USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 895 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 82 TYR OH : rot 73:sc= 1.28 USER MOD Set 1.2: A 99 HIS : no HD1:sc= -6.37! C(o=-5.1!,f=-16!) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 10 SER OG : rot -118:sc= 1.3 USER MOD Single : A 16 THR OG1 : rot 73:sc= 1.25 USER MOD Single : A 22 TYR OH : rot -137:sc= 0.78 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00234 USER MOD Single : A 42 SER OG : rot 91:sc= 1.31 USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -159:sc= 1.08 (180deg=0.211) USER MOD Single : A 61 SER OG : rot -150:sc= -0.275 USER MOD Single : A 64 TYR OH : rot -123:sc= 1.91 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.604 X(o=-0.6,f=-0.15) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0296 USER MOD Single : A 81 ASN : amide:sc= 1.05 K(o=1,f=-0.79) USER MOD Single : A 83 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0462) USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 0:sc= -0.254 USER MOD Single : A 105 ASN : amide:sc= -0.333 K(o=-0.33,f=-1.5!) USER MOD Single : A 114 SER OG : rot -75:sc= 1.12 USER MOD Single : A 115 TYR OH : rot 45:sc= 0.341 USER MOD Single : A 118 SER OG : rot 88:sc= 1.28 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 11:sc= 0.138 USER MOD Single : A 123 ASN : amide:sc= -0.0171 X(o=-0.017,f=0) USER MOD Single : A 124 SER OG : rot 32:sc= 0.515 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 30:sc= -0.0319 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -6.819 2.761 -12.447 1.00 0.00 N ATOM 21 CA PRO A 2 -6.717 2.631 -10.992 1.00 0.00 C ATOM 22 C PRO A 2 -7.754 3.494 -10.280 1.00 0.00 C ATOM 23 O PRO A 2 -8.230 4.486 -10.829 1.00 0.00 O ATOM 24 CB PRO A 2 -5.297 3.118 -10.686 1.00 0.00 C ATOM 25 CG PRO A 2 -4.942 4.009 -11.827 1.00 0.00 C ATOM 26 CD PRO A 2 -5.643 3.438 -13.028 1.00 0.00 C ATOM 0 HA PRO A 2 -6.903 1.613 -10.650 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.259 3.656 -9.739 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -4.602 2.282 -10.606 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.263 5.033 -11.637 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -3.863 4.036 -11.981 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -5.935 4.218 -13.731 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -5.006 2.741 -13.572 1.00 0.00 H new ATOM 34 N VAL A 3 -8.112 3.107 -9.065 1.00 0.00 N ATOM 35 CA VAL A 3 -9.109 3.844 -8.301 1.00 0.00 C ATOM 36 C VAL A 3 -8.476 5.080 -7.676 1.00 0.00 C ATOM 37 O VAL A 3 -7.725 4.983 -6.708 1.00 0.00 O ATOM 38 CB VAL A 3 -9.744 2.972 -7.197 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.846 3.732 -6.470 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.286 1.679 -7.785 1.00 0.00 C ATOM 0 H VAL A 3 -7.729 2.291 -8.588 1.00 0.00 H new ATOM 0 HA VAL A 3 -9.899 4.141 -8.990 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.968 2.724 -6.472 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -11.278 3.096 -5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.428 4.628 -6.011 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.622 4.016 -7.181 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -10.730 1.077 -6.992 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.044 1.909 -8.534 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.473 1.122 -8.251 1.00 0.00 H new ATOM 50 N GLU A 4 -8.771 6.234 -8.245 1.00 0.00 N ATOM 51 CA GLU A 4 -8.172 7.479 -7.795 1.00 0.00 C ATOM 52 C GLU A 4 -9.128 8.234 -6.881 1.00 0.00 C ATOM 53 O GLU A 4 -10.210 8.640 -7.306 1.00 0.00 O ATOM 54 CB GLU A 4 -7.821 8.349 -9.003 1.00 0.00 C ATOM 55 CG GLU A 4 -7.034 7.615 -10.076 1.00 0.00 C ATOM 56 CD GLU A 4 -6.780 8.468 -11.300 1.00 0.00 C ATOM 57 OE1 GLU A 4 -7.711 8.644 -12.119 1.00 0.00 O ATOM 58 OE2 GLU A 4 -5.650 8.975 -11.455 1.00 0.00 O ATOM 0 H GLU A 4 -9.424 6.336 -9.022 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.265 7.247 -7.236 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.741 8.736 -9.441 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.243 9.209 -8.665 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.080 7.288 -9.662 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.578 6.718 -10.370 1.00 0.00 H new ATOM 65 N LEU A 5 -8.734 8.422 -5.630 1.00 0.00 N ATOM 66 CA LEU A 5 -9.537 9.201 -4.703 1.00 0.00 C ATOM 67 C LEU A 5 -9.175 10.671 -4.836 1.00 0.00 C ATOM 68 O LEU A 5 -8.150 11.126 -4.329 1.00 0.00 O ATOM 69 CB LEU A 5 -9.337 8.735 -3.255 1.00 0.00 C ATOM 70 CG LEU A 5 -10.204 9.454 -2.211 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.680 9.153 -2.427 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.784 9.062 -0.802 1.00 0.00 C ATOM 0 H LEU A 5 -7.870 8.049 -5.237 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.588 9.056 -4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.544 7.666 -3.202 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.289 8.870 -2.988 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.054 10.527 -2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.272 9.674 -1.674 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.978 9.489 -3.420 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.849 8.080 -2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.411 9.582 -0.078 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.899 7.986 -0.674 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.741 9.337 -0.643 1.00 0.00 H new ATOM 84 N ARG A 6 -10.002 11.399 -5.557 1.00 0.00 N ATOM 85 CA ARG A 6 -9.802 12.823 -5.731 1.00 0.00 C ATOM 86 C ARG A 6 -10.240 13.549 -4.468 1.00 0.00 C ATOM 87 O ARG A 6 -11.250 13.192 -3.875 1.00 0.00 O ATOM 88 CB ARG A 6 -10.597 13.314 -6.940 1.00 0.00 C ATOM 89 CG ARG A 6 -10.448 14.798 -7.230 1.00 0.00 C ATOM 90 CD ARG A 6 -11.291 15.210 -8.425 1.00 0.00 C ATOM 91 NE ARG A 6 -12.695 14.840 -8.247 1.00 0.00 N ATOM 92 CZ ARG A 6 -13.611 14.877 -9.213 1.00 0.00 C ATOM 93 NH1 ARG A 6 -13.292 15.315 -10.427 1.00 0.00 N ATOM 94 NH2 ARG A 6 -14.849 14.479 -8.963 1.00 0.00 N ATOM 0 H ARG A 6 -10.823 11.026 -6.034 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.746 13.029 -5.909 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -10.282 12.751 -7.819 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -11.652 13.092 -6.780 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -10.747 15.374 -6.354 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -9.401 15.031 -7.423 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -11.214 16.287 -8.571 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -10.901 14.737 -9.326 1.00 0.00 H new ATOM 0 HE ARG A 6 -12.992 14.533 -7.321 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -12.340 15.625 -10.623 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -13.999 15.341 -11.162 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -15.099 14.145 -8.032 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -15.552 14.506 -9.701 1.00 0.00 H new ATOM 108 N ALA A 7 -9.471 14.552 -4.057 1.00 0.00 N ATOM 109 CA ALA A 7 -9.781 15.323 -2.852 1.00 0.00 C ATOM 110 C ALA A 7 -11.198 15.880 -2.910 1.00 0.00 C ATOM 111 O ALA A 7 -11.869 16.022 -1.890 1.00 0.00 O ATOM 112 CB ALA A 7 -8.771 16.438 -2.661 1.00 0.00 C ATOM 0 H ALA A 7 -8.625 14.853 -4.541 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.720 14.653 -1.994 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.017 17.001 -1.761 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.773 16.012 -2.561 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.797 17.104 -3.524 1.00 0.00 H new ATOM 118 N ASN A 8 -11.640 16.207 -4.112 1.00 0.00 N ATOM 119 CA ASN A 8 -13.041 16.502 -4.343 1.00 0.00 C ATOM 120 C ASN A 8 -13.772 15.200 -4.632 1.00 0.00 C ATOM 121 O ASN A 8 -13.808 14.731 -5.771 1.00 0.00 O ATOM 122 CB ASN A 8 -13.213 17.488 -5.503 1.00 0.00 C ATOM 123 CG ASN A 8 -14.672 17.752 -5.833 1.00 0.00 C ATOM 124 OD1 ASN A 8 -15.258 17.089 -6.689 1.00 0.00 O ATOM 125 ND2 ASN A 8 -15.272 18.715 -5.151 1.00 0.00 N ATOM 0 H ASN A 8 -11.049 16.275 -4.941 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.462 16.971 -3.454 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -12.725 18.429 -5.250 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.710 17.095 -6.387 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -16.254 18.929 -5.327 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.753 19.243 -4.449 1.00 0.00 H new ATOM 132 N TRP A 9 -14.307 14.591 -3.590 1.00 0.00 N ATOM 133 CA TRP A 9 -14.934 13.289 -3.722 1.00 0.00 C ATOM 134 C TRP A 9 -16.342 13.291 -3.162 1.00 0.00 C ATOM 135 O TRP A 9 -16.732 14.186 -2.411 1.00 0.00 O ATOM 136 CB TRP A 9 -14.099 12.211 -3.014 1.00 0.00 C ATOM 137 CG TRP A 9 -13.756 12.538 -1.586 1.00 0.00 C ATOM 138 CD1 TRP A 9 -12.580 13.061 -1.133 1.00 0.00 C ATOM 139 CD2 TRP A 9 -14.585 12.354 -0.426 1.00 0.00 C ATOM 140 NE1 TRP A 9 -12.629 13.227 0.227 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.847 12.800 0.686 1.00 0.00 C ATOM 142 CE3 TRP A 9 -15.879 11.864 -0.217 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.357 12.768 1.981 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.384 11.833 1.069 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.625 12.283 2.154 1.00 0.00 C ATOM 0 H TRP A 9 -14.320 14.976 -2.645 1.00 0.00 H new ATOM 0 HA TRP A 9 -14.988 13.061 -4.787 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -14.646 11.269 -3.038 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.175 12.057 -3.572 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -11.733 13.308 -1.756 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.879 13.607 0.804 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.474 11.515 -1.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -13.772 13.114 2.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.381 11.455 1.239 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -16.048 12.247 3.147 1.00 0.00 H new ATOM 156 N SER A 10 -17.103 12.290 -3.558 1.00 0.00 N ATOM 157 CA SER A 10 -18.373 12.001 -2.940 1.00 0.00 C ATOM 158 C SER A 10 -18.246 10.656 -2.238 1.00 0.00 C ATOM 159 O SER A 10 -17.268 9.936 -2.458 1.00 0.00 O ATOM 160 CB SER A 10 -19.487 11.972 -3.995 1.00 0.00 C ATOM 161 OG SER A 10 -20.770 11.932 -3.386 1.00 0.00 O ATOM 0 H SER A 10 -16.854 11.656 -4.318 1.00 0.00 H new ATOM 0 HA SER A 10 -18.636 12.774 -2.218 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.411 12.853 -4.632 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.360 11.101 -4.638 1.00 0.00 H new ATOM 0 HG SER A 10 -21.228 11.104 -3.642 1.00 0.00 H new ATOM 167 N GLU A 11 -19.203 10.306 -1.395 1.00 0.00 N ATOM 168 CA GLU A 11 -19.130 9.040 -0.675 1.00 0.00 C ATOM 169 C GLU A 11 -19.183 7.857 -1.639 1.00 0.00 C ATOM 170 O GLU A 11 -18.748 6.758 -1.303 1.00 0.00 O ATOM 171 CB GLU A 11 -20.231 8.950 0.377 1.00 0.00 C ATOM 172 CG GLU A 11 -19.977 9.853 1.570 1.00 0.00 C ATOM 173 CD GLU A 11 -21.082 9.795 2.598 1.00 0.00 C ATOM 174 OE1 GLU A 11 -21.074 8.871 3.437 1.00 0.00 O ATOM 175 OE2 GLU A 11 -21.960 10.682 2.576 1.00 0.00 O ATOM 0 H GLU A 11 -20.029 10.869 -1.192 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.172 8.999 -0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.185 9.216 -0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -20.317 7.919 0.719 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -19.035 9.569 2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.863 10.880 1.224 1.00 0.00 H new ATOM 182 N GLU A 12 -19.688 8.099 -2.845 1.00 0.00 N ATOM 183 CA GLU A 12 -19.649 7.102 -3.912 1.00 0.00 C ATOM 184 C GLU A 12 -18.203 6.749 -4.236 1.00 0.00 C ATOM 185 O GLU A 12 -17.846 5.577 -4.366 1.00 0.00 O ATOM 186 CB GLU A 12 -20.344 7.627 -5.176 1.00 0.00 C ATOM 187 CG GLU A 12 -21.861 7.701 -5.077 1.00 0.00 C ATOM 188 CD GLU A 12 -22.336 8.537 -3.911 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.165 9.773 -3.951 1.00 0.00 O ATOM 190 OE2 GLU A 12 -22.870 7.961 -2.943 1.00 0.00 O ATOM 0 H GLU A 12 -20.130 8.979 -3.109 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.176 6.212 -3.569 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -19.958 8.621 -5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.078 6.984 -6.015 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.260 8.117 -6.002 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.263 6.692 -4.982 1.00 0.00 H new ATOM 197 N ASP A 13 -17.372 7.781 -4.343 1.00 0.00 N ATOM 198 CA ASP A 13 -15.956 7.604 -4.634 1.00 0.00 C ATOM 199 C ASP A 13 -15.266 6.948 -3.448 1.00 0.00 C ATOM 200 O ASP A 13 -14.453 6.043 -3.614 1.00 0.00 O ATOM 201 CB ASP A 13 -15.286 8.951 -4.937 1.00 0.00 C ATOM 202 CG ASP A 13 -15.977 9.724 -6.043 1.00 0.00 C ATOM 203 OD1 ASP A 13 -15.703 9.460 -7.230 1.00 0.00 O ATOM 204 OD2 ASP A 13 -16.804 10.608 -5.727 1.00 0.00 O ATOM 0 H ASP A 13 -17.658 8.754 -4.232 1.00 0.00 H new ATOM 0 HA ASP A 13 -15.864 6.966 -5.513 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -15.275 9.557 -4.031 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -14.247 8.778 -5.217 1.00 0.00 H new ATOM 209 N LEU A 14 -15.620 7.401 -2.247 1.00 0.00 N ATOM 210 CA LEU A 14 -15.031 6.876 -1.020 1.00 0.00 C ATOM 211 C LEU A 14 -15.311 5.377 -0.894 1.00 0.00 C ATOM 212 O LEU A 14 -14.396 4.588 -0.649 1.00 0.00 O ATOM 213 CB LEU A 14 -15.585 7.620 0.201 1.00 0.00 C ATOM 214 CG LEU A 14 -14.564 7.960 1.297 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.781 6.730 1.729 1.00 0.00 C ATOM 216 CD2 LEU A 14 -13.614 9.047 0.824 1.00 0.00 C ATOM 0 H LEU A 14 -16.315 8.133 -2.099 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.953 7.029 -1.063 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.046 8.547 -0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.376 7.015 0.643 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.118 8.327 2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -13.068 7.007 2.505 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -14.469 5.979 2.119 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.245 6.321 0.873 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.898 9.274 1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.080 8.703 -0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.181 9.945 0.580 1.00 0.00 H new ATOM 228 N GLU A 15 -16.574 4.989 -1.077 1.00 0.00 N ATOM 229 CA GLU A 15 -16.957 3.582 -1.011 1.00 0.00 C ATOM 230 C GLU A 15 -16.226 2.770 -2.072 1.00 0.00 C ATOM 231 O GLU A 15 -15.803 1.647 -1.817 1.00 0.00 O ATOM 232 CB GLU A 15 -18.470 3.412 -1.166 1.00 0.00 C ATOM 233 CG GLU A 15 -19.264 3.937 0.021 1.00 0.00 C ATOM 234 CD GLU A 15 -20.746 3.657 -0.100 1.00 0.00 C ATOM 235 OE1 GLU A 15 -21.185 2.559 0.297 1.00 0.00 O ATOM 236 OE2 GLU A 15 -21.486 4.529 -0.591 1.00 0.00 O ATOM 0 H GLU A 15 -17.345 5.628 -1.271 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.670 3.209 -0.028 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.795 3.930 -2.068 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.697 2.355 -1.306 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.886 3.482 0.936 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.107 5.012 0.111 1.00 0.00 H new ATOM 243 N THR A 16 -16.062 3.352 -3.254 1.00 0.00 N ATOM 244 CA THR A 16 -15.331 2.696 -4.332 1.00 0.00 C ATOM 245 C THR A 16 -13.890 2.406 -3.909 1.00 0.00 C ATOM 246 O THR A 16 -13.361 1.324 -4.162 1.00 0.00 O ATOM 247 CB THR A 16 -15.332 3.558 -5.615 1.00 0.00 C ATOM 248 OG1 THR A 16 -16.679 3.850 -6.010 1.00 0.00 O ATOM 249 CG2 THR A 16 -14.615 2.849 -6.757 1.00 0.00 C ATOM 0 H THR A 16 -16.425 4.276 -3.490 1.00 0.00 H new ATOM 0 HA THR A 16 -15.838 1.755 -4.546 1.00 0.00 H new ATOM 0 HB THR A 16 -14.802 4.485 -5.394 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.063 4.512 -5.398 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.633 3.480 -7.645 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.581 2.653 -6.472 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.117 1.906 -6.972 1.00 0.00 H new ATOM 257 N VAL A 17 -13.271 3.375 -3.246 1.00 0.00 N ATOM 258 CA VAL A 17 -11.897 3.236 -2.782 1.00 0.00 C ATOM 259 C VAL A 17 -11.776 2.125 -1.742 1.00 0.00 C ATOM 260 O VAL A 17 -11.014 1.177 -1.928 1.00 0.00 O ATOM 261 CB VAL A 17 -11.367 4.558 -2.182 1.00 0.00 C ATOM 262 CG1 VAL A 17 -9.984 4.370 -1.572 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.329 5.643 -3.246 1.00 0.00 C ATOM 0 H VAL A 17 -13.702 4.270 -3.017 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.293 2.978 -3.652 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.048 4.864 -1.388 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.637 5.317 -1.158 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.034 3.624 -0.779 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.289 4.035 -2.342 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.954 6.568 -2.809 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.672 5.333 -4.059 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.334 5.807 -3.635 1.00 0.00 H new ATOM 273 N ILE A 18 -12.547 2.229 -0.664 1.00 0.00 N ATOM 274 CA ILE A 18 -12.441 1.277 0.436 1.00 0.00 C ATOM 275 C ILE A 18 -12.859 -0.129 0.007 1.00 0.00 C ATOM 276 O ILE A 18 -12.233 -1.111 0.400 1.00 0.00 O ATOM 277 CB ILE A 18 -13.269 1.711 1.668 1.00 0.00 C ATOM 278 CG1 ILE A 18 -14.742 1.913 1.297 1.00 0.00 C ATOM 279 CG2 ILE A 18 -12.686 2.979 2.269 1.00 0.00 C ATOM 280 CD1 ILE A 18 -15.623 2.293 2.469 1.00 0.00 C ATOM 0 H ILE A 18 -13.248 2.958 -0.529 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.389 1.261 0.720 1.00 0.00 H new ATOM 0 HB ILE A 18 -13.220 0.917 2.413 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -14.812 2.690 0.536 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -15.124 0.995 0.851 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -13.277 3.276 3.136 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -11.657 2.796 2.577 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.706 3.776 1.526 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -16.650 2.418 2.126 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.585 1.506 3.223 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -15.268 3.228 2.902 1.00 0.00 H new ATOM 292 N ARG A 19 -13.891 -0.224 -0.821 1.00 0.00 N ATOM 293 CA ARG A 19 -14.400 -1.521 -1.261 1.00 0.00 C ATOM 294 C ARG A 19 -13.430 -2.183 -2.240 1.00 0.00 C ATOM 295 O ARG A 19 -13.403 -3.406 -2.372 1.00 0.00 O ATOM 296 CB ARG A 19 -15.787 -1.351 -1.889 1.00 0.00 C ATOM 297 CG ARG A 19 -16.468 -2.654 -2.278 1.00 0.00 C ATOM 298 CD ARG A 19 -17.927 -2.426 -2.644 1.00 0.00 C ATOM 299 NE ARG A 19 -18.721 -2.008 -1.485 1.00 0.00 N ATOM 300 CZ ARG A 19 -19.691 -1.097 -1.526 1.00 0.00 C ATOM 301 NH1 ARG A 19 -19.979 -0.470 -2.659 1.00 0.00 N ATOM 302 NH2 ARG A 19 -20.367 -0.806 -0.422 1.00 0.00 N ATOM 0 H ARG A 19 -14.393 0.578 -1.202 1.00 0.00 H new ATOM 0 HA ARG A 19 -14.490 -2.176 -0.394 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -16.427 -0.817 -1.186 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.696 -0.725 -2.776 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -15.945 -3.103 -3.122 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -16.404 -3.361 -1.451 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.992 -1.665 -3.422 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.345 -3.343 -3.059 1.00 0.00 H new ATOM 0 HE ARG A 19 -18.517 -2.445 -0.586 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -19.456 -0.684 -3.508 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -20.724 0.227 -2.681 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -20.143 -1.280 0.453 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -21.111 -0.109 -0.448 1.00 0.00 H new ATOM 316 N ALA A 20 -12.622 -1.372 -2.915 1.00 0.00 N ATOM 317 CA ALA A 20 -11.602 -1.895 -3.813 1.00 0.00 C ATOM 318 C ALA A 20 -10.424 -2.444 -3.016 1.00 0.00 C ATOM 319 O ALA A 20 -9.770 -3.406 -3.429 1.00 0.00 O ATOM 320 CB ALA A 20 -11.132 -0.817 -4.780 1.00 0.00 C ATOM 0 H ALA A 20 -12.654 -0.354 -2.857 1.00 0.00 H new ATOM 0 HA ALA A 20 -12.040 -2.708 -4.393 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.370 -1.229 -5.442 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.977 -0.467 -5.373 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.712 0.018 -4.218 1.00 0.00 H new ATOM 326 N VAL A 21 -10.157 -1.824 -1.872 1.00 0.00 N ATOM 327 CA VAL A 21 -9.069 -2.249 -1.005 1.00 0.00 C ATOM 328 C VAL A 21 -9.481 -3.468 -0.185 1.00 0.00 C ATOM 329 O VAL A 21 -8.824 -4.510 -0.239 1.00 0.00 O ATOM 330 CB VAL A 21 -8.620 -1.115 -0.058 1.00 0.00 C ATOM 331 CG1 VAL A 21 -7.474 -1.576 0.827 1.00 0.00 C ATOM 332 CG2 VAL A 21 -8.216 0.119 -0.850 1.00 0.00 C ATOM 0 H VAL A 21 -10.683 -1.022 -1.524 1.00 0.00 H new ATOM 0 HA VAL A 21 -8.228 -2.512 -1.647 1.00 0.00 H new ATOM 0 HB VAL A 21 -9.464 -0.853 0.580 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -7.173 -0.762 1.486 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.797 -2.428 1.426 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.629 -1.870 0.204 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.903 0.906 -0.163 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.390 -0.131 -1.516 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -9.065 0.467 -1.439 1.00 0.00 H new ATOM 342 N TYR A 22 -10.579 -3.336 0.560 1.00 0.00 N ATOM 343 CA TYR A 22 -11.086 -4.440 1.366 1.00 0.00 C ATOM 344 C TYR A 22 -11.574 -5.573 0.470 1.00 0.00 C ATOM 345 O TYR A 22 -10.892 -6.588 0.303 1.00 0.00 O ATOM 346 CB TYR A 22 -12.248 -3.995 2.266 1.00 0.00 C ATOM 347 CG TYR A 22 -11.902 -2.963 3.318 1.00 0.00 C ATOM 348 CD1 TYR A 22 -10.934 -3.211 4.281 1.00 0.00 C ATOM 349 CD2 TYR A 22 -12.581 -1.755 3.367 1.00 0.00 C ATOM 350 CE1 TYR A 22 -10.650 -2.278 5.263 1.00 0.00 C ATOM 351 CE2 TYR A 22 -12.300 -0.816 4.338 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.336 -1.082 5.287 1.00 0.00 C ATOM 353 OH TYR A 22 -11.065 -0.152 6.265 1.00 0.00 O ATOM 0 H TYR A 22 -11.130 -2.480 0.620 1.00 0.00 H new ATOM 0 HA TYR A 22 -10.263 -4.783 1.992 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -13.040 -3.592 1.634 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -12.655 -4.874 2.765 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -10.394 -4.146 4.264 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -13.344 -1.545 2.632 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -9.895 -2.486 6.007 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -12.833 0.123 4.355 1.00 0.00 H new ATOM 0 HH TYR A 22 -11.906 0.221 6.604 1.00 0.00 H new ATOM 586 N LEU A 37 -9.823 -1.517 11.397 1.00 0.00 N ATOM 587 CA LEU A 37 -9.420 -0.539 10.389 1.00 0.00 C ATOM 588 C LEU A 37 -10.519 0.474 10.102 1.00 0.00 C ATOM 589 O LEU A 37 -10.349 1.361 9.266 1.00 0.00 O ATOM 590 CB LEU A 37 -9.023 -1.246 9.096 1.00 0.00 C ATOM 591 CG LEU A 37 -7.842 -2.206 9.217 1.00 0.00 C ATOM 592 CD1 LEU A 37 -7.554 -2.847 7.876 1.00 0.00 C ATOM 593 CD2 LEU A 37 -6.609 -1.478 9.727 1.00 0.00 C ATOM 0 HA LEU A 37 -8.564 0.003 10.790 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.885 -1.800 8.724 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.782 -0.491 8.347 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.101 -2.985 9.934 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.710 -3.530 7.973 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.432 -3.400 7.541 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.313 -2.073 7.147 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.779 -2.180 9.806 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.345 -0.680 9.033 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.818 -1.051 10.708 1.00 0.00 H new ATOM 605 N VAL A 38 -11.633 0.358 10.806 1.00 0.00 N ATOM 606 CA VAL A 38 -12.745 1.277 10.613 1.00 0.00 C ATOM 607 C VAL A 38 -12.357 2.673 11.094 1.00 0.00 C ATOM 608 O VAL A 38 -12.848 3.681 10.589 1.00 0.00 O ATOM 609 CB VAL A 38 -14.018 0.785 11.335 1.00 0.00 C ATOM 610 CG1 VAL A 38 -15.164 1.776 11.178 1.00 0.00 C ATOM 611 CG2 VAL A 38 -14.427 -0.579 10.802 1.00 0.00 C ATOM 0 H VAL A 38 -11.792 -0.360 11.513 1.00 0.00 H new ATOM 0 HA VAL A 38 -12.970 1.319 9.547 1.00 0.00 H new ATOM 0 HB VAL A 38 -13.791 0.702 12.398 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.045 1.399 11.698 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -14.875 2.737 11.603 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -15.394 1.902 10.120 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.326 -0.917 11.318 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -14.628 -0.507 9.733 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -13.621 -1.293 10.972 1.00 0.00 H new ATOM 621 N SER A 39 -11.455 2.725 12.059 1.00 0.00 N ATOM 622 CA SER A 39 -10.875 3.983 12.498 1.00 0.00 C ATOM 623 C SER A 39 -10.122 4.652 11.344 1.00 0.00 C ATOM 624 O SER A 39 -10.267 5.854 11.104 1.00 0.00 O ATOM 625 CB SER A 39 -9.932 3.724 13.675 1.00 0.00 C ATOM 626 OG SER A 39 -9.035 2.667 13.375 1.00 0.00 O ATOM 0 H SER A 39 -11.107 1.905 12.556 1.00 0.00 H new ATOM 0 HA SER A 39 -11.671 4.655 12.820 1.00 0.00 H new ATOM 0 HB2 SER A 39 -9.371 4.630 13.904 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.512 3.475 14.564 1.00 0.00 H new ATOM 0 HG SER A 39 -8.439 2.517 14.138 1.00 0.00 H new ATOM 632 N ALA A 40 -9.355 3.848 10.610 1.00 0.00 N ATOM 633 CA ALA A 40 -8.554 4.332 9.491 1.00 0.00 C ATOM 634 C ALA A 40 -9.438 4.912 8.391 1.00 0.00 C ATOM 635 O ALA A 40 -9.216 6.036 7.935 1.00 0.00 O ATOM 636 CB ALA A 40 -7.683 3.211 8.936 1.00 0.00 C ATOM 0 H ALA A 40 -9.272 2.845 10.775 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.908 5.129 9.860 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.092 3.589 8.102 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.016 2.847 9.718 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.317 2.394 8.591 1.00 0.00 H new ATOM 642 N GLU A 41 -10.448 4.152 7.975 1.00 0.00 N ATOM 643 CA GLU A 41 -11.354 4.598 6.916 1.00 0.00 C ATOM 644 C GLU A 41 -12.143 5.835 7.347 1.00 0.00 C ATOM 645 O GLU A 41 -12.492 6.675 6.519 1.00 0.00 O ATOM 646 CB GLU A 41 -12.309 3.473 6.504 1.00 0.00 C ATOM 647 CG GLU A 41 -13.114 2.913 7.660 1.00 0.00 C ATOM 648 CD GLU A 41 -14.117 1.866 7.234 1.00 0.00 C ATOM 649 OE1 GLU A 41 -13.712 0.709 7.010 1.00 0.00 O ATOM 650 OE2 GLU A 41 -15.322 2.197 7.148 1.00 0.00 O ATOM 0 H GLU A 41 -10.660 3.228 8.352 1.00 0.00 H new ATOM 0 HA GLU A 41 -10.745 4.868 6.053 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.993 3.848 5.743 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.734 2.667 6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.433 2.478 8.392 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.639 3.728 8.158 1.00 0.00 H new ATOM 657 N SER A 42 -12.415 5.951 8.643 1.00 0.00 N ATOM 658 CA SER A 42 -13.102 7.124 9.169 1.00 0.00 C ATOM 659 C SER A 42 -12.198 8.351 9.076 1.00 0.00 C ATOM 660 O SER A 42 -12.639 9.432 8.682 1.00 0.00 O ATOM 661 CB SER A 42 -13.545 6.888 10.616 1.00 0.00 C ATOM 662 OG SER A 42 -14.393 5.753 10.710 1.00 0.00 O ATOM 0 H SER A 42 -12.172 5.251 9.344 1.00 0.00 H new ATOM 0 HA SER A 42 -13.993 7.303 8.567 1.00 0.00 H new ATOM 0 HB2 SER A 42 -12.669 6.746 11.249 1.00 0.00 H new ATOM 0 HB3 SER A 42 -14.068 7.769 10.988 1.00 0.00 H new ATOM 0 HG SER A 42 -13.853 4.955 10.891 1.00 0.00 H new ATOM 668 N LEU A 43 -10.924 8.174 9.416 1.00 0.00 N ATOM 669 CA LEU A 43 -9.945 9.246 9.288 1.00 0.00 C ATOM 670 C LEU A 43 -9.786 9.643 7.824 1.00 0.00 C ATOM 671 O LEU A 43 -9.672 10.825 7.500 1.00 0.00 O ATOM 672 CB LEU A 43 -8.594 8.818 9.869 1.00 0.00 C ATOM 673 CG LEU A 43 -8.580 8.571 11.381 1.00 0.00 C ATOM 674 CD1 LEU A 43 -7.209 8.094 11.834 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.979 9.835 12.131 1.00 0.00 C ATOM 0 H LEU A 43 -10.547 7.299 9.781 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.304 10.108 9.851 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.273 7.906 9.366 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.857 9.587 9.636 1.00 0.00 H new ATOM 0 HG LEU A 43 -9.306 7.790 11.607 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.220 7.924 12.911 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.960 7.164 11.323 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.463 8.851 11.594 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.964 9.642 13.204 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.276 10.634 11.896 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.983 10.135 11.831 1.00 0.00 H new ATOM 687 N LEU A 44 -9.788 8.648 6.947 1.00 0.00 N ATOM 688 CA LEU A 44 -9.730 8.885 5.508 1.00 0.00 C ATOM 689 C LEU A 44 -10.955 9.672 5.052 1.00 0.00 C ATOM 690 O LEU A 44 -10.850 10.602 4.254 1.00 0.00 O ATOM 691 CB LEU A 44 -9.653 7.550 4.759 1.00 0.00 C ATOM 692 CG LEU A 44 -9.547 7.656 3.235 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.247 8.337 2.832 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.649 6.278 2.598 1.00 0.00 C ATOM 0 H LEU A 44 -9.829 7.663 7.208 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.837 9.468 5.284 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -8.791 6.995 5.128 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.538 6.964 5.005 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.376 8.265 2.875 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.192 8.402 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.214 9.340 3.258 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.402 7.757 3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.572 6.371 1.515 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.841 5.646 2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.608 5.828 2.856 1.00 0.00 H new ATOM 706 N ARG A 45 -12.112 9.304 5.589 1.00 0.00 N ATOM 707 CA ARG A 45 -13.373 9.962 5.260 1.00 0.00 C ATOM 708 C ARG A 45 -13.355 11.428 5.692 1.00 0.00 C ATOM 709 O ARG A 45 -14.000 12.277 5.079 1.00 0.00 O ATOM 710 CB ARG A 45 -14.522 9.232 5.953 1.00 0.00 C ATOM 711 CG ARG A 45 -15.903 9.650 5.483 1.00 0.00 C ATOM 712 CD ARG A 45 -16.993 8.980 6.310 1.00 0.00 C ATOM 713 NE ARG A 45 -16.741 7.552 6.500 1.00 0.00 N ATOM 714 CZ ARG A 45 -17.296 6.588 5.764 1.00 0.00 C ATOM 715 NH1 ARG A 45 -18.150 6.893 4.798 1.00 0.00 N ATOM 716 NH2 ARG A 45 -17.005 5.317 6.010 1.00 0.00 N ATOM 0 H ARG A 45 -12.204 8.544 6.263 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.512 9.928 4.179 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.405 8.160 5.792 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.450 9.403 7.027 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.002 10.733 5.555 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.027 9.388 4.432 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.061 9.468 7.282 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -17.956 9.115 5.817 1.00 0.00 H new ATOM 0 HE ARG A 45 -16.100 7.275 7.243 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -18.385 7.868 4.615 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.572 6.152 4.238 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -16.358 5.078 6.761 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -17.429 4.579 5.448 1.00 0.00 H new ATOM 730 N ASN A 46 -12.619 11.717 6.756 1.00 0.00 N ATOM 731 CA ASN A 46 -12.509 13.082 7.259 1.00 0.00 C ATOM 732 C ASN A 46 -11.416 13.846 6.526 1.00 0.00 C ATOM 733 O ASN A 46 -11.314 15.064 6.646 1.00 0.00 O ATOM 734 CB ASN A 46 -12.208 13.089 8.761 1.00 0.00 C ATOM 735 CG ASN A 46 -13.296 12.431 9.583 1.00 0.00 C ATOM 736 OD1 ASN A 46 -14.467 12.426 9.200 1.00 0.00 O ATOM 737 ND2 ASN A 46 -12.922 11.883 10.727 1.00 0.00 N ATOM 0 H ASN A 46 -12.089 11.027 7.288 1.00 0.00 H new ATOM 0 HA ASN A 46 -13.467 13.572 7.083 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -11.264 12.575 8.940 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -12.079 14.118 9.096 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -13.614 11.435 11.328 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -11.942 11.908 11.008 1.00 0.00 H new ATOM 744 N GLY A 47 -10.603 13.122 5.763 1.00 0.00 N ATOM 745 CA GLY A 47 -9.466 13.733 5.098 1.00 0.00 C ATOM 746 C GLY A 47 -8.321 13.964 6.059 1.00 0.00 C ATOM 747 O GLY A 47 -7.449 14.798 5.819 1.00 0.00 O ATOM 0 H GLY A 47 -10.711 12.122 5.593 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.133 13.092 4.281 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.769 14.682 4.656 1.00 0.00 H new ATOM 751 N LYS A 48 -8.332 13.216 7.153 1.00 0.00 N ATOM 752 CA LYS A 48 -7.336 13.358 8.199 1.00 0.00 C ATOM 753 C LYS A 48 -6.050 12.636 7.802 1.00 0.00 C ATOM 754 O LYS A 48 -4.947 13.118 8.065 1.00 0.00 O ATOM 755 CB LYS A 48 -7.900 12.791 9.506 1.00 0.00 C ATOM 756 CG LYS A 48 -7.390 13.489 10.754 1.00 0.00 C ATOM 757 CD LYS A 48 -5.986 13.056 11.113 1.00 0.00 C ATOM 758 CE LYS A 48 -5.412 13.923 12.213 1.00 0.00 C ATOM 759 NZ LYS A 48 -4.108 13.405 12.706 1.00 0.00 N ATOM 0 H LYS A 48 -9.031 12.496 7.338 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.098 14.412 8.342 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.987 12.862 9.481 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.651 11.732 9.568 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.408 14.568 10.599 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.059 13.276 11.588 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.994 12.014 11.434 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.348 13.113 10.231 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.282 14.940 11.843 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.119 13.973 13.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -3.749 14.027 13.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.236 12.444 13.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.425 13.381 11.922 1.00 0.00 H new ATOM 773 N ILE A 49 -6.201 11.483 7.161 1.00 0.00 N ATOM 774 CA ILE A 49 -5.058 10.711 6.692 1.00 0.00 C ATOM 775 C ILE A 49 -5.183 10.444 5.195 1.00 0.00 C ATOM 776 O ILE A 49 -6.289 10.431 4.650 1.00 0.00 O ATOM 777 CB ILE A 49 -4.898 9.378 7.475 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.163 8.511 7.397 1.00 0.00 C ATOM 779 CG2 ILE A 49 -4.549 9.660 8.932 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.194 7.555 6.223 1.00 0.00 C ATOM 0 H ILE A 49 -7.107 11.062 6.954 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.161 11.302 6.875 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.085 8.821 7.008 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.253 7.938 8.320 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -7.034 9.164 7.341 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.440 8.718 9.469 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.613 10.216 8.981 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.345 10.248 9.389 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.121 6.982 6.245 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.138 8.120 5.292 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.345 6.874 6.286 1.00 0.00 H new ATOM 792 N THR A 50 -4.052 10.248 4.531 1.00 0.00 N ATOM 793 CA THR A 50 -4.044 10.025 3.094 1.00 0.00 C ATOM 794 C THR A 50 -4.295 8.555 2.775 1.00 0.00 C ATOM 795 O THR A 50 -4.194 7.695 3.655 1.00 0.00 O ATOM 796 CB THR A 50 -2.702 10.463 2.471 1.00 0.00 C ATOM 797 OG1 THR A 50 -1.614 9.757 3.087 1.00 0.00 O ATOM 798 CG2 THR A 50 -2.493 11.963 2.630 1.00 0.00 C ATOM 0 H THR A 50 -3.129 10.239 4.965 1.00 0.00 H new ATOM 0 HA THR A 50 -4.844 10.628 2.665 1.00 0.00 H new ATOM 0 HB THR A 50 -2.731 10.225 1.408 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.768 10.042 2.682 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.540 12.247 2.183 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.302 12.498 2.132 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.487 12.219 3.689 1.00 0.00 H new ATOM 806 N VAL A 51 -4.611 8.264 1.515 1.00 0.00 N ATOM 807 CA VAL A 51 -4.831 6.889 1.079 1.00 0.00 C ATOM 808 C VAL A 51 -3.564 6.061 1.287 1.00 0.00 C ATOM 809 O VAL A 51 -3.629 4.860 1.543 1.00 0.00 O ATOM 810 CB VAL A 51 -5.259 6.835 -0.405 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.504 5.404 -0.857 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.501 7.679 -0.630 1.00 0.00 C ATOM 0 H VAL A 51 -4.720 8.962 0.779 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.637 6.470 1.681 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.443 7.242 -1.003 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.804 5.400 -1.905 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.589 4.823 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.295 4.962 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.789 7.630 -1.680 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.315 7.300 -0.012 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.292 8.714 -0.359 1.00 0.00 H new ATOM 822 N ARG A 52 -2.416 6.727 1.204 1.00 0.00 N ATOM 823 CA ARG A 52 -1.128 6.090 1.459 1.00 0.00 C ATOM 824 C ARG A 52 -1.132 5.400 2.826 1.00 0.00 C ATOM 825 O ARG A 52 -0.738 4.240 2.954 1.00 0.00 O ATOM 826 CB ARG A 52 -0.014 7.137 1.423 1.00 0.00 C ATOM 827 CG ARG A 52 1.380 6.537 1.398 1.00 0.00 C ATOM 828 CD ARG A 52 2.446 7.565 1.731 1.00 0.00 C ATOM 829 NE ARG A 52 2.495 7.861 3.165 1.00 0.00 N ATOM 830 CZ ARG A 52 3.597 8.242 3.810 1.00 0.00 C ATOM 831 NH1 ARG A 52 4.748 8.371 3.160 1.00 0.00 N ATOM 832 NH2 ARG A 52 3.550 8.474 5.112 1.00 0.00 N ATOM 0 H ARG A 52 -2.352 7.715 0.960 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.953 5.343 0.685 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.146 7.766 0.543 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.107 7.785 2.295 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.434 5.714 2.111 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.577 6.117 0.412 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.419 7.198 1.403 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.249 8.483 1.178 1.00 0.00 H new ATOM 0 HE ARG A 52 1.633 7.770 3.702 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.793 8.178 2.159 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.587 8.663 3.661 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.672 8.361 5.619 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.392 8.766 5.609 1.00 0.00 H new ATOM 846 N GLU A 53 -1.597 6.127 3.838 1.00 0.00 N ATOM 847 CA GLU A 53 -1.670 5.604 5.199 1.00 0.00 C ATOM 848 C GLU A 53 -2.684 4.465 5.277 1.00 0.00 C ATOM 849 O GLU A 53 -2.434 3.432 5.902 1.00 0.00 O ATOM 850 CB GLU A 53 -2.075 6.715 6.172 1.00 0.00 C ATOM 851 CG GLU A 53 -1.138 7.913 6.178 1.00 0.00 C ATOM 852 CD GLU A 53 0.254 7.563 6.656 1.00 0.00 C ATOM 853 OE1 GLU A 53 0.446 7.402 7.880 1.00 0.00 O ATOM 854 OE2 GLU A 53 1.164 7.433 5.814 1.00 0.00 O ATOM 0 H GLU A 53 -1.931 7.086 3.740 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.686 5.225 5.474 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.079 7.055 5.919 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.123 6.301 7.179 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.079 8.328 5.172 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.553 8.691 6.819 1.00 0.00 H new ATOM 861 N PHE A 54 -3.823 4.668 4.625 1.00 0.00 N ATOM 862 CA PHE A 54 -4.914 3.700 4.633 1.00 0.00 C ATOM 863 C PHE A 54 -4.476 2.361 4.040 1.00 0.00 C ATOM 864 O PHE A 54 -4.655 1.314 4.661 1.00 0.00 O ATOM 865 CB PHE A 54 -6.109 4.264 3.855 1.00 0.00 C ATOM 866 CG PHE A 54 -7.293 3.339 3.789 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.108 3.152 4.895 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.590 2.656 2.620 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.194 2.302 4.835 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.676 1.803 2.555 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.478 1.625 3.664 1.00 0.00 C ATOM 0 H PHE A 54 -4.016 5.506 4.077 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.207 3.521 5.668 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.419 5.201 4.317 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.789 4.500 2.840 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.891 3.677 5.813 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.965 2.792 1.749 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.822 2.166 5.703 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.896 1.277 1.638 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.326 0.958 3.617 1.00 0.00 H new ATOM 881 N VAL A 55 -3.894 2.405 2.843 1.00 0.00 N ATOM 882 CA VAL A 55 -3.454 1.193 2.156 1.00 0.00 C ATOM 883 C VAL A 55 -2.441 0.425 3.002 1.00 0.00 C ATOM 884 O VAL A 55 -2.521 -0.799 3.119 1.00 0.00 O ATOM 885 CB VAL A 55 -2.840 1.512 0.770 1.00 0.00 C ATOM 886 CG1 VAL A 55 -2.325 0.248 0.096 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.865 2.201 -0.120 1.00 0.00 C ATOM 0 H VAL A 55 -3.716 3.268 2.329 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.338 0.573 2.005 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.996 2.185 0.923 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.899 0.501 -0.875 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.558 -0.210 0.720 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -3.148 -0.453 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.417 2.418 -1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.727 1.547 -0.256 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.186 3.132 0.348 1.00 0.00 H new ATOM 897 N ARG A 56 -1.509 1.153 3.610 1.00 0.00 N ATOM 898 CA ARG A 56 -0.496 0.538 4.460 1.00 0.00 C ATOM 899 C ARG A 56 -1.148 -0.197 5.620 1.00 0.00 C ATOM 900 O ARG A 56 -0.834 -1.359 5.883 1.00 0.00 O ATOM 901 CB ARG A 56 0.469 1.592 5.003 1.00 0.00 C ATOM 902 CG ARG A 56 1.597 1.007 5.844 1.00 0.00 C ATOM 903 CD ARG A 56 2.412 2.096 6.520 1.00 0.00 C ATOM 904 NE ARG A 56 1.613 2.858 7.477 1.00 0.00 N ATOM 905 CZ ARG A 56 1.428 4.175 7.418 1.00 0.00 C ATOM 906 NH1 ARG A 56 1.962 4.882 6.429 1.00 0.00 N ATOM 907 NH2 ARG A 56 0.709 4.784 8.350 1.00 0.00 N ATOM 0 H ARG A 56 -1.435 2.167 3.530 1.00 0.00 H new ATOM 0 HA ARG A 56 0.062 -0.174 3.853 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.898 2.145 4.168 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.089 2.308 5.606 1.00 0.00 H new ATOM 0 HG2 ARG A 56 1.181 0.341 6.600 1.00 0.00 H new ATOM 0 HG3 ARG A 56 2.248 0.404 5.211 1.00 0.00 H new ATOM 0 HD2 ARG A 56 3.263 1.648 7.033 1.00 0.00 H new ATOM 0 HD3 ARG A 56 2.815 2.771 5.764 1.00 0.00 H new ATOM 0 HE ARG A 56 1.168 2.348 8.240 1.00 0.00 H new ATOM 0 HH11 ARG A 56 2.516 4.416 5.711 1.00 0.00 H new ATOM 0 HH12 ARG A 56 1.818 5.891 6.388 1.00 0.00 H new ATOM 0 HH21 ARG A 56 0.298 4.244 9.111 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.567 5.793 8.306 1.00 0.00 H new ATOM 921 N ALA A 57 -2.063 0.488 6.298 1.00 0.00 N ATOM 922 CA ALA A 57 -2.738 -0.064 7.465 1.00 0.00 C ATOM 923 C ALA A 57 -3.470 -1.360 7.127 1.00 0.00 C ATOM 924 O ALA A 57 -3.412 -2.323 7.887 1.00 0.00 O ATOM 925 CB ALA A 57 -3.707 0.957 8.041 1.00 0.00 C ATOM 0 H ALA A 57 -2.355 1.435 6.056 1.00 0.00 H new ATOM 0 HA ALA A 57 -1.980 -0.297 8.212 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.206 0.534 8.913 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.160 1.852 8.335 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.451 1.218 7.288 1.00 0.00 H new ATOM 931 N VAL A 58 -4.148 -1.378 5.986 1.00 0.00 N ATOM 932 CA VAL A 58 -4.887 -2.560 5.554 1.00 0.00 C ATOM 933 C VAL A 58 -3.934 -3.704 5.212 1.00 0.00 C ATOM 934 O VAL A 58 -4.165 -4.855 5.589 1.00 0.00 O ATOM 935 CB VAL A 58 -5.782 -2.259 4.329 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.567 -3.497 3.913 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.730 -1.108 4.630 1.00 0.00 C ATOM 0 H VAL A 58 -4.202 -0.588 5.343 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.525 -2.856 6.387 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.135 -1.970 3.501 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.189 -3.260 3.050 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.874 -4.297 3.653 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.201 -3.821 4.739 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.352 -0.911 3.757 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.365 -1.372 5.476 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.153 -0.216 4.874 1.00 0.00 H new ATOM 947 N ALA A 59 -2.853 -3.377 4.513 1.00 0.00 N ATOM 948 CA ALA A 59 -1.888 -4.380 4.076 1.00 0.00 C ATOM 949 C ALA A 59 -1.194 -5.051 5.259 1.00 0.00 C ATOM 950 O ALA A 59 -1.012 -6.268 5.270 1.00 0.00 O ATOM 951 CB ALA A 59 -0.860 -3.756 3.147 1.00 0.00 C ATOM 0 H ALA A 59 -2.622 -2.423 4.236 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.437 -5.150 3.535 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.147 -4.517 2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.363 -3.343 2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.331 -2.960 3.671 1.00 0.00 H new ATOM 957 N LYS A 60 -0.818 -4.258 6.254 1.00 0.00 N ATOM 958 CA LYS A 60 -0.088 -4.778 7.409 1.00 0.00 C ATOM 959 C LYS A 60 -1.040 -5.137 8.551 1.00 0.00 C ATOM 960 O LYS A 60 -0.615 -5.315 9.695 1.00 0.00 O ATOM 961 CB LYS A 60 0.970 -3.762 7.874 1.00 0.00 C ATOM 962 CG LYS A 60 0.398 -2.470 8.440 1.00 0.00 C ATOM 963 CD LYS A 60 1.473 -1.398 8.598 1.00 0.00 C ATOM 964 CE LYS A 60 2.609 -1.851 9.504 1.00 0.00 C ATOM 965 NZ LYS A 60 3.642 -0.793 9.680 1.00 0.00 N ATOM 0 H LYS A 60 -1.004 -3.256 6.287 1.00 0.00 H new ATOM 0 HA LYS A 60 0.421 -5.693 7.106 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.596 -4.230 8.633 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.618 -3.519 7.031 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -0.389 -2.102 7.782 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.062 -2.669 9.408 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.873 -1.140 7.617 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.024 -0.493 9.007 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.206 -2.129 10.478 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.073 -2.744 9.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.536 -1.228 9.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.789 -0.298 8.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.324 -0.113 10.400 1.00 0.00 H new ATOM 979 N SER A 61 -2.323 -5.251 8.239 1.00 0.00 N ATOM 980 CA SER A 61 -3.319 -5.605 9.221 1.00 0.00 C ATOM 981 C SER A 61 -3.416 -7.128 9.356 1.00 0.00 C ATOM 982 O SER A 61 -2.861 -7.872 8.543 1.00 0.00 O ATOM 983 CB SER A 61 -4.658 -4.986 8.810 1.00 0.00 C ATOM 984 OG SER A 61 -5.734 -5.534 9.536 1.00 0.00 O ATOM 0 H SER A 61 -2.694 -5.100 7.301 1.00 0.00 H new ATOM 0 HA SER A 61 -3.038 -5.214 10.199 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.624 -3.908 8.969 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.820 -5.146 7.744 1.00 0.00 H new ATOM 0 HG SER A 61 -6.545 -5.513 8.986 1.00 0.00 H new ATOM 990 N GLU A 62 -4.121 -7.578 10.387 1.00 0.00 N ATOM 991 CA GLU A 62 -4.234 -8.998 10.699 1.00 0.00 C ATOM 992 C GLU A 62 -5.119 -9.731 9.683 1.00 0.00 C ATOM 993 O GLU A 62 -6.302 -9.972 9.924 1.00 0.00 O ATOM 994 CB GLU A 62 -4.795 -9.163 12.116 1.00 0.00 C ATOM 995 CG GLU A 62 -4.875 -10.603 12.596 1.00 0.00 C ATOM 996 CD GLU A 62 -5.639 -10.723 13.897 1.00 0.00 C ATOM 997 OE1 GLU A 62 -6.887 -10.689 13.855 1.00 0.00 O ATOM 998 OE2 GLU A 62 -5.000 -10.842 14.964 1.00 0.00 O ATOM 0 H GLU A 62 -4.630 -6.970 11.029 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.241 -9.444 10.644 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.173 -8.596 12.808 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.792 -8.725 12.152 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.359 -11.213 11.833 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.868 -10.998 12.729 1.00 0.00 H new ATOM 1005 N LEU A 63 -4.544 -10.041 8.526 1.00 0.00 N ATOM 1006 CA LEU A 63 -5.233 -10.827 7.503 1.00 0.00 C ATOM 1007 C LEU A 63 -4.394 -12.035 7.105 1.00 0.00 C ATOM 1008 O LEU A 63 -4.885 -13.161 7.046 1.00 0.00 O ATOM 1009 CB LEU A 63 -5.529 -9.987 6.247 1.00 0.00 C ATOM 1010 CG LEU A 63 -6.712 -9.009 6.337 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -7.944 -9.700 6.903 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -6.351 -7.780 7.157 1.00 0.00 C ATOM 0 H LEU A 63 -3.598 -9.759 8.270 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.178 -11.158 7.933 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.634 -9.417 5.999 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.713 -10.669 5.417 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.946 -8.675 5.326 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.768 -8.988 6.957 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -8.225 -10.531 6.256 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.723 -10.076 7.902 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -7.208 -7.108 7.202 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.075 -8.084 8.167 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.511 -7.266 6.691 1.00 0.00 H new ATOM 1024 N TYR A 64 -3.115 -11.788 6.849 1.00 0.00 N ATOM 1025 CA TYR A 64 -2.187 -12.821 6.385 1.00 0.00 C ATOM 1026 C TYR A 64 -1.928 -13.881 7.457 1.00 0.00 C ATOM 1027 O TYR A 64 -1.509 -14.992 7.146 1.00 0.00 O ATOM 1028 CB TYR A 64 -0.860 -12.169 5.975 1.00 0.00 C ATOM 1029 CG TYR A 64 -0.240 -11.327 7.072 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -0.549 -9.979 7.198 1.00 0.00 C ATOM 1031 CD2 TYR A 64 0.633 -11.887 7.998 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -0.009 -9.215 8.211 1.00 0.00 C ATOM 1033 CE2 TYR A 64 1.181 -11.127 9.012 1.00 0.00 C ATOM 1034 CZ TYR A 64 0.854 -9.792 9.115 1.00 0.00 C ATOM 1035 OH TYR A 64 1.381 -9.034 10.130 1.00 0.00 O ATOM 0 H TYR A 64 -2.689 -10.868 6.956 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.643 -13.320 5.530 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -0.156 -12.948 5.683 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -1.026 -11.544 5.097 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -1.224 -9.521 6.490 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.887 -12.934 7.923 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -0.262 -8.168 8.295 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.862 -11.576 9.720 1.00 0.00 H new ATOM 0 HH TYR A 64 2.360 -9.064 10.086 1.00 0.00 H new ATOM 1045 N LYS A 65 -2.218 -13.536 8.705 1.00 0.00 N ATOM 1046 CA LYS A 65 -1.882 -14.375 9.855 1.00 0.00 C ATOM 1047 C LYS A 65 -2.452 -15.794 9.736 1.00 0.00 C ATOM 1048 O LYS A 65 -1.857 -16.746 10.233 1.00 0.00 O ATOM 1049 CB LYS A 65 -2.408 -13.725 11.140 1.00 0.00 C ATOM 1050 CG LYS A 65 -1.972 -14.436 12.411 1.00 0.00 C ATOM 1051 CD LYS A 65 -0.497 -14.215 12.704 1.00 0.00 C ATOM 1052 CE LYS A 65 -0.048 -15.014 13.918 1.00 0.00 C ATOM 1053 NZ LYS A 65 1.290 -14.586 14.403 1.00 0.00 N ATOM 0 H LYS A 65 -2.693 -12.667 8.952 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.796 -14.458 9.885 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.067 -12.690 11.178 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.497 -13.700 11.104 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.567 -14.077 13.251 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.168 -15.504 12.315 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.096 -14.505 11.836 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.313 -13.154 12.876 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.778 -14.897 14.719 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.020 -16.074 13.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.558 -15.156 15.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.992 -14.721 13.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.257 -13.581 14.670 1.00 0.00 H new ATOM 1185 N PHE A 73 9.310 -20.425 1.757 1.00 0.00 N ATOM 1186 CA PHE A 73 9.535 -19.427 0.710 1.00 0.00 C ATOM 1187 C PHE A 73 9.052 -18.046 1.134 1.00 0.00 C ATOM 1188 O PHE A 73 7.880 -17.701 0.984 1.00 0.00 O ATOM 1189 CB PHE A 73 8.880 -19.846 -0.611 1.00 0.00 C ATOM 1190 CG PHE A 73 9.630 -20.930 -1.335 1.00 0.00 C ATOM 1191 CD1 PHE A 73 9.516 -22.253 -0.946 1.00 0.00 C ATOM 1192 CD2 PHE A 73 10.455 -20.618 -2.402 1.00 0.00 C ATOM 1193 CE1 PHE A 73 10.207 -23.247 -1.611 1.00 0.00 C ATOM 1194 CE2 PHE A 73 11.150 -21.606 -3.071 1.00 0.00 C ATOM 1195 CZ PHE A 73 11.025 -22.922 -2.675 1.00 0.00 C ATOM 0 HA PHE A 73 10.612 -19.369 0.552 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.865 -20.189 -0.411 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.800 -18.974 -1.260 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.879 -22.511 -0.113 1.00 0.00 H new ATOM 0 HD2 PHE A 73 10.556 -19.589 -2.715 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.108 -24.276 -1.299 1.00 0.00 H new ATOM 0 HE2 PHE A 73 11.790 -21.349 -3.902 1.00 0.00 H new ATOM 0 HZ PHE A 73 11.567 -23.697 -3.197 1.00 0.00 H new ATOM 1205 N GLN A 74 9.975 -17.250 1.660 1.00 0.00 N ATOM 1206 CA GLN A 74 9.656 -15.905 2.125 1.00 0.00 C ATOM 1207 C GLN A 74 9.256 -15.013 0.955 1.00 0.00 C ATOM 1208 O GLN A 74 8.529 -14.033 1.127 1.00 0.00 O ATOM 1209 CB GLN A 74 10.846 -15.303 2.873 1.00 0.00 C ATOM 1210 CG GLN A 74 11.352 -16.176 4.015 1.00 0.00 C ATOM 1211 CD GLN A 74 10.244 -16.614 4.957 1.00 0.00 C ATOM 1212 OE1 GLN A 74 9.633 -17.661 4.769 1.00 0.00 O ATOM 1213 NE2 GLN A 74 9.986 -15.819 5.980 1.00 0.00 N ATOM 0 H GLN A 74 10.954 -17.513 1.776 1.00 0.00 H new ATOM 0 HA GLN A 74 8.812 -15.970 2.811 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.660 -15.133 2.168 1.00 0.00 H new ATOM 0 HB3 GLN A 74 10.560 -14.329 3.270 1.00 0.00 H new ATOM 0 HG2 GLN A 74 11.842 -17.058 3.602 1.00 0.00 H new ATOM 0 HG3 GLN A 74 12.106 -15.627 4.579 1.00 0.00 H new ATOM 0 HE21 GLN A 74 10.516 -14.956 6.102 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.256 -16.068 6.648 1.00 0.00 H new ATOM 1222 N THR A 75 9.741 -15.363 -0.232 1.00 0.00 N ATOM 1223 CA THR A 75 9.377 -14.666 -1.458 1.00 0.00 C ATOM 1224 C THR A 75 7.865 -14.685 -1.666 1.00 0.00 C ATOM 1225 O THR A 75 7.271 -13.684 -2.068 1.00 0.00 O ATOM 1226 CB THR A 75 10.074 -15.315 -2.669 1.00 0.00 C ATOM 1227 OG1 THR A 75 10.123 -16.741 -2.491 1.00 0.00 O ATOM 1228 CG2 THR A 75 11.482 -14.767 -2.849 1.00 0.00 C ATOM 0 H THR A 75 10.394 -16.134 -0.370 1.00 0.00 H new ATOM 0 HA THR A 75 9.704 -13.630 -1.367 1.00 0.00 H new ATOM 0 HB THR A 75 9.500 -15.077 -3.565 1.00 0.00 H new ATOM 0 HG1 THR A 75 10.565 -17.152 -3.263 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.950 -15.243 -3.711 1.00 0.00 H new ATOM 0 HG22 THR A 75 11.435 -13.690 -3.010 1.00 0.00 H new ATOM 0 HG23 THR A 75 12.070 -14.975 -1.955 1.00 0.00 H new ATOM 1236 N ARG A 76 7.256 -15.824 -1.355 1.00 0.00 N ATOM 1237 CA ARG A 76 5.814 -16.001 -1.473 1.00 0.00 C ATOM 1238 C ARG A 76 5.069 -14.951 -0.653 1.00 0.00 C ATOM 1239 O ARG A 76 4.144 -14.307 -1.147 1.00 0.00 O ATOM 1240 CB ARG A 76 5.430 -17.413 -1.011 1.00 0.00 C ATOM 1241 CG ARG A 76 3.934 -17.652 -0.875 1.00 0.00 C ATOM 1242 CD ARG A 76 3.642 -19.080 -0.439 1.00 0.00 C ATOM 1243 NE ARG A 76 3.981 -20.048 -1.480 1.00 0.00 N ATOM 1244 CZ ARG A 76 4.794 -21.088 -1.313 1.00 0.00 C ATOM 1245 NH1 ARG A 76 5.376 -21.308 -0.142 1.00 0.00 N ATOM 1246 NH2 ARG A 76 5.024 -21.905 -2.327 1.00 0.00 N ATOM 0 H ARG A 76 7.748 -16.650 -1.014 1.00 0.00 H new ATOM 0 HA ARG A 76 5.529 -15.875 -2.517 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.837 -18.135 -1.719 1.00 0.00 H new ATOM 0 HB3 ARG A 76 5.904 -17.607 -0.049 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.516 -16.955 -0.149 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.443 -17.452 -1.828 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.207 -19.306 0.465 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.586 -19.174 -0.186 1.00 0.00 H new ATOM 0 HE ARG A 76 3.564 -19.917 -2.402 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.202 -20.677 0.640 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.998 -22.108 -0.024 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.579 -21.736 -3.229 1.00 0.00 H new ATOM 0 HH22 ARG A 76 5.646 -22.704 -2.207 1.00 0.00 H new ATOM 1260 N VAL A 77 5.496 -14.767 0.591 1.00 0.00 N ATOM 1261 CA VAL A 77 4.854 -13.813 1.490 1.00 0.00 C ATOM 1262 C VAL A 77 4.965 -12.390 0.941 1.00 0.00 C ATOM 1263 O VAL A 77 3.978 -11.653 0.891 1.00 0.00 O ATOM 1264 CB VAL A 77 5.472 -13.868 2.905 1.00 0.00 C ATOM 1265 CG1 VAL A 77 4.792 -12.878 3.839 1.00 0.00 C ATOM 1266 CG2 VAL A 77 5.389 -15.278 3.473 1.00 0.00 C ATOM 0 H VAL A 77 6.285 -15.266 1.001 1.00 0.00 H new ATOM 0 HA VAL A 77 3.802 -14.091 1.558 1.00 0.00 H new ATOM 0 HB VAL A 77 6.522 -13.588 2.822 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.247 -12.939 4.827 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.910 -11.868 3.447 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.731 -13.117 3.913 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.830 -15.295 4.470 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.345 -15.585 3.532 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.933 -15.964 2.824 1.00 0.00 H new ATOM 1276 N ILE A 78 6.164 -12.022 0.504 1.00 0.00 N ATOM 1277 CA ILE A 78 6.409 -10.678 -0.010 1.00 0.00 C ATOM 1278 C ILE A 78 5.616 -10.425 -1.295 1.00 0.00 C ATOM 1279 O ILE A 78 5.069 -9.337 -1.488 1.00 0.00 O ATOM 1280 CB ILE A 78 7.916 -10.436 -0.254 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.681 -10.582 1.064 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.162 -9.060 -0.864 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.160 -10.292 0.946 1.00 0.00 C ATOM 0 H ILE A 78 6.980 -12.633 0.495 1.00 0.00 H new ATOM 0 HA ILE A 78 6.069 -9.973 0.749 1.00 0.00 H new ATOM 0 HB ILE A 78 8.276 -11.181 -0.963 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.246 -9.909 1.802 1.00 0.00 H new ATOM 0 HG13 ILE A 78 8.548 -11.596 1.440 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.231 -8.919 -1.024 1.00 0.00 H new ATOM 0 HG22 ILE A 78 7.639 -8.986 -1.818 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.792 -8.290 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.634 -10.416 1.920 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.610 -10.982 0.233 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.304 -9.268 0.601 1.00 0.00 H new ATOM 1295 N GLU A 79 5.530 -11.435 -2.160 1.00 0.00 N ATOM 1296 CA GLU A 79 4.743 -11.314 -3.386 1.00 0.00 C ATOM 1297 C GLU A 79 3.262 -11.143 -3.070 1.00 0.00 C ATOM 1298 O GLU A 79 2.518 -10.580 -3.864 1.00 0.00 O ATOM 1299 CB GLU A 79 4.938 -12.524 -4.304 1.00 0.00 C ATOM 1300 CG GLU A 79 6.252 -12.514 -5.065 1.00 0.00 C ATOM 1301 CD GLU A 79 6.292 -13.566 -6.155 1.00 0.00 C ATOM 1302 OE1 GLU A 79 5.657 -13.357 -7.211 1.00 0.00 O ATOM 1303 OE2 GLU A 79 6.958 -14.604 -5.966 1.00 0.00 O ATOM 0 H GLU A 79 5.990 -12.337 -2.037 1.00 0.00 H new ATOM 0 HA GLU A 79 5.100 -10.426 -3.907 1.00 0.00 H new ATOM 0 HB2 GLU A 79 4.883 -13.434 -3.706 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.116 -12.562 -5.019 1.00 0.00 H new ATOM 0 HG2 GLU A 79 6.406 -11.530 -5.507 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.074 -12.683 -4.369 1.00 0.00 H new ATOM 1310 N LEU A 80 2.840 -11.623 -1.905 1.00 0.00 N ATOM 1311 CA LEU A 80 1.457 -11.468 -1.471 1.00 0.00 C ATOM 1312 C LEU A 80 1.226 -10.071 -0.901 1.00 0.00 C ATOM 1313 O LEU A 80 0.198 -9.435 -1.180 1.00 0.00 O ATOM 1314 CB LEU A 80 1.097 -12.537 -0.444 1.00 0.00 C ATOM 1315 CG LEU A 80 1.149 -13.970 -0.978 1.00 0.00 C ATOM 1316 CD1 LEU A 80 0.981 -14.967 0.151 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.079 -14.187 -2.038 1.00 0.00 C ATOM 0 H LEU A 80 3.436 -12.122 -1.245 1.00 0.00 H new ATOM 0 HA LEU A 80 0.808 -11.593 -2.337 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.777 -12.453 0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.093 -12.339 -0.068 1.00 0.00 H new ATOM 0 HG LEU A 80 2.126 -14.127 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.021 -15.980 -0.249 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.782 -14.832 0.878 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.019 -14.807 0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.133 -15.212 -2.405 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.905 -14.008 -1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.241 -13.496 -2.866 1.00 0.00 H new ATOM 1329 N ASN A 81 2.180 -9.587 -0.112 1.00 0.00 N ATOM 1330 CA ASN A 81 2.128 -8.211 0.374 1.00 0.00 C ATOM 1331 C ASN A 81 2.032 -7.269 -0.813 1.00 0.00 C ATOM 1332 O ASN A 81 1.144 -6.418 -0.892 1.00 0.00 O ATOM 1333 CB ASN A 81 3.370 -7.853 1.203 1.00 0.00 C ATOM 1334 CG ASN A 81 3.516 -8.696 2.453 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.535 -9.218 2.982 1.00 0.00 O ATOM 1336 ND2 ASN A 81 4.737 -8.806 2.953 1.00 0.00 N ATOM 0 H ASN A 81 2.991 -10.120 0.202 1.00 0.00 H new ATOM 0 HA ASN A 81 1.254 -8.112 1.017 1.00 0.00 H new ATOM 0 HB2 ASN A 81 4.259 -7.975 0.584 1.00 0.00 H new ATOM 0 HB3 ASN A 81 3.320 -6.801 1.485 1.00 0.00 H new ATOM 0 HD21 ASN A 81 4.892 -9.339 3.809 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.523 -8.357 2.483 1.00 0.00 H new ATOM 1343 N TYR A 82 2.934 -7.466 -1.762 1.00 0.00 N ATOM 1344 CA TYR A 82 2.980 -6.645 -2.958 1.00 0.00 C ATOM 1345 C TYR A 82 1.831 -6.990 -3.896 1.00 0.00 C ATOM 1346 O TYR A 82 1.474 -6.200 -4.759 1.00 0.00 O ATOM 1347 CB TYR A 82 4.334 -6.786 -3.656 1.00 0.00 C ATOM 1348 CG TYR A 82 5.491 -6.237 -2.843 1.00 0.00 C ATOM 1349 CD1 TYR A 82 5.285 -5.686 -1.581 1.00 0.00 C ATOM 1350 CD2 TYR A 82 6.788 -6.271 -3.334 1.00 0.00 C ATOM 1351 CE1 TYR A 82 6.333 -5.191 -0.835 1.00 0.00 C ATOM 1352 CE2 TYR A 82 7.842 -5.779 -2.591 1.00 0.00 C ATOM 1353 CZ TYR A 82 7.609 -5.241 -1.344 1.00 0.00 C ATOM 1354 OH TYR A 82 8.662 -4.757 -0.602 1.00 0.00 O ATOM 0 H TYR A 82 3.648 -8.193 -1.724 1.00 0.00 H new ATOM 0 HA TYR A 82 2.863 -5.602 -2.665 1.00 0.00 H new ATOM 0 HB2 TYR A 82 4.517 -7.839 -3.869 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.296 -6.269 -4.615 1.00 0.00 H new ATOM 0 HD1 TYR A 82 4.284 -5.646 -1.178 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.976 -6.689 -4.312 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.153 -4.767 0.142 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.847 -5.816 -2.986 1.00 0.00 H new ATOM 0 HH TYR A 82 8.856 -5.376 0.133 1.00 0.00 H new ATOM 1364 N LYS A 83 1.246 -8.169 -3.730 1.00 0.00 N ATOM 1365 CA LYS A 83 0.027 -8.523 -4.458 1.00 0.00 C ATOM 1366 C LYS A 83 -1.063 -7.517 -4.127 1.00 0.00 C ATOM 1367 O LYS A 83 -1.901 -7.190 -4.964 1.00 0.00 O ATOM 1368 CB LYS A 83 -0.423 -9.946 -4.099 1.00 0.00 C ATOM 1369 CG LYS A 83 -1.637 -10.451 -4.871 1.00 0.00 C ATOM 1370 CD LYS A 83 -1.436 -10.338 -6.373 1.00 0.00 C ATOM 1371 CE LYS A 83 -2.238 -11.377 -7.143 1.00 0.00 C ATOM 1372 NZ LYS A 83 -3.676 -11.394 -6.763 1.00 0.00 N ATOM 0 H LYS A 83 1.591 -8.895 -3.102 1.00 0.00 H new ATOM 0 HA LYS A 83 0.227 -8.497 -5.529 1.00 0.00 H new ATOM 0 HB2 LYS A 83 0.409 -10.629 -4.272 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -0.648 -9.982 -3.033 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -1.829 -11.491 -4.607 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.518 -9.880 -4.578 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.727 -9.341 -6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.377 -10.454 -6.605 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.152 -11.177 -8.211 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.809 -12.364 -6.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -4.201 -12.007 -7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.775 -11.759 -5.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.059 -10.428 -6.810 1.00 0.00 H new ATOM 1386 N HIS A 84 -1.023 -7.016 -2.900 1.00 0.00 N ATOM 1387 CA HIS A 84 -1.959 -5.981 -2.474 1.00 0.00 C ATOM 1388 C HIS A 84 -1.411 -4.580 -2.774 1.00 0.00 C ATOM 1389 O HIS A 84 -2.179 -3.632 -2.929 1.00 0.00 O ATOM 1390 CB HIS A 84 -2.245 -6.093 -0.971 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.534 -7.484 -0.485 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -3.384 -8.359 -1.131 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -2.059 -8.157 0.591 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -3.419 -9.503 -0.474 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -2.624 -9.408 0.576 1.00 0.00 N ATOM 0 H HIS A 84 -0.357 -7.307 -2.184 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.882 -6.130 -3.034 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.388 -5.703 -0.423 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -3.095 -5.455 -0.729 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -1.364 -7.779 1.326 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -4.000 -10.371 -0.749 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -2.457 -10.143 1.263 1.00 0.00 H new ATOM 1404 N LEU A 85 -0.085 -4.452 -2.842 1.00 0.00 N ATOM 1405 CA LEU A 85 0.557 -3.132 -2.946 1.00 0.00 C ATOM 1406 C LEU A 85 1.012 -2.770 -4.367 1.00 0.00 C ATOM 1407 O LEU A 85 0.670 -1.709 -4.879 1.00 0.00 O ATOM 1408 CB LEU A 85 1.759 -3.063 -2.001 1.00 0.00 C ATOM 1409 CG LEU A 85 1.429 -3.235 -0.519 1.00 0.00 C ATOM 1410 CD1 LEU A 85 2.701 -3.236 0.311 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.490 -2.136 -0.051 1.00 0.00 C ATOM 0 H LEU A 85 0.565 -5.238 -2.827 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.205 -2.405 -2.666 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.473 -3.834 -2.290 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.254 -2.102 -2.138 1.00 0.00 H new ATOM 0 HG LEU A 85 0.929 -4.194 -0.386 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.448 -3.359 1.364 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.342 -4.058 -0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.227 -2.291 0.172 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.266 -2.275 1.007 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.964 -1.166 -0.197 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.435 -2.178 -0.626 1.00 0.00 H new ATOM 1423 N LEU A 86 1.794 -3.640 -4.996 1.00 0.00 N ATOM 1424 CA LEU A 86 2.461 -3.297 -6.256 1.00 0.00 C ATOM 1425 C LEU A 86 1.937 -4.129 -7.423 1.00 0.00 C ATOM 1426 O LEU A 86 2.497 -4.098 -8.520 1.00 0.00 O ATOM 1427 CB LEU A 86 3.974 -3.507 -6.126 1.00 0.00 C ATOM 1428 CG LEU A 86 4.654 -2.711 -5.011 1.00 0.00 C ATOM 1429 CD1 LEU A 86 6.141 -3.025 -4.965 1.00 0.00 C ATOM 1430 CD2 LEU A 86 4.434 -1.219 -5.209 1.00 0.00 C ATOM 0 H LEU A 86 1.984 -4.584 -4.660 1.00 0.00 H new ATOM 0 HA LEU A 86 2.245 -2.249 -6.461 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.163 -4.567 -5.959 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.443 -3.245 -7.074 1.00 0.00 H new ATOM 0 HG LEU A 86 4.208 -3.002 -4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.610 -2.450 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.282 -4.089 -4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.598 -2.761 -5.918 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.925 -0.669 -4.406 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.853 -0.913 -6.168 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.366 -1.004 -5.195 1.00 0.00 H new ATOM 1442 N GLY A 87 0.868 -4.870 -7.191 1.00 0.00 N ATOM 1443 CA GLY A 87 0.333 -5.722 -8.231 1.00 0.00 C ATOM 1444 C GLY A 87 1.085 -7.034 -8.325 1.00 0.00 C ATOM 1445 O GLY A 87 1.377 -7.514 -9.424 1.00 0.00 O ATOM 0 H GLY A 87 0.362 -4.898 -6.306 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.720 -5.920 -8.033 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.385 -5.204 -9.188 1.00 0.00 H new ATOM 1449 N ARG A 88 1.402 -7.577 -7.150 1.00 0.00 N ATOM 1450 CA ARG A 88 2.100 -8.856 -6.971 1.00 0.00 C ATOM 1451 C ARG A 88 3.603 -8.730 -7.177 1.00 0.00 C ATOM 1452 O ARG A 88 4.359 -8.592 -6.219 1.00 0.00 O ATOM 1453 CB ARG A 88 1.573 -9.976 -7.876 1.00 0.00 C ATOM 1454 CG ARG A 88 2.282 -11.296 -7.605 1.00 0.00 C ATOM 1455 CD ARG A 88 2.314 -12.207 -8.819 1.00 0.00 C ATOM 1456 NE ARG A 88 3.403 -13.176 -8.711 1.00 0.00 N ATOM 1457 CZ ARG A 88 3.572 -14.228 -9.506 1.00 0.00 C ATOM 1458 NH1 ARG A 88 2.706 -14.497 -10.478 1.00 0.00 N ATOM 1459 NH2 ARG A 88 4.620 -15.016 -9.323 1.00 0.00 N ATOM 0 H ARG A 88 1.173 -7.125 -6.264 1.00 0.00 H new ATOM 0 HA ARG A 88 1.895 -9.129 -5.936 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.502 -10.099 -7.718 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.711 -9.696 -8.920 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.303 -11.095 -7.280 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.782 -11.810 -6.784 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.363 -12.731 -8.912 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.439 -11.611 -9.723 1.00 0.00 H new ATOM 0 HE ARG A 88 4.087 -13.034 -7.968 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.897 -13.892 -10.622 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.850 -15.308 -11.079 1.00 0.00 H new ATOM 0 HH21 ARG A 88 5.287 -14.813 -8.578 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.760 -15.826 -9.927 1.00 0.00 H new ATOM 1473 N ALA A 89 4.019 -8.771 -8.430 1.00 0.00 N ATOM 1474 CA ALA A 89 5.418 -8.967 -8.756 1.00 0.00 C ATOM 1475 C ALA A 89 6.210 -7.672 -8.665 1.00 0.00 C ATOM 1476 O ALA A 89 5.838 -6.663 -9.263 1.00 0.00 O ATOM 1477 CB ALA A 89 5.541 -9.581 -10.139 1.00 0.00 C ATOM 0 H ALA A 89 3.406 -8.671 -9.239 1.00 0.00 H new ATOM 0 HA ALA A 89 5.844 -9.650 -8.021 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.594 -9.727 -10.380 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.028 -10.543 -10.157 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.089 -8.915 -10.874 1.00 0.00 H new ATOM 1483 N PRO A 90 7.307 -7.694 -7.894 1.00 0.00 N ATOM 1484 CA PRO A 90 8.243 -6.568 -7.799 1.00 0.00 C ATOM 1485 C PRO A 90 8.888 -6.248 -9.149 1.00 0.00 C ATOM 1486 O PRO A 90 8.651 -6.942 -10.144 1.00 0.00 O ATOM 1487 CB PRO A 90 9.299 -7.056 -6.800 1.00 0.00 C ATOM 1488 CG PRO A 90 9.149 -8.538 -6.748 1.00 0.00 C ATOM 1489 CD PRO A 90 7.706 -8.820 -7.038 1.00 0.00 C ATOM 0 HA PRO A 90 7.747 -5.648 -7.489 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.302 -6.775 -7.121 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.143 -6.612 -5.817 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.795 -9.021 -7.481 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.433 -8.924 -5.769 1.00 0.00 H new ATOM 0 HD2 PRO A 90 7.577 -9.776 -7.545 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.113 -8.861 -6.125 1.00 0.00 H new ATOM 1497 N TYR A 91 9.719 -5.217 -9.190 1.00 0.00 N ATOM 1498 CA TYR A 91 10.287 -4.773 -10.453 1.00 0.00 C ATOM 1499 C TYR A 91 11.686 -5.340 -10.658 1.00 0.00 C ATOM 1500 O TYR A 91 11.973 -5.932 -11.699 1.00 0.00 O ATOM 1501 CB TYR A 91 10.325 -3.241 -10.528 1.00 0.00 C ATOM 1502 CG TYR A 91 10.624 -2.713 -11.920 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.928 -2.619 -12.390 1.00 0.00 C ATOM 1504 CD2 TYR A 91 9.595 -2.323 -12.770 1.00 0.00 C ATOM 1505 CE1 TYR A 91 12.199 -2.153 -13.665 1.00 0.00 C ATOM 1506 CE2 TYR A 91 9.857 -1.859 -14.046 1.00 0.00 C ATOM 1507 CZ TYR A 91 11.158 -1.775 -14.489 1.00 0.00 C ATOM 1508 OH TYR A 91 11.424 -1.323 -15.766 1.00 0.00 O ATOM 0 H TYR A 91 10.012 -4.679 -8.375 1.00 0.00 H new ATOM 0 HA TYR A 91 9.644 -5.146 -11.250 1.00 0.00 H new ATOM 0 HB2 TYR A 91 9.366 -2.844 -10.195 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.081 -2.869 -9.836 1.00 0.00 H new ATOM 0 HD1 TYR A 91 12.745 -2.915 -11.749 1.00 0.00 H new ATOM 0 HD2 TYR A 91 8.573 -2.384 -12.427 1.00 0.00 H new ATOM 0 HE1 TYR A 91 13.219 -2.086 -14.013 1.00 0.00 H new ATOM 0 HE2 TYR A 91 9.044 -1.564 -14.693 1.00 0.00 H new ATOM 0 HH TYR A 91 10.583 -1.099 -16.215 1.00 0.00 H new ATOM 1518 N ASP A 92 12.549 -5.179 -9.665 1.00 0.00 N ATOM 1519 CA ASP A 92 13.952 -5.551 -9.820 1.00 0.00 C ATOM 1520 C ASP A 92 14.337 -6.652 -8.839 1.00 0.00 C ATOM 1521 O ASP A 92 13.796 -6.732 -7.740 1.00 0.00 O ATOM 1522 CB ASP A 92 14.847 -4.327 -9.623 1.00 0.00 C ATOM 1523 CG ASP A 92 16.319 -4.656 -9.771 1.00 0.00 C ATOM 1524 OD1 ASP A 92 16.789 -4.805 -10.921 1.00 0.00 O ATOM 1525 OD2 ASP A 92 17.011 -4.762 -8.743 1.00 0.00 O ATOM 0 H ASP A 92 12.308 -4.797 -8.751 1.00 0.00 H new ATOM 0 HA ASP A 92 14.094 -5.934 -10.831 1.00 0.00 H new ATOM 0 HB2 ASP A 92 14.574 -3.561 -10.349 1.00 0.00 H new ATOM 0 HB3 ASP A 92 14.670 -3.906 -8.633 1.00 0.00 H new ATOM 1530 N GLU A 93 15.280 -7.496 -9.244 1.00 0.00 N ATOM 1531 CA GLU A 93 15.697 -8.639 -8.441 1.00 0.00 C ATOM 1532 C GLU A 93 16.462 -8.196 -7.194 1.00 0.00 C ATOM 1533 O GLU A 93 16.245 -8.730 -6.105 1.00 0.00 O ATOM 1534 CB GLU A 93 16.558 -9.575 -9.289 1.00 0.00 C ATOM 1535 CG GLU A 93 16.822 -10.924 -8.647 1.00 0.00 C ATOM 1536 CD GLU A 93 17.521 -11.874 -9.593 1.00 0.00 C ATOM 1537 OE1 GLU A 93 16.844 -12.437 -10.479 1.00 0.00 O ATOM 1538 OE2 GLU A 93 18.749 -12.050 -9.470 1.00 0.00 O ATOM 0 H GLU A 93 15.774 -7.408 -10.132 1.00 0.00 H new ATOM 0 HA GLU A 93 14.804 -9.169 -8.108 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.068 -9.731 -10.250 1.00 0.00 H new ATOM 0 HB3 GLU A 93 17.512 -9.089 -9.493 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.432 -10.787 -7.754 1.00 0.00 H new ATOM 0 HG3 GLU A 93 15.878 -11.363 -8.324 1.00 0.00 H new ATOM 1545 N SER A 94 17.339 -7.209 -7.345 1.00 0.00 N ATOM 1546 CA SER A 94 18.100 -6.696 -6.214 1.00 0.00 C ATOM 1547 C SER A 94 17.144 -6.024 -5.239 1.00 0.00 C ATOM 1548 O SER A 94 17.308 -6.106 -4.018 1.00 0.00 O ATOM 1549 CB SER A 94 19.173 -5.707 -6.685 1.00 0.00 C ATOM 1550 OG SER A 94 20.016 -5.313 -5.617 1.00 0.00 O ATOM 0 H SER A 94 17.539 -6.751 -8.234 1.00 0.00 H new ATOM 0 HA SER A 94 18.607 -7.522 -5.716 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.771 -6.164 -7.473 1.00 0.00 H new ATOM 0 HB3 SER A 94 18.695 -4.828 -7.117 1.00 0.00 H new ATOM 0 HG SER A 94 20.691 -4.684 -5.948 1.00 0.00 H new ATOM 1556 N GLU A 95 16.133 -5.373 -5.807 1.00 0.00 N ATOM 1557 CA GLU A 95 15.042 -4.801 -5.060 1.00 0.00 C ATOM 1558 C GLU A 95 14.366 -5.879 -4.208 1.00 0.00 C ATOM 1559 O GLU A 95 14.171 -5.699 -3.003 1.00 0.00 O ATOM 1560 CB GLU A 95 14.072 -4.186 -6.063 1.00 0.00 C ATOM 1561 CG GLU A 95 12.816 -3.633 -5.451 1.00 0.00 C ATOM 1562 CD GLU A 95 11.577 -4.317 -5.985 1.00 0.00 C ATOM 1563 OE1 GLU A 95 11.268 -4.154 -7.187 1.00 0.00 O ATOM 1564 OE2 GLU A 95 10.923 -5.044 -5.210 1.00 0.00 O ATOM 0 H GLU A 95 16.057 -5.232 -6.814 1.00 0.00 H new ATOM 0 HA GLU A 95 15.396 -4.030 -4.375 1.00 0.00 H new ATOM 0 HB2 GLU A 95 14.582 -3.387 -6.601 1.00 0.00 H new ATOM 0 HB3 GLU A 95 13.801 -4.943 -6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 95 12.858 -3.752 -4.368 1.00 0.00 H new ATOM 0 HG3 GLU A 95 12.755 -2.563 -5.652 1.00 0.00 H new ATOM 1571 N VAL A 96 14.041 -7.010 -4.838 1.00 0.00 N ATOM 1572 CA VAL A 96 13.466 -8.154 -4.133 1.00 0.00 C ATOM 1573 C VAL A 96 14.332 -8.538 -2.940 1.00 0.00 C ATOM 1574 O VAL A 96 13.840 -8.639 -1.815 1.00 0.00 O ATOM 1575 CB VAL A 96 13.316 -9.392 -5.050 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.669 -10.548 -4.305 1.00 0.00 C ATOM 1577 CG2 VAL A 96 12.517 -9.057 -6.295 1.00 0.00 C ATOM 0 H VAL A 96 14.168 -7.157 -5.839 1.00 0.00 H new ATOM 0 HA VAL A 96 12.475 -7.846 -3.799 1.00 0.00 H new ATOM 0 HB VAL A 96 14.317 -9.696 -5.356 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.576 -11.404 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 96 13.287 -10.821 -3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.680 -10.249 -3.958 1.00 0.00 H new ATOM 0 HG21 VAL A 96 12.428 -9.945 -6.920 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.523 -8.714 -6.008 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.025 -8.270 -6.853 1.00 0.00 H new ATOM 1587 N ILE A 97 15.625 -8.722 -3.194 1.00 0.00 N ATOM 1588 CA ILE A 97 16.574 -9.117 -2.155 1.00 0.00 C ATOM 1589 C ILE A 97 16.567 -8.115 -1.002 1.00 0.00 C ATOM 1590 O ILE A 97 16.625 -8.499 0.168 1.00 0.00 O ATOM 1591 CB ILE A 97 18.013 -9.230 -2.710 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.046 -10.081 -3.987 1.00 0.00 C ATOM 1593 CG2 ILE A 97 18.945 -9.814 -1.659 1.00 0.00 C ATOM 1594 CD1 ILE A 97 17.528 -11.495 -3.813 1.00 0.00 C ATOM 0 H ILE A 97 16.042 -8.603 -4.117 1.00 0.00 H new ATOM 0 HA ILE A 97 16.257 -10.095 -1.794 1.00 0.00 H new ATOM 0 HB ILE A 97 18.357 -8.227 -2.963 1.00 0.00 H new ATOM 0 HG12 ILE A 97 17.455 -9.583 -4.756 1.00 0.00 H new ATOM 0 HG13 ILE A 97 19.072 -10.126 -4.352 1.00 0.00 H new ATOM 0 HG21 ILE A 97 19.953 -9.886 -2.067 1.00 0.00 H new ATOM 0 HG22 ILE A 97 18.954 -9.168 -0.781 1.00 0.00 H new ATOM 0 HG23 ILE A 97 18.596 -10.807 -1.375 1.00 0.00 H new ATOM 0 HD11 ILE A 97 17.588 -12.024 -4.764 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.133 -12.015 -3.070 1.00 0.00 H new ATOM 0 HD13 ILE A 97 16.491 -11.464 -3.480 1.00 0.00 H new ATOM 1606 N PHE A 98 16.467 -6.833 -1.344 1.00 0.00 N ATOM 1607 CA PHE A 98 16.469 -5.762 -0.353 1.00 0.00 C ATOM 1608 C PHE A 98 15.372 -5.971 0.689 1.00 0.00 C ATOM 1609 O PHE A 98 15.642 -5.980 1.888 1.00 0.00 O ATOM 1610 CB PHE A 98 16.297 -4.405 -1.043 1.00 0.00 C ATOM 1611 CG PHE A 98 16.235 -3.245 -0.090 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.375 -2.804 0.561 1.00 0.00 C ATOM 1613 CD2 PHE A 98 15.034 -2.599 0.156 1.00 0.00 C ATOM 1614 CE1 PHE A 98 17.319 -1.738 1.439 1.00 0.00 C ATOM 1615 CE2 PHE A 98 14.971 -1.533 1.033 1.00 0.00 C ATOM 1616 CZ PHE A 98 16.116 -1.102 1.675 1.00 0.00 C ATOM 0 H PHE A 98 16.383 -6.510 -2.308 1.00 0.00 H new ATOM 0 HA PHE A 98 17.429 -5.779 0.163 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.126 -4.252 -1.734 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.384 -4.423 -1.638 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.318 -3.298 0.381 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.137 -2.933 -0.344 1.00 0.00 H new ATOM 0 HE1 PHE A 98 18.215 -1.403 1.940 1.00 0.00 H new ATOM 0 HE2 PHE A 98 14.029 -1.038 1.216 1.00 0.00 H new ATOM 0 HZ PHE A 98 16.070 -0.269 2.361 1.00 0.00 H new ATOM 1626 N HIS A 99 14.136 -6.162 0.239 1.00 0.00 N ATOM 1627 CA HIS A 99 13.037 -6.349 1.180 1.00 0.00 C ATOM 1628 C HIS A 99 12.952 -7.792 1.669 1.00 0.00 C ATOM 1629 O HIS A 99 12.291 -8.066 2.659 1.00 0.00 O ATOM 1630 CB HIS A 99 11.685 -5.856 0.641 1.00 0.00 C ATOM 1631 CG HIS A 99 11.392 -6.200 -0.782 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.910 -7.423 -1.184 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.490 -5.451 -1.902 1.00 0.00 C ATOM 1634 CE1 HIS A 99 10.728 -7.412 -2.491 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.072 -6.227 -2.948 1.00 0.00 N ATOM 0 H HIS A 99 13.873 -6.191 -0.746 1.00 0.00 H new ATOM 0 HA HIS A 99 13.268 -5.718 2.038 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.893 -6.269 1.266 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.645 -4.772 0.749 1.00 0.00 H new ATOM 0 HD2 HIS A 99 11.834 -4.429 -1.961 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.359 -8.236 -3.085 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.033 -5.934 -3.924 1.00 0.00 H new ATOM 1644 N LEU A 100 13.606 -8.718 0.972 1.00 0.00 N ATOM 1645 CA LEU A 100 13.744 -10.083 1.482 1.00 0.00 C ATOM 1646 C LEU A 100 14.444 -10.066 2.837 1.00 0.00 C ATOM 1647 O LEU A 100 13.979 -10.682 3.798 1.00 0.00 O ATOM 1648 CB LEU A 100 14.528 -10.963 0.503 1.00 0.00 C ATOM 1649 CG LEU A 100 13.708 -11.575 -0.634 1.00 0.00 C ATOM 1650 CD1 LEU A 100 14.618 -12.290 -1.617 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.675 -12.543 -0.080 1.00 0.00 C ATOM 0 H LEU A 100 14.044 -8.554 0.065 1.00 0.00 H new ATOM 0 HA LEU A 100 12.745 -10.504 1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.331 -10.367 0.069 1.00 0.00 H new ATOM 0 HB3 LEU A 100 14.998 -11.771 1.064 1.00 0.00 H new ATOM 0 HG LEU A 100 13.190 -10.771 -1.157 1.00 0.00 H new ATOM 0 HD11 LEU A 100 14.020 -12.720 -2.420 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.331 -11.580 -2.036 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.158 -13.084 -1.101 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.099 -12.970 -0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.180 -13.342 0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.004 -12.012 0.595 1.00 0.00 H new ATOM 1663 N ASP A 101 15.561 -9.351 2.903 1.00 0.00 N ATOM 1664 CA ASP A 101 16.296 -9.176 4.152 1.00 0.00 C ATOM 1665 C ASP A 101 15.444 -8.411 5.157 1.00 0.00 C ATOM 1666 O ASP A 101 15.330 -8.794 6.322 1.00 0.00 O ATOM 1667 CB ASP A 101 17.600 -8.419 3.893 1.00 0.00 C ATOM 1668 CG ASP A 101 18.418 -8.199 5.153 1.00 0.00 C ATOM 1669 OD1 ASP A 101 18.178 -7.197 5.863 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.316 -9.022 5.432 1.00 0.00 O ATOM 0 H ASP A 101 15.980 -8.880 2.101 1.00 0.00 H new ATOM 0 HA ASP A 101 16.532 -10.158 4.561 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.198 -8.974 3.170 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.370 -7.453 3.442 1.00 0.00 H new ATOM 1675 N LEU A 102 14.838 -7.332 4.673 1.00 0.00 N ATOM 1676 CA LEU A 102 13.977 -6.474 5.482 1.00 0.00 C ATOM 1677 C LEU A 102 12.850 -7.276 6.140 1.00 0.00 C ATOM 1678 O LEU A 102 12.595 -7.145 7.338 1.00 0.00 O ATOM 1679 CB LEU A 102 13.396 -5.372 4.590 1.00 0.00 C ATOM 1680 CG LEU A 102 12.503 -4.342 5.281 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.288 -3.559 6.316 1.00 0.00 C ATOM 1682 CD2 LEU A 102 11.904 -3.400 4.253 1.00 0.00 C ATOM 0 H LEU A 102 14.930 -7.026 3.704 1.00 0.00 H new ATOM 0 HA LEU A 102 14.571 -6.031 6.281 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.223 -4.844 4.116 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.821 -5.844 3.794 1.00 0.00 H new ATOM 0 HG LEU A 102 11.697 -4.870 5.791 1.00 0.00 H new ATOM 0 HD11 LEU A 102 12.633 -2.832 6.796 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.682 -4.243 7.067 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.113 -3.039 5.830 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.269 -2.670 4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.704 -2.882 3.724 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.308 -3.970 3.541 1.00 0.00 H new ATOM 1694 N TYR A 103 12.193 -8.115 5.350 1.00 0.00 N ATOM 1695 CA TYR A 103 11.088 -8.938 5.827 1.00 0.00 C ATOM 1696 C TYR A 103 11.525 -9.886 6.945 1.00 0.00 C ATOM 1697 O TYR A 103 10.873 -9.968 7.985 1.00 0.00 O ATOM 1698 CB TYR A 103 10.489 -9.734 4.660 1.00 0.00 C ATOM 1699 CG TYR A 103 9.539 -10.841 5.074 1.00 0.00 C ATOM 1700 CD1 TYR A 103 8.508 -10.605 5.976 1.00 0.00 C ATOM 1701 CD2 TYR A 103 9.680 -12.126 4.568 1.00 0.00 C ATOM 1702 CE1 TYR A 103 7.649 -11.615 6.359 1.00 0.00 C ATOM 1703 CE2 TYR A 103 8.824 -13.140 4.947 1.00 0.00 C ATOM 1704 CZ TYR A 103 7.811 -12.879 5.844 1.00 0.00 C ATOM 1705 OH TYR A 103 6.954 -13.885 6.226 1.00 0.00 O ATOM 0 H TYR A 103 12.410 -8.245 4.362 1.00 0.00 H new ATOM 0 HA TYR A 103 10.331 -8.272 6.241 1.00 0.00 H new ATOM 0 HB2 TYR A 103 9.959 -9.046 4.002 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.302 -10.169 4.079 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.377 -9.614 6.384 1.00 0.00 H new ATOM 0 HD2 TYR A 103 10.473 -12.336 3.866 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.853 -11.413 7.060 1.00 0.00 H new ATOM 0 HE2 TYR A 103 8.948 -14.134 4.542 1.00 0.00 H new ATOM 0 HH TYR A 103 6.297 -13.532 6.862 1.00 0.00 H new ATOM 1715 N GLU A 104 12.621 -10.597 6.737 1.00 0.00 N ATOM 1716 CA GLU A 104 13.051 -11.601 7.700 1.00 0.00 C ATOM 1717 C GLU A 104 13.683 -10.971 8.938 1.00 0.00 C ATOM 1718 O GLU A 104 13.476 -11.445 10.054 1.00 0.00 O ATOM 1719 CB GLU A 104 14.024 -12.584 7.057 1.00 0.00 C ATOM 1720 CG GLU A 104 13.399 -13.422 5.954 1.00 0.00 C ATOM 1721 CD GLU A 104 14.309 -14.538 5.494 1.00 0.00 C ATOM 1722 OE1 GLU A 104 15.211 -14.273 4.676 1.00 0.00 O ATOM 1723 OE2 GLU A 104 14.127 -15.686 5.952 1.00 0.00 O ATOM 0 H GLU A 104 13.224 -10.501 5.920 1.00 0.00 H new ATOM 0 HA GLU A 104 12.160 -12.140 8.020 1.00 0.00 H new ATOM 0 HB2 GLU A 104 14.869 -12.031 6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 104 14.420 -13.247 7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 104 12.460 -13.846 6.311 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.158 -12.781 5.106 1.00 0.00 H new ATOM 1730 N ASN A 105 14.443 -9.903 8.747 1.00 0.00 N ATOM 1731 CA ASN A 105 15.147 -9.274 9.858 1.00 0.00 C ATOM 1732 C ASN A 105 14.259 -8.306 10.630 1.00 0.00 C ATOM 1733 O ASN A 105 14.125 -8.423 11.848 1.00 0.00 O ATOM 1734 CB ASN A 105 16.409 -8.559 9.370 1.00 0.00 C ATOM 1735 CG ASN A 105 17.588 -9.506 9.249 1.00 0.00 C ATOM 1736 OD1 ASN A 105 17.707 -10.465 10.016 1.00 0.00 O ATOM 1737 ND2 ASN A 105 18.463 -9.259 8.287 1.00 0.00 N ATOM 0 H ASN A 105 14.588 -9.456 7.842 1.00 0.00 H new ATOM 0 HA ASN A 105 15.434 -10.073 10.542 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.213 -8.098 8.402 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.660 -7.754 10.061 1.00 0.00 H new ATOM 0 HD21 ASN A 105 19.269 -9.872 8.161 1.00 0.00 H new ATOM 0 HD22 ASN A 105 18.331 -8.456 7.672 1.00 0.00 H new ATOM 1744 N GLU A 106 13.647 -7.362 9.927 1.00 0.00 N ATOM 1745 CA GLU A 106 12.868 -6.322 10.588 1.00 0.00 C ATOM 1746 C GLU A 106 11.406 -6.733 10.740 1.00 0.00 C ATOM 1747 O GLU A 106 10.769 -6.417 11.744 1.00 0.00 O ATOM 1748 CB GLU A 106 12.971 -5.007 9.815 1.00 0.00 C ATOM 1749 CG GLU A 106 14.392 -4.477 9.699 1.00 0.00 C ATOM 1750 CD GLU A 106 15.017 -4.161 11.044 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.774 -3.053 11.569 1.00 0.00 O ATOM 1752 OE2 GLU A 106 15.763 -5.011 11.577 1.00 0.00 O ATOM 0 H GLU A 106 13.674 -7.294 8.910 1.00 0.00 H new ATOM 0 HA GLU A 106 13.282 -6.180 11.586 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.563 -5.151 8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.352 -4.257 10.307 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.008 -5.213 9.182 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.389 -3.576 9.085 1.00 0.00 H new ATOM 1759 N GLY A 107 10.872 -7.436 9.753 1.00 0.00 N ATOM 1760 CA GLY A 107 9.520 -7.941 9.868 1.00 0.00 C ATOM 1761 C GLY A 107 8.679 -7.673 8.637 1.00 0.00 C ATOM 1762 O GLY A 107 9.050 -6.870 7.779 1.00 0.00 O ATOM 0 H GLY A 107 11.347 -7.665 8.880 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.554 -9.015 10.051 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.041 -7.485 10.734 1.00 0.00 H new ATOM 1766 N PHE A 108 7.537 -8.348 8.561 1.00 0.00 N ATOM 1767 CA PHE A 108 6.595 -8.179 7.453 1.00 0.00 C ATOM 1768 C PHE A 108 6.069 -6.753 7.387 1.00 0.00 C ATOM 1769 O PHE A 108 5.807 -6.226 6.308 1.00 0.00 O ATOM 1770 CB PHE A 108 5.425 -9.160 7.598 1.00 0.00 C ATOM 1771 CG PHE A 108 5.073 -9.470 9.030 1.00 0.00 C ATOM 1772 CD1 PHE A 108 4.494 -8.509 9.847 1.00 0.00 C ATOM 1773 CD2 PHE A 108 5.340 -10.721 9.563 1.00 0.00 C ATOM 1774 CE1 PHE A 108 4.186 -8.791 11.163 1.00 0.00 C ATOM 1775 CE2 PHE A 108 5.036 -11.008 10.880 1.00 0.00 C ATOM 1776 CZ PHE A 108 4.457 -10.043 11.680 1.00 0.00 C ATOM 0 H PHE A 108 7.236 -9.026 9.261 1.00 0.00 H new ATOM 0 HA PHE A 108 7.129 -8.388 6.526 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.549 -8.745 7.099 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.674 -10.089 7.084 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.282 -7.528 9.448 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.791 -11.481 8.942 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.734 -8.034 11.787 1.00 0.00 H new ATOM 0 HE2 PHE A 108 5.251 -11.986 11.283 1.00 0.00 H new ATOM 0 HZ PHE A 108 4.216 -10.267 12.709 1.00 0.00 H new ATOM 1786 N ASP A 109 5.933 -6.131 8.545 1.00 0.00 N ATOM 1787 CA ASP A 109 5.429 -4.773 8.625 1.00 0.00 C ATOM 1788 C ASP A 109 6.419 -3.802 7.998 1.00 0.00 C ATOM 1789 O ASP A 109 6.023 -2.846 7.339 1.00 0.00 O ATOM 1790 CB ASP A 109 5.149 -4.391 10.082 1.00 0.00 C ATOM 1791 CG ASP A 109 6.386 -4.469 10.952 1.00 0.00 C ATOM 1792 OD1 ASP A 109 6.789 -5.591 11.323 1.00 0.00 O ATOM 1793 OD2 ASP A 109 6.964 -3.411 11.259 1.00 0.00 O ATOM 0 H ASP A 109 6.166 -6.548 9.446 1.00 0.00 H new ATOM 0 HA ASP A 109 4.493 -4.717 8.069 1.00 0.00 H new ATOM 0 HB2 ASP A 109 4.747 -3.378 10.118 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.383 -5.052 10.486 1.00 0.00 H new ATOM 1798 N ALA A 110 7.705 -4.080 8.176 1.00 0.00 N ATOM 1799 CA ALA A 110 8.754 -3.239 7.620 1.00 0.00 C ATOM 1800 C ALA A 110 8.796 -3.363 6.103 1.00 0.00 C ATOM 1801 O ALA A 110 9.010 -2.377 5.396 1.00 0.00 O ATOM 1802 CB ALA A 110 10.099 -3.604 8.226 1.00 0.00 C ATOM 0 H ALA A 110 8.045 -4.884 8.703 1.00 0.00 H new ATOM 0 HA ALA A 110 8.533 -2.201 7.869 1.00 0.00 H new ATOM 0 HB1 ALA A 110 10.875 -2.967 7.801 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.063 -3.460 9.306 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.326 -4.647 8.007 1.00 0.00 H new ATOM 1808 N ASP A 111 8.583 -4.579 5.611 1.00 0.00 N ATOM 1809 CA ASP A 111 8.529 -4.833 4.170 1.00 0.00 C ATOM 1810 C ASP A 111 7.428 -3.996 3.532 1.00 0.00 C ATOM 1811 O ASP A 111 7.616 -3.385 2.484 1.00 0.00 O ATOM 1812 CB ASP A 111 8.284 -6.325 3.905 1.00 0.00 C ATOM 1813 CG ASP A 111 8.001 -6.638 2.444 1.00 0.00 C ATOM 1814 OD1 ASP A 111 8.846 -6.304 1.585 1.00 0.00 O ATOM 1815 OD2 ASP A 111 6.943 -7.241 2.158 1.00 0.00 O ATOM 0 H ASP A 111 8.444 -5.408 6.188 1.00 0.00 H new ATOM 0 HA ASP A 111 9.484 -4.552 3.727 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.157 -6.892 4.228 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.443 -6.661 4.511 1.00 0.00 H new ATOM 1820 N ILE A 112 6.292 -3.946 4.207 1.00 0.00 N ATOM 1821 CA ILE A 112 5.140 -3.186 3.745 1.00 0.00 C ATOM 1822 C ILE A 112 5.376 -1.676 3.882 1.00 0.00 C ATOM 1823 O ILE A 112 4.946 -0.890 3.032 1.00 0.00 O ATOM 1824 CB ILE A 112 3.881 -3.613 4.536 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.538 -5.067 4.194 1.00 0.00 C ATOM 1826 CG2 ILE A 112 2.699 -2.695 4.249 1.00 0.00 C ATOM 1827 CD1 ILE A 112 2.393 -5.636 5.001 1.00 0.00 C ATOM 0 H ILE A 112 6.141 -4.431 5.091 1.00 0.00 H new ATOM 0 HA ILE A 112 4.988 -3.400 2.687 1.00 0.00 H new ATOM 0 HB ILE A 112 4.095 -3.532 5.602 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.289 -5.131 3.135 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.422 -5.685 4.352 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.833 -3.026 4.822 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.954 -1.674 4.534 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.463 -2.727 3.185 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.213 -6.668 4.699 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.645 -5.606 6.061 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.495 -5.044 4.825 1.00 0.00 H new ATOM 1839 N ASP A 113 6.082 -1.278 4.936 1.00 0.00 N ATOM 1840 CA ASP A 113 6.333 0.139 5.202 1.00 0.00 C ATOM 1841 C ASP A 113 7.265 0.758 4.167 1.00 0.00 C ATOM 1842 O ASP A 113 7.204 1.961 3.922 1.00 0.00 O ATOM 1843 CB ASP A 113 6.934 0.347 6.596 1.00 0.00 C ATOM 1844 CG ASP A 113 5.940 0.136 7.721 1.00 0.00 C ATOM 1845 OD1 ASP A 113 4.718 0.181 7.468 1.00 0.00 O ATOM 1846 OD2 ASP A 113 6.375 -0.076 8.874 1.00 0.00 O ATOM 0 H ASP A 113 6.491 -1.914 5.620 1.00 0.00 H new ATOM 0 HA ASP A 113 5.364 0.635 5.145 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.771 -0.339 6.728 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.336 1.358 6.662 1.00 0.00 H new ATOM 1851 N SER A 114 8.119 -0.061 3.561 1.00 0.00 N ATOM 1852 CA SER A 114 9.145 0.435 2.643 1.00 0.00 C ATOM 1853 C SER A 114 8.533 1.246 1.496 1.00 0.00 C ATOM 1854 O SER A 114 8.846 2.427 1.322 1.00 0.00 O ATOM 1855 CB SER A 114 9.969 -0.734 2.091 1.00 0.00 C ATOM 1856 OG SER A 114 9.164 -1.625 1.337 1.00 0.00 O ATOM 0 H SER A 114 8.123 -1.073 3.688 1.00 0.00 H new ATOM 0 HA SER A 114 9.801 1.101 3.203 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.774 -0.350 1.464 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.436 -1.273 2.915 1.00 0.00 H new ATOM 0 HG SER A 114 8.612 -2.161 1.944 1.00 0.00 H new ATOM 1862 N TYR A 115 7.655 0.606 0.733 1.00 0.00 N ATOM 1863 CA TYR A 115 6.991 1.239 -0.403 1.00 0.00 C ATOM 1864 C TYR A 115 6.136 2.428 0.036 1.00 0.00 C ATOM 1865 O TYR A 115 6.076 3.448 -0.652 1.00 0.00 O ATOM 1866 CB TYR A 115 6.133 0.200 -1.139 1.00 0.00 C ATOM 1867 CG TYR A 115 5.005 0.784 -1.966 1.00 0.00 C ATOM 1868 CD1 TYR A 115 5.261 1.532 -3.110 1.00 0.00 C ATOM 1869 CD2 TYR A 115 3.679 0.591 -1.593 1.00 0.00 C ATOM 1870 CE1 TYR A 115 4.227 2.068 -3.856 1.00 0.00 C ATOM 1871 CE2 TYR A 115 2.643 1.124 -2.334 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.922 1.860 -3.463 1.00 0.00 C ATOM 1873 OH TYR A 115 1.892 2.392 -4.201 1.00 0.00 O ATOM 0 H TYR A 115 7.383 -0.365 0.883 1.00 0.00 H new ATOM 0 HA TYR A 115 7.756 1.622 -1.078 1.00 0.00 H new ATOM 0 HB2 TYR A 115 6.778 -0.387 -1.792 1.00 0.00 H new ATOM 0 HB3 TYR A 115 5.710 -0.487 -0.406 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.282 1.697 -3.421 1.00 0.00 H new ATOM 0 HD2 TYR A 115 3.456 0.014 -0.708 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.441 2.647 -4.742 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.619 0.964 -2.029 1.00 0.00 H new ATOM 0 HH TYR A 115 2.057 2.234 -5.154 1.00 0.00 H new ATOM 1883 N ILE A 116 5.501 2.297 1.188 1.00 0.00 N ATOM 1884 CA ILE A 116 4.560 3.301 1.662 1.00 0.00 C ATOM 1885 C ILE A 116 5.273 4.560 2.157 1.00 0.00 C ATOM 1886 O ILE A 116 4.899 5.674 1.798 1.00 0.00 O ATOM 1887 CB ILE A 116 3.679 2.738 2.796 1.00 0.00 C ATOM 1888 CG1 ILE A 116 2.860 1.543 2.296 1.00 0.00 C ATOM 1889 CG2 ILE A 116 2.760 3.819 3.345 1.00 0.00 C ATOM 1890 CD1 ILE A 116 1.865 1.893 1.208 1.00 0.00 C ATOM 0 H ILE A 116 5.620 1.502 1.816 1.00 0.00 H new ATOM 0 HA ILE A 116 3.932 3.569 0.812 1.00 0.00 H new ATOM 0 HB ILE A 116 4.331 2.398 3.601 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.541 0.780 1.920 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.324 1.105 3.138 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.146 3.403 4.144 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.359 4.641 3.738 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.116 4.188 2.547 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.324 0.996 0.907 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.159 2.633 1.585 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.395 2.303 0.348 1.00 0.00 H new ATOM 1902 N ASP A 117 6.306 4.385 2.969 1.00 0.00 N ATOM 1903 CA ASP A 117 6.960 5.520 3.611 1.00 0.00 C ATOM 1904 C ASP A 117 7.842 6.278 2.623 1.00 0.00 C ATOM 1905 O ASP A 117 8.100 7.469 2.794 1.00 0.00 O ATOM 1906 CB ASP A 117 7.789 5.056 4.809 1.00 0.00 C ATOM 1907 CG ASP A 117 8.274 6.213 5.658 1.00 0.00 C ATOM 1908 OD1 ASP A 117 7.438 6.844 6.340 1.00 0.00 O ATOM 1909 OD2 ASP A 117 9.488 6.501 5.649 1.00 0.00 O ATOM 0 H ASP A 117 6.708 3.476 3.199 1.00 0.00 H new ATOM 0 HA ASP A 117 6.182 6.197 3.963 1.00 0.00 H new ATOM 0 HB2 ASP A 117 7.190 4.384 5.424 1.00 0.00 H new ATOM 0 HB3 ASP A 117 8.647 4.484 4.454 1.00 0.00 H new ATOM 1914 N SER A 118 8.284 5.587 1.581 1.00 0.00 N ATOM 1915 CA SER A 118 9.112 6.202 0.554 1.00 0.00 C ATOM 1916 C SER A 118 8.246 7.004 -0.425 1.00 0.00 C ATOM 1917 O SER A 118 7.430 6.435 -1.157 1.00 0.00 O ATOM 1918 CB SER A 118 9.907 5.129 -0.189 1.00 0.00 C ATOM 1919 OG SER A 118 10.666 4.339 0.712 1.00 0.00 O ATOM 0 H SER A 118 8.082 4.599 1.425 1.00 0.00 H new ATOM 0 HA SER A 118 9.811 6.888 1.032 1.00 0.00 H new ATOM 0 HB2 SER A 118 9.225 4.491 -0.751 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.572 5.601 -0.913 1.00 0.00 H new ATOM 0 HG SER A 118 10.121 3.588 1.027 1.00 0.00 H new ATOM 1925 N PRO A 119 8.436 8.336 -0.458 1.00 0.00 N ATOM 1926 CA PRO A 119 7.580 9.254 -1.220 1.00 0.00 C ATOM 1927 C PRO A 119 7.481 8.904 -2.703 1.00 0.00 C ATOM 1928 O PRO A 119 6.383 8.695 -3.219 1.00 0.00 O ATOM 1929 CB PRO A 119 8.254 10.624 -1.038 1.00 0.00 C ATOM 1930 CG PRO A 119 9.627 10.327 -0.538 1.00 0.00 C ATOM 1931 CD PRO A 119 9.509 9.055 0.246 1.00 0.00 C ATOM 0 HA PRO A 119 6.552 9.215 -0.861 1.00 0.00 H new ATOM 0 HB2 PRO A 119 8.289 11.173 -1.979 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.703 11.242 -0.329 1.00 0.00 H new ATOM 0 HG2 PRO A 119 10.328 10.213 -1.365 1.00 0.00 H new ATOM 0 HG3 PRO A 119 10.000 11.139 0.087 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.442 8.491 0.245 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.252 9.245 1.288 1.00 0.00 H new ATOM 1939 N GLU A 120 8.622 8.817 -3.382 1.00 0.00 N ATOM 1940 CA GLU A 120 8.625 8.609 -4.827 1.00 0.00 C ATOM 1941 C GLU A 120 8.030 7.254 -5.206 1.00 0.00 C ATOM 1942 O GLU A 120 7.402 7.124 -6.255 1.00 0.00 O ATOM 1943 CB GLU A 120 10.037 8.745 -5.404 1.00 0.00 C ATOM 1944 CG GLU A 120 11.038 7.751 -4.842 1.00 0.00 C ATOM 1945 CD GLU A 120 12.350 7.772 -5.593 1.00 0.00 C ATOM 1946 OE1 GLU A 120 12.483 7.027 -6.584 1.00 0.00 O ATOM 1947 OE2 GLU A 120 13.259 8.528 -5.197 1.00 0.00 O ATOM 0 H GLU A 120 9.548 8.887 -2.960 1.00 0.00 H new ATOM 0 HA GLU A 120 7.996 9.387 -5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.989 8.622 -6.486 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.399 9.755 -5.214 1.00 0.00 H new ATOM 0 HG2 GLU A 120 11.220 7.976 -3.791 1.00 0.00 H new ATOM 0 HG3 GLU A 120 10.614 6.748 -4.884 1.00 0.00 H new ATOM 1954 N TYR A 121 8.208 6.256 -4.342 1.00 0.00 N ATOM 1955 CA TYR A 121 7.672 4.922 -4.598 1.00 0.00 C ATOM 1956 C TYR A 121 6.149 4.959 -4.609 1.00 0.00 C ATOM 1957 O TYR A 121 5.508 4.383 -5.485 1.00 0.00 O ATOM 1958 CB TYR A 121 8.165 3.923 -3.547 1.00 0.00 C ATOM 1959 CG TYR A 121 9.641 3.591 -3.648 1.00 0.00 C ATOM 1960 CD1 TYR A 121 10.609 4.521 -3.300 1.00 0.00 C ATOM 1961 CD2 TYR A 121 10.062 2.340 -4.084 1.00 0.00 C ATOM 1962 CE1 TYR A 121 11.953 4.219 -3.379 1.00 0.00 C ATOM 1963 CE2 TYR A 121 11.407 2.029 -4.164 1.00 0.00 C ATOM 1964 CZ TYR A 121 12.347 2.973 -3.811 1.00 0.00 C ATOM 1965 OH TYR A 121 13.688 2.669 -3.879 1.00 0.00 O ATOM 0 H TYR A 121 8.717 6.346 -3.463 1.00 0.00 H new ATOM 0 HA TYR A 121 8.027 4.595 -5.575 1.00 0.00 H new ATOM 0 HB2 TYR A 121 7.962 4.327 -2.555 1.00 0.00 H new ATOM 0 HB3 TYR A 121 7.590 3.002 -3.640 1.00 0.00 H new ATOM 0 HD1 TYR A 121 10.305 5.500 -2.961 1.00 0.00 H new ATOM 0 HD2 TYR A 121 9.327 1.600 -4.365 1.00 0.00 H new ATOM 0 HE1 TYR A 121 12.692 4.957 -3.103 1.00 0.00 H new ATOM 0 HE2 TYR A 121 11.719 1.052 -4.501 1.00 0.00 H new ATOM 0 HH TYR A 121 13.799 1.750 -4.202 1.00 0.00 H new ATOM 1975 N THR A 122 5.575 5.650 -3.632 1.00 0.00 N ATOM 1976 CA THR A 122 4.134 5.833 -3.584 1.00 0.00 C ATOM 1977 C THR A 122 3.680 6.768 -4.706 1.00 0.00 C ATOM 1978 O THR A 122 2.634 6.565 -5.314 1.00 0.00 O ATOM 1979 CB THR A 122 3.688 6.404 -2.221 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.118 5.538 -1.164 1.00 0.00 O ATOM 1981 CG2 THR A 122 2.177 6.561 -2.161 1.00 0.00 C ATOM 0 H THR A 122 6.085 6.090 -2.866 1.00 0.00 H new ATOM 0 HA THR A 122 3.670 4.856 -3.717 1.00 0.00 H new ATOM 0 HB THR A 122 4.145 7.387 -2.102 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.749 4.877 -1.519 1.00 0.00 H new ATOM 0 HG21 THR A 122 1.891 6.965 -1.190 1.00 0.00 H new ATOM 0 HG22 THR A 122 1.850 7.242 -2.947 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.704 5.589 -2.303 1.00 0.00 H new ATOM 1989 N ASN A 123 4.504 7.769 -4.997 1.00 0.00 N ATOM 1990 CA ASN A 123 4.183 8.782 -6.000 1.00 0.00 C ATOM 1991 C ASN A 123 3.997 8.169 -7.390 1.00 0.00 C ATOM 1992 O ASN A 123 3.161 8.631 -8.166 1.00 0.00 O ATOM 1993 CB ASN A 123 5.278 9.856 -6.035 1.00 0.00 C ATOM 1994 CG ASN A 123 5.099 10.848 -7.171 1.00 0.00 C ATOM 1995 OD1 ASN A 123 4.361 11.826 -7.051 1.00 0.00 O ATOM 1996 ND2 ASN A 123 5.800 10.621 -8.270 1.00 0.00 N ATOM 0 H ASN A 123 5.410 7.902 -4.547 1.00 0.00 H new ATOM 0 HA ASN A 123 3.236 9.241 -5.715 1.00 0.00 H new ATOM 0 HB2 ASN A 123 5.282 10.394 -5.087 1.00 0.00 H new ATOM 0 HB3 ASN A 123 6.250 9.373 -6.131 1.00 0.00 H new ATOM 0 HD21 ASN A 123 5.740 11.268 -9.056 1.00 0.00 H new ATOM 0 HD22 ASN A 123 6.401 9.799 -8.331 1.00 0.00 H new ATOM 2003 N SER A 124 4.757 7.123 -7.697 1.00 0.00 N ATOM 2004 CA SER A 124 4.670 6.475 -9.002 1.00 0.00 C ATOM 2005 C SER A 124 3.359 5.695 -9.168 1.00 0.00 C ATOM 2006 O SER A 124 3.026 5.249 -10.267 1.00 0.00 O ATOM 2007 CB SER A 124 5.881 5.562 -9.221 1.00 0.00 C ATOM 2008 OG SER A 124 6.271 4.919 -8.017 1.00 0.00 O ATOM 0 H SER A 124 5.438 6.706 -7.063 1.00 0.00 H new ATOM 0 HA SER A 124 4.675 7.256 -9.762 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.641 4.812 -9.974 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.715 6.148 -9.609 1.00 0.00 H new ATOM 0 HG SER A 124 5.481 4.766 -7.457 1.00 0.00 H new ATOM 2014 N PHE A 125 2.620 5.536 -8.076 1.00 0.00 N ATOM 2015 CA PHE A 125 1.322 4.874 -8.125 1.00 0.00 C ATOM 2016 C PHE A 125 0.200 5.858 -7.810 1.00 0.00 C ATOM 2017 O PHE A 125 -0.862 5.823 -8.429 1.00 0.00 O ATOM 2018 CB PHE A 125 1.283 3.701 -7.144 1.00 0.00 C ATOM 2019 CG PHE A 125 2.146 2.542 -7.555 1.00 0.00 C ATOM 2020 CD1 PHE A 125 3.520 2.579 -7.380 1.00 0.00 C ATOM 2021 CD2 PHE A 125 1.579 1.412 -8.121 1.00 0.00 C ATOM 2022 CE1 PHE A 125 4.312 1.513 -7.763 1.00 0.00 C ATOM 2023 CE2 PHE A 125 2.364 0.343 -8.504 1.00 0.00 C ATOM 2024 CZ PHE A 125 3.732 0.393 -8.326 1.00 0.00 C ATOM 0 H PHE A 125 2.897 5.856 -7.148 1.00 0.00 H new ATOM 0 HA PHE A 125 1.174 4.493 -9.135 1.00 0.00 H new ATOM 0 HB2 PHE A 125 1.602 4.050 -6.162 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.253 3.358 -7.042 1.00 0.00 H new ATOM 0 HD1 PHE A 125 3.978 3.452 -6.939 1.00 0.00 H new ATOM 0 HD2 PHE A 125 0.510 1.367 -8.264 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.382 1.556 -7.622 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.908 -0.532 -8.943 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.348 -0.442 -8.626 1.00 0.00 H new ATOM 2034 N GLY A 126 0.456 6.745 -6.860 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.525 7.738 -6.476 1.00 0.00 C ATOM 2036 C GLY A 126 -0.711 7.798 -4.975 1.00 0.00 C ATOM 2037 O GLY A 126 -0.930 6.775 -4.332 1.00 0.00 O ATOM 0 H GLY A 126 1.334 6.794 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.214 8.716 -6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -1.479 7.508 -6.951 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.623 8.998 -4.413 1.00 0.00 N ATOM 2042 CA ASP A 127 -0.786 9.186 -2.970 1.00 0.00 C ATOM 2043 C ASP A 127 -2.232 8.948 -2.553 1.00 0.00 C ATOM 2044 O ASP A 127 -2.520 8.611 -1.402 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.365 10.599 -2.555 1.00 0.00 C ATOM 2046 CG ASP A 127 1.119 10.845 -2.718 1.00 0.00 C ATOM 2047 OD1 ASP A 127 1.880 10.569 -1.767 1.00 0.00 O ATOM 2048 OD2 ASP A 127 1.529 11.337 -3.795 1.00 0.00 O ATOM 0 H ASP A 127 -0.440 9.857 -4.931 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.146 8.460 -2.469 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -0.916 11.326 -3.151 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.643 10.764 -1.514 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.137 9.134 -3.501 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.561 8.968 -3.253 1.00 0.00 C ATOM 2055 C TRP A 128 -5.140 7.922 -4.198 1.00 0.00 C ATOM 2056 O TRP A 128 -6.350 7.850 -4.403 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.290 10.301 -3.448 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.834 11.385 -2.516 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.769 12.221 -2.691 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.436 11.755 -1.272 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.668 13.084 -1.629 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.683 12.820 -0.745 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.541 11.290 -0.551 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -5.000 13.425 0.469 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.852 11.891 0.653 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.086 12.950 1.152 1.00 0.00 C ATOM 0 H TRP A 128 -2.908 9.403 -4.458 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.699 8.634 -2.225 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.147 10.635 -4.476 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.360 10.143 -3.310 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -3.103 12.205 -3.541 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -2.955 13.804 -1.515 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.140 10.475 -0.929 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.409 14.241 0.858 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.701 11.537 1.219 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.357 13.401 2.095 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.270 7.098 -4.757 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.677 6.132 -5.762 1.00 0.00 C ATOM 2079 C VAL A 129 -4.545 4.709 -5.230 1.00 0.00 C ATOM 2080 O VAL A 129 -3.533 4.350 -4.631 1.00 0.00 O ATOM 2081 CB VAL A 129 -3.846 6.288 -7.055 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.286 5.283 -8.110 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -3.957 7.709 -7.592 1.00 0.00 C ATOM 0 H VAL A 129 -3.276 7.079 -4.531 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.723 6.325 -5.998 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.802 6.089 -6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.685 5.414 -9.010 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.151 4.271 -7.728 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.337 5.443 -8.349 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.365 7.801 -8.503 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.000 7.934 -7.813 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.585 8.410 -6.845 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.590 3.917 -5.430 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.586 2.519 -5.026 1.00 0.00 C ATOM 2095 C VAL A 130 -4.710 1.700 -5.969 1.00 0.00 C ATOM 2096 O VAL A 130 -4.868 1.775 -7.192 1.00 0.00 O ATOM 2097 CB VAL A 130 -7.018 1.934 -5.010 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -7.011 0.462 -4.620 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.903 2.728 -4.063 1.00 0.00 C ATOM 0 H VAL A 130 -6.457 4.223 -5.873 1.00 0.00 H new ATOM 0 HA VAL A 130 -5.182 2.467 -4.015 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.422 2.011 -6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.032 0.081 -4.618 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -6.415 -0.102 -5.338 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.581 0.351 -3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.907 2.304 -4.063 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.490 2.683 -3.055 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.947 3.766 -4.391 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.766 0.929 -5.402 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.823 0.096 -6.163 1.00 0.00 C ATOM 2111 C PRO A 131 -3.483 -0.747 -7.255 1.00 0.00 C ATOM 2112 O PRO A 131 -4.575 -1.298 -7.077 1.00 0.00 O ATOM 2113 CB PRO A 131 -2.224 -0.807 -5.089 1.00 0.00 C ATOM 2114 CG PRO A 131 -2.264 0.016 -3.854 1.00 0.00 C ATOM 2115 CD PRO A 131 -3.530 0.823 -3.946 1.00 0.00 C ATOM 0 HA PRO A 131 -2.100 0.709 -6.702 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -2.800 -1.725 -4.974 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -1.204 -1.100 -5.339 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -2.264 -0.613 -2.964 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.390 0.664 -3.786 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -4.359 0.328 -3.440 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -3.415 1.804 -3.485 1.00 0.00 H new ATOM 2123 N TYR A 132 -2.803 -0.842 -8.389 1.00 0.00 N ATOM 2124 CA TYR A 132 -3.275 -1.636 -9.510 1.00 0.00 C ATOM 2125 C TYR A 132 -2.387 -2.863 -9.688 1.00 0.00 C ATOM 2126 O TYR A 132 -1.368 -3.000 -9.011 1.00 0.00 O ATOM 2127 CB TYR A 132 -3.289 -0.798 -10.798 1.00 0.00 C ATOM 2128 CG TYR A 132 -1.949 -0.181 -11.152 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -0.949 -0.942 -11.737 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -1.684 1.159 -10.895 1.00 0.00 C ATOM 2131 CE1 TYR A 132 0.274 -0.395 -12.059 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -0.459 1.719 -11.215 1.00 0.00 C ATOM 2133 CZ TYR A 132 0.516 0.935 -11.796 1.00 0.00 C ATOM 2134 OH TYR A 132 1.738 1.484 -12.117 1.00 0.00 O ATOM 0 H TYR A 132 -1.913 -0.372 -8.556 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.294 -1.962 -9.302 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -3.616 -1.428 -11.625 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -4.026 -0.002 -10.693 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -1.132 -1.986 -11.945 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -2.446 1.773 -10.438 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.039 -1.006 -12.515 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -0.268 2.762 -11.011 1.00 0.00 H new ATOM 0 HH TYR A 132 1.746 2.432 -11.868 1.00 0.00 H new ATOM 2144 N TYR A 133 -2.760 -3.742 -10.605 1.00 0.00 N ATOM 2145 CA TYR A 133 -1.987 -4.951 -10.850 1.00 0.00 C ATOM 2146 C TYR A 133 -0.836 -4.654 -11.810 1.00 0.00 C ATOM 2147 O TYR A 133 -1.007 -3.896 -12.767 1.00 0.00 O ATOM 2148 CB TYR A 133 -2.889 -6.041 -11.429 1.00 0.00 C ATOM 2149 CG TYR A 133 -2.388 -7.447 -11.180 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -1.319 -7.971 -11.897 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -2.991 -8.250 -10.222 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -0.866 -9.257 -11.663 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -2.545 -9.533 -9.982 1.00 0.00 C ATOM 2154 CZ TYR A 133 -1.483 -10.034 -10.705 1.00 0.00 C ATOM 2155 OH TYR A 133 -1.039 -11.314 -10.464 1.00 0.00 O ATOM 0 H TYR A 133 -3.590 -3.642 -11.190 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.573 -5.302 -9.905 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -3.886 -5.940 -11.000 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -2.987 -5.885 -12.503 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -0.835 -7.365 -12.648 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -3.824 -7.863 -9.654 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -0.034 -9.650 -12.228 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -3.025 -10.143 -9.231 1.00 0.00 H new ATOM 0 HH TYR A 133 -0.078 -11.367 -10.650 1.00 0.00 H new ATOM 2165 N ARG A 134 0.327 -5.263 -11.551 1.00 0.00 N ATOM 2166 CA ARG A 134 1.531 -5.033 -12.350 1.00 0.00 C ATOM 2167 C ARG A 134 1.952 -3.569 -12.297 1.00 0.00 C ATOM 2168 O ARG A 134 1.763 -2.808 -13.248 1.00 0.00 O ATOM 2169 CB ARG A 134 1.341 -5.510 -13.803 1.00 0.00 C ATOM 2170 CG ARG A 134 2.550 -5.307 -14.719 1.00 0.00 C ATOM 2171 CD ARG A 134 3.799 -6.022 -14.212 1.00 0.00 C ATOM 2172 NE ARG A 134 4.504 -5.251 -13.184 1.00 0.00 N ATOM 2173 CZ ARG A 134 5.394 -5.769 -12.336 1.00 0.00 C ATOM 2174 NH1 ARG A 134 5.698 -7.061 -12.384 1.00 0.00 N ATOM 2175 NH2 ARG A 134 5.988 -4.987 -11.441 1.00 0.00 N ATOM 0 H ARG A 134 0.457 -5.925 -10.786 1.00 0.00 H new ATOM 0 HA ARG A 134 2.336 -5.626 -11.915 1.00 0.00 H new ATOM 0 HB2 ARG A 134 1.089 -6.570 -13.790 1.00 0.00 H new ATOM 0 HB3 ARG A 134 0.488 -4.985 -14.232 1.00 0.00 H new ATOM 0 HG2 ARG A 134 2.309 -5.670 -15.718 1.00 0.00 H new ATOM 0 HG3 ARG A 134 2.758 -4.241 -14.809 1.00 0.00 H new ATOM 0 HD2 ARG A 134 3.519 -6.994 -13.805 1.00 0.00 H new ATOM 0 HD3 ARG A 134 4.473 -6.209 -15.048 1.00 0.00 H new ATOM 0 HE ARG A 134 4.301 -4.254 -13.112 1.00 0.00 H new ATOM 0 HH11 ARG A 134 5.250 -7.665 -13.073 1.00 0.00 H new ATOM 0 HH12 ARG A 134 6.380 -7.449 -11.732 1.00 0.00 H new ATOM 0 HH21 ARG A 134 5.763 -3.993 -11.403 1.00 0.00 H new ATOM 0 HH22 ARG A 134 6.669 -5.381 -10.792 1.00 0.00 H new