USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 810 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 Single : A 2 SER OG : rot -28:sc= 0.293 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 155:sc= 1.24 (180deg=0.77) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -169:sc= 0.0065 USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= 1.27 (180deg=-0.0936) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0346) USER MOD Single : A 32 CYS SG : rot 180:sc= -2.31! USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 39 SER OG : rot 180:sc= -0.361 USER MOD Single : A 41 SER OG : rot -159:sc= -2.19! USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 53 SER OG : rot 39:sc= 0.00321 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -141:sc= 0.291 (180deg=-2.78!) USER MOD Single : A 61 MET CE :methyl -125:sc= 0 (180deg=-2.31!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -134:sc= 0.0929 (180deg=-0.656) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 ASN : amide:sc= -0.205 K(o=-0.2,f=-2.3!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -1 K(o=-1,f=-7.2!) USER MOD Single : A 79 LYS NZ :NH3+ -179:sc= 1.87 (180deg=1.84) USER MOD Single : A 90 LYS NZ :NH3+ -153:sc= 1.22 (180deg=1.07) USER MOD Single : A 91 SER OG : rot -60:sc= 1.04 USER MOD Single : A 94 LYS NZ :NH3+ 139:sc= 1.12 (180deg=-0.408) USER MOD Single : A 98 TYR OH : rot 180:sc= -0.278 USER MOD Single : A 100 LYS NZ :NH3+ -175:sc= 1.67 (180deg=1.52) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 14 N SER A 2 -4.654 22.046 -3.370 1.00 0.00 N ATOM 15 CA SER A 2 -5.341 20.883 -3.902 1.00 0.00 C ATOM 16 C SER A 2 -4.334 19.838 -4.372 1.00 0.00 C ATOM 17 O SER A 2 -3.782 19.932 -5.471 1.00 0.00 O ATOM 18 CB SER A 2 -6.280 21.299 -5.040 1.00 0.00 C ATOM 19 OG SER A 2 -5.659 22.234 -5.914 1.00 0.00 O ATOM 0 HA SER A 2 -5.943 20.435 -3.111 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.582 20.417 -5.605 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.187 21.736 -4.623 1.00 0.00 H new ATOM 0 HG SER A 2 -4.984 22.745 -5.420 1.00 0.00 H new ATOM 25 N ARG A 3 -4.067 18.857 -3.523 1.00 0.00 N ATOM 26 CA ARG A 3 -3.123 17.804 -3.856 1.00 0.00 C ATOM 27 C ARG A 3 -3.856 16.538 -4.258 1.00 0.00 C ATOM 28 O ARG A 3 -5.071 16.440 -4.091 1.00 0.00 O ATOM 29 CB ARG A 3 -2.186 17.518 -2.684 1.00 0.00 C ATOM 30 CG ARG A 3 -1.134 18.592 -2.467 1.00 0.00 C ATOM 31 CD ARG A 3 -0.245 18.750 -3.689 1.00 0.00 C ATOM 32 NE ARG A 3 0.329 17.476 -4.128 1.00 0.00 N ATOM 33 CZ ARG A 3 0.704 17.226 -5.386 1.00 0.00 C ATOM 34 NH1 ARG A 3 0.626 18.178 -6.308 1.00 0.00 N ATOM 35 NH2 ARG A 3 1.176 16.028 -5.719 1.00 0.00 N ATOM 0 H ARG A 3 -4.491 18.769 -2.599 1.00 0.00 H new ATOM 0 HA ARG A 3 -2.524 18.146 -4.700 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -2.778 17.413 -1.775 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -1.688 16.563 -2.853 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -1.621 19.541 -2.244 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -0.523 18.336 -1.601 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -0.825 19.184 -4.503 1.00 0.00 H new ATOM 0 HD3 ARG A 3 0.560 19.449 -3.462 1.00 0.00 H new ATOM 0 HE ARG A 3 0.449 16.738 -3.434 1.00 0.00 H new ATOM 0 HH11 ARG A 3 0.279 19.104 -6.057 1.00 0.00 H new ATOM 0 HH12 ARG A 3 0.913 17.984 -7.267 1.00 0.00 H new ATOM 0 HH21 ARG A 3 1.253 15.296 -5.013 1.00 0.00 H new ATOM 0 HH22 ARG A 3 1.461 15.841 -6.680 1.00 0.00 H new ATOM 49 N ASN A 4 -3.111 15.581 -4.798 1.00 0.00 N ATOM 50 CA ASN A 4 -3.682 14.315 -5.233 1.00 0.00 C ATOM 51 C ASN A 4 -2.592 13.261 -5.398 1.00 0.00 C ATOM 52 O ASN A 4 -1.522 13.544 -5.940 1.00 0.00 O ATOM 53 CB ASN A 4 -4.456 14.490 -6.551 1.00 0.00 C ATOM 54 CG ASN A 4 -3.628 15.141 -7.647 1.00 0.00 C ATOM 55 OD1 ASN A 4 -2.962 14.464 -8.430 1.00 0.00 O ATOM 56 ND2 ASN A 4 -3.672 16.464 -7.716 1.00 0.00 N ATOM 0 H ASN A 4 -2.105 15.660 -4.945 1.00 0.00 H new ATOM 0 HA ASN A 4 -4.378 13.978 -4.465 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -4.801 13.515 -6.895 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -5.344 15.095 -6.367 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -3.142 16.955 -8.436 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -4.236 16.991 -7.049 1.00 0.00 H new ATOM 63 N PRO A 5 -2.827 12.048 -4.871 1.00 0.00 N ATOM 64 CA PRO A 5 -1.983 10.891 -5.118 1.00 0.00 C ATOM 65 C PRO A 5 -2.434 10.152 -6.375 1.00 0.00 C ATOM 66 O PRO A 5 -3.269 10.656 -7.125 1.00 0.00 O ATOM 67 CB PRO A 5 -2.190 10.017 -3.873 1.00 0.00 C ATOM 68 CG PRO A 5 -3.302 10.647 -3.089 1.00 0.00 C ATOM 69 CD PRO A 5 -3.919 11.702 -3.967 1.00 0.00 C ATOM 0 HA PRO A 5 -0.938 11.157 -5.281 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -2.445 8.995 -4.155 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.277 9.966 -3.279 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -4.044 9.901 -2.804 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -2.922 11.087 -2.167 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.786 11.322 -4.507 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.255 12.563 -3.390 1.00 0.00 H new ATOM 77 N GLU A 6 -1.905 8.959 -6.596 1.00 0.00 N ATOM 78 CA GLU A 6 -2.237 8.215 -7.798 1.00 0.00 C ATOM 79 C GLU A 6 -3.432 7.301 -7.547 1.00 0.00 C ATOM 80 O GLU A 6 -3.481 6.570 -6.555 1.00 0.00 O ATOM 81 CB GLU A 6 -1.026 7.420 -8.286 1.00 0.00 C ATOM 82 CG GLU A 6 -1.223 6.797 -9.659 1.00 0.00 C ATOM 83 CD GLU A 6 0.087 6.524 -10.357 1.00 0.00 C ATOM 84 OE1 GLU A 6 0.776 5.551 -9.984 1.00 0.00 O ATOM 85 OE2 GLU A 6 0.448 7.295 -11.270 1.00 0.00 O ATOM 0 H GLU A 6 -1.252 8.491 -5.967 1.00 0.00 H new ATOM 0 HA GLU A 6 -2.513 8.921 -8.581 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.157 8.078 -8.315 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -0.805 6.632 -7.566 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -1.779 5.865 -9.556 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -1.828 7.463 -10.274 1.00 0.00 H new ATOM 92 N VAL A 7 -4.398 7.369 -8.448 1.00 0.00 N ATOM 93 CA VAL A 7 -5.640 6.626 -8.322 1.00 0.00 C ATOM 94 C VAL A 7 -5.756 5.593 -9.438 1.00 0.00 C ATOM 95 O VAL A 7 -5.659 5.924 -10.618 1.00 0.00 O ATOM 96 CB VAL A 7 -6.856 7.580 -8.366 1.00 0.00 C ATOM 97 CG1 VAL A 7 -8.164 6.805 -8.363 1.00 0.00 C ATOM 98 CG2 VAL A 7 -6.816 8.547 -7.194 1.00 0.00 C ATOM 0 H VAL A 7 -4.342 7.943 -9.290 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.631 6.114 -7.360 1.00 0.00 H new ATOM 0 HB VAL A 7 -6.801 8.148 -9.295 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -9.001 7.503 -8.394 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -8.203 6.153 -9.236 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -8.228 6.203 -7.457 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -7.679 9.211 -7.241 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.839 7.987 -6.259 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.901 9.137 -7.241 1.00 0.00 H new ATOM 108 N LEU A 8 -5.953 4.343 -9.055 1.00 0.00 N ATOM 109 CA LEU A 8 -6.070 3.253 -10.007 1.00 0.00 C ATOM 110 C LEU A 8 -7.487 2.708 -9.951 1.00 0.00 C ATOM 111 O LEU A 8 -8.131 2.775 -8.906 1.00 0.00 O ATOM 112 CB LEU A 8 -5.081 2.132 -9.664 1.00 0.00 C ATOM 113 CG LEU A 8 -3.717 2.584 -9.134 1.00 0.00 C ATOM 114 CD1 LEU A 8 -2.906 1.386 -8.668 1.00 0.00 C ATOM 115 CD2 LEU A 8 -2.954 3.357 -10.195 1.00 0.00 C ATOM 0 H LEU A 8 -6.036 4.056 -8.080 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.844 3.623 -11.007 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.542 1.482 -8.920 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.921 1.529 -10.558 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.885 3.245 -8.284 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.939 1.724 -8.294 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.443 0.871 -7.872 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.753 0.703 -9.504 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.989 3.667 -9.795 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.798 2.721 -11.067 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.527 4.238 -10.486 1.00 0.00 H new ATOM 127 N TRP A 9 -7.996 2.194 -11.057 1.00 0.00 N ATOM 128 CA TRP A 9 -9.317 1.584 -11.036 1.00 0.00 C ATOM 129 C TRP A 9 -9.352 0.282 -11.821 1.00 0.00 C ATOM 130 O TRP A 9 -8.507 0.032 -12.682 1.00 0.00 O ATOM 131 CB TRP A 9 -10.380 2.555 -11.562 1.00 0.00 C ATOM 132 CG TRP A 9 -10.245 2.909 -13.013 1.00 0.00 C ATOM 133 CD1 TRP A 9 -9.290 3.699 -13.581 1.00 0.00 C ATOM 134 CD2 TRP A 9 -11.113 2.499 -14.077 1.00 0.00 C ATOM 135 NE1 TRP A 9 -9.508 3.806 -14.935 1.00 0.00 N ATOM 136 CE2 TRP A 9 -10.626 3.078 -15.263 1.00 0.00 C ATOM 137 CE3 TRP A 9 -12.260 1.699 -14.137 1.00 0.00 C ATOM 138 CZ2 TRP A 9 -11.249 2.883 -16.495 1.00 0.00 C ATOM 139 CZ3 TRP A 9 -12.870 1.503 -15.360 1.00 0.00 C ATOM 140 CH2 TRP A 9 -12.366 2.092 -16.523 1.00 0.00 C ATOM 0 H TRP A 9 -7.528 2.185 -11.963 1.00 0.00 H new ATOM 0 HA TRP A 9 -9.545 1.350 -9.996 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -11.365 2.117 -11.399 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -10.338 3.471 -10.973 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -8.480 4.172 -13.046 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -8.934 4.339 -15.588 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -12.660 1.244 -13.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -10.864 3.340 -17.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -13.753 0.883 -15.419 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -12.868 1.920 -17.463 1.00 0.00 H new ATOM 151 N ALA A 10 -10.328 -0.543 -11.487 1.00 0.00 N ATOM 152 CA ALA A 10 -10.559 -1.811 -12.159 1.00 0.00 C ATOM 153 C ALA A 10 -12.046 -2.138 -12.108 1.00 0.00 C ATOM 154 O ALA A 10 -12.696 -1.930 -11.085 1.00 0.00 O ATOM 155 CB ALA A 10 -9.746 -2.920 -11.503 1.00 0.00 C ATOM 0 H ALA A 10 -10.989 -0.351 -10.735 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.241 -1.732 -13.199 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.932 -3.862 -12.020 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.685 -2.677 -11.562 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -10.039 -3.016 -10.457 1.00 0.00 H new ATOM 161 N GLN A 11 -12.587 -2.648 -13.201 1.00 0.00 N ATOM 162 CA GLN A 11 -14.025 -2.853 -13.304 1.00 0.00 C ATOM 163 C GLN A 11 -14.383 -4.339 -13.299 1.00 0.00 C ATOM 164 O GLN A 11 -13.763 -5.143 -13.997 1.00 0.00 O ATOM 165 CB GLN A 11 -14.550 -2.184 -14.578 1.00 0.00 C ATOM 166 CG GLN A 11 -16.061 -2.225 -14.721 1.00 0.00 C ATOM 167 CD GLN A 11 -16.538 -1.533 -15.980 1.00 0.00 C ATOM 168 OE1 GLN A 11 -15.913 -0.587 -16.456 1.00 0.00 O ATOM 169 NE2 GLN A 11 -17.650 -1.996 -16.527 1.00 0.00 N ATOM 0 H GLN A 11 -12.057 -2.927 -14.027 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.497 -2.399 -12.433 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -14.222 -1.144 -14.591 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.100 -2.671 -15.443 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -16.395 -3.263 -14.731 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -16.519 -1.751 -13.853 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -18.139 -2.783 -16.101 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -18.019 -1.566 -17.375 1.00 0.00 H new ATOM 178 N ARG A 12 -15.372 -4.696 -12.488 1.00 0.00 N ATOM 179 CA ARG A 12 -15.915 -6.046 -12.483 1.00 0.00 C ATOM 180 C ARG A 12 -17.367 -6.004 -12.959 1.00 0.00 C ATOM 181 O ARG A 12 -17.837 -4.970 -13.428 1.00 0.00 O ATOM 182 CB ARG A 12 -15.827 -6.659 -11.078 1.00 0.00 C ATOM 183 CG ARG A 12 -14.408 -6.795 -10.544 1.00 0.00 C ATOM 184 CD ARG A 12 -13.596 -7.818 -11.328 1.00 0.00 C ATOM 185 NE ARG A 12 -12.255 -7.992 -10.772 1.00 0.00 N ATOM 186 CZ ARG A 12 -11.756 -9.163 -10.368 1.00 0.00 C ATOM 187 NH1 ARG A 12 -12.474 -10.273 -10.483 1.00 0.00 N ATOM 188 NH2 ARG A 12 -10.535 -9.220 -9.860 1.00 0.00 N ATOM 0 H ARG A 12 -15.816 -4.064 -11.822 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.331 -6.671 -13.158 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -16.405 -6.044 -10.389 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -16.293 -7.644 -11.094 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -13.910 -5.826 -10.589 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -14.443 -7.088 -9.495 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -14.117 -8.775 -11.324 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.519 -7.501 -12.368 1.00 0.00 H new ATOM 0 HE ARG A 12 -11.663 -7.166 -10.687 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.412 -10.235 -10.882 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -12.088 -11.165 -10.173 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.977 -8.370 -9.778 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.152 -10.114 -9.551 1.00 0.00 H new ATOM 202 N SER A 13 -18.075 -7.117 -12.831 1.00 0.00 N ATOM 203 CA SER A 13 -19.462 -7.194 -13.286 1.00 0.00 C ATOM 204 C SER A 13 -20.427 -6.772 -12.176 1.00 0.00 C ATOM 205 O SER A 13 -21.535 -6.307 -12.442 1.00 0.00 O ATOM 206 CB SER A 13 -19.783 -8.622 -13.749 1.00 0.00 C ATOM 207 OG SER A 13 -21.089 -8.714 -14.290 1.00 0.00 O ATOM 0 H SER A 13 -17.717 -7.978 -12.418 1.00 0.00 H new ATOM 0 HA SER A 13 -19.586 -6.508 -14.124 1.00 0.00 H new ATOM 0 HB2 SER A 13 -19.055 -8.934 -14.498 1.00 0.00 H new ATOM 0 HB3 SER A 13 -19.688 -9.308 -12.907 1.00 0.00 H new ATOM 0 HG SER A 13 -21.260 -9.635 -14.576 1.00 0.00 H new ATOM 213 N ASP A 14 -19.996 -6.926 -10.931 1.00 0.00 N ATOM 214 CA ASP A 14 -20.866 -6.671 -9.788 1.00 0.00 C ATOM 215 C ASP A 14 -20.518 -5.360 -9.091 1.00 0.00 C ATOM 216 O ASP A 14 -21.396 -4.663 -8.574 1.00 0.00 O ATOM 217 CB ASP A 14 -20.775 -7.827 -8.792 1.00 0.00 C ATOM 218 CG ASP A 14 -21.614 -7.586 -7.555 1.00 0.00 C ATOM 219 OD1 ASP A 14 -22.853 -7.691 -7.651 1.00 0.00 O ATOM 220 OD2 ASP A 14 -21.037 -7.271 -6.496 1.00 0.00 O ATOM 0 H ASP A 14 -19.052 -7.225 -10.686 1.00 0.00 H new ATOM 0 HA ASP A 14 -21.886 -6.589 -10.163 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -21.101 -8.747 -9.276 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -19.735 -7.972 -8.500 1.00 0.00 H new ATOM 225 N LYS A 15 -19.240 -5.021 -9.085 1.00 0.00 N ATOM 226 CA LYS A 15 -18.776 -3.834 -8.387 1.00 0.00 C ATOM 227 C LYS A 15 -17.526 -3.272 -9.049 1.00 0.00 C ATOM 228 O LYS A 15 -16.840 -3.972 -9.798 1.00 0.00 O ATOM 229 CB LYS A 15 -18.503 -4.153 -6.911 1.00 0.00 C ATOM 230 CG LYS A 15 -17.613 -5.369 -6.695 1.00 0.00 C ATOM 231 CD LYS A 15 -17.254 -5.552 -5.227 1.00 0.00 C ATOM 232 CE LYS A 15 -18.484 -5.782 -4.357 1.00 0.00 C ATOM 233 NZ LYS A 15 -19.192 -7.048 -4.694 1.00 0.00 N ATOM 0 H LYS A 15 -18.506 -5.550 -9.555 1.00 0.00 H new ATOM 0 HA LYS A 15 -19.560 -3.078 -8.441 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -18.036 -3.286 -6.443 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -19.454 -4.316 -6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -18.122 -6.261 -7.059 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -16.701 -5.261 -7.282 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -16.575 -6.398 -5.124 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -16.720 -4.670 -4.873 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -18.185 -5.805 -3.309 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -19.170 -4.943 -4.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -19.725 -7.379 -3.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -19.848 -6.879 -5.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -18.498 -7.771 -4.970 1.00 0.00 H new ATOM 247 N VAL A 16 -17.253 -2.007 -8.782 1.00 0.00 N ATOM 248 CA VAL A 16 -16.076 -1.345 -9.320 1.00 0.00 C ATOM 249 C VAL A 16 -15.013 -1.209 -8.234 1.00 0.00 C ATOM 250 O VAL A 16 -15.328 -0.909 -7.080 1.00 0.00 O ATOM 251 CB VAL A 16 -16.433 0.050 -9.879 1.00 0.00 C ATOM 252 CG1 VAL A 16 -15.222 0.710 -10.517 1.00 0.00 C ATOM 253 CG2 VAL A 16 -17.580 -0.041 -10.876 1.00 0.00 C ATOM 0 H VAL A 16 -17.835 -1.413 -8.191 1.00 0.00 H new ATOM 0 HA VAL A 16 -15.686 -1.953 -10.136 1.00 0.00 H new ATOM 0 HB VAL A 16 -16.755 0.670 -9.043 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -15.503 1.690 -10.902 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -14.435 0.824 -9.772 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -14.859 0.089 -11.336 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -17.812 0.954 -11.255 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -17.291 -0.687 -11.705 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -18.459 -0.456 -10.383 1.00 0.00 H new ATOM 263 N TYR A 17 -13.765 -1.452 -8.604 1.00 0.00 N ATOM 264 CA TYR A 17 -12.653 -1.353 -7.672 1.00 0.00 C ATOM 265 C TYR A 17 -11.916 -0.040 -7.873 1.00 0.00 C ATOM 266 O TYR A 17 -11.466 0.268 -8.977 1.00 0.00 O ATOM 267 CB TYR A 17 -11.680 -2.522 -7.859 1.00 0.00 C ATOM 268 CG TYR A 17 -12.188 -3.858 -7.350 1.00 0.00 C ATOM 269 CD1 TYR A 17 -13.503 -4.258 -7.558 1.00 0.00 C ATOM 270 CD2 TYR A 17 -11.341 -4.727 -6.671 1.00 0.00 C ATOM 271 CE1 TYR A 17 -13.959 -5.481 -7.104 1.00 0.00 C ATOM 272 CE2 TYR A 17 -11.792 -5.952 -6.212 1.00 0.00 C ATOM 273 CZ TYR A 17 -13.101 -6.323 -6.432 1.00 0.00 C ATOM 274 OH TYR A 17 -13.555 -7.544 -5.984 1.00 0.00 O ATOM 0 H TYR A 17 -13.496 -1.721 -9.550 1.00 0.00 H new ATOM 0 HA TYR A 17 -13.055 -1.391 -6.660 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -11.448 -2.617 -8.920 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -10.747 -2.285 -7.348 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -14.180 -3.601 -8.084 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.314 -4.441 -6.499 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -14.984 -5.775 -7.275 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -11.122 -6.614 -5.684 1.00 0.00 H new ATOM 0 HH TYR A 17 -12.826 -8.018 -5.531 1.00 0.00 H new ATOM 284 N LEU A 18 -11.810 0.728 -6.807 1.00 0.00 N ATOM 285 CA LEU A 18 -11.068 1.974 -6.831 1.00 0.00 C ATOM 286 C LEU A 18 -9.880 1.863 -5.881 1.00 0.00 C ATOM 287 O LEU A 18 -10.050 1.803 -4.667 1.00 0.00 O ATOM 288 CB LEU A 18 -11.985 3.140 -6.430 1.00 0.00 C ATOM 289 CG LEU A 18 -11.529 4.547 -6.857 1.00 0.00 C ATOM 290 CD1 LEU A 18 -10.326 5.013 -6.053 1.00 0.00 C ATOM 291 CD2 LEU A 18 -11.209 4.572 -8.344 1.00 0.00 C ATOM 0 H LEU A 18 -12.233 0.509 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.699 2.168 -7.838 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.973 2.958 -6.852 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -12.095 3.131 -5.346 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.350 5.235 -6.658 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.032 6.010 -6.382 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.585 5.042 -4.995 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.497 4.322 -6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.888 5.574 -8.630 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.411 3.861 -8.556 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -12.098 4.300 -8.912 1.00 0.00 H new ATOM 303 N THR A 19 -8.686 1.827 -6.438 1.00 0.00 N ATOM 304 CA THR A 19 -7.484 1.676 -5.649 1.00 0.00 C ATOM 305 C THR A 19 -6.738 3.002 -5.561 1.00 0.00 C ATOM 306 O THR A 19 -6.068 3.412 -6.506 1.00 0.00 O ATOM 307 CB THR A 19 -6.552 0.616 -6.267 1.00 0.00 C ATOM 308 OG1 THR A 19 -7.266 -0.608 -6.499 1.00 0.00 O ATOM 309 CG2 THR A 19 -5.361 0.350 -5.360 1.00 0.00 C ATOM 0 H THR A 19 -8.524 1.901 -7.442 1.00 0.00 H new ATOM 0 HA THR A 19 -7.779 1.354 -4.650 1.00 0.00 H new ATOM 0 HB THR A 19 -6.189 1.003 -7.219 1.00 0.00 H new ATOM 0 HG1 THR A 19 -6.631 -1.319 -6.726 1.00 0.00 H new ATOM 0 HG21 THR A 19 -4.717 -0.401 -5.816 1.00 0.00 H new ATOM 0 HG22 THR A 19 -4.798 1.273 -5.218 1.00 0.00 H new ATOM 0 HG23 THR A 19 -5.713 -0.012 -4.394 1.00 0.00 H new ATOM 317 N VAL A 20 -6.862 3.683 -4.438 1.00 0.00 N ATOM 318 CA VAL A 20 -6.156 4.935 -4.255 1.00 0.00 C ATOM 319 C VAL A 20 -4.827 4.682 -3.548 1.00 0.00 C ATOM 320 O VAL A 20 -4.784 4.161 -2.427 1.00 0.00 O ATOM 321 CB VAL A 20 -7.010 5.982 -3.494 1.00 0.00 C ATOM 322 CG1 VAL A 20 -7.431 5.482 -2.125 1.00 0.00 C ATOM 323 CG2 VAL A 20 -6.266 7.307 -3.385 1.00 0.00 C ATOM 0 H VAL A 20 -7.438 3.394 -3.647 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.957 5.357 -5.240 1.00 0.00 H new ATOM 0 HB VAL A 20 -7.920 6.143 -4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -8.027 6.246 -1.626 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -8.024 4.574 -2.236 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.545 5.266 -1.528 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.883 8.027 -2.848 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -5.331 7.156 -2.845 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.051 7.687 -4.384 1.00 0.00 H new ATOM 333 N ALA A 21 -3.741 5.005 -4.235 1.00 0.00 N ATOM 334 CA ALA A 21 -2.406 4.791 -3.701 1.00 0.00 C ATOM 335 C ALA A 21 -2.036 5.900 -2.735 1.00 0.00 C ATOM 336 O ALA A 21 -1.585 6.970 -3.136 1.00 0.00 O ATOM 337 CB ALA A 21 -1.387 4.694 -4.829 1.00 0.00 C ATOM 0 H ALA A 21 -3.760 5.418 -5.167 1.00 0.00 H new ATOM 0 HA ALA A 21 -2.400 3.847 -3.156 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -0.394 4.534 -4.409 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -1.644 3.859 -5.481 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.393 5.619 -5.405 1.00 0.00 H new ATOM 343 N LEU A 22 -2.261 5.637 -1.459 1.00 0.00 N ATOM 344 CA LEU A 22 -1.949 6.587 -0.413 1.00 0.00 C ATOM 345 C LEU A 22 -1.471 5.836 0.824 1.00 0.00 C ATOM 346 O LEU A 22 -2.252 5.139 1.474 1.00 0.00 O ATOM 347 CB LEU A 22 -3.179 7.444 -0.089 1.00 0.00 C ATOM 348 CG LEU A 22 -2.949 8.576 0.914 1.00 0.00 C ATOM 349 CD1 LEU A 22 -1.878 9.531 0.410 1.00 0.00 C ATOM 350 CD2 LEU A 22 -4.247 9.322 1.171 1.00 0.00 C ATOM 0 H LEU A 22 -2.663 4.762 -1.123 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.155 7.253 -0.751 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.554 7.875 -1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.962 6.792 0.299 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.604 8.141 1.852 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.730 10.329 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.943 8.988 0.271 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.193 9.961 -0.541 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.070 10.125 1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.615 9.744 0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.989 8.633 1.575 1.00 0.00 H new ATOM 362 N PRO A 23 -0.175 5.958 1.153 1.00 0.00 N ATOM 363 CA PRO A 23 0.433 5.235 2.275 1.00 0.00 C ATOM 364 C PRO A 23 -0.167 5.626 3.623 1.00 0.00 C ATOM 365 O PRO A 23 -0.290 4.794 4.523 1.00 0.00 O ATOM 366 CB PRO A 23 1.911 5.634 2.210 1.00 0.00 C ATOM 367 CG PRO A 23 1.944 6.898 1.421 1.00 0.00 C ATOM 368 CD PRO A 23 0.804 6.807 0.448 1.00 0.00 C ATOM 0 HA PRO A 23 0.266 4.161 2.194 1.00 0.00 H new ATOM 0 HB2 PRO A 23 2.322 5.783 3.208 1.00 0.00 H new ATOM 0 HB3 PRO A 23 2.507 4.857 1.732 1.00 0.00 H new ATOM 0 HG2 PRO A 23 1.835 7.767 2.070 1.00 0.00 H new ATOM 0 HG3 PRO A 23 2.895 7.008 0.899 1.00 0.00 H new ATOM 0 HD2 PRO A 23 0.392 7.790 0.217 1.00 0.00 H new ATOM 0 HD3 PRO A 23 1.116 6.362 -0.497 1.00 0.00 H new ATOM 376 N ASP A 24 -0.540 6.890 3.757 1.00 0.00 N ATOM 377 CA ASP A 24 -1.115 7.382 5.001 1.00 0.00 C ATOM 378 C ASP A 24 -2.247 8.363 4.731 1.00 0.00 C ATOM 379 O ASP A 24 -2.028 9.464 4.216 1.00 0.00 O ATOM 380 CB ASP A 24 -0.041 8.036 5.867 1.00 0.00 C ATOM 381 CG ASP A 24 -0.582 8.485 7.207 1.00 0.00 C ATOM 382 OD1 ASP A 24 -1.322 7.708 7.846 1.00 0.00 O ATOM 383 OD2 ASP A 24 -0.249 9.603 7.637 1.00 0.00 O ATOM 0 H ASP A 24 -0.455 7.592 3.022 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.527 6.529 5.540 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.775 7.331 6.024 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.376 8.894 5.340 1.00 0.00 H new ATOM 388 N ALA A 25 -3.451 7.959 5.095 1.00 0.00 N ATOM 389 CA ALA A 25 -4.647 8.739 4.823 1.00 0.00 C ATOM 390 C ALA A 25 -5.254 9.271 6.109 1.00 0.00 C ATOM 391 O ALA A 25 -4.970 8.766 7.196 1.00 0.00 O ATOM 392 CB ALA A 25 -5.663 7.892 4.073 1.00 0.00 C ATOM 0 H ALA A 25 -3.628 7.083 5.587 1.00 0.00 H new ATOM 0 HA ALA A 25 -4.366 9.591 4.203 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -6.555 8.485 3.874 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -5.232 7.557 3.129 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.931 7.025 4.677 1.00 0.00 H new ATOM 398 N LYS A 26 -6.092 10.290 5.978 1.00 0.00 N ATOM 399 CA LYS A 26 -6.736 10.908 7.122 1.00 0.00 C ATOM 400 C LYS A 26 -8.153 11.350 6.789 1.00 0.00 C ATOM 401 O LYS A 26 -8.357 12.236 5.956 1.00 0.00 O ATOM 402 CB LYS A 26 -5.919 12.104 7.624 1.00 0.00 C ATOM 403 CG LYS A 26 -4.869 11.716 8.648 1.00 0.00 C ATOM 404 CD LYS A 26 -5.523 11.084 9.863 1.00 0.00 C ATOM 405 CE LYS A 26 -6.305 12.108 10.674 1.00 0.00 C ATOM 406 NZ LYS A 26 -7.302 11.471 11.572 1.00 0.00 N ATOM 0 H LYS A 26 -6.341 10.707 5.081 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.789 10.159 7.912 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.432 12.586 6.776 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.593 12.839 8.064 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.160 11.017 8.204 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -4.302 12.597 8.949 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.192 10.285 9.543 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.759 10.627 10.492 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.612 12.704 11.268 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.815 12.793 9.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -7.399 12.037 12.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.221 11.418 11.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.985 10.512 11.818 1.00 0.00 H new ATOM 420 N ASP A 27 -9.116 10.702 7.445 1.00 0.00 N ATOM 421 CA ASP A 27 -10.533 11.060 7.346 1.00 0.00 C ATOM 422 C ASP A 27 -10.973 11.279 5.905 1.00 0.00 C ATOM 423 O ASP A 27 -11.460 12.353 5.548 1.00 0.00 O ATOM 424 CB ASP A 27 -10.827 12.307 8.185 1.00 0.00 C ATOM 425 CG ASP A 27 -10.731 12.035 9.671 1.00 0.00 C ATOM 426 OD1 ASP A 27 -9.604 12.041 10.215 1.00 0.00 O ATOM 427 OD2 ASP A 27 -11.780 11.808 10.306 1.00 0.00 O ATOM 0 H ASP A 27 -8.935 9.911 8.063 1.00 0.00 H new ATOM 0 HA ASP A 27 -11.106 10.219 7.736 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -10.125 13.097 7.916 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -11.826 12.674 7.949 1.00 0.00 H new ATOM 432 N ILE A 28 -10.791 10.257 5.079 1.00 0.00 N ATOM 433 CA ILE A 28 -11.209 10.326 3.689 1.00 0.00 C ATOM 434 C ILE A 28 -12.726 10.469 3.613 1.00 0.00 C ATOM 435 O ILE A 28 -13.464 9.526 3.894 1.00 0.00 O ATOM 436 CB ILE A 28 -10.767 9.066 2.911 1.00 0.00 C ATOM 437 CG1 ILE A 28 -9.246 8.888 2.985 1.00 0.00 C ATOM 438 CG2 ILE A 28 -11.226 9.148 1.461 1.00 0.00 C ATOM 439 CD1 ILE A 28 -8.755 7.588 2.377 1.00 0.00 C ATOM 0 H ILE A 28 -10.358 9.374 5.348 1.00 0.00 H new ATOM 0 HA ILE A 28 -10.734 11.195 3.233 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.234 8.196 3.373 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -8.766 9.722 2.474 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -8.934 8.932 4.029 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.907 8.253 0.927 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -12.313 9.222 1.427 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -10.787 10.028 0.990 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -7.670 7.532 2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -9.206 6.747 2.903 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -9.035 7.550 1.324 1.00 0.00 H new ATOM 451 N SER A 29 -13.185 11.658 3.256 1.00 0.00 N ATOM 452 CA SER A 29 -14.608 11.923 3.158 1.00 0.00 C ATOM 453 C SER A 29 -15.035 11.932 1.697 1.00 0.00 C ATOM 454 O SER A 29 -14.638 12.806 0.924 1.00 0.00 O ATOM 455 CB SER A 29 -14.932 13.269 3.809 1.00 0.00 C ATOM 456 OG SER A 29 -14.395 13.352 5.123 1.00 0.00 O ATOM 0 H SER A 29 -12.590 12.455 3.029 1.00 0.00 H new ATOM 0 HA SER A 29 -15.154 11.137 3.680 1.00 0.00 H new ATOM 0 HB2 SER A 29 -14.529 14.077 3.198 1.00 0.00 H new ATOM 0 HB3 SER A 29 -16.013 13.406 3.847 1.00 0.00 H new ATOM 0 HG SER A 29 -14.617 14.223 5.513 1.00 0.00 H new ATOM 462 N VAL A 30 -15.846 10.963 1.316 1.00 0.00 N ATOM 463 CA VAL A 30 -16.276 10.857 -0.062 1.00 0.00 C ATOM 464 C VAL A 30 -17.746 11.222 -0.184 1.00 0.00 C ATOM 465 O VAL A 30 -18.615 10.527 0.345 1.00 0.00 O ATOM 466 CB VAL A 30 -16.056 9.432 -0.620 1.00 0.00 C ATOM 467 CG1 VAL A 30 -16.491 9.346 -2.075 1.00 0.00 C ATOM 468 CG2 VAL A 30 -14.603 9.016 -0.475 1.00 0.00 C ATOM 0 H VAL A 30 -16.217 10.244 1.937 1.00 0.00 H new ATOM 0 HA VAL A 30 -15.673 11.552 -0.646 1.00 0.00 H new ATOM 0 HB VAL A 30 -16.671 8.745 -0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -16.326 8.334 -2.445 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -17.550 9.593 -2.153 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -15.909 10.049 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -14.471 8.010 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -13.969 9.711 -1.026 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -14.325 9.028 0.579 1.00 0.00 H new ATOM 478 N LYS A 31 -18.018 12.311 -0.882 1.00 0.00 N ATOM 479 CA LYS A 31 -19.381 12.707 -1.164 1.00 0.00 C ATOM 480 C LYS A 31 -19.677 12.336 -2.603 1.00 0.00 C ATOM 481 O LYS A 31 -19.117 12.936 -3.518 1.00 0.00 O ATOM 482 CB LYS A 31 -19.567 14.212 -0.946 1.00 0.00 C ATOM 483 CG LYS A 31 -19.191 14.677 0.452 1.00 0.00 C ATOM 484 CD LYS A 31 -19.342 16.181 0.584 1.00 0.00 C ATOM 485 CE LYS A 31 -18.867 16.677 1.940 1.00 0.00 C ATOM 486 NZ LYS A 31 -19.701 16.155 3.056 1.00 0.00 N ATOM 0 H LYS A 31 -17.308 12.937 -1.264 1.00 0.00 H new ATOM 0 HA LYS A 31 -20.069 12.197 -0.490 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -18.963 14.753 -1.674 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -20.608 14.472 -1.139 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -19.823 14.179 1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.162 14.391 0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.773 16.674 -0.204 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -20.387 16.456 0.442 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -17.831 16.375 2.092 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -18.887 17.767 1.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -19.393 16.586 3.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -20.699 16.391 2.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.595 15.122 3.115 1.00 0.00 H new ATOM 500 N CYS A 32 -20.494 11.306 -2.787 1.00 0.00 N ATOM 501 CA CYS A 32 -20.751 10.736 -4.106 1.00 0.00 C ATOM 502 C CYS A 32 -22.251 10.674 -4.421 1.00 0.00 C ATOM 503 O CYS A 32 -23.046 10.289 -3.563 1.00 0.00 O ATOM 504 CB CYS A 32 -20.152 9.330 -4.160 1.00 0.00 C ATOM 505 SG CYS A 32 -20.404 8.378 -2.640 1.00 0.00 S ATOM 0 H CYS A 32 -20.996 10.843 -2.030 1.00 0.00 H new ATOM 0 HA CYS A 32 -20.288 11.379 -4.855 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -20.593 8.788 -4.996 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -19.083 9.407 -4.358 1.00 0.00 H new ATOM 0 HG CYS A 32 -19.869 7.201 -2.772 1.00 0.00 H new ATOM 511 N GLU A 33 -22.643 11.053 -5.644 1.00 0.00 N ATOM 512 CA GLU A 33 -23.996 10.805 -6.108 1.00 0.00 C ATOM 513 C GLU A 33 -23.983 9.501 -6.876 1.00 0.00 C ATOM 514 O GLU A 33 -22.919 9.068 -7.318 1.00 0.00 O ATOM 515 CB GLU A 33 -24.470 11.939 -7.026 1.00 0.00 C ATOM 516 CG GLU A 33 -24.818 13.230 -6.309 1.00 0.00 C ATOM 517 CD GLU A 33 -26.239 13.255 -5.793 1.00 0.00 C ATOM 518 OE1 GLU A 33 -26.520 12.597 -4.774 1.00 0.00 O ATOM 519 OE2 GLU A 33 -27.085 13.940 -6.413 1.00 0.00 O ATOM 0 H GLU A 33 -22.042 11.528 -6.318 1.00 0.00 H new ATOM 0 HA GLU A 33 -24.678 10.753 -5.259 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -23.690 12.145 -7.759 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -25.345 11.599 -7.579 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -24.132 13.372 -5.474 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -24.670 14.068 -6.990 1.00 0.00 H new ATOM 526 N PRO A 34 -25.145 8.857 -7.071 1.00 0.00 N ATOM 527 CA PRO A 34 -25.256 7.659 -7.923 1.00 0.00 C ATOM 528 C PRO A 34 -24.920 7.962 -9.388 1.00 0.00 C ATOM 529 O PRO A 34 -25.144 7.139 -10.277 1.00 0.00 O ATOM 530 CB PRO A 34 -26.728 7.248 -7.778 1.00 0.00 C ATOM 531 CG PRO A 34 -27.431 8.465 -7.283 1.00 0.00 C ATOM 532 CD PRO A 34 -26.433 9.217 -6.454 1.00 0.00 C ATOM 0 HA PRO A 34 -24.557 6.878 -7.625 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -27.139 6.917 -8.732 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -26.838 6.419 -7.079 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -27.785 9.075 -8.114 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -28.305 8.196 -6.690 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -26.609 10.292 -6.488 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -26.475 8.920 -5.406 1.00 0.00 H new ATOM 540 N GLN A 35 -24.356 9.146 -9.599 1.00 0.00 N ATOM 541 CA GLN A 35 -24.014 9.656 -10.915 1.00 0.00 C ATOM 542 C GLN A 35 -22.821 10.622 -10.826 1.00 0.00 C ATOM 543 O GLN A 35 -22.527 11.356 -11.773 1.00 0.00 O ATOM 544 CB GLN A 35 -25.229 10.363 -11.513 1.00 0.00 C ATOM 545 CG GLN A 35 -25.779 11.464 -10.619 1.00 0.00 C ATOM 546 CD GLN A 35 -27.127 11.982 -11.079 1.00 0.00 C ATOM 547 OE1 GLN A 35 -27.911 11.254 -11.690 1.00 0.00 O ATOM 548 NE2 GLN A 35 -27.411 13.236 -10.778 1.00 0.00 N ATOM 0 H GLN A 35 -24.120 9.788 -8.843 1.00 0.00 H new ATOM 0 HA GLN A 35 -23.727 8.824 -11.559 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -24.955 10.790 -12.478 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -26.013 9.629 -11.700 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -25.869 11.086 -9.601 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -25.069 12.290 -10.591 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -26.733 13.805 -10.271 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -28.308 13.636 -11.053 1.00 0.00 H new ATOM 557 N GLY A 36 -22.137 10.642 -9.681 1.00 0.00 N ATOM 558 CA GLY A 36 -20.953 11.469 -9.554 1.00 0.00 C ATOM 559 C GLY A 36 -21.066 12.513 -8.461 1.00 0.00 C ATOM 560 O GLY A 36 -22.110 13.122 -8.290 1.00 0.00 O ATOM 0 H GLY A 36 -22.381 10.105 -8.849 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -20.093 10.831 -9.350 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -20.762 11.967 -10.505 1.00 0.00 H new ATOM 564 N LEU A 37 -20.035 12.620 -7.643 1.00 0.00 N ATOM 565 CA LEU A 37 -19.900 13.724 -6.695 1.00 0.00 C ATOM 566 C LEU A 37 -18.433 13.908 -6.298 1.00 0.00 C ATOM 567 O LEU A 37 -17.558 13.181 -6.776 1.00 0.00 O ATOM 568 CB LEU A 37 -20.817 13.603 -5.485 1.00 0.00 C ATOM 569 CG LEU A 37 -21.920 14.665 -5.372 1.00 0.00 C ATOM 570 CD1 LEU A 37 -22.603 14.572 -4.015 1.00 0.00 C ATOM 571 CD2 LEU A 37 -21.363 16.064 -5.593 1.00 0.00 C ATOM 0 H LEU A 37 -19.267 11.949 -7.613 1.00 0.00 H new ATOM 0 HA LEU A 37 -20.233 14.627 -7.207 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -21.287 12.620 -5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -20.205 13.645 -4.584 1.00 0.00 H new ATOM 0 HG LEU A 37 -22.657 14.472 -6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -23.383 15.330 -3.948 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -23.047 13.583 -3.898 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -21.869 14.736 -3.226 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -22.168 16.794 -5.507 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -20.600 16.275 -4.843 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -20.921 16.127 -6.588 1.00 0.00 H new ATOM 583 N PHE A 38 -18.163 14.880 -5.433 1.00 0.00 N ATOM 584 CA PHE A 38 -16.791 15.301 -5.153 1.00 0.00 C ATOM 585 C PHE A 38 -16.319 14.766 -3.811 1.00 0.00 C ATOM 586 O PHE A 38 -17.102 14.544 -2.891 1.00 0.00 O ATOM 587 CB PHE A 38 -16.661 16.831 -5.196 1.00 0.00 C ATOM 588 CG PHE A 38 -17.334 17.547 -4.053 1.00 0.00 C ATOM 589 CD1 PHE A 38 -18.699 17.792 -4.074 1.00 0.00 C ATOM 590 CD2 PHE A 38 -16.598 17.981 -2.958 1.00 0.00 C ATOM 591 CE1 PHE A 38 -19.315 18.450 -3.030 1.00 0.00 C ATOM 592 CE2 PHE A 38 -17.211 18.640 -1.909 1.00 0.00 C ATOM 593 CZ PHE A 38 -18.573 18.875 -1.945 1.00 0.00 C ATOM 0 H PHE A 38 -18.875 15.392 -4.913 1.00 0.00 H new ATOM 0 HA PHE A 38 -16.153 14.883 -5.932 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -15.603 17.093 -5.200 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -17.083 17.193 -6.134 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -19.287 17.463 -4.918 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -15.534 17.801 -2.926 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -20.379 18.633 -3.061 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -16.627 18.971 -1.063 1.00 0.00 H new ATOM 0 HZ PHE A 38 -19.056 19.389 -1.127 1.00 0.00 H new ATOM 603 N SER A 39 -15.025 14.577 -3.703 1.00 0.00 N ATOM 604 CA SER A 39 -14.454 13.884 -2.577 1.00 0.00 C ATOM 605 C SER A 39 -13.325 14.696 -1.939 1.00 0.00 C ATOM 606 O SER A 39 -12.521 15.317 -2.639 1.00 0.00 O ATOM 607 CB SER A 39 -13.948 12.538 -3.071 1.00 0.00 C ATOM 608 OG SER A 39 -14.942 11.876 -3.835 1.00 0.00 O ATOM 0 H SER A 39 -14.343 14.898 -4.390 1.00 0.00 H new ATOM 0 HA SER A 39 -15.209 13.742 -1.804 1.00 0.00 H new ATOM 0 HB2 SER A 39 -13.053 12.681 -3.676 1.00 0.00 H new ATOM 0 HB3 SER A 39 -13.663 11.918 -2.221 1.00 0.00 H new ATOM 0 HG SER A 39 -14.596 11.013 -4.145 1.00 0.00 H new ATOM 614 N PHE A 40 -13.275 14.684 -0.614 1.00 0.00 N ATOM 615 CA PHE A 40 -12.283 15.445 0.136 1.00 0.00 C ATOM 616 C PHE A 40 -11.567 14.553 1.144 1.00 0.00 C ATOM 617 O PHE A 40 -12.198 13.927 1.993 1.00 0.00 O ATOM 618 CB PHE A 40 -12.952 16.625 0.853 1.00 0.00 C ATOM 619 CG PHE A 40 -12.097 17.259 1.917 1.00 0.00 C ATOM 620 CD1 PHE A 40 -10.864 17.807 1.604 1.00 0.00 C ATOM 621 CD2 PHE A 40 -12.531 17.305 3.233 1.00 0.00 C ATOM 622 CE1 PHE A 40 -10.081 18.386 2.582 1.00 0.00 C ATOM 623 CE2 PHE A 40 -11.752 17.882 4.216 1.00 0.00 C ATOM 624 CZ PHE A 40 -10.525 18.421 3.890 1.00 0.00 C ATOM 0 H PHE A 40 -13.918 14.149 -0.030 1.00 0.00 H new ATOM 0 HA PHE A 40 -11.544 15.831 -0.566 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -13.217 17.382 0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -13.882 16.282 1.306 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.511 17.781 0.583 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -13.491 16.884 3.493 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -9.122 18.811 2.325 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -12.102 17.911 5.237 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.911 18.870 4.657 1.00 0.00 H new ATOM 634 N SER A 41 -10.252 14.492 1.041 1.00 0.00 N ATOM 635 CA SER A 41 -9.460 13.687 1.947 1.00 0.00 C ATOM 636 C SER A 41 -8.302 14.500 2.513 1.00 0.00 C ATOM 637 O SER A 41 -7.881 15.494 1.925 1.00 0.00 O ATOM 638 CB SER A 41 -8.930 12.448 1.222 1.00 0.00 C ATOM 639 OG SER A 41 -8.141 11.641 2.080 1.00 0.00 O ATOM 0 H SER A 41 -9.710 14.993 0.336 1.00 0.00 H new ATOM 0 HA SER A 41 -10.095 13.369 2.774 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.767 11.864 0.839 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.336 12.755 0.362 1.00 0.00 H new ATOM 0 HG SER A 41 -7.558 11.065 1.543 1.00 0.00 H new ATOM 645 N ALA A 42 -7.794 14.086 3.658 1.00 0.00 N ATOM 646 CA ALA A 42 -6.596 14.688 4.203 1.00 0.00 C ATOM 647 C ALA A 42 -5.433 13.718 4.064 1.00 0.00 C ATOM 648 O ALA A 42 -5.611 12.503 4.171 1.00 0.00 O ATOM 649 CB ALA A 42 -6.802 15.081 5.657 1.00 0.00 C ATOM 0 H ALA A 42 -8.192 13.338 4.226 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.369 15.596 3.645 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.888 15.531 6.045 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -7.619 15.799 5.728 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -7.047 14.195 6.242 1.00 0.00 H new ATOM 655 N LEU A 43 -4.258 14.249 3.785 1.00 0.00 N ATOM 656 CA LEU A 43 -3.061 13.442 3.695 1.00 0.00 C ATOM 657 C LEU A 43 -2.319 13.494 5.020 1.00 0.00 C ATOM 658 O LEU A 43 -1.836 14.553 5.424 1.00 0.00 O ATOM 659 CB LEU A 43 -2.149 13.936 2.574 1.00 0.00 C ATOM 660 CG LEU A 43 -2.822 14.121 1.213 1.00 0.00 C ATOM 661 CD1 LEU A 43 -1.818 14.619 0.184 1.00 0.00 C ATOM 662 CD2 LEU A 43 -3.452 12.820 0.749 1.00 0.00 C ATOM 0 H LEU A 43 -4.109 15.244 3.616 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.350 12.415 3.471 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.713 14.888 2.877 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.326 13.230 2.460 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.609 14.868 1.319 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.315 14.745 -0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.408 15.576 0.509 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.010 13.894 0.083 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.926 12.971 -0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.682 12.054 0.661 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.201 12.500 1.473 1.00 0.00 H new ATOM 674 N GLY A 44 -2.218 12.355 5.675 1.00 0.00 N ATOM 675 CA GLY A 44 -1.706 12.314 7.033 1.00 0.00 C ATOM 676 C GLY A 44 -0.253 12.739 7.143 1.00 0.00 C ATOM 677 O GLY A 44 0.078 13.636 7.918 1.00 0.00 O ATOM 0 H GLY A 44 -2.482 11.447 5.292 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.315 12.963 7.663 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.811 11.301 7.423 1.00 0.00 H new ATOM 681 N ALA A 45 0.602 12.105 6.345 1.00 0.00 N ATOM 682 CA ALA A 45 2.052 12.293 6.429 1.00 0.00 C ATOM 683 C ALA A 45 2.465 13.766 6.391 1.00 0.00 C ATOM 684 O ALA A 45 3.323 14.197 7.160 1.00 0.00 O ATOM 685 CB ALA A 45 2.738 11.531 5.305 1.00 0.00 C ATOM 0 H ALA A 45 0.312 11.447 5.622 1.00 0.00 H new ATOM 0 HA ALA A 45 2.369 11.901 7.395 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.816 11.675 5.373 1.00 0.00 H new ATOM 0 HB2 ALA A 45 2.507 10.469 5.392 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.382 11.902 4.344 1.00 0.00 H new ATOM 691 N GLN A 46 1.852 14.536 5.506 1.00 0.00 N ATOM 692 CA GLN A 46 2.247 15.926 5.324 1.00 0.00 C ATOM 693 C GLN A 46 1.287 16.885 6.015 1.00 0.00 C ATOM 694 O GLN A 46 1.585 18.069 6.152 1.00 0.00 O ATOM 695 CB GLN A 46 2.312 16.276 3.838 1.00 0.00 C ATOM 696 CG GLN A 46 3.386 15.527 3.072 1.00 0.00 C ATOM 697 CD GLN A 46 3.406 15.894 1.601 1.00 0.00 C ATOM 698 OE1 GLN A 46 2.375 16.215 1.014 1.00 0.00 O ATOM 699 NE2 GLN A 46 4.583 15.868 0.998 1.00 0.00 N ATOM 0 H GLN A 46 1.086 14.227 4.907 1.00 0.00 H new ATOM 0 HA GLN A 46 3.233 16.036 5.776 1.00 0.00 H new ATOM 0 HB2 GLN A 46 1.344 16.066 3.384 1.00 0.00 H new ATOM 0 HB3 GLN A 46 2.487 17.347 3.735 1.00 0.00 H new ATOM 0 HG2 GLN A 46 4.360 15.743 3.511 1.00 0.00 H new ATOM 0 HG3 GLN A 46 3.221 14.454 3.174 1.00 0.00 H new ATOM 0 HE21 GLN A 46 5.417 15.596 1.519 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.657 16.120 0.012 1.00 0.00 H new ATOM 708 N GLY A 47 0.141 16.379 6.450 1.00 0.00 N ATOM 709 CA GLY A 47 -0.915 17.262 6.906 1.00 0.00 C ATOM 710 C GLY A 47 -1.478 18.051 5.742 1.00 0.00 C ATOM 711 O GLY A 47 -2.020 19.142 5.904 1.00 0.00 O ATOM 0 H GLY A 47 -0.076 15.383 6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.707 16.680 7.377 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.527 17.944 7.663 1.00 0.00 H new ATOM 715 N GLU A 48 -1.348 17.460 4.564 1.00 0.00 N ATOM 716 CA GLU A 48 -1.709 18.100 3.312 1.00 0.00 C ATOM 717 C GLU A 48 -3.154 17.768 2.965 1.00 0.00 C ATOM 718 O GLU A 48 -3.729 16.845 3.526 1.00 0.00 O ATOM 719 CB GLU A 48 -0.757 17.625 2.209 1.00 0.00 C ATOM 720 CG GLU A 48 -0.955 18.313 0.871 1.00 0.00 C ATOM 721 CD GLU A 48 -0.788 19.815 0.957 1.00 0.00 C ATOM 722 OE1 GLU A 48 -1.781 20.506 1.252 1.00 0.00 O ATOM 723 OE2 GLU A 48 0.337 20.305 0.732 1.00 0.00 O ATOM 0 H GLU A 48 -0.985 16.513 4.451 1.00 0.00 H new ATOM 0 HA GLU A 48 -1.621 19.182 3.407 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.270 17.786 2.538 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.884 16.551 2.074 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.241 17.913 0.152 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.951 18.083 0.493 1.00 0.00 H new ATOM 730 N ARG A 49 -3.748 18.535 2.074 1.00 0.00 N ATOM 731 CA ARG A 49 -5.135 18.306 1.690 1.00 0.00 C ATOM 732 C ARG A 49 -5.239 17.700 0.291 1.00 0.00 C ATOM 733 O ARG A 49 -4.596 18.156 -0.655 1.00 0.00 O ATOM 734 CB ARG A 49 -5.919 19.626 1.777 1.00 0.00 C ATOM 735 CG ARG A 49 -7.211 19.656 0.969 1.00 0.00 C ATOM 736 CD ARG A 49 -7.931 20.988 1.129 1.00 0.00 C ATOM 737 NE ARG A 49 -8.936 21.208 0.086 1.00 0.00 N ATOM 738 CZ ARG A 49 -10.110 21.809 0.286 1.00 0.00 C ATOM 739 NH1 ARG A 49 -10.455 22.216 1.501 1.00 0.00 N ATOM 740 NH2 ARG A 49 -10.936 22.006 -0.736 1.00 0.00 N ATOM 0 H ARG A 49 -3.299 19.320 1.602 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.570 17.586 2.383 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -6.156 19.823 2.822 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -5.276 20.438 1.437 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.988 19.485 -0.084 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -7.864 18.846 1.293 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -8.412 21.023 2.106 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -7.202 21.798 1.104 1.00 0.00 H new ATOM 0 HE ARG A 49 -8.724 20.880 -0.856 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -9.821 22.070 2.287 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -11.354 22.675 1.649 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -10.672 21.698 -1.672 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -11.834 22.465 -0.585 1.00 0.00 H new ATOM 754 N PHE A 50 -6.058 16.668 0.181 1.00 0.00 N ATOM 755 CA PHE A 50 -6.323 16.015 -1.089 1.00 0.00 C ATOM 756 C PHE A 50 -7.783 16.227 -1.467 1.00 0.00 C ATOM 757 O PHE A 50 -8.676 16.100 -0.629 1.00 0.00 O ATOM 758 CB PHE A 50 -5.992 14.520 -0.958 1.00 0.00 C ATOM 759 CG PHE A 50 -6.546 13.621 -2.038 1.00 0.00 C ATOM 760 CD1 PHE A 50 -6.447 13.957 -3.377 1.00 0.00 C ATOM 761 CD2 PHE A 50 -7.151 12.422 -1.698 1.00 0.00 C ATOM 762 CE1 PHE A 50 -6.944 13.116 -4.356 1.00 0.00 C ATOM 763 CE2 PHE A 50 -7.650 11.579 -2.674 1.00 0.00 C ATOM 764 CZ PHE A 50 -7.545 11.927 -4.002 1.00 0.00 C ATOM 0 H PHE A 50 -6.558 16.259 0.970 1.00 0.00 H new ATOM 0 HA PHE A 50 -5.702 16.440 -1.877 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -4.908 14.409 -0.941 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -6.363 14.169 0.005 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -5.976 14.887 -3.661 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -7.234 12.142 -0.658 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -6.861 13.391 -5.397 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -8.122 10.648 -2.395 1.00 0.00 H new ATOM 0 HZ PHE A 50 -7.933 11.269 -4.766 1.00 0.00 H new ATOM 774 N GLU A 51 -8.026 16.540 -2.724 1.00 0.00 N ATOM 775 CA GLU A 51 -9.383 16.777 -3.181 1.00 0.00 C ATOM 776 C GLU A 51 -9.523 16.471 -4.661 1.00 0.00 C ATOM 777 O GLU A 51 -8.640 16.784 -5.465 1.00 0.00 O ATOM 778 CB GLU A 51 -9.801 18.219 -2.883 1.00 0.00 C ATOM 779 CG GLU A 51 -8.928 19.268 -3.554 1.00 0.00 C ATOM 780 CD GLU A 51 -9.267 20.671 -3.105 1.00 0.00 C ATOM 781 OE1 GLU A 51 -10.421 21.100 -3.287 1.00 0.00 O ATOM 782 OE2 GLU A 51 -8.382 21.355 -2.553 1.00 0.00 O ATOM 0 H GLU A 51 -7.309 16.636 -3.443 1.00 0.00 H new ATOM 0 HA GLU A 51 -10.047 16.104 -2.638 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.833 18.361 -3.204 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.778 18.378 -1.805 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -7.881 19.061 -3.333 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.045 19.197 -4.635 1.00 0.00 H new ATOM 789 N PHE A 52 -10.633 15.849 -5.011 1.00 0.00 N ATOM 790 CA PHE A 52 -10.919 15.505 -6.390 1.00 0.00 C ATOM 791 C PHE A 52 -12.413 15.278 -6.552 1.00 0.00 C ATOM 792 O PHE A 52 -13.159 15.319 -5.575 1.00 0.00 O ATOM 793 CB PHE A 52 -10.130 14.260 -6.827 1.00 0.00 C ATOM 794 CG PHE A 52 -10.610 12.967 -6.222 1.00 0.00 C ATOM 795 CD1 PHE A 52 -10.563 12.757 -4.855 1.00 0.00 C ATOM 796 CD2 PHE A 52 -11.091 11.955 -7.033 1.00 0.00 C ATOM 797 CE1 PHE A 52 -10.987 11.564 -4.304 1.00 0.00 C ATOM 798 CE2 PHE A 52 -11.520 10.760 -6.490 1.00 0.00 C ATOM 799 CZ PHE A 52 -11.468 10.564 -5.125 1.00 0.00 C ATOM 0 H PHE A 52 -11.358 15.569 -4.351 1.00 0.00 H new ATOM 0 HA PHE A 52 -10.607 16.330 -7.030 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -10.179 14.178 -7.913 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -9.081 14.401 -6.565 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -10.189 13.538 -4.209 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -11.131 12.101 -8.102 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -10.942 11.414 -3.235 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -11.896 9.979 -7.134 1.00 0.00 H new ATOM 0 HZ PHE A 52 -11.803 9.630 -4.700 1.00 0.00 H new ATOM 809 N SER A 53 -12.854 15.050 -7.769 1.00 0.00 N ATOM 810 CA SER A 53 -14.265 14.852 -8.026 1.00 0.00 C ATOM 811 C SER A 53 -14.474 13.725 -9.029 1.00 0.00 C ATOM 812 O SER A 53 -13.869 13.719 -10.100 1.00 0.00 O ATOM 813 CB SER A 53 -14.874 16.158 -8.543 1.00 0.00 C ATOM 814 OG SER A 53 -14.026 16.769 -9.512 1.00 0.00 O ATOM 0 H SER A 53 -12.258 14.997 -8.595 1.00 0.00 H new ATOM 0 HA SER A 53 -14.763 14.569 -7.099 1.00 0.00 H new ATOM 0 HB2 SER A 53 -15.851 15.958 -8.984 1.00 0.00 H new ATOM 0 HB3 SER A 53 -15.034 16.843 -7.711 1.00 0.00 H new ATOM 0 HG SER A 53 -13.633 16.078 -10.085 1.00 0.00 H new ATOM 820 N LEU A 54 -15.318 12.769 -8.672 1.00 0.00 N ATOM 821 CA LEU A 54 -15.619 11.663 -9.561 1.00 0.00 C ATOM 822 C LEU A 54 -16.952 11.881 -10.250 1.00 0.00 C ATOM 823 O LEU A 54 -18.009 11.614 -9.679 1.00 0.00 O ATOM 824 CB LEU A 54 -15.639 10.332 -8.804 1.00 0.00 C ATOM 825 CG LEU A 54 -14.279 9.842 -8.310 1.00 0.00 C ATOM 826 CD1 LEU A 54 -14.435 8.549 -7.526 1.00 0.00 C ATOM 827 CD2 LEU A 54 -13.329 9.639 -9.482 1.00 0.00 C ATOM 0 H LEU A 54 -15.804 12.739 -7.776 1.00 0.00 H new ATOM 0 HA LEU A 54 -14.831 11.620 -10.313 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -16.305 10.430 -7.947 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -16.067 9.569 -9.454 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.857 10.600 -7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.457 8.213 -7.181 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -15.084 8.720 -6.667 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -14.876 7.786 -8.167 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -12.365 9.290 -9.113 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -13.746 8.898 -10.164 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.195 10.583 -10.010 1.00 0.00 H new ATOM 839 N GLU A 55 -16.891 12.408 -11.461 1.00 0.00 N ATOM 840 CA GLU A 55 -18.065 12.530 -12.304 1.00 0.00 C ATOM 841 C GLU A 55 -18.356 11.168 -12.912 1.00 0.00 C ATOM 842 O GLU A 55 -17.499 10.592 -13.578 1.00 0.00 O ATOM 843 CB GLU A 55 -17.821 13.568 -13.399 1.00 0.00 C ATOM 844 CG GLU A 55 -17.377 14.919 -12.864 1.00 0.00 C ATOM 845 CD GLU A 55 -17.011 15.894 -13.964 1.00 0.00 C ATOM 846 OE1 GLU A 55 -15.850 15.867 -14.428 1.00 0.00 O ATOM 847 OE2 GLU A 55 -17.877 16.698 -14.360 1.00 0.00 O ATOM 0 H GLU A 55 -16.032 12.761 -11.884 1.00 0.00 H new ATOM 0 HA GLU A 55 -18.920 12.861 -11.715 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.062 13.190 -14.084 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -18.736 13.698 -13.977 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -18.176 15.345 -12.258 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.518 14.780 -12.207 1.00 0.00 H new ATOM 854 N LEU A 56 -19.544 10.643 -12.685 1.00 0.00 N ATOM 855 CA LEU A 56 -19.816 9.259 -13.029 1.00 0.00 C ATOM 856 C LEU A 56 -20.923 9.143 -14.070 1.00 0.00 C ATOM 857 O LEU A 56 -22.046 9.589 -13.862 1.00 0.00 O ATOM 858 CB LEU A 56 -20.156 8.477 -11.760 1.00 0.00 C ATOM 859 CG LEU A 56 -19.050 8.491 -10.698 1.00 0.00 C ATOM 860 CD1 LEU A 56 -19.559 7.942 -9.379 1.00 0.00 C ATOM 861 CD2 LEU A 56 -17.847 7.690 -11.175 1.00 0.00 C ATOM 0 H LEU A 56 -20.328 11.145 -12.269 1.00 0.00 H new ATOM 0 HA LEU A 56 -18.921 8.829 -13.480 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -21.067 8.889 -11.326 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -20.372 7.443 -12.030 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.743 9.525 -10.541 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -18.756 7.962 -8.642 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -20.390 8.553 -9.027 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -19.897 6.915 -9.519 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.071 7.709 -10.410 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -18.147 6.659 -11.361 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -17.461 8.127 -12.096 1.00 0.00 H new ATOM 873 N TYR A 57 -20.575 8.555 -15.206 1.00 0.00 N ATOM 874 CA TYR A 57 -21.510 8.384 -16.310 1.00 0.00 C ATOM 875 C TYR A 57 -22.445 7.197 -16.060 1.00 0.00 C ATOM 876 O TYR A 57 -23.540 7.125 -16.618 1.00 0.00 O ATOM 877 CB TYR A 57 -20.741 8.192 -17.626 1.00 0.00 C ATOM 878 CG TYR A 57 -21.631 8.016 -18.836 1.00 0.00 C ATOM 879 CD1 TYR A 57 -22.297 9.099 -19.394 1.00 0.00 C ATOM 880 CD2 TYR A 57 -21.806 6.766 -19.417 1.00 0.00 C ATOM 881 CE1 TYR A 57 -23.116 8.941 -20.494 1.00 0.00 C ATOM 882 CE2 TYR A 57 -22.622 6.599 -20.519 1.00 0.00 C ATOM 883 CZ TYR A 57 -23.274 7.691 -21.054 1.00 0.00 C ATOM 884 OH TYR A 57 -24.101 7.534 -22.143 1.00 0.00 O ATOM 0 H TYR A 57 -19.642 8.185 -15.388 1.00 0.00 H new ATOM 0 HA TYR A 57 -22.121 9.283 -16.384 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -20.093 9.054 -17.786 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -20.094 7.320 -17.533 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -22.172 10.080 -18.961 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -21.295 5.911 -19.000 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -23.631 9.793 -20.914 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -22.749 5.621 -20.959 1.00 0.00 H new ATOM 0 HH TYR A 57 -24.103 6.594 -22.419 1.00 0.00 H new ATOM 894 N GLY A 58 -22.009 6.276 -15.211 1.00 0.00 N ATOM 895 CA GLY A 58 -22.770 5.066 -14.973 1.00 0.00 C ATOM 896 C GLY A 58 -23.681 5.175 -13.766 1.00 0.00 C ATOM 897 O GLY A 58 -23.681 6.187 -13.067 1.00 0.00 O ATOM 0 H GLY A 58 -21.140 6.346 -14.682 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -23.368 4.839 -15.855 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -22.083 4.232 -14.830 1.00 0.00 H new ATOM 901 N LYS A 59 -24.456 4.126 -13.519 1.00 0.00 N ATOM 902 CA LYS A 59 -25.368 4.097 -12.389 1.00 0.00 C ATOM 903 C LYS A 59 -24.794 3.259 -11.251 1.00 0.00 C ATOM 904 O LYS A 59 -24.785 2.026 -11.311 1.00 0.00 O ATOM 905 CB LYS A 59 -26.724 3.536 -12.814 1.00 0.00 C ATOM 906 CG LYS A 59 -27.864 4.525 -12.658 1.00 0.00 C ATOM 907 CD LYS A 59 -28.010 4.969 -11.214 1.00 0.00 C ATOM 908 CE LYS A 59 -29.236 5.840 -11.013 1.00 0.00 C ATOM 909 NZ LYS A 59 -29.434 6.179 -9.580 1.00 0.00 N ATOM 0 H LYS A 59 -24.469 3.282 -14.091 1.00 0.00 H new ATOM 0 HA LYS A 59 -25.501 5.119 -12.035 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -26.667 3.220 -13.856 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -26.942 2.646 -12.223 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -27.685 5.393 -13.292 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -28.794 4.069 -12.997 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -28.077 4.093 -10.569 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -27.119 5.520 -10.911 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -29.132 6.756 -11.594 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -30.118 5.322 -11.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -30.449 6.155 -9.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -28.931 5.488 -8.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -29.061 7.132 -9.394 1.00 0.00 H new ATOM 923 N ILE A 60 -24.324 3.934 -10.218 1.00 0.00 N ATOM 924 CA ILE A 60 -23.690 3.265 -9.087 1.00 0.00 C ATOM 925 C ILE A 60 -24.457 3.515 -7.796 1.00 0.00 C ATOM 926 O ILE A 60 -25.124 4.536 -7.644 1.00 0.00 O ATOM 927 CB ILE A 60 -22.215 3.701 -8.887 1.00 0.00 C ATOM 928 CG1 ILE A 60 -22.058 5.235 -8.962 1.00 0.00 C ATOM 929 CG2 ILE A 60 -21.316 3.012 -9.906 1.00 0.00 C ATOM 930 CD1 ILE A 60 -21.985 5.785 -10.373 1.00 0.00 C ATOM 0 H ILE A 60 -24.368 4.950 -10.135 1.00 0.00 H new ATOM 0 HA ILE A 60 -23.705 2.201 -9.324 1.00 0.00 H new ATOM 0 HB ILE A 60 -21.909 3.393 -7.887 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -22.898 5.700 -8.446 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -21.154 5.523 -8.425 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -20.284 3.328 -9.753 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -21.387 1.931 -9.782 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -21.633 3.283 -10.913 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -21.875 6.869 -10.336 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -21.128 5.351 -10.889 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -22.899 5.531 -10.910 1.00 0.00 H new ATOM 942 N MET A 61 -24.356 2.574 -6.868 1.00 0.00 N ATOM 943 CA MET A 61 -25.020 2.692 -5.580 1.00 0.00 C ATOM 944 C MET A 61 -24.048 3.257 -4.550 1.00 0.00 C ATOM 945 O MET A 61 -23.220 2.538 -3.996 1.00 0.00 O ATOM 946 CB MET A 61 -25.555 1.331 -5.127 1.00 0.00 C ATOM 947 CG MET A 61 -26.415 1.386 -3.874 1.00 0.00 C ATOM 948 SD MET A 61 -27.886 2.409 -4.083 1.00 0.00 S ATOM 949 CE MET A 61 -28.749 2.073 -2.550 1.00 0.00 C ATOM 0 H MET A 61 -23.817 1.716 -6.985 1.00 0.00 H new ATOM 0 HA MET A 61 -25.866 3.373 -5.677 1.00 0.00 H new ATOM 0 HB2 MET A 61 -26.140 0.895 -5.937 1.00 0.00 H new ATOM 0 HB3 MET A 61 -24.712 0.663 -4.947 1.00 0.00 H new ATOM 0 HG2 MET A 61 -26.717 0.375 -3.601 1.00 0.00 H new ATOM 0 HG3 MET A 61 -25.821 1.776 -3.047 1.00 0.00 H new ATOM 0 HE1 MET A 61 -29.757 1.720 -2.770 1.00 0.00 H new ATOM 0 HE2 MET A 61 -28.211 1.309 -1.990 1.00 0.00 H new ATOM 0 HE3 MET A 61 -28.805 2.986 -1.957 1.00 0.00 H new ATOM 959 N THR A 62 -24.151 4.552 -4.307 1.00 0.00 N ATOM 960 CA THR A 62 -23.214 5.252 -3.443 1.00 0.00 C ATOM 961 C THR A 62 -23.617 5.174 -1.971 1.00 0.00 C ATOM 962 O THR A 62 -23.018 5.835 -1.120 1.00 0.00 O ATOM 963 CB THR A 62 -23.104 6.719 -3.873 1.00 0.00 C ATOM 964 OG1 THR A 62 -24.414 7.291 -4.006 1.00 0.00 O ATOM 965 CG2 THR A 62 -22.363 6.826 -5.195 1.00 0.00 C ATOM 0 H THR A 62 -24.881 5.146 -4.700 1.00 0.00 H new ATOM 0 HA THR A 62 -22.246 4.761 -3.545 1.00 0.00 H new ATOM 0 HB THR A 62 -22.549 7.265 -3.110 1.00 0.00 H new ATOM 0 HG1 THR A 62 -24.335 8.229 -4.279 1.00 0.00 H new ATOM 0 HG21 THR A 62 -22.292 7.873 -5.489 1.00 0.00 H new ATOM 0 HG22 THR A 62 -21.361 6.411 -5.085 1.00 0.00 H new ATOM 0 HG23 THR A 62 -22.904 6.270 -5.961 1.00 0.00 H new ATOM 973 N GLU A 63 -24.620 4.352 -1.671 1.00 0.00 N ATOM 974 CA GLU A 63 -25.099 4.203 -0.304 1.00 0.00 C ATOM 975 C GLU A 63 -24.165 3.296 0.498 1.00 0.00 C ATOM 976 O GLU A 63 -23.375 3.774 1.315 1.00 0.00 O ATOM 977 CB GLU A 63 -26.525 3.648 -0.290 1.00 0.00 C ATOM 978 CG GLU A 63 -27.137 3.566 1.101 1.00 0.00 C ATOM 979 CD GLU A 63 -27.113 4.897 1.827 1.00 0.00 C ATOM 980 OE1 GLU A 63 -27.811 5.835 1.385 1.00 0.00 O ATOM 981 OE2 GLU A 63 -26.396 5.015 2.843 1.00 0.00 O ATOM 0 H GLU A 63 -25.114 3.781 -2.357 1.00 0.00 H new ATOM 0 HA GLU A 63 -25.108 5.188 0.163 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -27.156 4.277 -0.918 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -26.522 2.653 -0.735 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -28.167 3.218 1.021 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -26.595 2.825 1.689 1.00 0.00 H new ATOM 988 N TYR A 64 -24.238 1.992 0.256 1.00 0.00 N ATOM 989 CA TYR A 64 -23.370 1.058 0.950 1.00 0.00 C ATOM 990 C TYR A 64 -22.085 0.864 0.160 1.00 0.00 C ATOM 991 O TYR A 64 -22.100 0.458 -1.002 1.00 0.00 O ATOM 992 CB TYR A 64 -24.077 -0.279 1.237 1.00 0.00 C ATOM 993 CG TYR A 64 -24.478 -1.090 0.022 1.00 0.00 C ATOM 994 CD1 TYR A 64 -25.604 -0.766 -0.725 1.00 0.00 C ATOM 995 CD2 TYR A 64 -23.740 -2.204 -0.358 1.00 0.00 C ATOM 996 CE1 TYR A 64 -25.983 -1.529 -1.813 1.00 0.00 C ATOM 997 CE2 TYR A 64 -24.106 -2.969 -1.448 1.00 0.00 C ATOM 998 CZ TYR A 64 -25.230 -2.629 -2.172 1.00 0.00 C ATOM 999 OH TYR A 64 -25.606 -3.397 -3.257 1.00 0.00 O ATOM 0 H TYR A 64 -24.883 1.564 -0.409 1.00 0.00 H new ATOM 0 HA TYR A 64 -23.116 1.481 1.922 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -23.420 -0.889 1.856 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -24.972 -0.076 1.825 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -26.193 0.097 -0.451 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -22.863 -2.477 0.210 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -26.864 -1.266 -2.380 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -23.516 -3.828 -1.732 1.00 0.00 H new ATOM 0 HH TYR A 64 -24.968 -4.132 -3.374 1.00 0.00 H new ATOM 1009 N ARG A 65 -20.981 1.200 0.798 1.00 0.00 N ATOM 1010 CA ARG A 65 -19.675 1.191 0.159 1.00 0.00 C ATOM 1011 C ARG A 65 -18.660 0.497 1.054 1.00 0.00 C ATOM 1012 O ARG A 65 -18.924 0.261 2.234 1.00 0.00 O ATOM 1013 CB ARG A 65 -19.243 2.631 -0.130 1.00 0.00 C ATOM 1014 CG ARG A 65 -19.389 3.555 1.072 1.00 0.00 C ATOM 1015 CD ARG A 65 -19.170 5.012 0.702 1.00 0.00 C ATOM 1016 NE ARG A 65 -19.508 5.909 1.810 1.00 0.00 N ATOM 1017 CZ ARG A 65 -19.309 7.224 1.796 1.00 0.00 C ATOM 1018 NH1 ARG A 65 -18.775 7.813 0.735 1.00 0.00 N ATOM 1019 NH2 ARG A 65 -19.659 7.953 2.844 1.00 0.00 N ATOM 0 H ARG A 65 -20.962 1.488 1.776 1.00 0.00 H new ATOM 0 HA ARG A 65 -19.733 0.642 -0.781 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.203 2.633 -0.457 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -19.837 3.023 -0.955 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -20.384 3.436 1.502 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -18.673 3.265 1.841 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -18.129 5.162 0.417 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -19.778 5.262 -0.167 1.00 0.00 H new ATOM 0 HE ARG A 65 -19.923 5.498 2.646 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -18.513 7.257 -0.079 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -18.626 8.822 0.733 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -20.080 7.506 3.659 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -19.508 8.962 2.837 1.00 0.00 H new ATOM 1033 N LYS A 66 -17.506 0.156 0.504 1.00 0.00 N ATOM 1034 CA LYS A 66 -16.479 -0.504 1.289 1.00 0.00 C ATOM 1035 C LYS A 66 -15.104 0.088 1.056 1.00 0.00 C ATOM 1036 O LYS A 66 -14.727 0.403 -0.071 1.00 0.00 O ATOM 1037 CB LYS A 66 -16.470 -2.008 1.021 1.00 0.00 C ATOM 1038 CG LYS A 66 -17.339 -2.772 1.997 1.00 0.00 C ATOM 1039 CD LYS A 66 -16.872 -2.516 3.420 1.00 0.00 C ATOM 1040 CE LYS A 66 -17.921 -2.898 4.445 1.00 0.00 C ATOM 1041 NZ LYS A 66 -19.201 -2.158 4.249 1.00 0.00 N ATOM 0 H LYS A 66 -17.260 0.323 -0.472 1.00 0.00 H new ATOM 0 HA LYS A 66 -16.727 -0.337 2.337 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -16.818 -2.196 0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -15.447 -2.379 1.082 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -18.379 -2.466 1.887 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -17.295 -3.839 1.778 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -15.960 -3.082 3.608 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.622 -1.461 3.534 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -18.111 -3.970 4.385 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -17.538 -2.698 5.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -19.538 -1.798 5.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -19.045 -1.361 3.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -19.914 -2.799 3.845 1.00 0.00 H new ATOM 1055 N ASN A 67 -14.365 0.231 2.147 1.00 0.00 N ATOM 1056 CA ASN A 67 -13.012 0.763 2.107 1.00 0.00 C ATOM 1057 C ASN A 67 -12.082 -0.116 2.929 1.00 0.00 C ATOM 1058 O ASN A 67 -12.131 -0.113 4.159 1.00 0.00 O ATOM 1059 CB ASN A 67 -12.969 2.204 2.637 1.00 0.00 C ATOM 1060 CG ASN A 67 -13.603 3.208 1.690 1.00 0.00 C ATOM 1061 OD1 ASN A 67 -14.801 3.481 1.760 1.00 0.00 O ATOM 1062 ND2 ASN A 67 -12.795 3.773 0.802 1.00 0.00 N ATOM 0 H ASN A 67 -14.686 -0.018 3.082 1.00 0.00 H new ATOM 0 HA ASN A 67 -12.681 0.769 1.068 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -13.482 2.246 3.598 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -11.932 2.488 2.816 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -13.161 4.461 0.145 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -11.807 3.519 0.777 1.00 0.00 H new ATOM 1069 N VAL A 68 -11.265 -0.900 2.242 1.00 0.00 N ATOM 1070 CA VAL A 68 -10.312 -1.787 2.900 1.00 0.00 C ATOM 1071 C VAL A 68 -8.888 -1.346 2.580 1.00 0.00 C ATOM 1072 O VAL A 68 -8.547 -1.148 1.416 1.00 0.00 O ATOM 1073 CB VAL A 68 -10.508 -3.252 2.449 1.00 0.00 C ATOM 1074 CG1 VAL A 68 -9.587 -4.183 3.221 1.00 0.00 C ATOM 1075 CG2 VAL A 68 -11.958 -3.673 2.620 1.00 0.00 C ATOM 0 H VAL A 68 -11.242 -0.941 1.223 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.485 -1.730 3.975 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.251 -3.320 1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.743 -5.209 2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.550 -3.897 3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.807 -4.111 4.286 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.077 -4.707 2.297 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.241 -3.585 3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.597 -3.029 2.016 1.00 0.00 H new ATOM 1085 N GLY A 69 -8.056 -1.189 3.597 1.00 0.00 N ATOM 1086 CA GLY A 69 -6.708 -0.719 3.360 1.00 0.00 C ATOM 1087 C GLY A 69 -5.649 -1.705 3.797 1.00 0.00 C ATOM 1088 O GLY A 69 -5.865 -2.507 4.707 1.00 0.00 O ATOM 0 H GLY A 69 -8.286 -1.376 4.573 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -6.584 -0.510 2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.560 0.222 3.889 1.00 0.00 H new ATOM 1092 N LEU A 70 -4.510 -1.645 3.126 1.00 0.00 N ATOM 1093 CA LEU A 70 -3.355 -2.468 3.457 1.00 0.00 C ATOM 1094 C LEU A 70 -2.086 -1.747 3.012 1.00 0.00 C ATOM 1095 O LEU A 70 -1.346 -1.198 3.828 1.00 0.00 O ATOM 1096 CB LEU A 70 -3.456 -3.839 2.774 1.00 0.00 C ATOM 1097 CG LEU A 70 -2.331 -4.820 3.108 1.00 0.00 C ATOM 1098 CD1 LEU A 70 -2.345 -5.171 4.590 1.00 0.00 C ATOM 1099 CD2 LEU A 70 -2.451 -6.074 2.254 1.00 0.00 C ATOM 0 H LEU A 70 -4.359 -1.022 2.333 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.325 -2.630 4.535 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -4.407 -4.295 3.050 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.476 -3.688 1.695 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.377 -4.342 2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.537 -5.870 4.806 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -2.208 -4.265 5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.300 -5.630 4.846 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.644 -6.762 2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -3.410 -6.555 2.446 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -2.385 -5.804 1.200 1.00 0.00 H new ATOM 1111 N ARG A 71 -1.858 -1.742 1.707 1.00 0.00 N ATOM 1112 CA ARG A 71 -0.779 -0.966 1.103 1.00 0.00 C ATOM 1113 C ARG A 71 -1.386 0.235 0.378 1.00 0.00 C ATOM 1114 O ARG A 71 -0.690 1.087 -0.173 1.00 0.00 O ATOM 1115 CB ARG A 71 0.024 -1.856 0.133 1.00 0.00 C ATOM 1116 CG ARG A 71 1.155 -1.143 -0.601 1.00 0.00 C ATOM 1117 CD ARG A 71 2.165 -0.533 0.356 1.00 0.00 C ATOM 1118 NE ARG A 71 2.882 -1.543 1.128 1.00 0.00 N ATOM 1119 CZ ARG A 71 3.543 -1.288 2.256 1.00 0.00 C ATOM 1120 NH1 ARG A 71 3.559 -0.062 2.761 1.00 0.00 N ATOM 1121 NH2 ARG A 71 4.189 -2.264 2.877 1.00 0.00 N ATOM 0 H ARG A 71 -2.413 -2.274 1.036 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.094 -0.606 1.871 1.00 0.00 H new ATOM 0 HB2 ARG A 71 0.443 -2.693 0.692 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -0.661 -2.276 -0.604 1.00 0.00 H new ATOM 0 HG2 ARG A 71 1.661 -1.849 -1.259 1.00 0.00 H new ATOM 0 HG3 ARG A 71 0.738 -0.360 -1.234 1.00 0.00 H new ATOM 0 HD2 ARG A 71 2.881 0.065 -0.208 1.00 0.00 H new ATOM 0 HD3 ARG A 71 1.652 0.145 1.038 1.00 0.00 H new ATOM 0 HE ARG A 71 2.877 -2.503 0.783 1.00 0.00 H new ATOM 0 HH11 ARG A 71 3.063 0.692 2.285 1.00 0.00 H new ATOM 0 HH12 ARG A 71 4.067 0.127 3.625 1.00 0.00 H new ATOM 0 HH21 ARG A 71 4.179 -3.208 2.491 1.00 0.00 H new ATOM 0 HH22 ARG A 71 4.696 -2.071 3.741 1.00 0.00 H new ATOM 1135 N ASN A 72 -2.705 0.294 0.427 1.00 0.00 N ATOM 1136 CA ASN A 72 -3.480 1.292 -0.284 1.00 0.00 C ATOM 1137 C ASN A 72 -4.905 1.243 0.230 1.00 0.00 C ATOM 1138 O ASN A 72 -5.217 0.416 1.085 1.00 0.00 O ATOM 1139 CB ASN A 72 -3.446 1.036 -1.799 1.00 0.00 C ATOM 1140 CG ASN A 72 -3.750 -0.411 -2.174 1.00 0.00 C ATOM 1141 OD1 ASN A 72 -4.466 -1.121 -1.469 1.00 0.00 O ATOM 1142 ND2 ASN A 72 -3.193 -0.859 -3.290 1.00 0.00 N ATOM 0 H ASN A 72 -3.273 -0.358 0.968 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.053 2.280 -0.110 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -4.169 1.690 -2.287 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.462 1.305 -2.184 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.353 -1.821 -3.589 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -2.605 -0.242 -3.850 1.00 0.00 H new ATOM 1149 N ILE A 73 -5.762 2.119 -0.268 1.00 0.00 N ATOM 1150 CA ILE A 73 -7.153 2.107 0.142 1.00 0.00 C ATOM 1151 C ILE A 73 -8.026 1.600 -0.995 1.00 0.00 C ATOM 1152 O ILE A 73 -8.160 2.258 -2.027 1.00 0.00 O ATOM 1153 CB ILE A 73 -7.639 3.507 0.588 1.00 0.00 C ATOM 1154 CG1 ILE A 73 -6.761 4.043 1.728 1.00 0.00 C ATOM 1155 CG2 ILE A 73 -9.103 3.457 1.014 1.00 0.00 C ATOM 1156 CD1 ILE A 73 -6.770 3.174 2.969 1.00 0.00 C ATOM 0 H ILE A 73 -5.521 2.839 -0.949 1.00 0.00 H new ATOM 0 HA ILE A 73 -7.235 1.438 0.999 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.554 4.187 -0.260 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -5.736 4.138 1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -7.100 5.044 1.995 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.426 4.451 1.324 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.714 3.122 0.176 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -9.216 2.763 1.847 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.127 3.618 3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.787 3.099 3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -6.402 2.179 2.719 1.00 0.00 H new ATOM 1168 N ILE A 74 -8.592 0.420 -0.806 1.00 0.00 N ATOM 1169 CA ILE A 74 -9.480 -0.167 -1.791 1.00 0.00 C ATOM 1170 C ILE A 74 -10.906 0.294 -1.529 1.00 0.00 C ATOM 1171 O ILE A 74 -11.464 0.050 -0.458 1.00 0.00 O ATOM 1172 CB ILE A 74 -9.433 -1.715 -1.752 1.00 0.00 C ATOM 1173 CG1 ILE A 74 -8.001 -2.222 -1.968 1.00 0.00 C ATOM 1174 CG2 ILE A 74 -10.372 -2.307 -2.796 1.00 0.00 C ATOM 1175 CD1 ILE A 74 -7.420 -1.859 -3.318 1.00 0.00 C ATOM 0 H ILE A 74 -8.450 -0.152 0.026 1.00 0.00 H new ATOM 0 HA ILE A 74 -9.149 0.161 -2.776 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.765 -2.040 -0.766 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -7.360 -1.815 -1.186 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -7.989 -3.306 -1.858 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.325 -3.395 -2.753 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -11.392 -1.980 -2.595 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -10.072 -1.970 -3.788 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -6.406 -2.252 -3.395 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -8.037 -2.289 -4.107 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.398 -0.774 -3.425 1.00 0.00 H new ATOM 1187 N PHE A 75 -11.476 0.970 -2.505 1.00 0.00 N ATOM 1188 CA PHE A 75 -12.834 1.465 -2.410 1.00 0.00 C ATOM 1189 C PHE A 75 -13.726 0.673 -3.353 1.00 0.00 C ATOM 1190 O PHE A 75 -13.542 0.705 -4.569 1.00 0.00 O ATOM 1191 CB PHE A 75 -12.857 2.962 -2.750 1.00 0.00 C ATOM 1192 CG PHE A 75 -14.204 3.617 -2.615 1.00 0.00 C ATOM 1193 CD1 PHE A 75 -15.051 3.292 -1.571 1.00 0.00 C ATOM 1194 CD2 PHE A 75 -14.609 4.575 -3.529 1.00 0.00 C ATOM 1195 CE1 PHE A 75 -16.279 3.906 -1.440 1.00 0.00 C ATOM 1196 CE2 PHE A 75 -15.838 5.193 -3.406 1.00 0.00 C ATOM 1197 CZ PHE A 75 -16.674 4.859 -2.360 1.00 0.00 C ATOM 0 H PHE A 75 -11.012 1.192 -3.386 1.00 0.00 H new ATOM 0 HA PHE A 75 -13.210 1.339 -1.395 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -12.150 3.479 -2.101 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -12.505 3.094 -3.773 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -14.747 2.548 -0.849 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -13.957 4.842 -4.347 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -16.931 3.643 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -16.144 5.936 -4.127 1.00 0.00 H new ATOM 0 HZ PHE A 75 -17.635 5.341 -2.260 1.00 0.00 H new ATOM 1207 N SER A 76 -14.659 -0.065 -2.783 1.00 0.00 N ATOM 1208 CA SER A 76 -15.550 -0.903 -3.565 1.00 0.00 C ATOM 1209 C SER A 76 -16.911 -0.236 -3.735 1.00 0.00 C ATOM 1210 O SER A 76 -17.568 0.115 -2.752 1.00 0.00 O ATOM 1211 CB SER A 76 -15.711 -2.262 -2.883 1.00 0.00 C ATOM 1212 OG SER A 76 -14.447 -2.857 -2.638 1.00 0.00 O ATOM 0 H SER A 76 -14.821 -0.102 -1.777 1.00 0.00 H new ATOM 0 HA SER A 76 -15.115 -1.045 -4.554 1.00 0.00 H new ATOM 0 HB2 SER A 76 -16.249 -2.140 -1.943 1.00 0.00 H new ATOM 0 HB3 SER A 76 -16.312 -2.920 -3.511 1.00 0.00 H new ATOM 0 HG SER A 76 -14.573 -3.724 -2.200 1.00 0.00 H new ATOM 1218 N ILE A 77 -17.315 -0.048 -4.986 1.00 0.00 N ATOM 1219 CA ILE A 77 -18.606 0.553 -5.288 1.00 0.00 C ATOM 1220 C ILE A 77 -19.492 -0.451 -6.015 1.00 0.00 C ATOM 1221 O ILE A 77 -19.170 -0.884 -7.124 1.00 0.00 O ATOM 1222 CB ILE A 77 -18.483 1.823 -6.168 1.00 0.00 C ATOM 1223 CG1 ILE A 77 -17.429 2.793 -5.623 1.00 0.00 C ATOM 1224 CG2 ILE A 77 -19.829 2.522 -6.270 1.00 0.00 C ATOM 1225 CD1 ILE A 77 -16.020 2.491 -6.090 1.00 0.00 C ATOM 0 H ILE A 77 -16.766 -0.304 -5.807 1.00 0.00 H new ATOM 0 HA ILE A 77 -19.045 0.841 -4.333 1.00 0.00 H new ATOM 0 HB ILE A 77 -18.162 1.506 -7.160 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -17.692 3.807 -5.924 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -17.454 2.767 -4.534 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -19.730 3.413 -6.890 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -20.557 1.846 -6.719 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -20.166 2.809 -5.274 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -15.331 3.220 -5.663 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -15.736 1.490 -5.766 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -15.978 2.546 -7.178 1.00 0.00 H new ATOM 1237 N GLN A 78 -20.587 -0.839 -5.386 1.00 0.00 N ATOM 1238 CA GLN A 78 -21.544 -1.731 -6.015 1.00 0.00 C ATOM 1239 C GLN A 78 -22.379 -0.970 -7.038 1.00 0.00 C ATOM 1240 O GLN A 78 -22.755 0.182 -6.820 1.00 0.00 O ATOM 1241 CB GLN A 78 -22.461 -2.383 -4.975 1.00 0.00 C ATOM 1242 CG GLN A 78 -21.896 -3.642 -4.324 1.00 0.00 C ATOM 1243 CD GLN A 78 -20.911 -3.370 -3.200 1.00 0.00 C ATOM 1244 OE1 GLN A 78 -20.182 -2.382 -3.201 1.00 0.00 O ATOM 1245 NE2 GLN A 78 -20.890 -4.257 -2.218 1.00 0.00 N ATOM 0 H GLN A 78 -20.836 -0.550 -4.440 1.00 0.00 H new ATOM 0 HA GLN A 78 -20.986 -2.519 -6.520 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -22.678 -1.654 -4.195 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -23.409 -2.632 -5.452 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -22.721 -4.238 -3.933 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -21.402 -4.243 -5.088 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -21.509 -5.067 -2.249 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -20.254 -4.131 -1.430 1.00 0.00 H new ATOM 1254 N LYS A 79 -22.645 -1.611 -8.164 1.00 0.00 N ATOM 1255 CA LYS A 79 -23.473 -1.011 -9.202 1.00 0.00 C ATOM 1256 C LYS A 79 -24.939 -0.964 -8.780 1.00 0.00 C ATOM 1257 O LYS A 79 -25.406 -1.828 -8.035 1.00 0.00 O ATOM 1258 CB LYS A 79 -23.309 -1.773 -10.534 1.00 0.00 C ATOM 1259 CG LYS A 79 -23.365 -3.301 -10.419 1.00 0.00 C ATOM 1260 CD LYS A 79 -24.771 -3.820 -10.146 1.00 0.00 C ATOM 1261 CE LYS A 79 -24.754 -5.273 -9.692 1.00 0.00 C ATOM 1262 NZ LYS A 79 -24.088 -5.438 -8.369 1.00 0.00 N ATOM 0 H LYS A 79 -22.301 -2.546 -8.384 1.00 0.00 H new ATOM 0 HA LYS A 79 -23.137 0.015 -9.350 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -24.091 -1.447 -11.220 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -22.355 -1.492 -10.981 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -22.992 -3.744 -11.342 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -22.701 -3.625 -9.618 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -25.244 -3.205 -9.381 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -25.375 -3.727 -11.048 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -25.777 -5.646 -9.632 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -24.237 -5.879 -10.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -24.083 -6.444 -8.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -23.109 -5.091 -8.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -24.606 -4.894 -7.649 1.00 0.00 H new ATOM 1276 N GLU A 80 -25.649 0.062 -9.227 1.00 0.00 N ATOM 1277 CA GLU A 80 -27.091 0.116 -9.052 1.00 0.00 C ATOM 1278 C GLU A 80 -27.736 -0.563 -10.250 1.00 0.00 C ATOM 1279 O GLU A 80 -28.723 -1.296 -10.131 1.00 0.00 O ATOM 1280 CB GLU A 80 -27.585 1.563 -8.939 1.00 0.00 C ATOM 1281 CG GLU A 80 -29.045 1.672 -8.519 1.00 0.00 C ATOM 1282 CD GLU A 80 -29.622 3.057 -8.734 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -29.378 3.957 -7.904 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -30.330 3.254 -9.740 1.00 0.00 O ATOM 0 H GLU A 80 -25.250 0.866 -9.712 1.00 0.00 H new ATOM 0 HA GLU A 80 -27.363 -0.394 -8.128 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -26.966 2.095 -8.217 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -27.453 2.060 -9.900 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -29.634 0.948 -9.082 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -29.135 1.407 -7.466 1.00 0.00 H new ATOM 1427 N LEU A 88 -17.214 5.037 -17.400 1.00 0.00 N ATOM 1428 CA LEU A 88 -17.926 5.239 -16.147 1.00 0.00 C ATOM 1429 C LEU A 88 -17.608 6.622 -15.602 1.00 0.00 C ATOM 1430 O LEU A 88 -18.243 7.103 -14.668 1.00 0.00 O ATOM 1431 CB LEU A 88 -17.601 4.134 -15.127 1.00 0.00 C ATOM 1432 CG LEU A 88 -16.116 3.897 -14.812 1.00 0.00 C ATOM 1433 CD1 LEU A 88 -15.565 4.960 -13.869 1.00 0.00 C ATOM 1434 CD2 LEU A 88 -15.929 2.511 -14.213 1.00 0.00 C ATOM 0 HA LEU A 88 -18.998 5.177 -16.336 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -18.112 4.372 -14.194 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -18.024 3.199 -15.493 1.00 0.00 H new ATOM 0 HG LEU A 88 -15.558 3.966 -15.746 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.512 4.759 -13.669 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.666 5.943 -14.330 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -16.122 4.940 -12.932 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -14.874 2.349 -13.992 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -16.509 2.431 -13.293 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -16.270 1.758 -14.924 1.00 0.00 H new ATOM 1446 N LEU A 89 -16.625 7.258 -16.217 1.00 0.00 N ATOM 1447 CA LEU A 89 -16.199 8.588 -15.834 1.00 0.00 C ATOM 1448 C LEU A 89 -16.797 9.610 -16.792 1.00 0.00 C ATOM 1449 O LEU A 89 -16.508 9.590 -17.987 1.00 0.00 O ATOM 1450 CB LEU A 89 -14.671 8.673 -15.841 1.00 0.00 C ATOM 1451 CG LEU A 89 -14.081 9.949 -15.241 1.00 0.00 C ATOM 1452 CD1 LEU A 89 -14.417 10.049 -13.761 1.00 0.00 C ATOM 1453 CD2 LEU A 89 -12.575 9.987 -15.446 1.00 0.00 C ATOM 0 H LEU A 89 -16.100 6.863 -16.998 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.549 8.804 -14.825 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -14.274 7.818 -15.294 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -14.324 8.582 -16.870 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.522 10.804 -15.753 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -13.988 10.964 -13.352 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.499 10.067 -13.634 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.004 9.188 -13.235 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.172 10.902 -15.013 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -12.120 9.124 -14.960 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.352 9.962 -16.513 1.00 0.00 H new ATOM 1465 N LYS A 90 -17.660 10.473 -16.269 1.00 0.00 N ATOM 1466 CA LYS A 90 -18.340 11.483 -17.074 1.00 0.00 C ATOM 1467 C LYS A 90 -17.343 12.512 -17.622 1.00 0.00 C ATOM 1468 O LYS A 90 -17.659 13.286 -18.528 1.00 0.00 O ATOM 1469 CB LYS A 90 -19.440 12.167 -16.251 1.00 0.00 C ATOM 1470 CG LYS A 90 -20.236 13.211 -17.024 1.00 0.00 C ATOM 1471 CD LYS A 90 -20.827 12.632 -18.301 1.00 0.00 C ATOM 1472 CE LYS A 90 -21.429 13.720 -19.175 1.00 0.00 C ATOM 1473 NZ LYS A 90 -21.835 13.199 -20.506 1.00 0.00 N ATOM 0 H LYS A 90 -17.908 10.493 -15.280 1.00 0.00 H new ATOM 0 HA LYS A 90 -18.805 10.988 -17.926 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -20.125 11.406 -15.877 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -18.986 12.642 -15.381 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -21.037 13.598 -16.394 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -19.589 14.053 -17.271 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -20.052 12.104 -18.856 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -21.594 11.899 -18.050 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -22.296 14.150 -18.674 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -20.704 14.524 -19.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -21.803 13.969 -21.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -21.184 12.441 -20.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -22.803 12.822 -20.451 1.00 0.00 H new ATOM 1487 N SER A 91 -16.133 12.512 -17.071 1.00 0.00 N ATOM 1488 CA SER A 91 -15.048 13.319 -17.611 1.00 0.00 C ATOM 1489 C SER A 91 -14.541 12.687 -18.912 1.00 0.00 C ATOM 1490 O SER A 91 -13.401 12.231 -19.005 1.00 0.00 O ATOM 1491 CB SER A 91 -13.911 13.423 -16.586 1.00 0.00 C ATOM 1492 OG SER A 91 -14.411 13.721 -15.288 1.00 0.00 O ATOM 0 H SER A 91 -15.881 11.961 -16.250 1.00 0.00 H new ATOM 0 HA SER A 91 -15.413 14.324 -17.823 1.00 0.00 H new ATOM 0 HB2 SER A 91 -13.357 12.485 -16.558 1.00 0.00 H new ATOM 0 HB3 SER A 91 -13.210 14.198 -16.895 1.00 0.00 H new ATOM 0 HG SER A 91 -14.890 14.576 -15.310 1.00 0.00 H new ATOM 1498 N GLU A 92 -15.417 12.660 -19.911 1.00 0.00 N ATOM 1499 CA GLU A 92 -15.163 11.968 -21.168 1.00 0.00 C ATOM 1500 C GLU A 92 -14.124 12.689 -22.027 1.00 0.00 C ATOM 1501 O GLU A 92 -13.632 12.129 -23.009 1.00 0.00 O ATOM 1502 CB GLU A 92 -16.472 11.829 -21.949 1.00 0.00 C ATOM 1503 CG GLU A 92 -17.553 11.076 -21.192 1.00 0.00 C ATOM 1504 CD GLU A 92 -18.905 11.161 -21.871 1.00 0.00 C ATOM 1505 OE1 GLU A 92 -19.189 10.323 -22.748 1.00 0.00 O ATOM 1506 OE2 GLU A 92 -19.686 12.073 -21.536 1.00 0.00 O ATOM 0 H GLU A 92 -16.327 13.120 -19.871 1.00 0.00 H new ATOM 0 HA GLU A 92 -14.761 10.984 -20.927 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -16.842 12.823 -22.202 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -16.272 11.314 -22.889 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -17.263 10.030 -21.097 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -17.632 11.478 -20.182 1.00 0.00 H new ATOM 1513 N GLU A 93 -13.792 13.920 -21.662 1.00 0.00 N ATOM 1514 CA GLU A 93 -12.841 14.710 -22.437 1.00 0.00 C ATOM 1515 C GLU A 93 -11.421 14.162 -22.296 1.00 0.00 C ATOM 1516 O GLU A 93 -10.710 13.986 -23.288 1.00 0.00 O ATOM 1517 CB GLU A 93 -12.882 16.188 -22.018 1.00 0.00 C ATOM 1518 CG GLU A 93 -12.690 16.417 -20.528 1.00 0.00 C ATOM 1519 CD GLU A 93 -12.543 17.881 -20.177 1.00 0.00 C ATOM 1520 OE1 GLU A 93 -13.576 18.573 -20.066 1.00 0.00 O ATOM 1521 OE2 GLU A 93 -11.395 18.343 -19.998 1.00 0.00 O ATOM 0 H GLU A 93 -14.164 14.393 -20.838 1.00 0.00 H new ATOM 0 HA GLU A 93 -13.134 14.638 -23.484 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -12.107 16.730 -22.561 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -13.839 16.613 -22.320 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -13.541 16.002 -19.988 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -11.805 15.876 -20.192 1.00 0.00 H new ATOM 1528 N LYS A 94 -11.027 13.872 -21.066 1.00 0.00 N ATOM 1529 CA LYS A 94 -9.673 13.424 -20.773 1.00 0.00 C ATOM 1530 C LYS A 94 -9.633 12.737 -19.418 1.00 0.00 C ATOM 1531 O LYS A 94 -10.362 13.118 -18.502 1.00 0.00 O ATOM 1532 CB LYS A 94 -8.703 14.613 -20.769 1.00 0.00 C ATOM 1533 CG LYS A 94 -9.073 15.693 -19.760 1.00 0.00 C ATOM 1534 CD LYS A 94 -7.985 16.748 -19.615 1.00 0.00 C ATOM 1535 CE LYS A 94 -7.769 17.529 -20.901 1.00 0.00 C ATOM 1536 NZ LYS A 94 -9.022 18.149 -21.405 1.00 0.00 N ATOM 0 H LYS A 94 -11.631 13.940 -20.247 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.370 12.719 -21.547 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -7.698 14.252 -20.551 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -8.674 15.052 -21.766 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.002 16.173 -20.069 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -9.260 15.232 -18.790 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -8.253 17.437 -18.814 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -7.052 16.267 -19.322 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.025 18.307 -20.730 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -7.364 16.863 -21.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.819 19.108 -21.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -9.407 17.573 -22.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -9.718 18.201 -20.634 1.00 0.00 H new ATOM 1550 N PRO A 95 -8.804 11.698 -19.279 1.00 0.00 N ATOM 1551 CA PRO A 95 -8.551 11.079 -17.986 1.00 0.00 C ATOM 1552 C PRO A 95 -7.612 11.938 -17.148 1.00 0.00 C ATOM 1553 O PRO A 95 -6.611 12.451 -17.652 1.00 0.00 O ATOM 1554 CB PRO A 95 -7.888 9.752 -18.348 1.00 0.00 C ATOM 1555 CG PRO A 95 -7.219 10.007 -19.656 1.00 0.00 C ATOM 1556 CD PRO A 95 -8.060 11.034 -20.369 1.00 0.00 C ATOM 0 HA PRO A 95 -9.456 10.955 -17.392 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -7.168 9.449 -17.588 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.623 8.951 -18.429 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -6.203 10.372 -19.508 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -7.147 9.090 -20.241 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -7.443 11.742 -20.922 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -8.734 10.569 -21.088 1.00 0.00 H new ATOM 1564 N ALA A 96 -7.950 12.120 -15.881 1.00 0.00 N ATOM 1565 CA ALA A 96 -7.102 12.883 -14.980 1.00 0.00 C ATOM 1566 C ALA A 96 -5.727 12.230 -14.873 1.00 0.00 C ATOM 1567 O ALA A 96 -5.625 11.004 -14.805 1.00 0.00 O ATOM 1568 CB ALA A 96 -7.754 12.998 -13.611 1.00 0.00 C ATOM 0 H ALA A 96 -8.801 11.752 -15.456 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.975 13.888 -15.382 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.107 13.572 -12.947 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -8.715 13.503 -13.707 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.907 12.002 -13.196 1.00 0.00 H new ATOM 1574 N PRO A 97 -4.653 13.040 -14.841 1.00 0.00 N ATOM 1575 CA PRO A 97 -3.271 12.544 -14.863 1.00 0.00 C ATOM 1576 C PRO A 97 -2.974 11.549 -13.742 1.00 0.00 C ATOM 1577 O PRO A 97 -2.118 10.675 -13.885 1.00 0.00 O ATOM 1578 CB PRO A 97 -2.420 13.810 -14.689 1.00 0.00 C ATOM 1579 CG PRO A 97 -3.363 14.858 -14.202 1.00 0.00 C ATOM 1580 CD PRO A 97 -4.700 14.508 -14.784 1.00 0.00 C ATOM 0 HA PRO A 97 -3.065 11.998 -15.784 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.613 13.646 -13.975 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.957 14.105 -15.631 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -3.403 14.873 -13.113 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.045 15.850 -14.523 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -5.519 14.863 -14.159 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -4.839 14.947 -15.772 1.00 0.00 H new ATOM 1588 N TYR A 98 -3.693 11.667 -12.636 1.00 0.00 N ATOM 1589 CA TYR A 98 -3.459 10.798 -11.495 1.00 0.00 C ATOM 1590 C TYR A 98 -4.174 9.462 -11.659 1.00 0.00 C ATOM 1591 O TYR A 98 -3.983 8.553 -10.860 1.00 0.00 O ATOM 1592 CB TYR A 98 -3.878 11.479 -10.186 1.00 0.00 C ATOM 1593 CG TYR A 98 -5.315 11.959 -10.136 1.00 0.00 C ATOM 1594 CD1 TYR A 98 -6.348 11.086 -9.811 1.00 0.00 C ATOM 1595 CD2 TYR A 98 -5.639 13.288 -10.387 1.00 0.00 C ATOM 1596 CE1 TYR A 98 -7.657 11.520 -9.742 1.00 0.00 C ATOM 1597 CE2 TYR A 98 -6.948 13.729 -10.321 1.00 0.00 C ATOM 1598 CZ TYR A 98 -7.953 12.842 -9.999 1.00 0.00 C ATOM 1599 OH TYR A 98 -9.259 13.279 -9.934 1.00 0.00 O ATOM 0 H TYR A 98 -4.438 12.351 -12.505 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.388 10.602 -11.448 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -3.717 10.781 -9.365 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -3.221 12.332 -10.013 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -6.122 10.049 -9.609 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.855 13.987 -10.638 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.445 10.827 -9.488 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -7.182 14.764 -10.521 1.00 0.00 H new ATOM 0 HH TYR A 98 -9.294 14.236 -10.141 1.00 0.00 H new ATOM 1609 N ILE A 99 -4.978 9.333 -12.706 1.00 0.00 N ATOM 1610 CA ILE A 99 -5.742 8.114 -12.918 1.00 0.00 C ATOM 1611 C ILE A 99 -5.001 7.129 -13.802 1.00 0.00 C ATOM 1612 O ILE A 99 -4.601 7.437 -14.925 1.00 0.00 O ATOM 1613 CB ILE A 99 -7.151 8.409 -13.483 1.00 0.00 C ATOM 1614 CG1 ILE A 99 -8.082 8.749 -12.328 1.00 0.00 C ATOM 1615 CG2 ILE A 99 -7.696 7.231 -14.288 1.00 0.00 C ATOM 1616 CD1 ILE A 99 -9.223 9.661 -12.718 1.00 0.00 C ATOM 0 H ILE A 99 -5.117 10.052 -13.416 1.00 0.00 H new ATOM 0 HA ILE A 99 -5.867 7.651 -11.939 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.085 9.255 -14.167 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -8.490 7.825 -11.918 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -7.504 9.223 -11.534 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -8.687 7.478 -14.668 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.029 7.022 -15.124 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.761 6.352 -13.647 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -9.845 9.860 -11.845 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.824 10.600 -13.101 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -9.825 9.181 -13.490 1.00 0.00 H new ATOM 1628 N LYS A 100 -4.811 5.952 -13.247 1.00 0.00 N ATOM 1629 CA LYS A 100 -4.228 4.827 -13.961 1.00 0.00 C ATOM 1630 C LYS A 100 -5.130 3.612 -13.757 1.00 0.00 C ATOM 1631 O LYS A 100 -6.163 3.709 -13.092 1.00 0.00 O ATOM 1632 CB LYS A 100 -2.815 4.502 -13.447 1.00 0.00 C ATOM 1633 CG LYS A 100 -1.858 5.689 -13.374 1.00 0.00 C ATOM 1634 CD LYS A 100 -1.591 6.306 -14.737 1.00 0.00 C ATOM 1635 CE LYS A 100 -0.420 7.282 -14.692 1.00 0.00 C ATOM 1636 NZ LYS A 100 -0.562 8.290 -13.607 1.00 0.00 N ATOM 0 H LYS A 100 -5.057 5.743 -12.280 1.00 0.00 H new ATOM 0 HA LYS A 100 -4.148 5.084 -15.017 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -2.900 4.063 -12.453 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.377 3.742 -14.094 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -2.275 6.447 -12.711 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -0.915 5.365 -12.935 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -1.380 5.517 -15.459 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -2.485 6.825 -15.083 1.00 0.00 H new ATOM 0 HE2 LYS A 100 0.507 6.727 -14.549 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.340 7.794 -15.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 0.213 8.980 -13.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.473 8.782 -13.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -0.526 7.813 -12.683 1.00 0.00 H new ATOM 1650 N VAL A 101 -4.749 2.475 -14.308 1.00 0.00 N ATOM 1651 CA VAL A 101 -5.521 1.255 -14.123 1.00 0.00 C ATOM 1652 C VAL A 101 -4.817 0.329 -13.136 1.00 0.00 C ATOM 1653 O VAL A 101 -3.611 0.097 -13.245 1.00 0.00 O ATOM 1654 CB VAL A 101 -5.763 0.524 -15.470 1.00 0.00 C ATOM 1655 CG1 VAL A 101 -4.451 0.231 -16.182 1.00 0.00 C ATOM 1656 CG2 VAL A 101 -6.565 -0.758 -15.267 1.00 0.00 C ATOM 0 H VAL A 101 -3.915 2.368 -14.885 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.494 1.534 -13.718 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.348 1.191 -16.103 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.654 -0.282 -17.122 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.930 1.167 -16.384 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -3.828 -0.402 -15.551 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.718 -1.247 -16.229 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.019 -1.427 -14.602 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.532 -0.516 -14.825 1.00 0.00 H new ATOM 1666 N ASP A 102 -5.550 -0.171 -12.147 1.00 0.00 N ATOM 1667 CA ASP A 102 -4.974 -1.123 -11.206 1.00 0.00 C ATOM 1668 C ASP A 102 -4.893 -2.490 -11.862 1.00 0.00 C ATOM 1669 O ASP A 102 -5.897 -3.195 -11.990 1.00 0.00 O ATOM 1670 CB ASP A 102 -5.780 -1.213 -9.909 1.00 0.00 C ATOM 1671 CG ASP A 102 -5.084 -2.073 -8.869 1.00 0.00 C ATOM 1672 OD1 ASP A 102 -5.024 -3.301 -9.053 1.00 0.00 O ATOM 1673 OD2 ASP A 102 -4.578 -1.523 -7.869 1.00 0.00 O ATOM 0 H ASP A 102 -6.528 0.062 -11.978 1.00 0.00 H new ATOM 0 HA ASP A 102 -3.976 -0.772 -10.942 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -5.935 -0.212 -9.507 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -6.766 -1.627 -10.122 1.00 0.00 H new ATOM 1678 N TRP A 103 -3.694 -2.846 -12.289 1.00 0.00 N ATOM 1679 CA TRP A 103 -3.478 -4.062 -13.056 1.00 0.00 C ATOM 1680 C TRP A 103 -3.472 -5.301 -12.157 1.00 0.00 C ATOM 1681 O TRP A 103 -3.324 -6.429 -12.636 1.00 0.00 O ATOM 1682 CB TRP A 103 -2.163 -3.950 -13.835 1.00 0.00 C ATOM 1683 CG TRP A 103 -2.135 -4.790 -15.077 1.00 0.00 C ATOM 1684 CD1 TRP A 103 -1.363 -5.894 -15.311 1.00 0.00 C ATOM 1685 CD2 TRP A 103 -2.924 -4.590 -16.256 1.00 0.00 C ATOM 1686 NE1 TRP A 103 -1.623 -6.389 -16.566 1.00 0.00 N ATOM 1687 CE2 TRP A 103 -2.578 -5.609 -17.164 1.00 0.00 C ATOM 1688 CE3 TRP A 103 -3.893 -3.651 -16.633 1.00 0.00 C ATOM 1689 CZ2 TRP A 103 -3.163 -5.713 -18.424 1.00 0.00 C ATOM 1690 CZ3 TRP A 103 -4.473 -3.758 -17.884 1.00 0.00 C ATOM 1691 CH2 TRP A 103 -4.107 -4.783 -18.766 1.00 0.00 C ATOM 0 H TRP A 103 -2.847 -2.305 -12.116 1.00 0.00 H new ATOM 0 HA TRP A 103 -4.304 -4.178 -13.758 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -1.997 -2.907 -14.106 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -1.338 -4.246 -13.186 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.654 -6.314 -14.613 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -1.177 -7.205 -16.985 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -4.182 -2.858 -15.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -2.881 -6.500 -19.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -5.221 -3.039 -18.186 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -4.579 -4.840 -19.736 1.00 0.00 H new ATOM 1702 N ASN A 104 -3.645 -5.092 -10.857 1.00 0.00 N ATOM 1703 CA ASN A 104 -3.668 -6.190 -9.902 1.00 0.00 C ATOM 1704 C ASN A 104 -5.098 -6.660 -9.670 1.00 0.00 C ATOM 1705 O ASN A 104 -5.383 -7.860 -9.693 1.00 0.00 O ATOM 1706 CB ASN A 104 -3.037 -5.775 -8.567 1.00 0.00 C ATOM 1707 CG ASN A 104 -1.557 -5.462 -8.684 1.00 0.00 C ATOM 1708 OD1 ASN A 104 -1.164 -4.312 -8.896 1.00 0.00 O ATOM 1709 ND2 ASN A 104 -0.725 -6.480 -8.538 1.00 0.00 N ATOM 0 H ASN A 104 -3.772 -4.169 -10.441 1.00 0.00 H new ATOM 0 HA ASN A 104 -3.083 -7.009 -10.321 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -3.559 -4.899 -8.181 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.177 -6.575 -7.840 1.00 0.00 H new ATOM 0 HD21 ASN A 104 0.282 -6.329 -8.600 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -1.090 -7.416 -8.364 1.00 0.00 H new ATOM 1716 N LYS A 105 -5.996 -5.705 -9.455 1.00 0.00 N ATOM 1717 CA LYS A 105 -7.399 -6.013 -9.225 1.00 0.00 C ATOM 1718 C LYS A 105 -8.095 -6.319 -10.542 1.00 0.00 C ATOM 1719 O LYS A 105 -9.108 -7.020 -10.571 1.00 0.00 O ATOM 1720 CB LYS A 105 -8.104 -4.855 -8.512 1.00 0.00 C ATOM 1721 CG LYS A 105 -7.413 -4.424 -7.228 1.00 0.00 C ATOM 1722 CD LYS A 105 -7.159 -5.605 -6.303 1.00 0.00 C ATOM 1723 CE LYS A 105 -6.255 -5.217 -5.147 1.00 0.00 C ATOM 1724 NZ LYS A 105 -5.771 -6.403 -4.394 1.00 0.00 N ATOM 0 H LYS A 105 -5.775 -4.709 -9.436 1.00 0.00 H new ATOM 0 HA LYS A 105 -7.452 -6.893 -8.584 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -8.161 -4.002 -9.189 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -9.128 -5.149 -8.283 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -6.467 -3.940 -7.469 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -8.028 -3.685 -6.714 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -8.108 -5.977 -5.916 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -6.703 -6.419 -6.866 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -5.401 -4.656 -5.527 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -6.796 -4.555 -4.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -5.157 -6.092 -3.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -6.584 -6.925 -4.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -5.233 -7.023 -5.032 1.00 0.00 H new ATOM 1738 N TRP A 106 -7.571 -5.753 -11.625 1.00 0.00 N ATOM 1739 CA TRP A 106 -7.997 -6.107 -12.960 1.00 0.00 C ATOM 1740 C TRP A 106 -7.859 -7.607 -13.185 1.00 0.00 C ATOM 1741 O TRP A 106 -6.809 -8.188 -12.909 1.00 0.00 O ATOM 1742 CB TRP A 106 -7.146 -5.363 -13.982 1.00 0.00 C ATOM 1743 CG TRP A 106 -7.830 -5.211 -15.287 1.00 0.00 C ATOM 1744 CD1 TRP A 106 -8.815 -4.328 -15.557 1.00 0.00 C ATOM 1745 CD2 TRP A 106 -7.595 -5.951 -16.488 1.00 0.00 C ATOM 1746 NE1 TRP A 106 -9.231 -4.469 -16.860 1.00 0.00 N ATOM 1747 CE2 TRP A 106 -8.487 -5.459 -17.455 1.00 0.00 C ATOM 1748 CE3 TRP A 106 -6.715 -6.979 -16.838 1.00 0.00 C ATOM 1749 CZ2 TRP A 106 -8.526 -5.963 -18.753 1.00 0.00 C ATOM 1750 CZ3 TRP A 106 -6.754 -7.477 -18.128 1.00 0.00 C ATOM 1751 CH2 TRP A 106 -7.655 -6.967 -19.072 1.00 0.00 C ATOM 0 H TRP A 106 -6.843 -5.040 -11.594 1.00 0.00 H new ATOM 0 HA TRP A 106 -9.044 -5.828 -13.077 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -6.893 -4.377 -13.591 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -6.208 -5.898 -14.127 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -9.217 -3.615 -14.853 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -9.969 -3.928 -17.310 1.00 0.00 H new ATOM 0 HE3 TRP A 106 -6.018 -7.377 -16.115 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -9.221 -5.574 -19.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 -6.079 -8.271 -18.412 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -7.661 -7.375 -20.072 1.00 0.00 H new