.00 1.00 C ATOM 1654 OG SER A 112 -0.268 27.102 -19.862 1.00 1.00 O ATOM 0 H SER A 112 2.598 26.408 -19.947 1.00 1.00 H new ATOM 0 HA SER A 112 1.106 24.083 -19.465 1.00 1.00 H new ATOM 0 HB2 SER A 112 -0.581 25.467 -18.666 1.00 1.00 H new ATOM 0 HB3 SER A 112 0.896 26.356 -18.348 1.00 1.00 H new ATOM 0 HG SER A 112 0.411 27.427 -20.490 1.00 1.00 H new ATOM 1660 N HIS A 113 0.526 25.424 -22.409 1.00 1.00 N ATOM 1661 CA HIS A 113 -0.031 25.146 -23.732 1.00 1.00 C ATOM 1662 C HIS A 113 0.610 23.884 -24.350 1.00 1.00 C ATOM 1663 O HIS A 113 -0.108 23.007 -24.840 1.00 1.00 O ATOM 1664 CB HIS A 113 0.164 26.380 -24.627 1.00 1.00 C ATOM 1665 CG HIS A 113 -0.183 26.135 -26.073 1.00 1.00 C ATOM 1666 ND1 HIS A 113 -1.444 25.979 -26.606 1.00 1.00 N ATOM 1667 CD2 HIS A 113 0.710 25.958 -27.096 1.00 1.00 C ATOM 1668 CE1 HIS A 113 -1.309 25.706 -27.916 1.00 1.00 C ATOM 1669 NE2 HIS A 113 -0.011 25.692 -28.264 1.00 1.00 N ATOM 0 H HIS A 113 1.129 26.246 -22.387 1.00 1.00 H new ATOM 0 HA HIS A 113 -1.098 24.943 -23.642 1.00 1.00 H new ATOM 0 HB2 HIS A 113 -0.451 27.195 -24.247 1.00 1.00 H new ATOM 0 HB3 HIS A 113 1.202 26.707 -24.561 1.00 1.00 H new ATOM 0 HD1 HIS A 113 -2.324 26.057 -26.097 1.00 1.00 H new ATOM 0 HD2 HIS A 113 1.785 26.014 -27.015 1.00 1.00 H new ATOM 0 HE1 HIS A 113 -2.130 25.523 -28.594 1.00 1.00 H new ATOM 1677 N TYR A 114 1.944 23.758 -24.312 1.00 1.00 N ATOM 1678 CA TYR A 114 2.672 22.615 -24.885 1.00 1.00 C ATOM 1679 C TYR A 114 2.333 21.251 -24.262 1.00 1.00 C ATOM 1680 O TYR A 114 2.342 20.249 -24.981 1.00 1.00 O ATOM 1681 CB TYR A 114 4.190 22.872 -24.851 1.00 1.00 C ATOM 1682 CG TYR A 114 4.662 24.092 -25.632 1.00 1.00 C ATOM 1683 CD1 TYR A 114 4.061 24.421 -26.862 1.00 1.00 C ATOM 1684 CD2 TYR A 114 5.701 24.903 -25.128 1.00 1.00 C ATOM 1685 CE1 TYR A 114 4.440 25.583 -27.550 1.00 1.00 C ATOM 1686 CE2 TYR A 114 6.085 26.074 -25.815 1.00 1.00 C ATOM 1687 CZ TYR A 114 5.432 26.424 -27.018 1.00 1.00 C ATOM 1688 OH TYR A 114 5.734 27.566 -27.680 1.00 1.00 O ATOM 0 H TYR A 114 2.554 24.452 -23.879 1.00 1.00 H new ATOM 0 HA TYR A 114 2.330 22.544 -25.918 1.00 1.00 H new ATOM 0 HB2 TYR A 114 4.500 22.984 -23.812 1.00 1.00 H new ATOM 0 HB3 TYR A 114 4.700 21.991 -25.242 1.00 1.00 H new ATOM 0 HD1 TYR A 114 3.303 23.774 -27.279 1.00 1.00 H new ATOM 0 HD2 TYR A 114 6.204 24.626 -24.213 1.00 1.00 H new ATOM 0 HE1 TYR A 114 3.969 25.832 -28.490 1.00 1.00 H new ATOM 0 HE2 TYR A 114 6.874 26.699 -25.423 1.00 1.00 H new ATOM 0 HH TYR A 114 6.402 28.072 -27.172 1.00 1.00 H new ATOM 1698 N ILE A 115 2.003 21.182 -22.964 1.00 1.00 N ATOM 1699 CA ILE A 115 1.605 19.916 -22.312 1.00 1.00 C ATOM 1700 C ILE A 115 0.160 19.484 -22.641 1.00 1.00 C ATOM 1701 O ILE A 115 -0.256 18.393 -22.245 1.00 1.00 O ATOM 1702 CB ILE A 115 1.895 19.916 -20.788 1.00 1.00 C ATOM 1703 CG1 ILE A 115 1.172 20.988 -19.942 1.00 1.00 C ATOM 1704 CG2 ILE A 115 3.413 20.045 -20.565 1.00 1.00 C ATOM 1705 CD1 ILE A 115 -0.331 20.763 -19.740 1.00 1.00 C ATOM 0 H ILE A 115 2.003 21.988 -22.339 1.00 1.00 H new ATOM 0 HA ILE A 115 2.244 19.149 -22.749 1.00 1.00 H new ATOM 0 HB ILE A 115 1.491 18.967 -20.434 1.00 1.00 H new ATOM 0 HG12 ILE A 115 1.650 21.037 -18.963 1.00 1.00 H new ATOM 0 HG13 ILE A 115 1.316 21.959 -20.416 1.00 1.00 H new ATOM 0 HG21 ILE A 115 3.625 20.046 -19.496 1.00 1.00 H new ATOM 0 HG22 ILE A 115 3.923 19.204 -21.035 1.00 1.00 H new ATOM 0 HG23 ILE A 115 3.768 20.977 -21.006 1.00 1.00 H new ATOM 0 HD11 ILE A 115 -0.741 21.570 -19.134 1.00 1.00 H new ATOM 0 HD12 ILE A 115 -0.830 20.747 -20.709 1.00 1.00 H new ATOM 0 HD13 ILE A 115 -0.492 19.811 -19.234 1.00 1.00 H new ATOM 1717 N GLY A 116 -0.607 20.305 -23.372 1.00 1.00 N ATOM 1718 CA GLY A 116 -1.992 20.024 -23.764 1.00 1.00 C ATOM 1719 C GLY A 116 -2.116 19.421 -25.170 1.00 1.00 C ATOM 1720 O GLY A 116 -1.321 19.710 -26.069 1.00 1.00 O ATOM 0 H GLY A 116 -0.271 21.205 -23.715 1.00 1.00 H new ATOM 0 HA2 GLY A 116 -2.434 19.338 -23.042 1.00 1.00 H new ATOM 0 HA3 GLY A 116 -2.569 20.948 -23.720 1.00 1.00 H new ATOM 1724 N LYS A 117 -3.140 18.582 -25.373 1.00 1.00 N ATOM 1725 CA LYS A 117 -3.412 17.891 -26.649 1.00 1.00 C ATOM 1726 C LYS A 117 -3.645 18.840 -27.832 1.00 1.00 C ATOM 1727 O LYS A 117 -3.317 18.484 -28.961 1.00 1.00 O ATOM 1728 CB LYS A 117 -4.573 16.897 -26.446 1.00 1.00 C ATOM 1729 CG LYS A 117 -4.781 15.977 -27.662 1.00 1.00 C ATOM 1730 CD LYS A 117 -5.700 14.782 -27.368 1.00 1.00 C ATOM 1731 CE LYS A 117 -7.122 15.214 -26.981 1.00 1.00 C ATOM 1732 NZ LYS A 117 -8.001 14.040 -26.735 1.00 1.00 N ATOM 0 H LYS A 117 -3.817 18.357 -24.644 1.00 1.00 H new ATOM 0 HA LYS A 117 -2.514 17.340 -26.929 1.00 1.00 H new ATOM 0 HB2 LYS A 117 -4.376 16.288 -25.564 1.00 1.00 H new ATOM 0 HB3 LYS A 117 -5.492 17.451 -26.252 1.00 1.00 H new ATOM 0 HG2 LYS A 117 -5.204 16.559 -28.481 1.00 1.00 H new ATOM 0 HG3 LYS A 117 -3.813 15.608 -28.000 1.00 1.00 H new ATOM 0 HD2 LYS A 117 -5.746 14.138 -28.247 1.00 1.00 H new ATOM 0 HD3 LYS A 117 -5.272 14.189 -26.560 1.00 1.00 H new ATOM 0 HE2 LYS A 117 -7.084 15.835 -26.086 1.00 1.00 H new ATOM 0 HE3 LYS A 117 -7.546 15.827 -27.776 1.00 1.00 H new ATOM 0 HZ1 LYS A 117 -8.953 14.368 -26.476 1.00 1.00 H new ATOM 0 HZ2 LYS A 117 -8.057 13.461 -27.597 1.00 1.00 H new ATOM 0 HZ3 LYS A 117 -7.609 13.469 -25.959 1.00 1.00 H new ATOM 1746 N THR A 118 -4.155 20.051 -27.596 1.00 1.00 N ATOM 1747 CA THR A 118 -4.386 21.078 -28.636 1.00 1.00 C ATOM 1748 C THR A 118 -3.116 21.377 -29.443 1.00 1.00 C ATOM 1749 O THR A 118 -3.165 21.479 -30.671 1.00 1.00 O ATOM 1750 CB THR A 118 -4.920 22.376 -28.004 1.00 1.00 C ATOM 1751 OG1 THR A 118 -6.000 22.076 -27.142 1.00 1.00 O ATOM 1752 CG2 THR A 118 -5.430 23.375 -29.044 1.00 1.00 C ATOM 0 H THR A 118 -4.427 20.359 -26.662 1.00 1.00 H new ATOM 0 HA THR A 118 -5.131 20.676 -29.323 1.00 1.00 H new ATOM 0 HB THR A 118 -4.084 22.824 -27.468 1.00 1.00 H new ATOM 0 HG1 THR A 118 -6.337 22.904 -26.740 1.00 1.00 H new ATOM 0 HG21 THR A 118 -5.794 24.271 -28.540 1.00 1.00 H new ATOM 0 HG22 THR A 118 -4.618 23.643 -29.720 1.00 1.00 H new ATOM 0 HG23 THR A 118 -6.242 22.924 -29.614 1.00 1.00 H new ATOM 1760 N HIS A 119 -1.958 21.457 -28.778 1.00 1.00 N ATOM 1761 CA HIS A 119 -0.668 21.654 -29.449 1.00 1.00 C ATOM 1762 C HIS A 119 -0.271 20.412 -30.257 1.00 1.00 C ATOM 1763 O HIS A 119 0.128 20.520 -31.413 1.00 1.00 O ATOM 1764 CB HIS A 119 0.405 21.994 -28.408 1.00 1.00 C ATOM 1765 CG HIS A 119 1.727 22.332 -29.048 1.00 1.00 C ATOM 1766 ND1 HIS A 119 2.018 23.525 -29.714 1.00 1.00 N ATOM 1767 CD2 HIS A 119 2.830 21.529 -29.070 1.00 1.00 C ATOM 1768 CE1 HIS A 119 3.292 23.413 -30.124 1.00 1.00 C ATOM 1769 NE2 HIS A 119 3.805 22.229 -29.746 1.00 1.00 N ATOM 0 H HIS A 119 -1.888 21.387 -27.763 1.00 1.00 H new ATOM 0 HA HIS A 119 -0.759 22.484 -30.150 1.00 1.00 H new ATOM 0 HB2 HIS A 119 0.069 22.837 -27.803 1.00 1.00 H new ATOM 0 HB3 HIS A 119 0.535 21.149 -27.732 1.00 1.00 H new ATOM 0 HD2 HIS A 119 2.921 20.541 -28.643 1.00 1.00 H new ATOM 0 HE1 HIS A 119 3.829 24.168 -30.679 1.00 1.00 H new ATOM 0 HE2 HIS A 119 4.755 21.904 -29.929 1.00 1.00 H new ATOM 1777 N ILE A 120 -0.429 19.218 -29.674 1.00 1.00 N ATOM 1778 CA ILE A 120 -0.110 17.926 -30.307 1.00 1.00 C ATOM 1779 C ILE A 120 -0.949 17.676 -31.571 1.00 1.00 C ATOM 1780 O ILE A 120 -0.416 17.194 -32.573 1.00 1.00 O ATOM 1781 CB ILE A 120 -0.184 16.784 -29.265 1.00 1.00 C ATOM 1782 CG1 ILE A 120 0.880 17.059 -28.170 1.00 1.00 C ATOM 1783 CG2 ILE A 120 0.033 15.405 -29.915 1.00 1.00 C ATOM 1784 CD1 ILE A 120 0.916 16.029 -27.033 1.00 1.00 C ATOM 0 H ILE A 120 -0.791 19.117 -28.726 1.00 1.00 H new ATOM 0 HA ILE A 120 0.920 17.956 -30.664 1.00 1.00 H new ATOM 0 HB ILE A 120 -1.179 16.762 -28.822 1.00 1.00 H new ATOM 0 HG12 ILE A 120 1.863 17.095 -28.640 1.00 1.00 H new ATOM 0 HG13 ILE A 120 0.695 18.044 -27.743 1.00 1.00 H new ATOM 0 HG21 ILE A 120 -0.026 14.629 -29.151 1.00 1.00 H new ATOM 0 HG22 ILE A 120 -0.736 15.233 -30.668 1.00 1.00 H new ATOM 0 HG23 ILE A 120 1.015 15.376 -30.387 1.00 1.00 H new ATOM 0 HD11 ILE A 120 1.690 16.305 -26.317 1.00 1.00 H new ATOM 0 HD12 ILE A 120 -0.051 16.007 -26.531 1.00 1.00 H new ATOM 0 HD13 ILE A 120 1.135 15.043 -27.442 1.00 1.00 H new ATOM 1796 N LYS A 121 -2.231 18.065 -31.584 1.00 1.00 N ATOM 1797 CA LYS A 121 -3.079 17.993 -32.790 1.00 1.00 C ATOM 1798 C LYS A 121 -2.476 18.836 -33.920 1.00 1.00 C ATOM 1799 O LYS A 121 -2.420 18.387 -35.065 1.00 1.00 O ATOM 1800 CB LYS A 121 -4.514 18.441 -32.464 1.00 1.00 C ATOM 1801 CG LYS A 121 -5.263 17.380 -31.639 1.00 1.00 C ATOM 1802 CD LYS A 121 -6.646 17.852 -31.161 1.00 1.00 C ATOM 1803 CE LYS A 121 -7.605 18.119 -32.330 1.00 1.00 C ATOM 1804 NZ LYS A 121 -8.960 18.505 -31.854 1.00 1.00 N ATOM 0 H LYS A 121 -2.711 18.437 -30.765 1.00 1.00 H new ATOM 0 HA LYS A 121 -3.120 16.958 -33.130 1.00 1.00 H new ATOM 0 HB2 LYS A 121 -4.486 19.380 -31.911 1.00 1.00 H new ATOM 0 HB3 LYS A 121 -5.056 18.632 -33.390 1.00 1.00 H new ATOM 0 HG2 LYS A 121 -5.381 16.478 -32.240 1.00 1.00 H new ATOM 0 HG3 LYS A 121 -4.659 17.109 -30.773 1.00 1.00 H new ATOM 0 HD2 LYS A 121 -7.078 17.097 -30.504 1.00 1.00 H new ATOM 0 HD3 LYS A 121 -6.533 18.762 -30.571 1.00 1.00 H new ATOM 0 HE2 LYS A 121 -7.200 18.913 -32.958 1.00 1.00 H new ATOM 0 HE3 LYS A 121 -7.678 17.227 -32.951 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 -9.579 18.677 -32.672 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 -9.356 17.737 -31.275 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 -8.893 19.371 -31.282 1.00 1.00 H new ATOM 1818 N ASN A 122 -1.955 20.022 -33.596 1.00 1.00 N ATOM 1819 CA ASN A 122 -1.266 20.880 -34.560 1.00 1.00 C ATOM 1820 C ASN A 122 0.097 20.292 -34.989 1.00 1.00 C ATOM 1821 O ASN A 122 0.437 20.410 -36.165 1.00 1.00 O ATOM 1822 CB ASN A 122 -1.164 22.314 -34.019 1.00 1.00 C ATOM 1823 CG ASN A 122 -2.491 23.053 -34.111 1.00 1.00 C ATOM 1824 OD1 ASN A 122 -2.808 23.672 -35.116 1.00 1.00 O ATOM 1825 ND2 ASN A 122 -3.322 23.006 -33.095 1.00 1.00 N ATOM 0 H ASN A 122 -2.000 20.414 -32.655 1.00 1.00 H new ATOM 0 HA ASN A 122 -1.860 20.922 -35.473 1.00 1.00 H new ATOM 0 HB2 ASN A 122 -0.835 22.287 -32.980 1.00 1.00 H new ATOM 0 HB3 ASN A 122 -0.405 22.860 -34.580 1.00 1.00 H new ATOM 0 HD21 ASN A 122 -4.222 23.483 -33.150 1.00 1.00 H new ATOM 0 HD22 ASN A 122 -3.068 22.492 -32.251 1.00 1.00 H new ATOM 1832 N LEU A 123 0.847 19.602 -34.109 1.00 1.00 N ATOM 1833 CA LEU A 123 2.104 18.924 -34.493 1.00 1.00 C ATOM 1834 C LEU A 123 1.855 17.967 -35.672 1.00 1.00 C ATOM 1835 O LEU A 123 2.572 18.018 -36.670 1.00 1.00 O ATOM 1836 CB LEU A 123 2.725 18.104 -33.337 1.00 1.00 C ATOM 1837 CG LEU A 123 3.204 18.851 -32.083 1.00 1.00 C ATOM 1838 CD1 LEU A 123 3.718 17.839 -31.054 1.00 1.00 C ATOM 1839 CD2 LEU A 123 4.352 19.809 -32.373 1.00 1.00 C ATOM 0 H LEU A 123 0.605 19.498 -33.124 1.00 1.00 H new ATOM 0 HA LEU A 123 2.801 19.716 -34.768 1.00 1.00 H new ATOM 0 HB2 LEU A 123 1.988 17.365 -33.022 1.00 1.00 H new ATOM 0 HB3 LEU A 123 3.575 17.554 -33.740 1.00 1.00 H new ATOM 0 HG LEU A 123 2.350 19.420 -31.715 1.00 1.00 H new ATOM 0 HD11 LEU A 123 4.058 18.367 -30.163 1.00 1.00 H new ATOM 0 HD12 LEU A 123 2.914 17.154 -30.785 1.00 1.00 H new ATOM 0 HD13 LEU A 123 4.548 17.275 -31.481 1.00 1.00 H new ATOM 0 HD21 LEU A 123 4.650 20.309 -31.452 1.00 1.00 H new ATOM 0 HD22 LEU A 123 5.199 19.252 -32.773 1.00 1.00 H new ATOM 0 HD23 LEU A 123 4.030 20.553 -33.102 1.00 1.00 H new ATOM 1851 N ARG A 124 0.811 17.127 -35.568 1.00 1.00 N ATOM 1852 CA ARG A 124 0.407 16.156 -36.603 1.00 1.00 C ATOM 1853 C ARG A 124 0.020 16.822 -37.928 1.00 1.00 C ATOM 1854 O ARG A 124 0.344 16.299 -38.993 1.00 1.00 O ATOM 1855 CB ARG A 124 -0.737 15.270 -36.081 1.00 1.00 C ATOM 1856 CG ARG A 124 -0.292 14.377 -34.909 1.00 1.00 C ATOM 1857 CD ARG A 124 -1.437 13.509 -34.369 1.00 1.00 C ATOM 1858 NE ARG A 124 -1.920 12.524 -35.361 1.00 1.00 N ATOM 1859 CZ ARG A 124 -1.393 11.346 -35.649 1.00 1.00 C ATOM 1860 NH1 ARG A 124 -0.323 10.895 -35.053 1.00 1.00 N ATOM 1861 NH2 ARG A 124 -1.937 10.587 -36.556 1.00 1.00 N ATOM 0 H ARG A 124 0.210 17.103 -34.744 1.00 1.00 H new ATOM 0 HA ARG A 124 1.277 15.534 -36.815 1.00 1.00 H new ATOM 0 HB2 ARG A 124 -1.566 15.901 -35.760 1.00 1.00 H new ATOM 0 HB3 ARG A 124 -1.108 14.644 -36.892 1.00 1.00 H new ATOM 0 HG2 ARG A 124 0.525 13.734 -35.235 1.00 1.00 H new ATOM 0 HG3 ARG A 124 0.096 15.003 -34.106 1.00 1.00 H new ATOM 0 HD2 ARG A 124 -1.100 12.984 -33.475 1.00 1.00 H new ATOM 0 HD3 ARG A 124 -2.264 14.152 -34.068 1.00 1.00 H new ATOM 0 HE ARG A 124 -2.757 12.784 -35.884 1.00 1.00 H new ATOM 0 HH11 ARG A 124 0.137 11.457 -34.337 1.00 1.00 H new ATOM 0 HH12 ARG A 124 0.053 9.981 -35.303 1.00 1.00 H new ATOM 0 HH21 ARG A 124 -2.774 10.900 -37.048 1.00 1.00 H new ATOM 0 HH22 ARG A 124 -1.527 9.679 -36.774 1.00 1.00 H new ATOM 1875 N LEU A 125 -0.639 17.984 -37.877 1.00 1.00 N ATOM 1876 CA LEU A 125 -1.007 18.761 -39.071 1.00 1.00 C ATOM 1877 C LEU A 125 0.228 19.357 -39.775 1.00 1.00 C ATOM 1878 O LEU A 125 0.258 19.425 -41.005 1.00 1.00 O ATOM 1879 CB LEU A 125 -2.017 19.865 -38.686 1.00 1.00 C ATOM 1880 CG LEU A 125 -3.484 19.501 -38.981 1.00 1.00 C ATOM 1881 CD1 LEU A 125 -3.974 18.262 -38.230 1.00 1.00 C ATOM 1882 CD2 LEU A 125 -4.390 20.673 -38.598 1.00 1.00 C ATOM 0 H LEU A 125 -0.935 18.417 -37.002 1.00 1.00 H new ATOM 0 HA LEU A 125 -1.477 18.084 -39.785 1.00 1.00 H new ATOM 0 HB2 LEU A 125 -1.914 20.083 -37.623 1.00 1.00 H new ATOM 0 HB3 LEU A 125 -1.764 20.778 -39.225 1.00 1.00 H new ATOM 0 HG LEU A 125 -3.530 19.281 -40.048 1.00 1.00 H new ATOM 0 HD11 LEU A 125 -5.015 18.068 -38.488 1.00 1.00 H new ATOM 0 HD12 LEU A 125 -3.365 17.403 -38.509 1.00 1.00 H new ATOM 0 HD13 LEU A 125 -3.892 18.431 -37.156 1.00 1.00 H new ATOM 0 HD21 LEU A 125 -5.428 20.414 -38.807 1.00 1.00 H new ATOM 0 HD22 LEU A 125 -4.277 20.888 -37.535 1.00 1.00 H new ATOM 0 HD23 LEU A 125 -4.112 21.553 -39.178 1.00 1.00 H new ATOM 1894 N ARG A 126 1.249 19.776 -39.011 1.00 1.00 N ATOM 1895 CA ARG A 126 2.510 20.341 -39.532 1.00 1.00 C ATOM 1896 C ARG A 126 3.472 19.266 -40.056 1.00 1.00 C ATOM 1897 O ARG A 126 4.134 19.495 -41.069 1.00 1.00 O ATOM 1898 CB ARG A 126 3.182 21.195 -38.436 1.00 1.00 C ATOM 1899 CG ARG A 126 2.725 22.666 -38.404 1.00 1.00 C ATOM 1900 CD ARG A 126 1.203 22.871 -38.410 1.00 1.00 C ATOM 1901 NE ARG A 126 0.835 24.251 -38.050 1.00 1.00 N ATOM 1902 CZ ARG A 126 0.740 25.311 -38.828 1.00 1.00 C ATOM 1903 NH1 ARG A 126 0.975 25.271 -40.109 1.00 1.00 N ATOM 1904 NH2 ARG A 126 0.401 26.450 -38.301 1.00 1.00 N ATOM 0 H ARG A 126 1.223 19.732 -37.992 1.00 1.00 H new ATOM 0 HA ARG A 126 2.263 20.969 -40.388 1.00 1.00 H new ATOM 0 HB2 ARG A 126 2.979 20.743 -37.465 1.00 1.00 H new ATOM 0 HB3 ARG A 126 4.262 21.166 -38.581 1.00 1.00 H new ATOM 0 HG2 ARG A 126 3.137 23.140 -37.513 1.00 1.00 H new ATOM 0 HG3 ARG A 126 3.150 23.182 -39.265 1.00 1.00 H new ATOM 0 HD2 ARG A 126 0.809 22.636 -39.399 1.00 1.00 H new ATOM 0 HD3 ARG A 126 0.740 22.177 -37.709 1.00 1.00 H new ATOM 0 HE ARG A 126 0.625 24.408 -37.064 1.00 1.00 H new ATOM 0 HH11 ARG A 126 1.246 24.392 -40.551 1.00 1.00 H new ATOM 0 HH12 ARG A 126 0.888 26.118 -40.670 1.00 1.00 H new ATOM 0 HH21 ARG A 126 0.213 26.513 -37.300 1.00 1.00 H new ATOM 0 HH22 ARG A 126 0.323 27.280 -38.888 1.00 1.00 H new ATOM 1918 N GLU A 127 3.554 18.105 -39.402 1.00 1.00 N ATOM 1919 CA GLU A 127 4.425 16.985 -39.793 1.00 1.00 C ATOM 1920 C GLU A 127 3.875 15.625 -39.314 1.00 1.00 C ATOM 1921 O GLU A 127 3.556 15.443 -38.137 1.00 1.00 O ATOM 1922 CB GLU A 127 5.837 17.225 -39.224 1.00 1.00 C ATOM 1923 CG GLU A 127 6.859 16.199 -39.732 1.00 1.00 C ATOM 1924 CD GLU A 127 8.278 16.536 -39.234 1.00 1.00 C ATOM 1925 OE1 GLU A 127 8.669 16.068 -38.135 1.00 1.00 O ATOM 1926 OE2 GLU A 127 9.019 17.262 -39.941 1.00 1.00 O ATOM 0 H GLU A 127 3.005 17.909 -38.565 1.00 1.00 H new ATOM 0 HA GLU A 127 4.462 16.944 -40.882 1.00 1.00 H new ATOM 0 HB2 GLU A 127 6.168 18.227 -39.495 1.00 1.00 H new ATOM 0 HB3 GLU A 127 5.798 17.185 -38.135 1.00 1.00 H new ATOM 0 HG2 GLU A 127 6.578 15.202 -39.392 1.00 1.00 H new ATOM 0 HG3 GLU A 127 6.848 16.179 -40.822 1.00 1.00 H new ATOM 1933 N GLN A 128 3.797 14.650 -40.229 1.00 1.00 N ATOM 1934 CA GLN A 128 3.336 13.275 -39.966 1.00 1.00 C ATOM 1935 C GLN A 128 3.939 12.256 -40.949 1.00 1.00 C ATOM 1936 O GLN A 128 4.494 12.620 -41.998 1.00 1.00 O ATOM 1937 CB GLN A 128 1.792 13.211 -39.941 1.00 1.00 C ATOM 1938 CG GLN A 128 1.046 13.782 -41.166 1.00 1.00 C ATOM 1939 CD GLN A 128 1.204 12.966 -42.450 1.00 1.00 C ATOM 1940 OE1 GLN A 128 1.249 11.741 -42.450 1.00 1.00 O ATOM 1941 NE2 GLN A 128 1.290 13.604 -43.598 1.00 1.00 N ATOM 0 H GLN A 128 4.060 14.798 -41.203 1.00 1.00 H new ATOM 0 HA GLN A 128 3.699 12.992 -38.978 1.00 1.00 H new ATOM 0 HB2 GLN A 128 1.498 12.168 -39.822 1.00 1.00 H new ATOM 0 HB3 GLN A 128 1.445 13.743 -39.055 1.00 1.00 H new ATOM 0 HG2 GLN A 128 -0.015 13.855 -40.926 1.00 1.00 H new ATOM 0 HG3 GLN A 128 1.401 14.796 -41.350 1.00 1.00 H new ATOM 0 HE21 GLN A 128 1.255 14.623 -43.619 1.00 1.00 H new ATOM 0 HE22 GLN A 128 1.392 13.079 -44.467 1.00 1.00 H new TER 1950 GLN A 128 HETATM 1951 ZN ZN A 129 -5.040 6.864 7.291 1.00 1.00 ZN HETATM 1952 ZN ZN A 130 0.966 25.295 -30.061 1.00 1.00 ZN