USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 930 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot 54:sc= 0.55 USER MOD Set 1.2: A 53 HIS : no HE2:sc= -0.626 K(o=-0.076,f=-1.8) USER MOD Single : A 2 ASN : amide:sc= -0.238 X(o=-0.24,f=-0.37) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.05) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -1.17 K(o=-1.2,f=-7.1!) USER MOD Single : A 16 TYR OH : rot 90:sc= -0.229 USER MOD Single : A 17 ASN : amide:sc= -0.563 K(o=-0.56,f=-1.4) USER MOD Single : A 25 MET CE :methyl -177:sc= -1.03 (180deg=-1.05) USER MOD Single : A 32 CYS SG : rot -139:sc= -1.62! USER MOD Single : A 33 GLN : amide:sc= 0.183 K(o=0.18,f=-0.76) USER MOD Single : A 35 TYR OH : rot 180:sc=-0.00149 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.51 K(o=-1.5,f=-6.1!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc=-0.00522 USER MOD Single : A 74 ASN : amide:sc= 0.241 X(o=0.24,f=0.41) USER MOD Single : A 79 HIS : no HD1:sc= -1.57 K(o=-1.6,f=-4.6!) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.162 X(o=0.16,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 180:sc= -0.532 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.22) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASN A 2 1.472 -2.297 -0.411 1.00 0.00 N ATOM 21 CA ASN A 2 1.705 -3.768 -0.426 1.00 0.00 C ATOM 22 C ASN A 2 0.393 -4.547 -0.668 1.00 0.00 C ATOM 23 O ASN A 2 0.348 -5.760 -0.481 1.00 0.00 O ATOM 24 CB ASN A 2 2.400 -4.262 0.882 1.00 0.00 C ATOM 25 CG ASN A 2 3.681 -3.499 1.220 1.00 0.00 C ATOM 26 OD1 ASN A 2 4.756 -3.816 0.728 1.00 0.00 O ATOM 27 ND2 ASN A 2 3.575 -2.501 2.081 1.00 0.00 N ATOM 0 HA ASN A 2 2.380 -3.969 -1.258 1.00 0.00 H new ATOM 0 HB2 ASN A 2 1.701 -4.168 1.713 1.00 0.00 H new ATOM 0 HB3 ASN A 2 2.634 -5.322 0.781 1.00 0.00 H new ATOM 0 HD21 ASN A 2 4.403 -1.971 2.352 1.00 0.00 H new ATOM 0 HD22 ASN A 2 2.665 -2.261 2.474 1.00 0.00 H new ATOM 34 N SER A 3 -0.644 -3.830 -1.147 1.00 0.00 N ATOM 35 CA SER A 3 -2.030 -4.322 -1.230 1.00 0.00 C ATOM 36 C SER A 3 -2.152 -5.482 -2.226 1.00 0.00 C ATOM 37 O SER A 3 -2.786 -6.489 -1.936 1.00 0.00 O ATOM 38 CB SER A 3 -2.956 -3.152 -1.632 1.00 0.00 C ATOM 39 OG SER A 3 -2.728 -2.018 -0.806 1.00 0.00 O ATOM 0 H SER A 3 -0.537 -2.876 -1.492 1.00 0.00 H new ATOM 0 HA SER A 3 -2.330 -4.705 -0.254 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.783 -2.888 -2.675 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.998 -3.463 -1.551 1.00 0.00 H new ATOM 0 HG SER A 3 -3.323 -1.289 -1.079 1.00 0.00 H new ATOM 45 N GLU A 4 -1.479 -5.330 -3.376 1.00 0.00 N ATOM 46 CA GLU A 4 -1.421 -6.355 -4.445 1.00 0.00 C ATOM 47 C GLU A 4 -0.718 -7.661 -3.986 1.00 0.00 C ATOM 48 O GLU A 4 -0.865 -8.706 -4.626 1.00 0.00 O ATOM 49 CB GLU A 4 -0.686 -5.761 -5.671 1.00 0.00 C ATOM 50 CG GLU A 4 0.734 -5.231 -5.358 1.00 0.00 C ATOM 51 CD GLU A 4 1.482 -4.712 -6.594 1.00 0.00 C ATOM 52 OE1 GLU A 4 1.300 -3.530 -6.960 1.00 0.00 O ATOM 53 OE2 GLU A 4 2.240 -5.487 -7.216 1.00 0.00 O ATOM 0 H GLU A 4 -0.952 -4.486 -3.599 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.445 -6.625 -4.704 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -0.615 -6.526 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -1.284 -4.947 -6.081 1.00 0.00 H new ATOM 0 HG2 GLU A 4 0.660 -4.428 -4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 4 1.318 -6.029 -4.899 1.00 0.00 H new ATOM 60 N ILE A 5 0.068 -7.567 -2.899 1.00 0.00 N ATOM 61 CA ILE A 5 0.801 -8.707 -2.301 1.00 0.00 C ATOM 62 C ILE A 5 -0.025 -9.301 -1.132 1.00 0.00 C ATOM 63 O ILE A 5 0.044 -10.502 -0.841 1.00 0.00 O ATOM 64 CB ILE A 5 2.214 -8.244 -1.774 1.00 0.00 C ATOM 65 CG1 ILE A 5 2.948 -7.320 -2.807 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.104 -9.453 -1.388 1.00 0.00 C ATOM 67 CD1 ILE A 5 3.206 -7.933 -4.177 1.00 0.00 C ATOM 0 H ILE A 5 0.217 -6.689 -2.402 1.00 0.00 H new ATOM 0 HA ILE A 5 0.949 -9.468 -3.067 1.00 0.00 H new ATOM 0 HB ILE A 5 2.036 -7.657 -0.873 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.356 -6.414 -2.941 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.904 -7.016 -2.380 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.069 -9.095 -1.030 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.615 -10.028 -0.601 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.254 -10.088 -2.261 1.00 0.00 H new ATOM 0 HD11 ILE A 5 3.718 -7.208 -4.810 1.00 0.00 H new ATOM 0 HD12 ILE A 5 3.828 -8.821 -4.067 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.257 -8.210 -4.636 1.00 0.00 H new ATOM 79 N GLU A 6 -0.814 -8.425 -0.485 1.00 0.00 N ATOM 80 CA GLU A 6 -1.732 -8.787 0.609 1.00 0.00 C ATOM 81 C GLU A 6 -2.936 -9.579 0.084 1.00 0.00 C ATOM 82 O GLU A 6 -3.389 -10.511 0.746 1.00 0.00 O ATOM 83 CB GLU A 6 -2.224 -7.500 1.328 1.00 0.00 C ATOM 84 CG GLU A 6 -1.160 -6.794 2.187 1.00 0.00 C ATOM 85 CD GLU A 6 -0.848 -7.567 3.475 1.00 0.00 C ATOM 86 OE1 GLU A 6 -1.634 -7.453 4.441 1.00 0.00 O ATOM 87 OE2 GLU A 6 0.161 -8.290 3.540 1.00 0.00 O ATOM 0 H GLU A 6 -0.832 -7.431 -0.711 1.00 0.00 H new ATOM 0 HA GLU A 6 -1.190 -9.418 1.313 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.589 -6.799 0.578 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.072 -7.757 1.963 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -0.246 -6.676 1.605 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -1.507 -5.793 2.441 1.00 0.00 H new ATOM 94 N LEU A 7 -3.422 -9.210 -1.119 1.00 0.00 N ATOM 95 CA LEU A 7 -4.635 -9.812 -1.716 1.00 0.00 C ATOM 96 C LEU A 7 -4.501 -11.352 -1.883 1.00 0.00 C ATOM 97 O LEU A 7 -5.371 -12.064 -1.383 1.00 0.00 O ATOM 98 CB LEU A 7 -5.008 -9.140 -3.070 1.00 0.00 C ATOM 99 CG LEU A 7 -5.522 -7.673 -2.998 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.658 -7.056 -4.407 1.00 0.00 C ATOM 101 CD2 LEU A 7 -6.849 -7.580 -2.206 1.00 0.00 C ATOM 0 H LEU A 7 -2.990 -8.492 -1.701 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.449 -9.626 -1.015 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.130 -9.163 -3.716 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.774 -9.747 -3.553 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.778 -7.088 -2.457 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.019 -6.031 -4.322 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -4.686 -7.059 -4.901 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.365 -7.642 -4.994 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.182 -6.542 -2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.608 -8.190 -2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.693 -7.942 -1.190 1.00 0.00 H new ATOM 113 N PRO A 8 -3.411 -11.910 -2.545 1.00 0.00 N ATOM 114 CA PRO A 8 -3.236 -13.368 -2.650 1.00 0.00 C ATOM 115 C PRO A 8 -3.198 -14.051 -1.273 1.00 0.00 C ATOM 116 O PRO A 8 -4.094 -14.828 -0.946 1.00 0.00 O ATOM 117 CB PRO A 8 -1.903 -13.552 -3.444 1.00 0.00 C ATOM 118 CG PRO A 8 -1.215 -12.228 -3.365 1.00 0.00 C ATOM 119 CD PRO A 8 -2.317 -11.199 -3.258 1.00 0.00 C ATOM 0 HA PRO A 8 -4.076 -13.842 -3.158 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.290 -14.341 -3.008 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.097 -13.834 -4.479 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.552 -12.183 -2.501 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.601 -12.053 -4.248 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -1.988 -10.319 -2.706 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.639 -10.856 -4.241 1.00 0.00 H new ATOM 127 N VAL A 9 -2.227 -13.656 -0.445 1.00 0.00 N ATOM 128 CA VAL A 9 -1.907 -14.348 0.819 1.00 0.00 C ATOM 129 C VAL A 9 -3.077 -14.331 1.831 1.00 0.00 C ATOM 130 O VAL A 9 -3.228 -15.265 2.632 1.00 0.00 O ATOM 131 CB VAL A 9 -0.604 -13.749 1.463 1.00 0.00 C ATOM 132 CG1 VAL A 9 0.554 -13.794 0.440 1.00 0.00 C ATOM 133 CG2 VAL A 9 -0.819 -12.308 2.005 1.00 0.00 C ATOM 0 H VAL A 9 -1.635 -12.845 -0.628 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.732 -15.394 0.567 1.00 0.00 H new ATOM 0 HB VAL A 9 -0.344 -14.365 2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.455 -13.378 0.891 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.740 -14.827 0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.285 -13.209 -0.440 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.111 -11.940 2.439 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.122 -11.653 1.188 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.597 -12.319 2.768 1.00 0.00 H new ATOM 143 N GLN A 10 -3.908 -13.269 1.768 1.00 0.00 N ATOM 144 CA GLN A 10 -5.067 -13.110 2.657 1.00 0.00 C ATOM 145 C GLN A 10 -6.188 -14.080 2.254 1.00 0.00 C ATOM 146 O GLN A 10 -6.619 -14.897 3.066 1.00 0.00 O ATOM 147 CB GLN A 10 -5.590 -11.647 2.642 1.00 0.00 C ATOM 148 CG GLN A 10 -6.690 -11.351 3.678 1.00 0.00 C ATOM 149 CD GLN A 10 -6.229 -11.573 5.122 1.00 0.00 C ATOM 150 OE1 GLN A 10 -5.692 -10.667 5.760 1.00 0.00 O ATOM 151 NE2 GLN A 10 -6.425 -12.777 5.644 1.00 0.00 N ATOM 0 H GLN A 10 -3.791 -12.505 1.102 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.746 -13.344 3.672 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -4.752 -10.973 2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -5.975 -11.423 1.647 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -7.021 -10.319 3.563 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.552 -11.987 3.476 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.873 -13.507 5.089 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -6.128 -12.973 6.600 1.00 0.00 H new ATOM 160 N LYS A 11 -6.609 -14.002 0.970 1.00 0.00 N ATOM 161 CA LYS A 11 -7.755 -14.787 0.437 1.00 0.00 C ATOM 162 C LYS A 11 -7.463 -16.292 0.491 1.00 0.00 C ATOM 163 O LYS A 11 -8.357 -17.103 0.750 1.00 0.00 O ATOM 164 CB LYS A 11 -8.079 -14.382 -1.023 1.00 0.00 C ATOM 165 CG LYS A 11 -8.322 -12.876 -1.243 1.00 0.00 C ATOM 166 CD LYS A 11 -9.473 -12.297 -0.398 1.00 0.00 C ATOM 167 CE LYS A 11 -9.608 -10.775 -0.568 1.00 0.00 C ATOM 168 NZ LYS A 11 -10.706 -10.226 0.261 1.00 0.00 N ATOM 0 H LYS A 11 -6.169 -13.398 0.276 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.617 -14.567 1.067 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.256 -14.699 -1.663 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.964 -14.929 -1.348 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.406 -12.333 -1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.537 -12.703 -2.298 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.409 -12.777 -0.684 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.303 -12.530 0.653 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.669 -10.294 -0.294 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.792 -10.541 -1.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -10.766 -9.197 0.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.606 -10.667 -0.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -10.518 -10.427 1.264 1.00 0.00 H new ATOM 182 N GLN A 12 -6.188 -16.630 0.239 1.00 0.00 N ATOM 183 CA GLN A 12 -5.676 -18.003 0.306 1.00 0.00 C ATOM 184 C GLN A 12 -5.800 -18.570 1.723 1.00 0.00 C ATOM 185 O GLN A 12 -6.261 -19.694 1.881 1.00 0.00 O ATOM 186 CB GLN A 12 -4.208 -18.051 -0.168 1.00 0.00 C ATOM 187 CG GLN A 12 -4.034 -17.825 -1.686 1.00 0.00 C ATOM 188 CD GLN A 12 -2.586 -17.642 -2.123 1.00 0.00 C ATOM 189 OE1 GLN A 12 -2.316 -16.939 -3.093 1.00 0.00 O ATOM 190 NE2 GLN A 12 -1.648 -18.299 -1.439 1.00 0.00 N ATOM 0 H GLN A 12 -5.477 -15.946 -0.020 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.280 -18.622 -0.357 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -3.638 -17.294 0.370 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.782 -19.019 0.097 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -4.460 -18.674 -2.221 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -4.606 -16.945 -1.980 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.909 -18.874 -0.638 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.669 -18.226 -1.717 1.00 0.00 H new ATOM 199 N LEU A 13 -5.403 -17.782 2.744 1.00 0.00 N ATOM 200 CA LEU A 13 -5.538 -18.196 4.161 1.00 0.00 C ATOM 201 C LEU A 13 -7.003 -18.459 4.478 1.00 0.00 C ATOM 202 O LEU A 13 -7.344 -19.503 5.048 1.00 0.00 O ATOM 203 CB LEU A 13 -4.964 -17.115 5.125 1.00 0.00 C ATOM 204 CG LEU A 13 -4.980 -17.423 6.676 1.00 0.00 C ATOM 205 CD1 LEU A 13 -6.344 -17.178 7.361 1.00 0.00 C ATOM 206 CD2 LEU A 13 -4.438 -18.840 6.985 1.00 0.00 C ATOM 0 H LEU A 13 -4.988 -16.859 2.617 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.963 -19.110 4.308 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.932 -16.921 4.833 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -5.520 -16.192 4.962 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.301 -16.692 7.116 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.266 -17.414 8.422 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.629 -16.133 7.242 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.101 -17.815 6.903 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.465 -19.013 8.061 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -5.056 -19.584 6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.411 -18.922 6.630 1.00 0.00 H new ATOM 218 N GLU A 14 -7.851 -17.493 4.088 1.00 0.00 N ATOM 219 CA GLU A 14 -9.284 -17.542 4.369 1.00 0.00 C ATOM 220 C GLU A 14 -9.909 -18.815 3.765 1.00 0.00 C ATOM 221 O GLU A 14 -10.842 -19.387 4.320 1.00 0.00 O ATOM 222 CB GLU A 14 -10.003 -16.291 3.801 1.00 0.00 C ATOM 223 CG GLU A 14 -9.515 -14.941 4.362 1.00 0.00 C ATOM 224 CD GLU A 14 -9.551 -14.861 5.895 1.00 0.00 C ATOM 225 OE1 GLU A 14 -10.653 -14.926 6.477 1.00 0.00 O ATOM 226 OE2 GLU A 14 -8.483 -14.699 6.525 1.00 0.00 O ATOM 0 H GLU A 14 -7.559 -16.663 3.572 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.411 -17.558 5.451 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.880 -16.282 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.071 -16.384 4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.495 -14.763 4.021 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.132 -14.142 3.951 1.00 0.00 H new ATOM 233 N ALA A 15 -9.355 -19.222 2.615 1.00 0.00 N ATOM 234 CA ALA A 15 -9.745 -20.431 1.887 1.00 0.00 C ATOM 235 C ALA A 15 -9.066 -21.702 2.448 1.00 0.00 C ATOM 236 O ALA A 15 -9.608 -22.799 2.304 1.00 0.00 O ATOM 237 CB ALA A 15 -9.415 -20.247 0.404 1.00 0.00 C ATOM 0 H ALA A 15 -8.605 -18.705 2.156 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.818 -20.575 2.014 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.702 -21.143 -0.147 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.963 -19.390 0.013 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.345 -20.077 0.288 1.00 0.00 H new ATOM 243 N TYR A 16 -7.878 -21.547 3.086 1.00 0.00 N ATOM 244 CA TYR A 16 -7.072 -22.689 3.579 1.00 0.00 C ATOM 245 C TYR A 16 -7.781 -23.356 4.773 1.00 0.00 C ATOM 246 O TYR A 16 -7.879 -24.589 4.844 1.00 0.00 O ATOM 247 CB TYR A 16 -5.646 -22.207 3.972 1.00 0.00 C ATOM 248 CG TYR A 16 -4.676 -23.326 4.400 1.00 0.00 C ATOM 249 CD1 TYR A 16 -4.066 -24.158 3.457 1.00 0.00 C ATOM 250 CD2 TYR A 16 -4.376 -23.554 5.745 1.00 0.00 C ATOM 251 CE1 TYR A 16 -3.199 -25.166 3.836 1.00 0.00 C ATOM 252 CE2 TYR A 16 -3.509 -24.562 6.124 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.924 -25.366 5.167 1.00 0.00 C ATOM 254 OH TYR A 16 -2.059 -26.376 5.542 1.00 0.00 O ATOM 0 H TYR A 16 -7.457 -20.637 3.271 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.972 -23.429 2.785 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -5.212 -21.675 3.125 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.733 -21.490 4.788 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.277 -24.010 2.408 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -4.829 -22.932 6.502 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.739 -25.794 3.088 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -3.289 -24.720 7.170 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.143 -26.028 5.571 1.00 0.00 H new ATOM 264 N ASN A 17 -8.288 -22.512 5.696 1.00 0.00 N ATOM 265 CA ASN A 17 -9.091 -22.967 6.854 1.00 0.00 C ATOM 266 C ASN A 17 -10.535 -23.320 6.431 1.00 0.00 C ATOM 267 O ASN A 17 -11.216 -24.083 7.121 1.00 0.00 O ATOM 268 CB ASN A 17 -9.091 -21.910 8.004 1.00 0.00 C ATOM 269 CG ASN A 17 -9.409 -20.471 7.558 1.00 0.00 C ATOM 270 OD1 ASN A 17 -8.547 -19.595 7.603 1.00 0.00 O ATOM 271 ND2 ASN A 17 -10.635 -20.213 7.122 1.00 0.00 N ATOM 0 H ASN A 17 -8.154 -21.501 5.662 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.621 -23.873 7.237 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.820 -22.212 8.756 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -8.114 -21.918 8.486 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -10.879 -19.272 6.815 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -11.333 -20.956 7.094 1.00 0.00 H new ATOM 278 N ALA A 18 -10.991 -22.754 5.301 1.00 0.00 N ATOM 279 CA ALA A 18 -12.355 -22.987 4.767 1.00 0.00 C ATOM 280 C ALA A 18 -12.402 -24.177 3.791 1.00 0.00 C ATOM 281 O ALA A 18 -13.475 -24.496 3.261 1.00 0.00 O ATOM 282 CB ALA A 18 -12.873 -21.706 4.096 1.00 0.00 C ATOM 0 H ALA A 18 -10.430 -22.123 4.729 1.00 0.00 H new ATOM 0 HA ALA A 18 -13.005 -23.244 5.604 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.875 -21.880 3.705 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.904 -20.899 4.828 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.207 -21.429 3.279 1.00 0.00 H new ATOM 288 N ARG A 19 -11.227 -24.810 3.554 1.00 0.00 N ATOM 289 CA ARG A 19 -11.066 -26.018 2.705 1.00 0.00 C ATOM 290 C ARG A 19 -11.300 -25.743 1.192 1.00 0.00 C ATOM 291 O ARG A 19 -11.297 -26.684 0.387 1.00 0.00 O ATOM 292 CB ARG A 19 -11.956 -27.198 3.205 1.00 0.00 C ATOM 293 CG ARG A 19 -11.646 -27.692 4.638 1.00 0.00 C ATOM 294 CD ARG A 19 -10.248 -28.324 4.771 1.00 0.00 C ATOM 295 NE ARG A 19 -10.036 -28.876 6.127 1.00 0.00 N ATOM 296 CZ ARG A 19 -9.961 -30.183 6.444 1.00 0.00 C ATOM 297 NH1 ARG A 19 -10.041 -31.122 5.508 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.804 -30.544 7.707 1.00 0.00 N ATOM 0 H ARG A 19 -10.346 -24.489 3.956 1.00 0.00 H new ATOM 0 HA ARG A 19 -10.021 -26.313 2.807 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.000 -26.889 3.162 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -11.843 -28.035 2.516 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -11.726 -26.854 5.330 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.398 -28.423 4.934 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.132 -29.116 4.031 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.486 -27.575 4.557 1.00 0.00 H new ATOM 0 HE ARG A 19 -9.938 -28.207 6.890 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -10.161 -30.858 4.530 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -9.982 -32.107 5.767 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -9.740 -29.834 8.436 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.747 -31.533 7.952 1.00 0.00 H new ATOM 312 N ASP A 20 -11.454 -24.461 0.811 1.00 0.00 N ATOM 313 CA ASP A 20 -11.645 -24.052 -0.595 1.00 0.00 C ATOM 314 C ASP A 20 -10.299 -24.047 -1.334 1.00 0.00 C ATOM 315 O ASP A 20 -9.533 -23.093 -1.212 1.00 0.00 O ATOM 316 CB ASP A 20 -12.290 -22.640 -0.688 1.00 0.00 C ATOM 317 CG ASP A 20 -13.740 -22.586 -0.188 1.00 0.00 C ATOM 318 OD1 ASP A 20 -13.954 -22.454 1.031 1.00 0.00 O ATOM 319 OD2 ASP A 20 -14.676 -22.647 -1.015 1.00 0.00 O ATOM 0 H ASP A 20 -11.450 -23.680 1.467 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.317 -24.772 -1.062 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.690 -21.938 -0.109 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.261 -22.305 -1.725 1.00 0.00 H new ATOM 324 N ILE A 21 -10.018 -25.124 -2.083 1.00 0.00 N ATOM 325 CA ILE A 21 -8.845 -25.196 -2.986 1.00 0.00 C ATOM 326 C ILE A 21 -8.947 -24.142 -4.095 1.00 0.00 C ATOM 327 O ILE A 21 -7.940 -23.554 -4.475 1.00 0.00 O ATOM 328 CB ILE A 21 -8.684 -26.648 -3.612 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.094 -27.624 -2.556 1.00 0.00 C ATOM 330 CG2 ILE A 21 -7.829 -26.669 -4.920 1.00 0.00 C ATOM 331 CD1 ILE A 21 -6.647 -27.326 -2.190 1.00 0.00 C ATOM 0 H ILE A 21 -10.590 -25.968 -2.085 1.00 0.00 H new ATOM 0 HA ILE A 21 -7.957 -24.987 -2.390 1.00 0.00 H new ATOM 0 HB ILE A 21 -9.683 -26.977 -3.898 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.704 -27.581 -1.654 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -8.161 -28.643 -2.938 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -7.760 -27.691 -5.293 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.301 -26.039 -5.674 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -6.829 -26.292 -4.707 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.303 -28.047 -1.449 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.024 -27.397 -3.082 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.576 -26.320 -1.777 1.00 0.00 H new ATOM 343 N ASP A 22 -10.178 -23.894 -4.566 1.00 0.00 N ATOM 344 CA ASP A 22 -10.447 -23.008 -5.711 1.00 0.00 C ATOM 345 C ASP A 22 -9.891 -21.586 -5.467 1.00 0.00 C ATOM 346 O ASP A 22 -9.165 -21.050 -6.304 1.00 0.00 O ATOM 347 CB ASP A 22 -11.978 -22.960 -5.954 1.00 0.00 C ATOM 348 CG ASP A 22 -12.381 -22.245 -7.257 1.00 0.00 C ATOM 349 OD1 ASP A 22 -12.427 -20.995 -7.283 1.00 0.00 O ATOM 350 OD2 ASP A 22 -12.669 -22.930 -8.260 1.00 0.00 O ATOM 0 H ASP A 22 -11.020 -24.304 -4.162 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.943 -23.403 -6.593 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.365 -23.979 -5.976 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.454 -22.456 -5.113 1.00 0.00 H new ATOM 355 N ALA A 23 -10.204 -21.016 -4.289 1.00 0.00 N ATOM 356 CA ALA A 23 -9.727 -19.667 -3.887 1.00 0.00 C ATOM 357 C ALA A 23 -8.316 -19.711 -3.299 1.00 0.00 C ATOM 358 O ALA A 23 -7.551 -18.745 -3.445 1.00 0.00 O ATOM 359 CB ALA A 23 -10.718 -19.013 -2.915 1.00 0.00 C ATOM 0 H ALA A 23 -10.791 -21.469 -3.588 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.674 -19.053 -4.786 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.352 -18.026 -2.632 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.690 -18.915 -3.398 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.817 -19.633 -2.024 1.00 0.00 H new ATOM 365 N PHE A 24 -7.965 -20.836 -2.644 1.00 0.00 N ATOM 366 CA PHE A 24 -6.601 -21.050 -2.130 1.00 0.00 C ATOM 367 C PHE A 24 -5.595 -21.161 -3.290 1.00 0.00 C ATOM 368 O PHE A 24 -4.414 -20.964 -3.086 1.00 0.00 O ATOM 369 CB PHE A 24 -6.534 -22.310 -1.219 1.00 0.00 C ATOM 370 CG PHE A 24 -5.142 -22.586 -0.645 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.553 -21.691 0.241 1.00 0.00 C ATOM 372 CD2 PHE A 24 -4.411 -23.709 -1.017 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.284 -21.897 0.733 1.00 0.00 C ATOM 374 CE2 PHE A 24 -3.145 -23.916 -0.518 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.579 -23.014 0.355 1.00 0.00 C ATOM 0 H PHE A 24 -8.607 -21.607 -2.460 1.00 0.00 H new ATOM 0 HA PHE A 24 -6.332 -20.186 -1.523 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.238 -22.189 -0.396 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.859 -23.178 -1.792 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.103 -20.815 0.550 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.840 -24.424 -1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -2.844 -21.183 1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.590 -24.794 -0.814 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.585 -23.184 0.741 1.00 0.00 H new ATOM 385 N MET A 25 -6.088 -21.480 -4.500 1.00 0.00 N ATOM 386 CA MET A 25 -5.252 -21.652 -5.707 1.00 0.00 C ATOM 387 C MET A 25 -5.642 -20.671 -6.826 1.00 0.00 C ATOM 388 O MET A 25 -5.094 -20.746 -7.935 1.00 0.00 O ATOM 389 CB MET A 25 -5.337 -23.122 -6.187 1.00 0.00 C ATOM 390 CG MET A 25 -4.651 -24.122 -5.236 1.00 0.00 C ATOM 391 SD MET A 25 -2.877 -23.813 -5.042 1.00 0.00 S ATOM 392 CE MET A 25 -2.342 -23.623 -6.750 1.00 0.00 C ATOM 0 H MET A 25 -7.083 -21.627 -4.671 1.00 0.00 H new ATOM 0 HA MET A 25 -4.219 -21.421 -5.446 1.00 0.00 H new ATOM 0 HB2 MET A 25 -6.385 -23.399 -6.298 1.00 0.00 H new ATOM 0 HB3 MET A 25 -4.881 -23.200 -7.174 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.131 -24.073 -4.259 1.00 0.00 H new ATOM 0 HG3 MET A 25 -4.799 -25.134 -5.614 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.262 -23.482 -6.779 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.606 -24.516 -7.316 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.834 -22.756 -7.191 1.00 0.00 H new ATOM 402 N ALA A 26 -6.563 -19.740 -6.518 1.00 0.00 N ATOM 403 CA ALA A 26 -7.002 -18.697 -7.467 1.00 0.00 C ATOM 404 C ALA A 26 -5.885 -17.669 -7.687 1.00 0.00 C ATOM 405 O ALA A 26 -5.525 -17.352 -8.814 1.00 0.00 O ATOM 406 CB ALA A 26 -8.270 -17.998 -6.947 1.00 0.00 C ATOM 0 H ALA A 26 -7.023 -19.688 -5.609 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.231 -19.173 -8.420 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.581 -17.232 -7.658 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.068 -18.731 -6.832 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.061 -17.535 -5.983 1.00 0.00 H new ATOM 412 N TRP A 27 -5.307 -17.215 -6.574 1.00 0.00 N ATOM 413 CA TRP A 27 -4.373 -16.074 -6.536 1.00 0.00 C ATOM 414 C TRP A 27 -2.907 -16.475 -6.799 1.00 0.00 C ATOM 415 O TRP A 27 -1.989 -15.657 -6.635 1.00 0.00 O ATOM 416 CB TRP A 27 -4.512 -15.402 -5.167 1.00 0.00 C ATOM 417 CG TRP A 27 -5.860 -14.762 -4.930 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.972 -15.347 -4.397 1.00 0.00 C ATOM 419 CD2 TRP A 27 -6.223 -13.405 -5.228 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.998 -14.442 -4.351 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.564 -13.243 -4.852 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.536 -12.312 -5.778 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -8.241 -12.035 -5.004 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -6.207 -11.113 -5.927 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.547 -10.984 -5.540 1.00 0.00 C ATOM 0 H TRP A 27 -5.473 -17.631 -5.658 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.634 -15.388 -7.341 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.332 -16.144 -4.389 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.738 -14.641 -5.067 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -7.033 -16.372 -4.061 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.937 -14.630 -3.999 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.503 -12.406 -6.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -9.275 -11.932 -4.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.691 -10.263 -6.348 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -8.044 -10.034 -5.667 1.00 0.00 H new ATOM 436 N TRP A 28 -2.702 -17.724 -7.208 1.00 0.00 N ATOM 437 CA TRP A 28 -1.391 -18.231 -7.640 1.00 0.00 C ATOM 438 C TRP A 28 -1.233 -17.990 -9.144 1.00 0.00 C ATOM 439 O TRP A 28 -2.228 -17.823 -9.862 1.00 0.00 O ATOM 440 CB TRP A 28 -1.265 -19.742 -7.312 1.00 0.00 C ATOM 441 CG TRP A 28 -1.289 -20.043 -5.830 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.318 -19.814 -4.961 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.239 -20.636 -5.045 1.00 0.00 C ATOM 444 NE1 TRP A 28 -1.960 -20.212 -3.704 1.00 0.00 N ATOM 445 CE2 TRP A 28 -0.700 -20.715 -3.725 1.00 0.00 C ATOM 446 CE3 TRP A 28 1.045 -21.098 -5.333 1.00 0.00 C ATOM 447 CZ2 TRP A 28 0.070 -21.235 -2.688 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.810 -21.620 -4.308 1.00 0.00 C ATOM 449 CH2 TRP A 28 1.322 -21.683 -2.997 1.00 0.00 C ATOM 0 H TRP A 28 -3.443 -18.423 -7.251 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.600 -17.703 -7.107 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -2.080 -20.280 -7.797 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.335 -20.121 -7.736 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.272 -19.383 -5.228 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.550 -20.142 -2.875 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.434 -21.049 -6.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.309 -21.282 -1.678 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.803 -21.986 -4.522 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.947 -22.093 -2.217 1.00 0.00 H new ATOM 460 N ALA A 29 0.019 -17.935 -9.606 1.00 0.00 N ATOM 461 CA ALA A 29 0.331 -17.846 -11.042 1.00 0.00 C ATOM 462 C ALA A 29 0.149 -19.217 -11.695 1.00 0.00 C ATOM 463 O ALA A 29 0.350 -20.248 -11.046 1.00 0.00 O ATOM 464 CB ALA A 29 1.758 -17.320 -11.268 1.00 0.00 C ATOM 0 H ALA A 29 0.842 -17.951 -9.004 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.357 -17.138 -11.504 1.00 0.00 H new ATOM 0 HB1 ALA A 29 1.960 -17.265 -12.338 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.853 -16.327 -10.829 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.473 -17.995 -10.798 1.00 0.00 H new ATOM 470 N ASP A 30 -0.218 -19.224 -12.983 1.00 0.00 N ATOM 471 CA ASP A 30 -0.387 -20.470 -13.759 1.00 0.00 C ATOM 472 C ASP A 30 0.967 -21.195 -13.927 1.00 0.00 C ATOM 473 O ASP A 30 1.017 -22.416 -14.052 1.00 0.00 O ATOM 474 CB ASP A 30 -1.012 -20.154 -15.140 1.00 0.00 C ATOM 475 CG ASP A 30 -1.285 -21.415 -15.981 1.00 0.00 C ATOM 476 OD1 ASP A 30 -2.254 -22.142 -15.673 1.00 0.00 O ATOM 477 OD2 ASP A 30 -0.539 -21.693 -16.944 1.00 0.00 O ATOM 0 H ASP A 30 -0.406 -18.376 -13.518 1.00 0.00 H new ATOM 0 HA ASP A 30 -1.060 -21.132 -13.214 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.947 -19.612 -14.994 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.344 -19.494 -15.692 1.00 0.00 H new ATOM 482 N ASP A 31 2.052 -20.410 -13.903 1.00 0.00 N ATOM 483 CA ASP A 31 3.440 -20.894 -14.040 1.00 0.00 C ATOM 484 C ASP A 31 4.149 -20.929 -12.676 1.00 0.00 C ATOM 485 O ASP A 31 5.386 -20.968 -12.627 1.00 0.00 O ATOM 486 CB ASP A 31 4.208 -19.967 -15.021 1.00 0.00 C ATOM 487 CG ASP A 31 3.636 -19.994 -16.446 1.00 0.00 C ATOM 488 OD1 ASP A 31 2.617 -19.317 -16.697 1.00 0.00 O ATOM 489 OD2 ASP A 31 4.184 -20.713 -17.312 1.00 0.00 O ATOM 0 H ASP A 31 1.993 -19.399 -13.785 1.00 0.00 H new ATOM 0 HA ASP A 31 3.423 -21.911 -14.432 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.179 -18.945 -14.644 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.256 -20.267 -15.050 1.00 0.00 H new ATOM 494 N CYS A 32 3.361 -20.929 -11.573 1.00 0.00 N ATOM 495 CA CYS A 32 3.914 -20.831 -10.210 1.00 0.00 C ATOM 496 C CYS A 32 4.797 -22.037 -9.865 1.00 0.00 C ATOM 497 O CYS A 32 4.363 -23.186 -9.947 1.00 0.00 O ATOM 498 CB CYS A 32 2.811 -20.690 -9.153 1.00 0.00 C ATOM 499 SG CYS A 32 3.443 -20.521 -7.462 1.00 0.00 S ATOM 0 H CYS A 32 2.344 -20.996 -11.606 1.00 0.00 H new ATOM 0 HA CYS A 32 4.528 -19.930 -10.197 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.200 -19.820 -9.392 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.158 -21.562 -9.203 1.00 0.00 H new ATOM 0 HG CYS A 32 2.711 -21.228 -6.653 1.00 0.00 H new ATOM 505 N GLN A 33 6.044 -21.749 -9.493 1.00 0.00 N ATOM 506 CA GLN A 33 7.014 -22.753 -9.050 1.00 0.00 C ATOM 507 C GLN A 33 6.808 -22.987 -7.550 1.00 0.00 C ATOM 508 O GLN A 33 6.548 -22.037 -6.809 1.00 0.00 O ATOM 509 CB GLN A 33 8.444 -22.248 -9.353 1.00 0.00 C ATOM 510 CG GLN A 33 8.633 -21.754 -10.803 1.00 0.00 C ATOM 511 CD GLN A 33 8.575 -22.852 -11.865 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.586 -23.462 -12.195 1.00 0.00 O ATOM 513 NE2 GLN A 33 7.397 -23.096 -12.423 1.00 0.00 N ATOM 0 H GLN A 33 6.415 -20.799 -9.490 1.00 0.00 H new ATOM 0 HA GLN A 33 6.874 -23.696 -9.578 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.686 -21.436 -8.667 1.00 0.00 H new ATOM 0 HB3 GLN A 33 9.153 -23.052 -9.157 1.00 0.00 H new ATOM 0 HG2 GLN A 33 7.864 -21.014 -11.023 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.595 -21.246 -10.877 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.574 -22.571 -12.127 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.314 -23.808 -13.148 1.00 0.00 H new ATOM 522 N TYR A 34 6.908 -24.242 -7.116 1.00 0.00 N ATOM 523 CA TYR A 34 6.581 -24.646 -5.742 1.00 0.00 C ATOM 524 C TYR A 34 7.703 -25.530 -5.208 1.00 0.00 C ATOM 525 O TYR A 34 7.879 -26.664 -5.661 1.00 0.00 O ATOM 526 CB TYR A 34 5.231 -25.405 -5.739 1.00 0.00 C ATOM 527 CG TYR A 34 4.651 -25.730 -4.355 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.939 -24.764 -3.634 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.799 -26.999 -3.779 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.394 -25.051 -2.399 1.00 0.00 C ATOM 531 CE2 TYR A 34 4.247 -27.288 -2.541 1.00 0.00 C ATOM 532 CZ TYR A 34 3.550 -26.308 -1.854 1.00 0.00 C ATOM 533 OH TYR A 34 2.988 -26.594 -0.625 1.00 0.00 O ATOM 0 H TYR A 34 7.219 -25.013 -7.707 1.00 0.00 H new ATOM 0 HA TYR A 34 6.486 -23.771 -5.100 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.500 -24.811 -6.288 1.00 0.00 H new ATOM 0 HB3 TYR A 34 5.359 -26.339 -6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.814 -23.776 -4.052 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.351 -27.762 -4.307 1.00 0.00 H new ATOM 0 HE1 TYR A 34 2.846 -24.292 -1.860 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.360 -28.273 -2.114 1.00 0.00 H new ATOM 0 HH TYR A 34 2.031 -26.384 -0.646 1.00 0.00 H new ATOM 543 N TYR A 35 8.459 -24.991 -4.253 1.00 0.00 N ATOM 544 CA TYR A 35 9.579 -25.669 -3.608 1.00 0.00 C ATOM 545 C TYR A 35 9.256 -25.992 -2.151 1.00 0.00 C ATOM 546 O TYR A 35 8.414 -25.347 -1.513 1.00 0.00 O ATOM 547 CB TYR A 35 10.854 -24.803 -3.654 1.00 0.00 C ATOM 548 CG TYR A 35 11.402 -24.500 -5.058 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.736 -23.629 -5.928 1.00 0.00 C ATOM 550 CD2 TYR A 35 12.596 -25.065 -5.503 1.00 0.00 C ATOM 551 CE1 TYR A 35 11.243 -23.339 -7.172 1.00 0.00 C ATOM 552 CE2 TYR A 35 13.105 -24.771 -6.748 1.00 0.00 C ATOM 553 CZ TYR A 35 12.425 -23.912 -7.578 1.00 0.00 C ATOM 554 OH TYR A 35 12.934 -23.622 -8.823 1.00 0.00 O ATOM 0 H TYR A 35 8.305 -24.047 -3.898 1.00 0.00 H new ATOM 0 HA TYR A 35 9.752 -26.595 -4.156 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.647 -23.858 -3.152 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.633 -25.305 -3.080 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.806 -23.176 -5.616 1.00 0.00 H new ATOM 0 HD2 TYR A 35 13.132 -25.746 -4.859 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.715 -22.663 -7.828 1.00 0.00 H new ATOM 0 HE2 TYR A 35 14.035 -25.214 -7.071 1.00 0.00 H new ATOM 0 HH TYR A 35 13.775 -24.108 -8.954 1.00 0.00 H new ATOM 564 N ALA A 36 9.957 -27.006 -1.655 1.00 0.00 N ATOM 565 CA ALA A 36 9.990 -27.384 -0.248 1.00 0.00 C ATOM 566 C ALA A 36 11.449 -27.416 0.217 1.00 0.00 C ATOM 567 O ALA A 36 12.370 -27.483 -0.607 1.00 0.00 O ATOM 568 CB ALA A 36 9.322 -28.751 -0.046 1.00 0.00 C ATOM 0 H ALA A 36 10.537 -27.607 -2.241 1.00 0.00 H new ATOM 0 HA ALA A 36 9.437 -26.655 0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.355 -29.019 1.010 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.284 -28.701 -0.376 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.852 -29.505 -0.628 1.00 0.00 H new ATOM 574 N PHE A 37 11.629 -27.339 1.535 1.00 0.00 N ATOM 575 CA PHE A 37 12.936 -27.443 2.211 1.00 0.00 C ATOM 576 C PHE A 37 13.736 -28.706 1.756 1.00 0.00 C ATOM 577 O PHE A 37 13.159 -29.798 1.691 1.00 0.00 O ATOM 578 CB PHE A 37 12.723 -27.456 3.751 1.00 0.00 C ATOM 579 CG PHE A 37 11.778 -28.553 4.270 1.00 0.00 C ATOM 580 CD1 PHE A 37 10.393 -28.409 4.182 1.00 0.00 C ATOM 581 CD2 PHE A 37 12.275 -29.719 4.846 1.00 0.00 C ATOM 582 CE1 PHE A 37 9.543 -29.386 4.652 1.00 0.00 C ATOM 583 CE2 PHE A 37 11.422 -30.700 5.317 1.00 0.00 C ATOM 584 CZ PHE A 37 10.055 -30.532 5.221 1.00 0.00 C ATOM 0 H PHE A 37 10.855 -27.199 2.185 1.00 0.00 H new ATOM 0 HA PHE A 37 13.531 -26.574 1.930 1.00 0.00 H new ATOM 0 HB2 PHE A 37 13.692 -27.574 4.235 1.00 0.00 H new ATOM 0 HB3 PHE A 37 12.331 -26.486 4.056 1.00 0.00 H new ATOM 0 HD1 PHE A 37 9.980 -27.516 3.737 1.00 0.00 H new ATOM 0 HD2 PHE A 37 13.343 -29.859 4.926 1.00 0.00 H new ATOM 0 HE1 PHE A 37 8.474 -29.254 4.574 1.00 0.00 H new ATOM 0 HE2 PHE A 37 11.825 -31.598 5.760 1.00 0.00 H new ATOM 0 HZ PHE A 37 9.388 -31.297 5.591 1.00 0.00 H new ATOM 594 N PRO A 38 15.064 -28.590 1.404 1.00 0.00 N ATOM 595 CA PRO A 38 15.824 -27.312 1.373 1.00 0.00 C ATOM 596 C PRO A 38 15.531 -26.437 0.119 1.00 0.00 C ATOM 597 O PRO A 38 15.395 -25.214 0.242 1.00 0.00 O ATOM 598 CB PRO A 38 17.298 -27.786 1.409 1.00 0.00 C ATOM 599 CG PRO A 38 17.280 -29.121 0.723 1.00 0.00 C ATOM 600 CD PRO A 38 15.933 -29.745 1.051 1.00 0.00 C ATOM 0 HA PRO A 38 15.550 -26.657 2.200 1.00 0.00 H new ATOM 0 HB2 PRO A 38 17.953 -27.084 0.894 1.00 0.00 H new ATOM 0 HB3 PRO A 38 17.663 -27.871 2.433 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.405 -29.008 -0.354 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.097 -29.751 1.074 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.533 -30.297 0.200 1.00 0.00 H new ATOM 0 HD3 PRO A 38 16.013 -30.449 1.879 1.00 0.00 H new ATOM 608 N ALA A 39 15.429 -27.075 -1.072 1.00 0.00 N ATOM 609 CA ALA A 39 15.203 -26.367 -2.357 1.00 0.00 C ATOM 610 C ALA A 39 14.764 -27.357 -3.463 1.00 0.00 C ATOM 611 O ALA A 39 15.396 -27.452 -4.525 1.00 0.00 O ATOM 612 CB ALA A 39 16.472 -25.577 -2.768 1.00 0.00 C ATOM 0 H ALA A 39 15.500 -28.088 -1.170 1.00 0.00 H new ATOM 0 HA ALA A 39 14.392 -25.651 -2.223 1.00 0.00 H new ATOM 0 HB1 ALA A 39 16.291 -25.063 -3.712 1.00 0.00 H new ATOM 0 HB2 ALA A 39 16.711 -24.845 -1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 39 17.308 -26.267 -2.885 1.00 0.00 H new ATOM 618 N THR A 40 13.670 -28.084 -3.209 1.00 0.00 N ATOM 619 CA THR A 40 13.149 -29.123 -4.118 1.00 0.00 C ATOM 620 C THR A 40 11.843 -28.653 -4.766 1.00 0.00 C ATOM 621 O THR A 40 10.858 -28.470 -4.065 1.00 0.00 O ATOM 622 CB THR A 40 12.889 -30.448 -3.328 1.00 0.00 C ATOM 623 OG1 THR A 40 14.099 -30.870 -2.684 1.00 0.00 O ATOM 624 CG2 THR A 40 12.362 -31.584 -4.229 1.00 0.00 C ATOM 0 H THR A 40 13.114 -27.970 -2.362 1.00 0.00 H new ATOM 0 HA THR A 40 13.891 -29.306 -4.896 1.00 0.00 H new ATOM 0 HB THR A 40 12.117 -30.236 -2.589 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.934 -31.699 -2.188 1.00 0.00 H new ATOM 0 HG21 THR A 40 12.199 -32.479 -3.628 1.00 0.00 H new ATOM 0 HG22 THR A 40 11.421 -31.278 -4.687 1.00 0.00 H new ATOM 0 HG23 THR A 40 13.093 -31.798 -5.009 1.00 0.00 H new ATOM 632 N LEU A 41 11.845 -28.449 -6.092 1.00 0.00 N ATOM 633 CA LEU A 41 10.635 -28.086 -6.850 1.00 0.00 C ATOM 634 C LEU A 41 9.760 -29.336 -7.035 1.00 0.00 C ATOM 635 O LEU A 41 10.131 -30.252 -7.771 1.00 0.00 O ATOM 636 CB LEU A 41 11.025 -27.435 -8.218 1.00 0.00 C ATOM 637 CG LEU A 41 9.859 -26.823 -9.097 1.00 0.00 C ATOM 638 CD1 LEU A 41 10.374 -25.684 -9.999 1.00 0.00 C ATOM 639 CD2 LEU A 41 9.156 -27.887 -9.974 1.00 0.00 C ATOM 0 H LEU A 41 12.682 -28.530 -6.669 1.00 0.00 H new ATOM 0 HA LEU A 41 10.058 -27.345 -6.297 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.747 -26.643 -8.020 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.536 -28.190 -8.816 1.00 0.00 H new ATOM 0 HG LEU A 41 9.130 -26.426 -8.391 1.00 0.00 H new ATOM 0 HD11 LEU A 41 9.549 -25.286 -10.589 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.793 -24.891 -9.380 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.145 -26.069 -10.667 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.365 -27.414 -10.556 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.882 -28.340 -10.649 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.725 -28.658 -9.335 1.00 0.00 H new ATOM 651 N LEU A 42 8.611 -29.372 -6.338 1.00 0.00 N ATOM 652 CA LEU A 42 7.610 -30.445 -6.485 1.00 0.00 C ATOM 653 C LEU A 42 6.709 -30.148 -7.687 1.00 0.00 C ATOM 654 O LEU A 42 6.419 -31.032 -8.500 1.00 0.00 O ATOM 655 CB LEU A 42 6.726 -30.606 -5.206 1.00 0.00 C ATOM 656 CG LEU A 42 7.453 -30.975 -3.875 1.00 0.00 C ATOM 657 CD1 LEU A 42 8.444 -32.141 -4.069 1.00 0.00 C ATOM 658 CD2 LEU A 42 8.122 -29.748 -3.236 1.00 0.00 C ATOM 0 H LEU A 42 8.350 -28.659 -5.657 1.00 0.00 H new ATOM 0 HA LEU A 42 8.152 -31.378 -6.637 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.188 -29.671 -5.048 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.979 -31.374 -5.407 1.00 0.00 H new ATOM 0 HG LEU A 42 6.692 -31.322 -3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.930 -32.368 -3.120 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.906 -33.021 -4.420 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.198 -31.859 -4.804 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.618 -30.044 -2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.858 -29.334 -3.926 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.366 -28.994 -3.017 1.00 0.00 H new ATOM 670 N ALA A 43 6.281 -28.885 -7.782 1.00 0.00 N ATOM 671 CA ALA A 43 5.264 -28.445 -8.752 1.00 0.00 C ATOM 672 C ALA A 43 5.725 -27.173 -9.486 1.00 0.00 C ATOM 673 O ALA A 43 6.024 -26.173 -8.849 1.00 0.00 O ATOM 674 CB ALA A 43 3.956 -28.215 -7.992 1.00 0.00 C ATOM 0 H ALA A 43 6.630 -28.133 -7.187 1.00 0.00 H new ATOM 0 HA ALA A 43 5.112 -29.208 -9.516 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.184 -27.888 -8.688 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.644 -29.144 -7.515 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.107 -27.449 -7.231 1.00 0.00 H new ATOM 680 N GLY A 44 5.798 -27.231 -10.829 1.00 0.00 N ATOM 681 CA GLY A 44 6.321 -26.117 -11.647 1.00 0.00 C ATOM 682 C GLY A 44 5.250 -25.459 -12.498 1.00 0.00 C ATOM 683 O GLY A 44 5.479 -25.169 -13.681 1.00 0.00 O ATOM 0 H GLY A 44 5.500 -28.040 -11.374 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.768 -25.370 -10.991 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.115 -26.489 -12.294 1.00 0.00 H new ATOM 687 N ASN A 45 4.115 -25.183 -11.843 1.00 0.00 N ATOM 688 CA ASN A 45 2.843 -24.702 -12.447 1.00 0.00 C ATOM 689 C ASN A 45 1.706 -24.940 -11.435 1.00 0.00 C ATOM 690 O ASN A 45 1.776 -25.886 -10.636 1.00 0.00 O ATOM 691 CB ASN A 45 2.480 -25.372 -13.814 1.00 0.00 C ATOM 692 CG ASN A 45 2.283 -26.889 -13.735 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.193 -27.368 -13.450 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.339 -27.651 -13.988 1.00 0.00 N ATOM 0 H ASN A 45 4.044 -25.290 -10.831 1.00 0.00 H new ATOM 0 HA ASN A 45 2.978 -23.643 -12.668 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.567 -24.917 -14.198 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.270 -25.156 -14.533 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.256 -28.667 -13.948 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.234 -27.221 -14.223 1.00 0.00 H new ATOM 701 N ALA A 46 0.647 -24.111 -11.512 1.00 0.00 N ATOM 702 CA ALA A 46 -0.480 -24.119 -10.544 1.00 0.00 C ATOM 703 C ALA A 46 -1.275 -25.443 -10.547 1.00 0.00 C ATOM 704 O ALA A 46 -1.890 -25.786 -9.531 1.00 0.00 O ATOM 705 CB ALA A 46 -1.422 -22.934 -10.816 1.00 0.00 C ATOM 0 H ALA A 46 0.544 -23.412 -12.248 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.039 -24.022 -9.552 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.244 -22.951 -10.100 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.870 -22.000 -10.713 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.820 -23.011 -11.828 1.00 0.00 H new ATOM 711 N ALA A 47 -1.248 -26.175 -11.683 1.00 0.00 N ATOM 712 CA ALA A 47 -2.012 -27.432 -11.849 1.00 0.00 C ATOM 713 C ALA A 47 -1.525 -28.512 -10.879 1.00 0.00 C ATOM 714 O ALA A 47 -2.326 -29.201 -10.255 1.00 0.00 O ATOM 715 CB ALA A 47 -1.915 -27.959 -13.287 1.00 0.00 C ATOM 0 H ALA A 47 -0.701 -25.914 -12.504 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.054 -27.200 -11.627 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.487 -28.883 -13.375 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.318 -27.216 -13.975 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.871 -28.153 -13.534 1.00 0.00 H new ATOM 721 N GLU A 48 -0.200 -28.643 -10.760 1.00 0.00 N ATOM 722 CA GLU A 48 0.418 -29.641 -9.873 1.00 0.00 C ATOM 723 C GLU A 48 0.323 -29.198 -8.394 1.00 0.00 C ATOM 724 O GLU A 48 0.169 -30.038 -7.495 1.00 0.00 O ATOM 725 CB GLU A 48 1.889 -29.874 -10.275 1.00 0.00 C ATOM 726 CG GLU A 48 2.118 -30.227 -11.751 1.00 0.00 C ATOM 727 CD GLU A 48 3.580 -30.631 -12.015 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.436 -29.732 -12.189 1.00 0.00 O ATOM 729 OE2 GLU A 48 3.884 -31.847 -12.004 1.00 0.00 O ATOM 0 H GLU A 48 0.471 -28.068 -11.269 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.126 -30.579 -9.980 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.459 -28.975 -10.041 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.294 -30.677 -9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.456 -31.044 -12.037 1.00 0.00 H new ATOM 0 HG3 GLU A 48 1.857 -29.372 -12.375 1.00 0.00 H new ATOM 736 N ILE A 49 0.397 -27.866 -8.163 1.00 0.00 N ATOM 737 CA ILE A 49 0.337 -27.276 -6.806 1.00 0.00 C ATOM 738 C ILE A 49 -1.048 -27.512 -6.173 1.00 0.00 C ATOM 739 O ILE A 49 -1.146 -27.866 -4.988 1.00 0.00 O ATOM 740 CB ILE A 49 0.631 -25.725 -6.812 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.973 -25.396 -7.512 1.00 0.00 C ATOM 742 CG2 ILE A 49 0.625 -25.139 -5.380 1.00 0.00 C ATOM 743 CD1 ILE A 49 2.300 -23.917 -7.594 1.00 0.00 C ATOM 0 H ILE A 49 0.499 -27.175 -8.906 1.00 0.00 H new ATOM 0 HA ILE A 49 1.111 -27.772 -6.220 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.174 -25.259 -7.380 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.778 -25.903 -6.980 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.950 -25.806 -8.522 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.831 -24.070 -5.424 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -0.352 -25.302 -4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 49 1.391 -25.632 -4.782 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.257 -23.783 -8.099 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.519 -23.402 -8.153 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.360 -23.501 -6.588 1.00 0.00 H new ATOM 755 N ARG A 50 -2.114 -27.322 -6.985 1.00 0.00 N ATOM 756 CA ARG A 50 -3.500 -27.453 -6.507 1.00 0.00 C ATOM 757 C ARG A 50 -3.811 -28.901 -6.120 1.00 0.00 C ATOM 758 O ARG A 50 -4.389 -29.124 -5.069 1.00 0.00 O ATOM 759 CB ARG A 50 -4.537 -26.912 -7.534 1.00 0.00 C ATOM 760 CG ARG A 50 -4.625 -27.670 -8.869 1.00 0.00 C ATOM 761 CD ARG A 50 -5.713 -27.111 -9.798 1.00 0.00 C ATOM 762 NE ARG A 50 -7.060 -27.194 -9.188 1.00 0.00 N ATOM 763 CZ ARG A 50 -7.951 -26.193 -9.138 1.00 0.00 C ATOM 764 NH1 ARG A 50 -7.638 -24.983 -9.589 1.00 0.00 N ATOM 765 NH2 ARG A 50 -9.148 -26.406 -8.623 1.00 0.00 N ATOM 0 H ARG A 50 -2.035 -27.078 -7.972 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.588 -26.832 -5.615 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.522 -26.925 -7.067 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.298 -25.870 -7.746 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.661 -27.620 -9.375 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.827 -28.723 -8.672 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.487 -26.072 -10.037 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.706 -27.663 -10.738 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.332 -28.085 -8.772 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.712 -24.808 -9.978 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.324 -24.229 -9.546 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -9.392 -27.329 -8.265 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -9.828 -25.647 -8.583 1.00 0.00 H new ATOM 779 N VAL A 51 -3.362 -29.870 -6.953 1.00 0.00 N ATOM 780 CA VAL A 51 -3.553 -31.319 -6.695 1.00 0.00 C ATOM 781 C VAL A 51 -2.866 -31.729 -5.383 1.00 0.00 C ATOM 782 O VAL A 51 -3.462 -32.413 -4.545 1.00 0.00 O ATOM 783 CB VAL A 51 -2.998 -32.198 -7.881 1.00 0.00 C ATOM 784 CG1 VAL A 51 -3.156 -33.715 -7.603 1.00 0.00 C ATOM 785 CG2 VAL A 51 -3.679 -31.819 -9.211 1.00 0.00 C ATOM 0 H VAL A 51 -2.860 -29.672 -7.818 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.625 -31.495 -6.612 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.931 -31.989 -7.963 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -2.761 -34.282 -8.446 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.607 -33.978 -6.699 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.211 -33.952 -7.469 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.280 -32.439 -10.014 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.754 -31.980 -9.128 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.486 -30.769 -9.433 1.00 0.00 H new ATOM 795 N ARG A 52 -1.629 -31.236 -5.207 1.00 0.00 N ATOM 796 CA ARG A 52 -0.792 -31.547 -4.036 1.00 0.00 C ATOM 797 C ARG A 52 -1.433 -31.021 -2.738 1.00 0.00 C ATOM 798 O ARG A 52 -1.328 -31.648 -1.674 1.00 0.00 O ATOM 799 CB ARG A 52 0.630 -30.964 -4.223 1.00 0.00 C ATOM 800 CG ARG A 52 1.655 -31.487 -3.194 1.00 0.00 C ATOM 801 CD ARG A 52 3.102 -31.049 -3.505 1.00 0.00 C ATOM 802 NE ARG A 52 4.092 -31.867 -2.778 1.00 0.00 N ATOM 803 CZ ARG A 52 4.549 -33.070 -3.189 1.00 0.00 C ATOM 804 NH1 ARG A 52 4.096 -33.635 -4.307 1.00 0.00 N ATOM 805 NH2 ARG A 52 5.458 -33.704 -2.467 1.00 0.00 N ATOM 0 H ARG A 52 -1.180 -30.609 -5.874 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.715 -32.631 -3.951 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.982 -31.203 -5.227 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.580 -29.877 -4.153 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.379 -31.130 -2.202 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.609 -32.576 -3.166 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.283 -31.128 -4.577 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.230 -30.000 -3.236 1.00 0.00 H new ATOM 0 HE ARG A 52 4.458 -31.497 -1.901 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.391 -33.159 -4.870 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.454 -34.544 -4.600 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.809 -33.284 -1.606 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.808 -34.613 -2.771 1.00 0.00 H new ATOM 819 N HIS A 53 -2.110 -29.865 -2.854 1.00 0.00 N ATOM 820 CA HIS A 53 -2.843 -29.251 -1.740 1.00 0.00 C ATOM 821 C HIS A 53 -4.183 -29.971 -1.496 1.00 0.00 C ATOM 822 O HIS A 53 -4.572 -30.117 -0.347 1.00 0.00 O ATOM 823 CB HIS A 53 -3.040 -27.729 -1.979 1.00 0.00 C ATOM 824 CG HIS A 53 -1.800 -26.903 -1.731 1.00 0.00 C ATOM 825 ND1 HIS A 53 -1.306 -25.976 -2.624 1.00 0.00 N ATOM 826 CD2 HIS A 53 -0.993 -26.826 -0.637 1.00 0.00 C ATOM 827 CE1 HIS A 53 -0.257 -25.371 -2.097 1.00 0.00 C ATOM 828 NE2 HIS A 53 -0.046 -25.864 -0.897 1.00 0.00 N ATOM 0 H HIS A 53 -2.163 -29.333 -3.723 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.246 -29.364 -0.835 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.369 -27.572 -3.006 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.839 -27.370 -1.330 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.691 -25.787 -3.549 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -1.081 -27.411 0.266 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.330 -24.599 -2.573 1.00 0.00 H new ATOM 837 N ILE A 54 -4.859 -30.449 -2.574 1.00 0.00 N ATOM 838 CA ILE A 54 -6.136 -31.207 -2.465 1.00 0.00 C ATOM 839 C ILE A 54 -5.952 -32.423 -1.544 1.00 0.00 C ATOM 840 O ILE A 54 -6.774 -32.659 -0.657 1.00 0.00 O ATOM 841 CB ILE A 54 -6.667 -31.672 -3.883 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.162 -30.455 -4.718 1.00 0.00 C ATOM 843 CG2 ILE A 54 -7.784 -32.742 -3.776 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.531 -30.777 -6.151 1.00 0.00 C ATOM 0 H ILE A 54 -4.539 -30.322 -3.534 1.00 0.00 H new ATOM 0 HA ILE A 54 -6.882 -30.538 -2.036 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.824 -32.134 -4.396 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.031 -30.021 -4.222 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.383 -29.693 -4.721 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.113 -33.026 -4.776 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.398 -33.620 -3.258 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.627 -32.333 -3.219 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -7.864 -29.869 -6.654 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.661 -31.180 -6.669 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.334 -31.514 -6.163 1.00 0.00 H new ATOM 856 N GLU A 55 -4.824 -33.132 -1.744 1.00 0.00 N ATOM 857 CA GLU A 55 -4.435 -34.308 -0.941 1.00 0.00 C ATOM 858 C GLU A 55 -4.400 -33.968 0.570 1.00 0.00 C ATOM 859 O GLU A 55 -4.909 -34.726 1.403 1.00 0.00 O ATOM 860 CB GLU A 55 -3.052 -34.835 -1.421 1.00 0.00 C ATOM 861 CG GLU A 55 -3.007 -35.234 -2.911 1.00 0.00 C ATOM 862 CD GLU A 55 -1.628 -35.754 -3.354 1.00 0.00 C ATOM 863 OE1 GLU A 55 -1.383 -36.977 -3.249 1.00 0.00 O ATOM 864 OE2 GLU A 55 -0.778 -34.948 -3.800 1.00 0.00 O ATOM 0 H GLU A 55 -4.151 -32.902 -2.475 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.182 -35.089 -1.083 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.301 -34.066 -1.240 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -2.776 -35.699 -0.817 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -3.756 -36.003 -3.098 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.277 -34.372 -3.521 1.00 0.00 H new ATOM 871 N ARG A 56 -3.832 -32.791 0.893 1.00 0.00 N ATOM 872 CA ARG A 56 -3.752 -32.281 2.283 1.00 0.00 C ATOM 873 C ARG A 56 -5.138 -31.806 2.799 1.00 0.00 C ATOM 874 O ARG A 56 -5.423 -31.911 3.987 1.00 0.00 O ATOM 875 CB ARG A 56 -2.686 -31.147 2.370 1.00 0.00 C ATOM 876 CG ARG A 56 -2.542 -30.457 3.755 1.00 0.00 C ATOM 877 CD ARG A 56 -2.299 -31.441 4.927 1.00 0.00 C ATOM 878 NE ARG A 56 -1.048 -32.211 4.783 1.00 0.00 N ATOM 879 CZ ARG A 56 0.090 -31.973 5.459 1.00 0.00 C ATOM 880 NH1 ARG A 56 0.185 -30.927 6.279 1.00 0.00 N ATOM 881 NH2 ARG A 56 1.128 -32.780 5.298 1.00 0.00 N ATOM 0 H ARG A 56 -3.416 -32.165 0.203 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.441 -33.098 2.934 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.718 -31.562 2.090 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.932 -30.386 1.630 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.715 -29.748 3.712 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.445 -29.882 3.958 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -2.270 -30.883 5.863 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -3.139 -32.132 4.994 1.00 0.00 H new ATOM 0 HE ARG A 56 -1.046 -32.985 4.118 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -0.610 -30.299 6.398 1.00 0.00 H new ATOM 0 HH12 ARG A 56 1.052 -30.755 6.787 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.061 -33.576 4.664 1.00 0.00 H new ATOM 0 HH22 ARG A 56 1.994 -32.605 5.808 1.00 0.00 H new ATOM 895 N PHE A 57 -6.001 -31.313 1.902 1.00 0.00 N ATOM 896 CA PHE A 57 -7.358 -30.827 2.274 1.00 0.00 C ATOM 897 C PHE A 57 -8.346 -32.002 2.488 1.00 0.00 C ATOM 898 O PHE A 57 -9.489 -31.782 2.894 1.00 0.00 O ATOM 899 CB PHE A 57 -7.891 -29.824 1.205 1.00 0.00 C ATOM 900 CG PHE A 57 -7.297 -28.408 1.279 1.00 0.00 C ATOM 901 CD1 PHE A 57 -5.932 -28.194 1.465 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.113 -27.288 1.146 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.411 -26.920 1.509 1.00 0.00 C ATOM 904 CE2 PHE A 57 -7.590 -26.010 1.189 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.241 -25.828 1.372 1.00 0.00 C ATOM 0 H PHE A 57 -5.793 -31.235 0.907 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.277 -30.300 3.225 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.690 -30.233 0.215 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.974 -29.752 1.306 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.272 -29.042 1.576 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.176 -27.421 1.006 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.350 -26.776 1.651 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.241 -25.155 1.079 1.00 0.00 H new ATOM 0 HZ PHE A 57 -5.831 -24.830 1.409 1.00 0.00 H new ATOM 915 N LYS A 58 -7.903 -33.240 2.183 1.00 0.00 N ATOM 916 CA LYS A 58 -8.655 -34.475 2.509 1.00 0.00 C ATOM 917 C LYS A 58 -8.329 -34.981 3.926 1.00 0.00 C ATOM 918 O LYS A 58 -9.018 -35.870 4.444 1.00 0.00 O ATOM 919 CB LYS A 58 -8.356 -35.569 1.451 1.00 0.00 C ATOM 920 CG LYS A 58 -8.658 -35.123 0.009 1.00 0.00 C ATOM 921 CD LYS A 58 -10.113 -34.616 -0.165 1.00 0.00 C ATOM 922 CE LYS A 58 -10.315 -33.844 -1.470 1.00 0.00 C ATOM 923 NZ LYS A 58 -11.721 -33.399 -1.639 1.00 0.00 N ATOM 0 H LYS A 58 -7.018 -33.414 1.706 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.719 -34.241 2.488 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.307 -35.856 1.523 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -8.946 -36.457 1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -7.965 -34.331 -0.275 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -8.484 -35.958 -0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -10.795 -35.466 -0.141 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.373 -33.974 0.677 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.656 -32.976 -1.484 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -10.030 -34.474 -2.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.815 -32.880 -2.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -12.348 -34.228 -1.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.985 -32.777 -0.849 1.00 0.00 H new ATOM 937 N GLU A 59 -7.264 -34.421 4.529 1.00 0.00 N ATOM 938 CA GLU A 59 -6.898 -34.665 5.934 1.00 0.00 C ATOM 939 C GLU A 59 -7.990 -34.061 6.848 1.00 0.00 C ATOM 940 O GLU A 59 -8.165 -32.839 6.852 1.00 0.00 O ATOM 941 CB GLU A 59 -5.515 -34.024 6.218 1.00 0.00 C ATOM 942 CG GLU A 59 -4.989 -34.156 7.660 1.00 0.00 C ATOM 943 CD GLU A 59 -3.615 -33.484 7.832 1.00 0.00 C ATOM 944 OE1 GLU A 59 -2.594 -34.101 7.443 1.00 0.00 O ATOM 945 OE2 GLU A 59 -3.549 -32.336 8.313 1.00 0.00 O ATOM 0 H GLU A 59 -6.629 -33.782 4.050 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.829 -35.734 6.133 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.785 -34.472 5.544 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.571 -32.964 5.969 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -5.703 -33.705 8.350 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.913 -35.211 7.924 1.00 0.00 H new ATOM 952 N PRO A 60 -8.752 -34.900 7.626 1.00 0.00 N ATOM 953 CA PRO A 60 -9.945 -34.432 8.378 1.00 0.00 C ATOM 954 C PRO A 60 -9.596 -33.471 9.531 1.00 0.00 C ATOM 955 O PRO A 60 -10.397 -32.606 9.892 1.00 0.00 O ATOM 956 CB PRO A 60 -10.580 -35.753 8.891 1.00 0.00 C ATOM 957 CG PRO A 60 -9.429 -36.706 8.995 1.00 0.00 C ATOM 958 CD PRO A 60 -8.506 -36.356 7.843 1.00 0.00 C ATOM 0 HA PRO A 60 -10.619 -33.843 7.756 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -11.066 -35.611 9.856 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -11.340 -36.122 8.202 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.918 -36.601 9.952 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.768 -37.740 8.926 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.463 -36.554 8.091 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.738 -36.939 6.952 1.00 0.00 H new ATOM 966 N ASP A 61 -8.381 -33.609 10.069 1.00 0.00 N ATOM 967 CA ASP A 61 -7.904 -32.807 11.209 1.00 0.00 C ATOM 968 C ASP A 61 -7.225 -31.506 10.771 1.00 0.00 C ATOM 969 O ASP A 61 -6.902 -30.689 11.638 1.00 0.00 O ATOM 970 CB ASP A 61 -6.942 -33.647 12.078 1.00 0.00 C ATOM 971 CG ASP A 61 -7.668 -34.758 12.851 1.00 0.00 C ATOM 972 OD1 ASP A 61 -8.085 -35.759 12.224 1.00 0.00 O ATOM 973 OD2 ASP A 61 -7.839 -34.630 14.087 1.00 0.00 O ATOM 0 H ASP A 61 -7.695 -34.282 9.728 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.779 -32.526 11.795 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.177 -34.092 11.442 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -6.429 -32.993 12.783 1.00 0.00 H new ATOM 978 N LEU A 62 -7.020 -31.310 9.445 1.00 0.00 N ATOM 979 CA LEU A 62 -6.367 -30.094 8.917 1.00 0.00 C ATOM 980 C LEU A 62 -7.110 -28.815 9.356 1.00 0.00 C ATOM 981 O LEU A 62 -8.310 -28.664 9.097 1.00 0.00 O ATOM 982 CB LEU A 62 -6.269 -30.117 7.368 1.00 0.00 C ATOM 983 CG LEU A 62 -5.598 -28.853 6.723 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.101 -28.752 7.105 1.00 0.00 C ATOM 985 CD2 LEU A 62 -5.804 -28.815 5.192 1.00 0.00 C ATOM 0 H LEU A 62 -7.298 -31.978 8.726 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.360 -30.084 9.334 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.705 -31.001 7.068 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.273 -30.225 6.958 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.097 -27.974 7.132 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.666 -27.866 6.642 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.006 -28.679 8.188 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.575 -29.640 6.754 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.325 -27.926 4.782 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.362 -29.704 4.743 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.871 -28.788 4.969 1.00 0.00 H new ATOM 997 N TYR A 63 -6.384 -27.926 10.043 1.00 0.00 N ATOM 998 CA TYR A 63 -6.849 -26.574 10.360 1.00 0.00 C ATOM 999 C TYR A 63 -5.641 -25.635 10.425 1.00 0.00 C ATOM 1000 O TYR A 63 -4.752 -25.826 11.256 1.00 0.00 O ATOM 1001 CB TYR A 63 -7.642 -26.540 11.700 1.00 0.00 C ATOM 1002 CG TYR A 63 -8.015 -25.109 12.137 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -8.876 -24.327 11.360 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -7.454 -24.520 13.280 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -9.170 -23.028 11.711 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.744 -23.214 13.625 1.00 0.00 C ATOM 1007 CZ TYR A 63 -8.601 -22.476 12.838 1.00 0.00 C ATOM 1008 OH TYR A 63 -8.886 -21.172 13.173 1.00 0.00 O ATOM 0 H TYR A 63 -5.449 -28.128 10.397 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.531 -26.245 9.576 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.551 -27.131 11.594 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.046 -27.010 12.482 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.318 -24.749 10.469 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.784 -25.097 13.900 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -9.845 -22.443 11.104 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.301 -22.774 14.507 1.00 0.00 H new ATOM 0 HH TYR A 63 -8.408 -20.933 13.994 1.00 0.00 H new ATOM 1018 N GLY A 64 -5.635 -24.615 9.556 1.00 0.00 N ATOM 1019 CA GLY A 64 -4.564 -23.623 9.520 1.00 0.00 C ATOM 1020 C GLY A 64 -4.832 -22.456 10.452 1.00 0.00 C ATOM 1021 O GLY A 64 -5.692 -21.615 10.154 1.00 0.00 O ATOM 0 H GLY A 64 -6.369 -24.459 8.865 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.622 -24.097 9.796 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -4.448 -23.253 8.501 1.00 0.00 H new ATOM 1025 N GLU A 65 -4.125 -22.417 11.598 1.00 0.00 N ATOM 1026 CA GLU A 65 -4.174 -21.278 12.526 1.00 0.00 C ATOM 1027 C GLU A 65 -2.908 -20.431 12.342 1.00 0.00 C ATOM 1028 O GLU A 65 -1.835 -20.800 12.824 1.00 0.00 O ATOM 1029 CB GLU A 65 -4.302 -21.763 13.998 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.300 -20.612 15.033 1.00 0.00 C ATOM 1031 CD GLU A 65 -4.542 -21.064 16.483 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -5.716 -21.270 16.858 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -3.573 -21.176 17.262 1.00 0.00 O ATOM 0 H GLU A 65 -3.509 -23.171 11.902 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.053 -20.673 12.305 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -5.224 -22.334 14.104 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.479 -22.442 14.221 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.342 -20.094 14.981 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.068 -19.890 14.757 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.038 -19.304 11.631 1.00 0.00 N ATOM 1041 CA LEU A 66 -1.928 -18.381 11.394 1.00 0.00 C ATOM 1042 C LEU A 66 -1.796 -17.443 12.598 1.00 0.00 C ATOM 1043 O LEU A 66 -2.778 -16.849 13.053 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.125 -17.615 10.053 1.00 0.00 C ATOM 1045 CG LEU A 66 -0.896 -16.773 9.541 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -0.928 -16.621 8.002 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -0.829 -15.375 10.201 1.00 0.00 C ATOM 0 H LEU A 66 -3.917 -19.009 11.205 1.00 0.00 H new ATOM 0 HA LEU A 66 -0.994 -18.934 11.293 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.389 -18.339 9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.976 -16.944 10.165 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.001 -17.325 9.829 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.068 -16.036 7.676 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.893 -17.607 7.538 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.846 -16.113 7.706 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.034 -14.832 9.817 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.738 -14.820 9.971 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -0.736 -15.487 11.281 1.00 0.00 H new ATOM 1059 N LEU A 67 -0.564 -17.320 13.083 1.00 0.00 N ATOM 1060 CA LEU A 67 -0.228 -16.577 14.310 1.00 0.00 C ATOM 1061 C LEU A 67 0.665 -15.364 13.997 1.00 0.00 C ATOM 1062 O LEU A 67 0.606 -14.348 14.691 1.00 0.00 O ATOM 1063 CB LEU A 67 0.449 -17.565 15.301 1.00 0.00 C ATOM 1064 CG LEU A 67 1.560 -18.505 14.677 1.00 0.00 C ATOM 1065 CD1 LEU A 67 2.991 -18.019 14.970 1.00 0.00 C ATOM 1066 CD2 LEU A 67 1.357 -19.978 15.079 1.00 0.00 C ATOM 0 H LEU A 67 0.249 -17.739 12.632 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.132 -16.174 14.767 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.898 -16.989 16.110 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.324 -18.192 15.746 1.00 0.00 H new ATOM 0 HG LEU A 67 1.437 -18.445 13.596 1.00 0.00 H new ATOM 0 HD11 LEU A 67 3.708 -18.704 14.517 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.129 -17.021 14.553 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.151 -17.987 16.048 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.140 -20.589 14.630 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.403 -20.069 16.164 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.384 -20.320 14.728 1.00 0.00 H new ATOM 1078 N THR A 68 1.493 -15.483 12.945 1.00 0.00 N ATOM 1079 CA THR A 68 2.415 -14.419 12.515 1.00 0.00 C ATOM 1080 C THR A 68 2.615 -14.503 10.996 1.00 0.00 C ATOM 1081 O THR A 68 2.867 -15.580 10.479 1.00 0.00 O ATOM 1082 CB THR A 68 3.807 -14.550 13.228 1.00 0.00 C ATOM 1083 OG1 THR A 68 3.641 -14.535 14.658 1.00 0.00 O ATOM 1084 CG2 THR A 68 4.790 -13.433 12.823 1.00 0.00 C ATOM 0 H THR A 68 1.541 -16.322 12.368 1.00 0.00 H new ATOM 0 HA THR A 68 1.979 -13.458 12.787 1.00 0.00 H new ATOM 0 HB THR A 68 4.231 -15.501 12.907 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.517 -14.619 15.090 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.736 -13.573 13.346 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.961 -13.471 11.747 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.369 -12.464 13.089 1.00 0.00 H new ATOM 1092 N ARG A 69 2.476 -13.373 10.288 1.00 0.00 N ATOM 1093 CA ARG A 69 2.818 -13.274 8.859 1.00 0.00 C ATOM 1094 C ARG A 69 3.548 -11.945 8.615 1.00 0.00 C ATOM 1095 O ARG A 69 3.005 -10.862 8.860 1.00 0.00 O ATOM 1096 CB ARG A 69 1.563 -13.435 7.949 1.00 0.00 C ATOM 1097 CG ARG A 69 0.457 -12.377 8.148 1.00 0.00 C ATOM 1098 CD ARG A 69 -0.742 -12.579 7.204 1.00 0.00 C ATOM 1099 NE ARG A 69 -1.637 -11.407 7.215 1.00 0.00 N ATOM 1100 CZ ARG A 69 -1.520 -10.347 6.398 1.00 0.00 C ATOM 1101 NH1 ARG A 69 -0.605 -10.325 5.434 1.00 0.00 N ATOM 1102 NH2 ARG A 69 -2.323 -9.316 6.550 1.00 0.00 N ATOM 0 H ARG A 69 2.124 -12.503 10.687 1.00 0.00 H new ATOM 0 HA ARG A 69 3.482 -14.095 8.590 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.885 -13.407 6.908 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.133 -14.421 8.124 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.110 -12.412 9.181 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.877 -11.384 7.986 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.383 -12.756 6.190 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.298 -13.467 7.504 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.400 -11.401 7.892 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.021 -11.120 5.307 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.529 -9.513 4.822 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.030 -9.324 7.285 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -2.239 -8.508 5.933 1.00 0.00 H new ATOM 1116 N VAL A 70 4.805 -12.045 8.172 1.00 0.00 N ATOM 1117 CA VAL A 70 5.693 -10.896 7.974 1.00 0.00 C ATOM 1118 C VAL A 70 5.832 -10.604 6.465 1.00 0.00 C ATOM 1119 O VAL A 70 6.303 -11.435 5.688 1.00 0.00 O ATOM 1120 CB VAL A 70 7.096 -11.147 8.676 1.00 0.00 C ATOM 1121 CG1 VAL A 70 6.909 -11.306 10.207 1.00 0.00 C ATOM 1122 CG2 VAL A 70 7.842 -12.376 8.103 1.00 0.00 C ATOM 0 H VAL A 70 5.240 -12.938 7.938 1.00 0.00 H new ATOM 0 HA VAL A 70 5.262 -10.012 8.445 1.00 0.00 H new ATOM 0 HB VAL A 70 7.713 -10.273 8.469 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.878 -11.477 10.676 1.00 0.00 H new ATOM 0 HG12 VAL A 70 6.464 -10.399 10.615 1.00 0.00 H new ATOM 0 HG13 VAL A 70 6.254 -12.154 10.407 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.793 -12.498 8.621 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.234 -13.270 8.245 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.024 -12.227 7.039 1.00 0.00 H new ATOM 1132 N ILE A 71 5.353 -9.429 6.043 1.00 0.00 N ATOM 1133 CA ILE A 71 5.406 -9.001 4.631 1.00 0.00 C ATOM 1134 C ILE A 71 6.476 -7.912 4.452 1.00 0.00 C ATOM 1135 O ILE A 71 6.466 -6.889 5.144 1.00 0.00 O ATOM 1136 CB ILE A 71 4.006 -8.519 4.076 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.159 -7.950 2.620 1.00 0.00 C ATOM 1138 CG2 ILE A 71 3.324 -7.503 5.024 1.00 0.00 C ATOM 1139 CD1 ILE A 71 2.858 -7.636 1.913 1.00 0.00 C ATOM 0 H ILE A 71 4.918 -8.746 6.664 1.00 0.00 H new ATOM 0 HA ILE A 71 5.678 -9.875 4.040 1.00 0.00 H new ATOM 0 HB ILE A 71 3.347 -9.386 4.032 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.760 -7.041 2.663 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.715 -8.671 2.021 1.00 0.00 H new ATOM 0 HG21 ILE A 71 2.366 -7.199 4.603 1.00 0.00 H new ATOM 0 HG22 ILE A 71 3.162 -7.966 5.998 1.00 0.00 H new ATOM 0 HG23 ILE A 71 3.963 -6.628 5.140 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.070 -7.249 0.916 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.260 -8.544 1.831 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.306 -6.888 2.482 1.00 0.00 H new ATOM 1151 N VAL A 72 7.421 -8.179 3.536 1.00 0.00 N ATOM 1152 CA VAL A 72 8.487 -7.254 3.152 1.00 0.00 C ATOM 1153 C VAL A 72 8.318 -6.952 1.656 1.00 0.00 C ATOM 1154 O VAL A 72 8.734 -7.754 0.808 1.00 0.00 O ATOM 1155 CB VAL A 72 9.926 -7.860 3.423 1.00 0.00 C ATOM 1156 CG1 VAL A 72 11.030 -6.782 3.269 1.00 0.00 C ATOM 1157 CG2 VAL A 72 10.002 -8.550 4.808 1.00 0.00 C ATOM 0 H VAL A 72 7.461 -9.066 3.033 1.00 0.00 H new ATOM 0 HA VAL A 72 8.410 -6.347 3.752 1.00 0.00 H new ATOM 0 HB VAL A 72 10.104 -8.626 2.668 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.005 -7.230 3.461 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.008 -6.381 2.256 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.854 -5.976 3.982 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.003 -8.954 4.959 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.782 -7.823 5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.274 -9.360 4.851 1.00 0.00 H new ATOM 1167 N GLY A 73 7.639 -5.834 1.353 1.00 0.00 N ATOM 1168 CA GLY A 73 7.449 -5.374 -0.022 1.00 0.00 C ATOM 1169 C GLY A 73 6.599 -6.318 -0.877 1.00 0.00 C ATOM 1170 O GLY A 73 5.369 -6.266 -0.837 1.00 0.00 O ATOM 0 H GLY A 73 7.210 -5.230 2.054 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.978 -4.391 -0.005 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.425 -5.252 -0.493 1.00 0.00 H new ATOM 1174 N ASN A 74 7.286 -7.198 -1.624 1.00 0.00 N ATOM 1175 CA ASN A 74 6.680 -8.081 -2.650 1.00 0.00 C ATOM 1176 C ASN A 74 6.655 -9.566 -2.182 1.00 0.00 C ATOM 1177 O ASN A 74 6.204 -10.466 -2.905 1.00 0.00 O ATOM 1178 CB ASN A 74 7.492 -7.876 -3.964 1.00 0.00 C ATOM 1179 CG ASN A 74 7.031 -8.718 -5.150 1.00 0.00 C ATOM 1180 OD1 ASN A 74 6.146 -8.319 -5.902 1.00 0.00 O ATOM 1181 ND2 ASN A 74 7.649 -9.883 -5.330 1.00 0.00 N ATOM 0 H ASN A 74 8.294 -7.322 -1.535 1.00 0.00 H new ATOM 0 HA ASN A 74 5.635 -7.822 -2.820 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.440 -6.824 -4.244 1.00 0.00 H new ATOM 0 HB3 ASN A 74 8.539 -8.102 -3.764 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.392 -10.481 -6.116 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.379 -10.178 -4.682 1.00 0.00 H new ATOM 1188 N VAL A 75 7.086 -9.794 -0.933 1.00 0.00 N ATOM 1189 CA VAL A 75 7.276 -11.140 -0.343 1.00 0.00 C ATOM 1190 C VAL A 75 6.533 -11.225 0.998 1.00 0.00 C ATOM 1191 O VAL A 75 6.554 -10.273 1.771 1.00 0.00 O ATOM 1192 CB VAL A 75 8.819 -11.420 -0.120 1.00 0.00 C ATOM 1193 CG1 VAL A 75 9.074 -12.706 0.705 1.00 0.00 C ATOM 1194 CG2 VAL A 75 9.577 -11.478 -1.471 1.00 0.00 C ATOM 0 H VAL A 75 7.318 -9.039 -0.288 1.00 0.00 H new ATOM 0 HA VAL A 75 6.875 -11.889 -1.026 1.00 0.00 H new ATOM 0 HB VAL A 75 9.207 -10.583 0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.147 -12.852 0.829 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.605 -12.609 1.684 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.649 -13.563 0.183 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.634 -11.671 -1.287 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.163 -12.277 -2.086 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.467 -10.526 -1.991 1.00 0.00 H new ATOM 1204 N VAL A 76 5.863 -12.364 1.258 1.00 0.00 N ATOM 1205 CA VAL A 76 5.213 -12.651 2.556 1.00 0.00 C ATOM 1206 C VAL A 76 5.719 -14.000 3.093 1.00 0.00 C ATOM 1207 O VAL A 76 5.690 -14.994 2.373 1.00 0.00 O ATOM 1208 CB VAL A 76 3.639 -12.707 2.438 1.00 0.00 C ATOM 1209 CG1 VAL A 76 2.963 -12.936 3.823 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.073 -11.439 1.759 1.00 0.00 C ATOM 0 H VAL A 76 5.756 -13.114 0.575 1.00 0.00 H new ATOM 0 HA VAL A 76 5.471 -11.839 3.236 1.00 0.00 H new ATOM 0 HB VAL A 76 3.402 -13.562 1.805 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.881 -12.968 3.699 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.308 -13.880 4.245 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.227 -12.120 4.496 1.00 0.00 H new ATOM 0 HG21 VAL A 76 1.987 -11.514 1.696 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.342 -10.561 2.346 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.490 -11.347 0.756 1.00 0.00 H new ATOM 1220 N ILE A 77 6.199 -14.017 4.343 1.00 0.00 N ATOM 1221 CA ILE A 77 6.387 -15.253 5.106 1.00 0.00 C ATOM 1222 C ILE A 77 5.190 -15.411 6.040 1.00 0.00 C ATOM 1223 O ILE A 77 5.049 -14.667 7.010 1.00 0.00 O ATOM 1224 CB ILE A 77 7.742 -15.278 5.929 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.951 -15.503 4.965 1.00 0.00 C ATOM 1226 CG2 ILE A 77 7.717 -16.325 7.089 1.00 0.00 C ATOM 1227 CD1 ILE A 77 10.231 -15.981 5.626 1.00 0.00 C ATOM 0 H ILE A 77 6.467 -13.174 4.851 1.00 0.00 H new ATOM 0 HA ILE A 77 6.454 -16.085 4.405 1.00 0.00 H new ATOM 0 HB ILE A 77 7.860 -14.306 6.408 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.659 -16.231 4.208 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.158 -14.568 4.445 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.668 -16.302 7.621 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.909 -16.084 7.780 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.556 -17.321 6.677 1.00 0.00 H new ATOM 0 HD11 ILE A 77 11.006 -16.106 4.870 1.00 0.00 H new ATOM 0 HD12 ILE A 77 10.557 -15.246 6.362 1.00 0.00 H new ATOM 0 HD13 ILE A 77 10.050 -16.935 6.121 1.00 0.00 H new ATOM 1239 N ASP A 78 4.305 -16.348 5.706 1.00 0.00 N ATOM 1240 CA ASP A 78 3.194 -16.738 6.578 1.00 0.00 C ATOM 1241 C ASP A 78 3.674 -17.883 7.483 1.00 0.00 C ATOM 1242 O ASP A 78 4.330 -18.825 7.026 1.00 0.00 O ATOM 1243 CB ASP A 78 1.925 -17.122 5.761 1.00 0.00 C ATOM 1244 CG ASP A 78 2.153 -18.237 4.727 1.00 0.00 C ATOM 1245 OD1 ASP A 78 2.772 -17.948 3.682 1.00 0.00 O ATOM 1246 OD2 ASP A 78 1.709 -19.391 4.948 1.00 0.00 O ATOM 0 H ASP A 78 4.336 -16.859 4.824 1.00 0.00 H new ATOM 0 HA ASP A 78 2.896 -15.892 7.197 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.144 -17.438 6.452 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.556 -16.235 5.246 1.00 0.00 H new ATOM 1251 N HIS A 79 3.392 -17.755 8.780 1.00 0.00 N ATOM 1252 CA HIS A 79 3.797 -18.721 9.802 1.00 0.00 C ATOM 1253 C HIS A 79 2.559 -19.097 10.614 1.00 0.00 C ATOM 1254 O HIS A 79 1.994 -18.279 11.356 1.00 0.00 O ATOM 1255 CB HIS A 79 4.922 -18.151 10.705 1.00 0.00 C ATOM 1256 CG HIS A 79 5.441 -19.120 11.744 1.00 0.00 C ATOM 1257 ND1 HIS A 79 5.666 -18.766 13.054 1.00 0.00 N ATOM 1258 CD2 HIS A 79 5.795 -20.425 11.652 1.00 0.00 C ATOM 1259 CE1 HIS A 79 6.132 -19.803 13.719 1.00 0.00 C ATOM 1260 NE2 HIS A 79 6.223 -20.822 12.892 1.00 0.00 N ATOM 0 H HIS A 79 2.868 -16.965 9.156 1.00 0.00 H new ATOM 0 HA HIS A 79 4.210 -19.612 9.328 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.753 -17.835 10.074 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.549 -17.260 11.211 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.748 -21.039 10.765 1.00 0.00 H new ATOM 0 HE1 HIS A 79 6.395 -19.815 14.766 1.00 0.00 H new ATOM 0 HE2 HIS A 79 6.557 -21.755 13.134 1.00 0.00 H new ATOM 1269 N GLU A 80 2.142 -20.338 10.423 1.00 0.00 N ATOM 1270 CA GLU A 80 0.957 -20.937 11.037 1.00 0.00 C ATOM 1271 C GLU A 80 1.381 -22.137 11.890 1.00 0.00 C ATOM 1272 O GLU A 80 2.557 -22.513 11.919 1.00 0.00 O ATOM 1273 CB GLU A 80 -0.093 -21.341 9.920 1.00 0.00 C ATOM 1274 CG GLU A 80 0.484 -21.629 8.501 1.00 0.00 C ATOM 1275 CD GLU A 80 1.332 -22.920 8.389 1.00 0.00 C ATOM 1276 OE1 GLU A 80 2.429 -22.964 8.971 1.00 0.00 O ATOM 1277 OE2 GLU A 80 0.901 -23.891 7.729 1.00 0.00 O ATOM 0 H GLU A 80 2.637 -20.987 9.811 1.00 0.00 H new ATOM 0 HA GLU A 80 0.469 -20.214 11.690 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.628 -22.228 10.258 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.827 -20.540 9.835 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.344 -21.694 7.795 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.098 -20.781 8.196 1.00 0.00 H new ATOM 1284 N THR A 81 0.430 -22.660 12.649 1.00 0.00 N ATOM 1285 CA THR A 81 0.522 -23.972 13.276 1.00 0.00 C ATOM 1286 C THR A 81 -0.723 -24.760 12.855 1.00 0.00 C ATOM 1287 O THR A 81 -1.835 -24.493 13.336 1.00 0.00 O ATOM 1288 CB THR A 81 0.649 -23.849 14.832 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.840 -23.114 15.143 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.716 -25.215 15.529 1.00 0.00 C ATOM 0 H THR A 81 -0.445 -22.176 12.851 1.00 0.00 H new ATOM 0 HA THR A 81 1.420 -24.497 12.950 1.00 0.00 H new ATOM 0 HB THR A 81 -0.242 -23.337 15.194 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.928 -23.030 16.115 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.803 -25.070 16.606 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.191 -25.779 15.311 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.583 -25.767 15.166 1.00 0.00 H new ATOM 1298 N VAL A 82 -0.533 -25.679 11.891 1.00 0.00 N ATOM 1299 CA VAL A 82 -1.620 -26.492 11.341 1.00 0.00 C ATOM 1300 C VAL A 82 -1.878 -27.719 12.216 1.00 0.00 C ATOM 1301 O VAL A 82 -0.969 -28.507 12.505 1.00 0.00 O ATOM 1302 CB VAL A 82 -1.371 -26.928 9.843 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -1.493 -25.715 8.903 1.00 0.00 C ATOM 1304 CG2 VAL A 82 -0.001 -27.629 9.658 1.00 0.00 C ATOM 0 H VAL A 82 0.378 -25.875 11.476 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.506 -25.857 11.341 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.140 -27.655 9.584 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.319 -26.032 7.875 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -2.493 -25.289 8.987 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -0.754 -24.964 9.181 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.125 -27.910 8.613 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.799 -26.948 9.950 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.038 -28.522 10.281 1.00 0.00 H new ATOM 1314 N THR A 83 -3.134 -27.844 12.650 1.00 0.00 N ATOM 1315 CA THR A 83 -3.636 -29.024 13.329 1.00 0.00 C ATOM 1316 C THR A 83 -3.638 -30.204 12.344 1.00 0.00 C ATOM 1317 O THR A 83 -4.173 -30.093 11.243 1.00 0.00 O ATOM 1318 CB THR A 83 -5.082 -28.766 13.868 1.00 0.00 C ATOM 1319 OG1 THR A 83 -5.079 -27.627 14.748 1.00 0.00 O ATOM 1320 CG2 THR A 83 -5.660 -29.990 14.607 1.00 0.00 C ATOM 0 H THR A 83 -3.836 -27.113 12.534 1.00 0.00 H new ATOM 0 HA THR A 83 -2.993 -29.258 14.177 1.00 0.00 H new ATOM 0 HB THR A 83 -5.720 -28.573 13.005 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.987 -27.469 15.081 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.665 -29.760 14.962 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.701 -30.840 13.926 1.00 0.00 H new ATOM 0 HG23 THR A 83 -5.023 -30.236 15.457 1.00 0.00 H new ATOM 1328 N ARG A 84 -2.955 -31.289 12.726 1.00 0.00 N ATOM 1329 CA ARG A 84 -2.948 -32.562 11.989 1.00 0.00 C ATOM 1330 C ARG A 84 -3.260 -33.662 13.012 1.00 0.00 C ATOM 1331 O ARG A 84 -3.611 -33.342 14.151 1.00 0.00 O ATOM 1332 CB ARG A 84 -1.571 -32.795 11.299 1.00 0.00 C ATOM 1333 CG ARG A 84 -1.053 -31.596 10.463 1.00 0.00 C ATOM 1334 CD ARG A 84 0.193 -31.945 9.643 1.00 0.00 C ATOM 1335 NE ARG A 84 -0.100 -33.030 8.691 1.00 0.00 N ATOM 1336 CZ ARG A 84 0.658 -34.111 8.475 1.00 0.00 C ATOM 1337 NH1 ARG A 84 1.812 -34.264 9.101 1.00 0.00 N ATOM 1338 NH2 ARG A 84 0.240 -35.034 7.629 1.00 0.00 N ATOM 0 H ARG A 84 -2.382 -31.310 13.569 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.691 -32.561 11.192 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.832 -33.033 12.064 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.649 -33.667 10.649 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.842 -31.258 9.792 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.824 -30.765 11.130 1.00 0.00 H new ATOM 0 HD2 ARG A 84 0.538 -31.063 9.103 1.00 0.00 H new ATOM 0 HD3 ARG A 84 1.001 -32.247 10.310 1.00 0.00 H new ATOM 0 HE ARG A 84 -0.959 -32.950 8.147 1.00 0.00 H new ATOM 0 HH11 ARG A 84 2.134 -33.553 9.758 1.00 0.00 H new ATOM 0 HH12 ARG A 84 2.380 -35.093 8.927 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -0.652 -34.919 7.148 1.00 0.00 H new ATOM 0 HH22 ARG A 84 0.809 -35.863 7.456 1.00 0.00 H new ATOM 1352 N ASN A 85 -3.129 -34.949 12.645 1.00 0.00 N ATOM 1353 CA ASN A 85 -3.472 -36.055 13.567 1.00 0.00 C ATOM 1354 C ASN A 85 -2.298 -37.029 13.718 1.00 0.00 C ATOM 1355 O ASN A 85 -2.082 -37.898 12.867 1.00 0.00 O ATOM 1356 CB ASN A 85 -4.742 -36.783 13.084 1.00 0.00 C ATOM 1357 CG ASN A 85 -5.367 -37.661 14.167 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -5.083 -38.849 14.266 1.00 0.00 O ATOM 1359 ND2 ASN A 85 -6.203 -37.061 15.005 1.00 0.00 N ATOM 0 H ASN A 85 -2.793 -35.250 11.730 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.676 -35.632 14.551 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -5.474 -36.047 12.752 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.496 -37.400 12.220 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.633 -37.591 15.763 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -6.415 -36.070 14.891 1.00 0.00 H new ATOM 1366 N PHE A 86 -1.521 -36.846 14.792 1.00 0.00 N ATOM 1367 CA PHE A 86 -0.400 -37.725 15.158 1.00 0.00 C ATOM 1368 C PHE A 86 -0.855 -38.674 16.283 1.00 0.00 C ATOM 1369 O PHE A 86 -1.571 -38.238 17.184 1.00 0.00 O ATOM 1370 CB PHE A 86 0.821 -36.874 15.617 1.00 0.00 C ATOM 1371 CG PHE A 86 1.536 -36.064 14.525 1.00 0.00 C ATOM 1372 CD1 PHE A 86 1.090 -36.043 13.199 1.00 0.00 C ATOM 1373 CD2 PHE A 86 2.668 -35.312 14.844 1.00 0.00 C ATOM 1374 CE1 PHE A 86 1.747 -35.304 12.237 1.00 0.00 C ATOM 1375 CE2 PHE A 86 3.322 -34.574 13.876 1.00 0.00 C ATOM 1376 CZ PHE A 86 2.862 -34.568 12.575 1.00 0.00 C ATOM 0 H PHE A 86 -1.654 -36.072 15.442 1.00 0.00 H new ATOM 0 HA PHE A 86 -0.095 -38.314 14.293 1.00 0.00 H new ATOM 0 HB2 PHE A 86 0.485 -36.183 16.390 1.00 0.00 H new ATOM 0 HB3 PHE A 86 1.548 -37.541 16.079 1.00 0.00 H new ATOM 0 HD1 PHE A 86 0.216 -36.615 12.924 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.037 -35.307 15.859 1.00 0.00 H new ATOM 0 HE1 PHE A 86 1.387 -35.302 11.219 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.198 -33.999 14.139 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.375 -33.987 11.823 1.00 0.00 H new ATOM 1386 N PRO A 87 -0.444 -39.984 16.259 1.00 0.00 N ATOM 1387 CA PRO A 87 -0.848 -40.973 17.297 1.00 0.00 C ATOM 1388 C PRO A 87 -0.306 -40.645 18.713 1.00 0.00 C ATOM 1389 O PRO A 87 -0.825 -41.158 19.707 1.00 0.00 O ATOM 1390 CB PRO A 87 -0.276 -42.312 16.754 1.00 0.00 C ATOM 1391 CG PRO A 87 0.864 -41.901 15.875 1.00 0.00 C ATOM 1392 CD PRO A 87 0.418 -40.618 15.216 1.00 0.00 C ATOM 0 HA PRO A 87 -1.928 -40.988 17.443 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.060 -42.958 17.565 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.029 -42.868 16.195 1.00 0.00 H new ATOM 0 HG2 PRO A 87 1.774 -41.749 16.456 1.00 0.00 H new ATOM 0 HG3 PRO A 87 1.085 -42.668 15.133 1.00 0.00 H new ATOM 0 HD2 PRO A 87 1.265 -39.984 14.953 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -0.135 -40.808 14.296 1.00 0.00 H new ATOM 1400 N GLU A 88 0.725 -39.775 18.792 1.00 0.00 N ATOM 1401 CA GLU A 88 1.330 -39.355 20.082 1.00 0.00 C ATOM 1402 C GLU A 88 0.543 -38.200 20.745 1.00 0.00 C ATOM 1403 O GLU A 88 0.830 -37.843 21.893 1.00 0.00 O ATOM 1404 CB GLU A 88 2.826 -38.954 19.906 1.00 0.00 C ATOM 1405 CG GLU A 88 3.102 -37.853 18.836 1.00 0.00 C ATOM 1406 CD GLU A 88 3.631 -38.405 17.500 1.00 0.00 C ATOM 1407 OE1 GLU A 88 2.930 -39.218 16.869 1.00 0.00 O ATOM 1408 OE2 GLU A 88 4.750 -38.040 17.077 1.00 0.00 O ATOM 0 H GLU A 88 1.160 -39.346 17.975 1.00 0.00 H new ATOM 0 HA GLU A 88 1.278 -40.219 20.744 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.207 -38.607 20.866 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.395 -39.845 19.641 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.181 -37.300 18.651 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.825 -37.143 19.237 1.00 0.00 H new ATOM 1415 N GLY A 89 -0.428 -37.609 20.018 1.00 0.00 N ATOM 1416 CA GLY A 89 -1.335 -36.615 20.607 1.00 0.00 C ATOM 1417 C GLY A 89 -2.089 -35.817 19.552 1.00 0.00 C ATOM 1418 O GLY A 89 -2.833 -36.392 18.761 1.00 0.00 O ATOM 0 H GLY A 89 -0.599 -37.804 19.032 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.050 -37.120 21.256 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.762 -35.932 21.234 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.909 -34.480 19.560 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.519 -33.568 18.587 1.00 0.00 C ATOM 1424 C LYS A 90 -1.951 -33.796 17.173 1.00 0.00 C ATOM 1425 O LYS A 90 -2.537 -34.535 16.387 1.00 0.00 O ATOM 1426 CB LYS A 90 -2.316 -32.095 19.049 1.00 0.00 C ATOM 1427 CG LYS A 90 -2.910 -31.017 18.111 1.00 0.00 C ATOM 1428 CD LYS A 90 -4.439 -31.126 17.917 1.00 0.00 C ATOM 1429 CE LYS A 90 -5.219 -31.099 19.243 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.681 -30.953 19.047 1.00 0.00 N ATOM 0 H LYS A 90 -1.329 -34.005 20.252 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.588 -33.774 18.537 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.761 -31.977 20.037 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.247 -31.910 19.156 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.674 -30.031 18.512 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.425 -31.089 17.138 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.779 -30.305 17.286 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.667 -32.051 17.387 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.021 -32.018 19.794 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.855 -30.275 19.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.156 -30.941 19.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.877 -30.063 18.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.038 -31.753 18.486 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.788 -33.186 16.880 1.00 0.00 N ATOM 1445 CA GLY A 91 -0.198 -33.209 15.541 1.00 0.00 C ATOM 1446 C GLY A 91 -0.041 -31.822 14.951 1.00 0.00 C ATOM 1447 O GLY A 91 0.007 -31.668 13.732 1.00 0.00 O ATOM 0 H GLY A 91 -0.238 -32.668 17.565 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.777 -33.694 15.586 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.823 -33.812 14.882 1.00 0.00 H new ATOM 1451 N GLU A 92 0.099 -30.812 15.814 1.00 0.00 N ATOM 1452 CA GLU A 92 0.108 -29.403 15.387 1.00 0.00 C ATOM 1453 C GLU A 92 1.553 -28.975 15.060 1.00 0.00 C ATOM 1454 O GLU A 92 2.407 -28.881 15.933 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.531 -28.501 16.487 1.00 0.00 C ATOM 1456 CG GLU A 92 0.106 -28.629 17.890 1.00 0.00 C ATOM 1457 CD GLU A 92 -0.454 -27.640 18.915 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -1.607 -27.825 19.341 1.00 0.00 O ATOM 1459 OE2 GLU A 92 0.247 -26.674 19.294 1.00 0.00 O ATOM 0 H GLU A 92 0.209 -30.942 16.820 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.492 -29.287 14.485 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.463 -27.461 16.167 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.591 -28.742 16.563 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.047 -29.644 18.257 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.182 -28.480 17.805 1.00 0.00 H new ATOM 1466 N VAL A 93 1.836 -28.785 13.761 1.00 0.00 N ATOM 1467 CA VAL A 93 3.194 -28.462 13.275 1.00 0.00 C ATOM 1468 C VAL A 93 3.221 -27.031 12.714 1.00 0.00 C ATOM 1469 O VAL A 93 2.240 -26.583 12.109 1.00 0.00 O ATOM 1470 CB VAL A 93 3.696 -29.514 12.193 1.00 0.00 C ATOM 1471 CG1 VAL A 93 3.474 -30.964 12.693 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.031 -29.310 10.809 1.00 0.00 C ATOM 0 H VAL A 93 1.138 -28.850 13.020 1.00 0.00 H new ATOM 0 HA VAL A 93 3.883 -28.522 14.118 1.00 0.00 H new ATOM 0 HB VAL A 93 4.764 -29.343 12.061 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.824 -31.667 11.937 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.029 -31.119 13.618 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.412 -31.127 12.876 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.410 -30.055 10.110 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.951 -29.419 10.905 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.263 -28.312 10.437 1.00 0.00 H new ATOM 1482 N ASP A 94 4.328 -26.308 12.949 1.00 0.00 N ATOM 1483 CA ASP A 94 4.505 -24.935 12.439 1.00 0.00 C ATOM 1484 C ASP A 94 5.317 -24.970 11.134 1.00 0.00 C ATOM 1485 O ASP A 94 6.185 -25.830 10.977 1.00 0.00 O ATOM 1486 CB ASP A 94 5.188 -24.027 13.502 1.00 0.00 C ATOM 1487 CG ASP A 94 6.676 -24.349 13.757 1.00 0.00 C ATOM 1488 OD1 ASP A 94 6.974 -25.377 14.400 1.00 0.00 O ATOM 1489 OD2 ASP A 94 7.553 -23.566 13.317 1.00 0.00 O ATOM 0 H ASP A 94 5.119 -26.653 13.492 1.00 0.00 H new ATOM 0 HA ASP A 94 3.524 -24.507 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.104 -22.988 13.183 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.644 -24.117 14.442 1.00 0.00 H new ATOM 1494 N VAL A 95 4.995 -24.074 10.177 1.00 0.00 N ATOM 1495 CA VAL A 95 5.705 -23.969 8.877 1.00 0.00 C ATOM 1496 C VAL A 95 5.942 -22.474 8.546 1.00 0.00 C ATOM 1497 O VAL A 95 5.057 -21.643 8.754 1.00 0.00 O ATOM 1498 CB VAL A 95 4.883 -24.625 7.687 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.727 -24.744 6.402 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.244 -25.983 8.081 1.00 0.00 C ATOM 0 H VAL A 95 4.236 -23.401 10.281 1.00 0.00 H new ATOM 0 HA VAL A 95 6.648 -24.507 8.975 1.00 0.00 H new ATOM 0 HB VAL A 95 4.059 -23.945 7.473 1.00 0.00 H new ATOM 0 HG11 VAL A 95 5.127 -25.198 5.613 1.00 0.00 H new ATOM 0 HG12 VAL A 95 6.051 -23.752 6.086 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.600 -25.366 6.597 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.694 -26.387 7.231 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.027 -26.683 8.372 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.561 -25.835 8.917 1.00 0.00 H new ATOM 1510 N ALA A 96 7.150 -22.138 8.066 1.00 0.00 N ATOM 1511 CA ALA A 96 7.467 -20.807 7.527 1.00 0.00 C ATOM 1512 C ALA A 96 7.421 -20.865 5.989 1.00 0.00 C ATOM 1513 O ALA A 96 8.369 -21.343 5.344 1.00 0.00 O ATOM 1514 CB ALA A 96 8.846 -20.344 8.034 1.00 0.00 C ATOM 0 H ALA A 96 7.938 -22.786 8.041 1.00 0.00 H new ATOM 0 HA ALA A 96 6.731 -20.080 7.870 1.00 0.00 H new ATOM 0 HB1 ALA A 96 9.070 -19.357 7.629 1.00 0.00 H new ATOM 0 HB2 ALA A 96 8.836 -20.295 9.123 1.00 0.00 H new ATOM 0 HB3 ALA A 96 9.609 -21.051 7.710 1.00 0.00 H new ATOM 1520 N CYS A 97 6.294 -20.424 5.411 1.00 0.00 N ATOM 1521 CA CYS A 97 6.070 -20.426 3.956 1.00 0.00 C ATOM 1522 C CYS A 97 6.363 -19.031 3.387 1.00 0.00 C ATOM 1523 O CYS A 97 5.673 -18.070 3.704 1.00 0.00 O ATOM 1524 CB CYS A 97 4.621 -20.850 3.644 1.00 0.00 C ATOM 1525 SG CYS A 97 4.165 -22.463 4.315 1.00 0.00 S ATOM 0 H CYS A 97 5.506 -20.053 5.943 1.00 0.00 H new ATOM 0 HA CYS A 97 6.744 -21.143 3.487 1.00 0.00 H new ATOM 0 HB2 CYS A 97 3.940 -20.097 4.041 1.00 0.00 H new ATOM 0 HB3 CYS A 97 4.483 -20.866 2.563 1.00 0.00 H new ATOM 0 HG CYS A 97 2.931 -22.730 4.003 1.00 0.00 H new ATOM 1531 N ILE A 98 7.424 -18.930 2.582 1.00 0.00 N ATOM 1532 CA ILE A 98 7.814 -17.684 1.901 1.00 0.00 C ATOM 1533 C ILE A 98 7.282 -17.686 0.451 1.00 0.00 C ATOM 1534 O ILE A 98 7.716 -18.480 -0.386 1.00 0.00 O ATOM 1535 CB ILE A 98 9.384 -17.466 1.952 1.00 0.00 C ATOM 1536 CG1 ILE A 98 9.819 -16.237 1.085 1.00 0.00 C ATOM 1537 CG2 ILE A 98 10.173 -18.742 1.581 1.00 0.00 C ATOM 1538 CD1 ILE A 98 11.309 -15.940 1.090 1.00 0.00 C ATOM 0 H ILE A 98 8.044 -19.715 2.380 1.00 0.00 H new ATOM 0 HA ILE A 98 7.363 -16.843 2.427 1.00 0.00 H new ATOM 0 HB ILE A 98 9.637 -17.242 2.988 1.00 0.00 H new ATOM 0 HG12 ILE A 98 9.502 -16.407 0.056 1.00 0.00 H new ATOM 0 HG13 ILE A 98 9.287 -15.355 1.441 1.00 0.00 H new ATOM 0 HG21 ILE A 98 11.242 -18.536 1.632 1.00 0.00 H new ATOM 0 HG22 ILE A 98 9.923 -19.540 2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 98 9.911 -19.051 0.569 1.00 0.00 H new ATOM 0 HD11 ILE A 98 11.509 -15.072 0.461 1.00 0.00 H new ATOM 0 HD12 ILE A 98 11.635 -15.733 2.109 1.00 0.00 H new ATOM 0 HD13 ILE A 98 11.853 -16.802 0.703 1.00 0.00 H new ATOM 1550 N TYR A 99 6.302 -16.816 0.177 1.00 0.00 N ATOM 1551 CA TYR A 99 5.760 -16.603 -1.176 1.00 0.00 C ATOM 1552 C TYR A 99 6.407 -15.363 -1.807 1.00 0.00 C ATOM 1553 O TYR A 99 6.844 -14.447 -1.097 1.00 0.00 O ATOM 1554 CB TYR A 99 4.222 -16.389 -1.151 1.00 0.00 C ATOM 1555 CG TYR A 99 3.388 -17.476 -0.452 1.00 0.00 C ATOM 1556 CD1 TYR A 99 3.762 -18.821 -0.448 1.00 0.00 C ATOM 1557 CD2 TYR A 99 2.195 -17.138 0.182 1.00 0.00 C ATOM 1558 CE1 TYR A 99 2.977 -19.781 0.170 1.00 0.00 C ATOM 1559 CE2 TYR A 99 1.407 -18.087 0.799 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.801 -19.408 0.792 1.00 0.00 C ATOM 1561 OH TYR A 99 1.017 -20.355 1.410 1.00 0.00 O ATOM 0 H TYR A 99 5.859 -16.236 0.889 1.00 0.00 H new ATOM 0 HA TYR A 99 5.984 -17.496 -1.759 1.00 0.00 H new ATOM 0 HB2 TYR A 99 4.018 -15.436 -0.662 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.873 -16.301 -2.180 1.00 0.00 H new ATOM 0 HD1 TYR A 99 4.679 -19.118 -0.935 1.00 0.00 H new ATOM 0 HD2 TYR A 99 1.878 -16.105 0.191 1.00 0.00 H new ATOM 0 HE1 TYR A 99 3.283 -20.817 0.166 1.00 0.00 H new ATOM 0 HE2 TYR A 99 0.487 -17.797 1.285 1.00 0.00 H new ATOM 0 HH TYR A 99 0.227 -19.923 1.798 1.00 0.00 H new ATOM 1571 N GLU A 100 6.430 -15.340 -3.141 1.00 0.00 N ATOM 1572 CA GLU A 100 6.859 -14.189 -3.936 1.00 0.00 C ATOM 1573 C GLU A 100 5.825 -13.950 -5.040 1.00 0.00 C ATOM 1574 O GLU A 100 5.570 -14.832 -5.877 1.00 0.00 O ATOM 1575 CB GLU A 100 8.257 -14.450 -4.525 1.00 0.00 C ATOM 1576 CG GLU A 100 8.850 -13.282 -5.328 1.00 0.00 C ATOM 1577 CD GLU A 100 10.306 -13.541 -5.745 1.00 0.00 C ATOM 1578 OE1 GLU A 100 11.222 -13.230 -4.951 1.00 0.00 O ATOM 1579 OE2 GLU A 100 10.544 -14.056 -6.859 1.00 0.00 O ATOM 0 H GLU A 100 6.145 -16.137 -3.710 1.00 0.00 H new ATOM 0 HA GLU A 100 6.926 -13.298 -3.312 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.939 -14.694 -3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 100 8.205 -15.326 -5.171 1.00 0.00 H new ATOM 0 HG2 GLU A 100 8.244 -13.111 -6.218 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.802 -12.372 -4.730 1.00 0.00 H new ATOM 1586 N VAL A 101 5.221 -12.761 -5.011 1.00 0.00 N ATOM 1587 CA VAL A 101 4.127 -12.376 -5.911 1.00 0.00 C ATOM 1588 C VAL A 101 4.684 -11.622 -7.137 1.00 0.00 C ATOM 1589 O VAL A 101 5.615 -10.838 -7.025 1.00 0.00 O ATOM 1590 CB VAL A 101 3.069 -11.502 -5.137 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.870 -11.112 -6.037 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.581 -12.238 -3.859 1.00 0.00 C ATOM 0 H VAL A 101 5.480 -12.026 -4.353 1.00 0.00 H new ATOM 0 HA VAL A 101 3.626 -13.276 -6.268 1.00 0.00 H new ATOM 0 HB VAL A 101 3.565 -10.578 -4.840 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.165 -10.510 -5.463 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.228 -10.536 -6.891 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.372 -12.015 -6.391 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.851 -11.618 -3.339 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.119 -13.185 -4.138 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.430 -12.428 -3.202 1.00 0.00 H new ATOM 1602 N GLU A 102 4.127 -11.904 -8.310 1.00 0.00 N ATOM 1603 CA GLU A 102 4.480 -11.238 -9.567 1.00 0.00 C ATOM 1604 C GLU A 102 3.190 -10.981 -10.347 1.00 0.00 C ATOM 1605 O GLU A 102 2.437 -11.927 -10.613 1.00 0.00 O ATOM 1606 CB GLU A 102 5.440 -12.123 -10.399 1.00 0.00 C ATOM 1607 CG GLU A 102 5.881 -11.519 -11.747 1.00 0.00 C ATOM 1608 CD GLU A 102 6.498 -12.559 -12.697 1.00 0.00 C ATOM 1609 OE1 GLU A 102 7.718 -12.812 -12.615 1.00 0.00 O ATOM 1610 OE2 GLU A 102 5.753 -13.133 -13.523 1.00 0.00 O ATOM 0 H GLU A 102 3.404 -12.615 -8.420 1.00 0.00 H new ATOM 0 HA GLU A 102 4.989 -10.297 -9.359 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.329 -12.329 -9.802 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.955 -13.080 -10.589 1.00 0.00 H new ATOM 0 HG2 GLU A 102 5.020 -11.058 -12.231 1.00 0.00 H new ATOM 0 HG3 GLU A 102 6.606 -10.726 -11.564 1.00 0.00 H new ATOM 1617 N ASN A 103 2.930 -9.700 -10.691 1.00 0.00 N ATOM 1618 CA ASN A 103 1.757 -9.291 -11.503 1.00 0.00 C ATOM 1619 C ASN A 103 0.430 -9.622 -10.767 1.00 0.00 C ATOM 1620 O ASN A 103 -0.600 -9.888 -11.396 1.00 0.00 O ATOM 1621 CB ASN A 103 1.819 -9.973 -12.913 1.00 0.00 C ATOM 1622 CG ASN A 103 3.109 -9.657 -13.684 1.00 0.00 C ATOM 1623 OD1 ASN A 103 3.628 -8.546 -13.615 1.00 0.00 O ATOM 1624 ND2 ASN A 103 3.662 -10.641 -14.380 1.00 0.00 N ATOM 0 H ASN A 103 3.526 -8.919 -10.415 1.00 0.00 H new ATOM 0 HA ASN A 103 1.786 -8.211 -11.645 1.00 0.00 H new ATOM 0 HB2 ASN A 103 1.732 -11.053 -12.791 1.00 0.00 H new ATOM 0 HB3 ASN A 103 0.962 -9.649 -13.504 1.00 0.00 H new ATOM 0 HD21 ASN A 103 4.540 -10.485 -14.875 1.00 0.00 H new ATOM 0 HD22 ASN A 103 3.209 -11.554 -14.420 1.00 0.00 H new ATOM 1631 N GLY A 104 0.475 -9.574 -9.419 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.695 -9.842 -8.571 1.00 0.00 C ATOM 1633 C GLY A 104 -0.905 -11.324 -8.242 1.00 0.00 C ATOM 1634 O GLY A 104 -1.782 -11.664 -7.440 1.00 0.00 O ATOM 0 H GLY A 104 1.321 -9.349 -8.895 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.590 -9.286 -7.640 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.586 -9.462 -9.070 1.00 0.00 H new ATOM 1638 N ARG A 105 -0.088 -12.207 -8.849 1.00 0.00 N ATOM 1639 CA ARG A 105 -0.219 -13.676 -8.716 1.00 0.00 C ATOM 1640 C ARG A 105 1.111 -14.274 -8.239 1.00 0.00 C ATOM 1641 O ARG A 105 2.152 -13.933 -8.780 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.614 -14.291 -10.088 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.927 -13.744 -10.692 1.00 0.00 C ATOM 1644 CD ARG A 105 -3.148 -14.014 -9.799 1.00 0.00 C ATOM 1645 NE ARG A 105 -4.374 -13.406 -10.354 1.00 0.00 N ATOM 1646 CZ ARG A 105 -5.481 -14.070 -10.713 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -5.537 -15.385 -10.611 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -6.521 -13.405 -11.191 1.00 0.00 N ATOM 0 H ARG A 105 0.686 -11.922 -9.449 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.994 -13.904 -7.985 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.196 -14.114 -10.796 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -0.706 -15.371 -9.973 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.829 -12.670 -10.852 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -2.089 -14.198 -11.670 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -3.291 -15.089 -9.693 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.964 -13.617 -8.801 1.00 0.00 H new ATOM 0 HE ARG A 105 -4.378 -12.393 -10.474 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -4.733 -15.904 -10.257 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -6.384 -15.882 -10.887 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -6.478 -12.390 -11.285 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -7.365 -13.907 -11.465 1.00 0.00 H new ATOM 1662 N ILE A 106 1.064 -15.186 -7.253 1.00 0.00 N ATOM 1663 CA ILE A 106 2.278 -15.815 -6.681 1.00 0.00 C ATOM 1664 C ILE A 106 3.006 -16.646 -7.751 1.00 0.00 C ATOM 1665 O ILE A 106 2.551 -17.725 -8.107 1.00 0.00 O ATOM 1666 CB ILE A 106 1.926 -16.713 -5.439 1.00 0.00 C ATOM 1667 CG1 ILE A 106 1.214 -15.858 -4.347 1.00 0.00 C ATOM 1668 CG2 ILE A 106 3.185 -17.421 -4.859 1.00 0.00 C ATOM 1669 CD1 ILE A 106 0.801 -16.635 -3.118 1.00 0.00 C ATOM 0 H ILE A 106 0.194 -15.509 -6.830 1.00 0.00 H new ATOM 0 HA ILE A 106 2.939 -15.017 -6.342 1.00 0.00 H new ATOM 0 HB ILE A 106 1.247 -17.497 -5.773 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.880 -15.050 -4.044 1.00 0.00 H new ATOM 0 HG13 ILE A 106 0.329 -15.396 -4.784 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.897 -18.031 -4.003 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.630 -18.057 -5.624 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.911 -16.672 -4.543 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.314 -15.964 -2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 106 0.108 -17.427 -3.404 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.683 -17.075 -2.652 1.00 0.00 H new ATOM 1681 N ALA A 107 4.115 -16.099 -8.277 1.00 0.00 N ATOM 1682 CA ALA A 107 4.887 -16.728 -9.367 1.00 0.00 C ATOM 1683 C ALA A 107 5.827 -17.812 -8.837 1.00 0.00 C ATOM 1684 O ALA A 107 6.212 -18.720 -9.581 1.00 0.00 O ATOM 1685 CB ALA A 107 5.676 -15.664 -10.142 1.00 0.00 C ATOM 0 H ALA A 107 4.503 -15.210 -7.961 1.00 0.00 H new ATOM 0 HA ALA A 107 4.180 -17.207 -10.044 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.241 -16.141 -10.943 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.985 -14.937 -10.569 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.364 -15.157 -9.466 1.00 0.00 H new ATOM 1691 N LYS A 108 6.211 -17.697 -7.554 1.00 0.00 N ATOM 1692 CA LYS A 108 7.141 -18.634 -6.893 1.00 0.00 C ATOM 1693 C LYS A 108 6.798 -18.726 -5.407 1.00 0.00 C ATOM 1694 O LYS A 108 6.493 -17.716 -4.774 1.00 0.00 O ATOM 1695 CB LYS A 108 8.623 -18.182 -7.073 1.00 0.00 C ATOM 1696 CG LYS A 108 9.176 -18.337 -8.510 1.00 0.00 C ATOM 1697 CD LYS A 108 10.551 -17.675 -8.718 1.00 0.00 C ATOM 1698 CE LYS A 108 11.025 -17.786 -10.177 1.00 0.00 C ATOM 1699 NZ LYS A 108 12.296 -17.066 -10.409 1.00 0.00 N ATOM 0 H LYS A 108 5.885 -16.949 -6.942 1.00 0.00 H new ATOM 0 HA LYS A 108 7.032 -19.614 -7.357 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.708 -17.137 -6.776 1.00 0.00 H new ATOM 0 HB3 LYS A 108 9.250 -18.759 -6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 108 9.254 -19.398 -8.748 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.464 -17.904 -9.213 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.495 -16.624 -8.433 1.00 0.00 H new ATOM 0 HD3 LYS A 108 11.283 -18.145 -8.061 1.00 0.00 H new ATOM 0 HE2 LYS A 108 11.152 -18.837 -10.437 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.257 -17.385 -10.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 12.576 -17.169 -11.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 12.169 -16.058 -10.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 13.037 -17.465 -9.798 1.00 0.00 H new ATOM 1713 N ALA A 109 6.867 -19.942 -4.868 1.00 0.00 N ATOM 1714 CA ALA A 109 6.563 -20.237 -3.464 1.00 0.00 C ATOM 1715 C ALA A 109 7.561 -21.272 -2.952 1.00 0.00 C ATOM 1716 O ALA A 109 7.908 -22.206 -3.668 1.00 0.00 O ATOM 1717 CB ALA A 109 5.120 -20.748 -3.323 1.00 0.00 C ATOM 0 H ALA A 109 7.140 -20.767 -5.402 1.00 0.00 H new ATOM 0 HA ALA A 109 6.650 -19.328 -2.869 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.911 -20.962 -2.275 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.428 -19.987 -3.683 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.997 -21.658 -3.911 1.00 0.00 H new ATOM 1723 N TRP A 110 8.039 -21.067 -1.726 1.00 0.00 N ATOM 1724 CA TRP A 110 9.020 -21.935 -1.053 1.00 0.00 C ATOM 1725 C TRP A 110 8.535 -22.105 0.396 1.00 0.00 C ATOM 1726 O TRP A 110 7.992 -21.156 0.956 1.00 0.00 O ATOM 1727 CB TRP A 110 10.446 -21.279 -1.083 1.00 0.00 C ATOM 1728 CG TRP A 110 10.831 -20.648 -2.413 1.00 0.00 C ATOM 1729 CD1 TRP A 110 11.305 -21.282 -3.512 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.762 -19.258 -2.769 1.00 0.00 C ATOM 1731 NE1 TRP A 110 11.507 -20.400 -4.532 1.00 0.00 N ATOM 1732 CE2 TRP A 110 11.195 -19.147 -4.099 1.00 0.00 C ATOM 1733 CE3 TRP A 110 10.375 -18.103 -2.095 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 11.253 -17.931 -4.765 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 10.432 -16.896 -2.753 1.00 0.00 C ATOM 1736 CH2 TRP A 110 10.869 -16.818 -4.078 1.00 0.00 C ATOM 0 H TRP A 110 7.751 -20.274 -1.153 1.00 0.00 H new ATOM 0 HA TRP A 110 9.099 -22.899 -1.555 1.00 0.00 H new ATOM 0 HB2 TRP A 110 10.495 -20.515 -0.307 1.00 0.00 H new ATOM 0 HB3 TRP A 110 11.185 -22.039 -0.830 1.00 0.00 H new ATOM 0 HD1 TRP A 110 11.497 -22.343 -3.572 1.00 0.00 H new ATOM 0 HE1 TRP A 110 11.838 -20.640 -5.467 1.00 0.00 H new ATOM 0 HE3 TRP A 110 10.035 -18.154 -1.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.590 -17.869 -5.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 10.134 -15.995 -2.237 1.00 0.00 H new ATOM 0 HH2 TRP A 110 10.903 -15.856 -4.568 1.00 0.00 H new ATOM 1747 N PHE A 111 8.692 -23.292 1.004 1.00 0.00 N ATOM 1748 CA PHE A 111 8.280 -23.490 2.414 1.00 0.00 C ATOM 1749 C PHE A 111 9.260 -24.404 3.155 1.00 0.00 C ATOM 1750 O PHE A 111 9.847 -25.315 2.563 1.00 0.00 O ATOM 1751 CB PHE A 111 6.812 -24.018 2.522 1.00 0.00 C ATOM 1752 CG PHE A 111 6.597 -25.513 2.249 1.00 0.00 C ATOM 1753 CD1 PHE A 111 6.339 -25.990 0.967 1.00 0.00 C ATOM 1754 CD2 PHE A 111 6.638 -26.443 3.297 1.00 0.00 C ATOM 1755 CE1 PHE A 111 6.130 -27.339 0.742 1.00 0.00 C ATOM 1756 CE2 PHE A 111 6.428 -27.785 3.075 1.00 0.00 C ATOM 1757 CZ PHE A 111 6.176 -28.237 1.795 1.00 0.00 C ATOM 0 H PHE A 111 9.092 -24.117 0.557 1.00 0.00 H new ATOM 0 HA PHE A 111 8.305 -22.514 2.899 1.00 0.00 H new ATOM 0 HB2 PHE A 111 6.444 -23.798 3.524 1.00 0.00 H new ATOM 0 HB3 PHE A 111 6.194 -23.452 1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 111 6.302 -25.299 0.138 1.00 0.00 H new ATOM 0 HD2 PHE A 111 6.839 -26.099 4.301 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.930 -27.693 -0.259 1.00 0.00 H new ATOM 0 HE2 PHE A 111 6.460 -28.482 3.899 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.015 -29.290 1.615 1.00 0.00 H new ATOM 1767 N LYS A 112 9.426 -24.132 4.455 1.00 0.00 N ATOM 1768 CA LYS A 112 10.206 -24.970 5.372 1.00 0.00 C ATOM 1769 C LYS A 112 9.385 -25.214 6.636 1.00 0.00 C ATOM 1770 O LYS A 112 8.896 -24.260 7.240 1.00 0.00 O ATOM 1771 CB LYS A 112 11.552 -24.291 5.723 1.00 0.00 C ATOM 1772 CG LYS A 112 12.428 -25.066 6.745 1.00 0.00 C ATOM 1773 CD LYS A 112 13.757 -24.345 7.071 1.00 0.00 C ATOM 1774 CE LYS A 112 13.547 -22.928 7.635 1.00 0.00 C ATOM 1775 NZ LYS A 112 14.825 -22.262 7.970 1.00 0.00 N ATOM 0 H LYS A 112 9.017 -23.313 4.905 1.00 0.00 H new ATOM 0 HA LYS A 112 10.430 -25.922 4.891 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.124 -24.155 4.805 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.348 -23.297 6.121 1.00 0.00 H new ATOM 0 HG2 LYS A 112 11.863 -25.208 7.666 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.647 -26.058 6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.319 -24.938 7.792 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.363 -24.285 6.167 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.006 -22.325 6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.924 -22.983 8.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.633 -21.311 8.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.331 -22.822 8.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.411 -22.184 7.114 1.00 0.00 H new ATOM 1789 N ILE A 113 9.274 -26.483 7.057 1.00 0.00 N ATOM 1790 CA ILE A 113 8.498 -26.857 8.244 1.00 0.00 C ATOM 1791 C ILE A 113 9.404 -26.760 9.477 1.00 0.00 C ATOM 1792 O ILE A 113 10.517 -27.308 9.491 1.00 0.00 O ATOM 1793 CB ILE A 113 7.885 -28.307 8.111 1.00 0.00 C ATOM 1794 CG1 ILE A 113 6.814 -28.327 6.970 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.267 -28.805 9.455 1.00 0.00 C ATOM 1796 CD1 ILE A 113 6.273 -29.701 6.615 1.00 0.00 C ATOM 0 H ILE A 113 9.717 -27.272 6.587 1.00 0.00 H new ATOM 0 HA ILE A 113 7.658 -26.169 8.346 1.00 0.00 H new ATOM 0 HB ILE A 113 8.694 -28.992 7.858 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.980 -27.691 7.266 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.251 -27.884 6.075 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.857 -29.806 9.318 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.040 -28.831 10.223 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.472 -28.126 9.763 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.539 -29.607 5.815 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.092 -30.340 6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.800 -30.144 7.492 1.00 0.00 H new ATOM 1808 N GLY A 114 8.918 -26.014 10.477 1.00 0.00 N ATOM 1809 CA GLY A 114 9.625 -25.801 11.734 1.00 0.00 C ATOM 1810 C GLY A 114 9.845 -27.080 12.526 1.00 0.00 C ATOM 1811 O GLY A 114 10.942 -27.654 12.483 1.00 0.00 O ATOM 0 H GLY A 114 8.016 -25.540 10.430 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.591 -25.340 11.526 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.061 -25.096 12.345 1.00 0.00 H new ATOM 1815 N GLU A 115 8.810 -27.533 13.248 1.00 0.00 N ATOM 1816 CA GLU A 115 8.888 -28.747 14.070 1.00 0.00 C ATOM 1817 C GLU A 115 7.469 -29.291 14.325 1.00 0.00 C ATOM 1818 O GLU A 115 6.482 -28.567 14.108 1.00 0.00 O ATOM 1819 CB GLU A 115 9.604 -28.430 15.421 1.00 0.00 C ATOM 1820 CG GLU A 115 8.715 -27.726 16.472 1.00 0.00 C ATOM 1821 CD GLU A 115 9.502 -27.148 17.657 1.00 0.00 C ATOM 1822 OE1 GLU A 115 10.369 -27.854 18.206 1.00 0.00 O ATOM 1823 OE2 GLU A 115 9.279 -25.973 18.037 1.00 0.00 O ATOM 0 H GLU A 115 7.901 -27.071 13.278 1.00 0.00 H new ATOM 0 HA GLU A 115 9.466 -29.506 13.542 1.00 0.00 H new ATOM 0 HB2 GLU A 115 9.978 -29.362 15.846 1.00 0.00 H new ATOM 0 HB3 GLU A 115 10.471 -27.801 15.219 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.162 -26.921 15.987 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.979 -28.437 16.848 1.00 0.00 H new ATOM 1830 N PRO A 116 7.333 -30.575 14.770 1.00 0.00 N ATOM 1831 CA PRO A 116 6.066 -31.082 15.312 1.00 0.00 C ATOM 1832 C PRO A 116 5.856 -30.688 16.789 1.00 0.00 C ATOM 1833 O PRO A 116 6.805 -30.663 17.584 1.00 0.00 O ATOM 1834 CB PRO A 116 6.211 -32.605 15.138 1.00 0.00 C ATOM 1835 CG PRO A 116 7.675 -32.863 15.308 1.00 0.00 C ATOM 1836 CD PRO A 116 8.373 -31.651 14.716 1.00 0.00 C ATOM 0 HA PRO A 116 5.193 -30.669 14.807 1.00 0.00 H new ATOM 0 HB2 PRO A 116 5.624 -33.147 15.879 1.00 0.00 H new ATOM 0 HB3 PRO A 116 5.862 -32.928 14.157 1.00 0.00 H new ATOM 0 HG2 PRO A 116 7.932 -32.989 16.360 1.00 0.00 H new ATOM 0 HG3 PRO A 116 7.974 -33.777 14.796 1.00 0.00 H new ATOM 0 HD2 PRO A 116 9.259 -31.380 15.290 1.00 0.00 H new ATOM 0 HD3 PRO A 116 8.701 -31.839 13.694 1.00 0.00 H new ATOM 1844 N ARG A 117 4.604 -30.361 17.135 1.00 0.00 N ATOM 1845 CA ARG A 117 4.183 -30.068 18.517 1.00 0.00 C ATOM 1846 C ARG A 117 2.894 -30.828 18.854 1.00 0.00 C ATOM 1847 O ARG A 117 2.130 -31.234 17.965 1.00 0.00 O ATOM 1848 CB ARG A 117 3.996 -28.530 18.736 1.00 0.00 C ATOM 1849 CG ARG A 117 5.315 -27.736 18.886 1.00 0.00 C ATOM 1850 CD ARG A 117 6.129 -28.197 20.116 1.00 0.00 C ATOM 1851 NE ARG A 117 7.407 -27.482 20.256 1.00 0.00 N ATOM 1852 CZ ARG A 117 8.456 -27.905 20.978 1.00 0.00 C ATOM 1853 NH1 ARG A 117 8.430 -29.075 21.605 1.00 0.00 N ATOM 1854 NH2 ARG A 117 9.544 -27.162 21.037 1.00 0.00 N ATOM 0 H ARG A 117 3.844 -30.291 16.458 1.00 0.00 H new ATOM 0 HA ARG A 117 4.970 -30.405 19.192 1.00 0.00 H new ATOM 0 HB2 ARG A 117 3.435 -28.122 17.895 1.00 0.00 H new ATOM 0 HB3 ARG A 117 3.390 -28.374 19.629 1.00 0.00 H new ATOM 0 HG2 ARG A 117 5.917 -27.859 17.986 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.091 -26.673 18.977 1.00 0.00 H new ATOM 0 HD2 ARG A 117 5.534 -28.047 21.017 1.00 0.00 H new ATOM 0 HD3 ARG A 117 6.323 -29.267 20.037 1.00 0.00 H new ATOM 0 HE ARG A 117 7.503 -26.593 19.765 1.00 0.00 H new ATOM 0 HH11 ARG A 117 7.603 -29.669 21.542 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.237 -29.380 22.149 1.00 0.00 H new ATOM 0 HH21 ARG A 117 9.583 -26.274 20.536 1.00 0.00 H new ATOM 0 HH22 ARG A 117 10.346 -27.475 21.583 1.00 0.00 H new ATOM 1868 N ILE A 118 2.679 -31.020 20.160 1.00 0.00 N ATOM 1869 CA ILE A 118 1.524 -31.735 20.727 1.00 0.00 C ATOM 1870 C ILE A 118 0.963 -30.883 21.885 1.00 0.00 C ATOM 1871 O ILE A 118 1.738 -30.233 22.593 1.00 0.00 O ATOM 1872 CB ILE A 118 1.964 -33.168 21.250 1.00 0.00 C ATOM 1873 CG1 ILE A 118 2.496 -34.073 20.087 1.00 0.00 C ATOM 1874 CG2 ILE A 118 0.832 -33.881 22.023 1.00 0.00 C ATOM 1875 CD1 ILE A 118 1.471 -34.387 19.010 1.00 0.00 C ATOM 0 H ILE A 118 3.320 -30.674 20.874 1.00 0.00 H new ATOM 0 HA ILE A 118 0.758 -31.883 19.965 1.00 0.00 H new ATOM 0 HB ILE A 118 2.784 -33.001 21.949 1.00 0.00 H new ATOM 0 HG12 ILE A 118 3.351 -33.581 19.624 1.00 0.00 H new ATOM 0 HG13 ILE A 118 2.858 -35.010 20.510 1.00 0.00 H new ATOM 0 HG21 ILE A 118 1.181 -34.857 22.361 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.546 -33.280 22.886 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -0.030 -34.010 21.369 1.00 0.00 H new ATOM 0 HD11 ILE A 118 1.927 -35.018 18.247 1.00 0.00 H new ATOM 0 HD12 ILE A 118 0.624 -34.910 19.455 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.126 -33.459 18.555 1.00 0.00 H new ATOM 1887 N VAL A 119 -0.374 -30.882 22.065 1.00 0.00 N ATOM 1888 CA VAL A 119 -1.045 -30.118 23.156 1.00 0.00 C ATOM 1889 C VAL A 119 -0.645 -30.669 24.541 1.00 0.00 C ATOM 1890 O VAL A 119 -0.363 -29.900 25.469 1.00 0.00 O ATOM 1891 CB VAL A 119 -2.615 -30.138 23.006 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -3.330 -29.444 24.196 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -3.042 -29.492 21.678 1.00 0.00 C ATOM 0 H VAL A 119 -1.019 -31.402 21.470 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.709 -29.084 23.073 1.00 0.00 H new ATOM 0 HB VAL A 119 -2.920 -31.184 23.008 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -4.409 -29.484 24.046 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.074 -29.956 25.123 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.010 -28.404 24.256 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.129 -29.516 21.594 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.699 -28.458 21.649 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.602 -30.043 20.847 1.00 0.00 H new