USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1083 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 137 HIS : no HE2:sc= -0.466 K(o=-0.61,f=-3.4!) USER MOD Set 1.2: A 141 ASN : amide:sc= -0.147 K(o=-0.61,f=-2.1) USER MOD Set 2.1: A 87 ASN : amide:sc= 0.0279 K(o=0.23,f=-0.92) USER MOD Set 2.2: A 126 TYR OH : rot 121:sc= 0.199 USER MOD Set 3.1: A 48 TYR OH : rot 30:sc= 0.191 USER MOD Set 3.2: A 114 LYS NZ :NH3+ 170:sc= 0.54 (180deg=0.205) USER MOD Set 4.1: A 34 SER OG : rot -71:sc= 0.0558 USER MOD Set 4.2: A 35 HIS : no HD1:sc= -1.13 X(o=-1.1,f=-0.74) USER MOD Set 5.1: A 12 ASN : amide:sc= -0.835 K(o=-1.7,f=-2.2!) USER MOD Set 5.2: A 15 THR OG1 : rot 180:sc= -0.833 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN :FLIP amide:sc= -3.69 F(o=-6!,f=-3.7) USER MOD Single : A 10 GLN : amide:sc= -0.953 X(o=-0.95,f=-0.99) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.287 K(o=-0.29,f=-2.1!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc=-0.00396 USER MOD Single : A 20 THR OG1 : rot -58:sc= 0.593 USER MOD Single : A 21 LYS NZ :NH3+ 154:sc= 0.0428 (180deg=0) USER MOD Single : A 25 TYR OH : rot 167:sc= -0.853 USER MOD Single : A 26 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.18) USER MOD Single : A 27 GLN : amide:sc= -1.01 K(o=-1,f=-3.8!) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.765 X(o=-0.76,f=-0.88) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 154:sc= 0.972 USER MOD Single : A 46 SER OG : rot 95:sc= 0.1 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HE2:sc= -0.269 K(o=-0.27,f=-1.2) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.127 K(o=-0.13,f=-2) USER MOD Single : A 56 TYR OH : rot -124:sc= 0.00895 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0889) USER MOD Single : A 82 HIS : no HD1:sc= -0.196 K(o=-0.2,f=-5.9!) USER MOD Single : A 83 SER OG : rot 180:sc= 0.216 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 HIS : no HD1:sc= -0.674 K(o=-0.67,f=-2.8) USER MOD Single : A 93 TYR OH : rot -127:sc= 0.96 USER MOD Single : A 99 THR OG1 : rot -170:sc= 0 USER MOD Single : A 104 HIS : no HD1:sc= -0.808 K(o=-0.81,f=-1.6) USER MOD Single : A 106 TYR OH : rot 59:sc= -1.66 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 ASN : amide:sc= -0.556 X(o=-0.56,f=-0.52) USER MOD Single : A 124 TYR OH : rot -130:sc= -0.0533 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0492 USER MOD Single : A 128 ASN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 129 LYS NZ :NH3+ -132:sc= -2.3 (180deg=-2.95!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.111 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc=-0.00528 X(o=-0.0053,f=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= -2.05 X(o=-2,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 11 N VAL A 2 4.163 -7.920 -15.596 1.00 0.00 N ATOM 12 CA VAL A 2 3.796 -9.225 -14.999 1.00 0.00 C ATOM 13 C VAL A 2 2.383 -9.126 -14.352 1.00 0.00 C ATOM 14 O VAL A 2 1.880 -8.042 -14.095 1.00 0.00 O ATOM 15 CB VAL A 2 4.879 -9.669 -13.998 1.00 0.00 C ATOM 16 CG1 VAL A 2 4.757 -11.170 -13.794 1.00 0.00 C ATOM 17 CG2 VAL A 2 6.321 -9.456 -14.484 1.00 0.00 C ATOM 0 HA VAL A 2 3.745 -9.991 -15.772 1.00 0.00 H new ATOM 0 HB VAL A 2 4.713 -9.067 -13.105 1.00 0.00 H new ATOM 0 HG11 VAL A 2 5.517 -11.504 -13.087 1.00 0.00 H new ATOM 0 HG12 VAL A 2 3.768 -11.405 -13.401 1.00 0.00 H new ATOM 0 HG13 VAL A 2 4.899 -11.679 -14.747 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.017 -9.796 -13.717 1.00 0.00 H new ATOM 0 HG22 VAL A 2 6.484 -10.024 -15.400 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.486 -8.397 -14.680 1.00 0.00 H new ATOM 27 N THR A 3 1.788 -10.288 -14.102 1.00 0.00 N ATOM 28 CA THR A 3 0.435 -10.407 -13.516 1.00 0.00 C ATOM 29 C THR A 3 0.509 -10.971 -12.088 1.00 0.00 C ATOM 30 O THR A 3 0.515 -12.175 -11.864 1.00 0.00 O ATOM 31 CB THR A 3 -0.442 -11.195 -14.514 1.00 0.00 C ATOM 32 OG1 THR A 3 -1.105 -10.224 -15.304 1.00 0.00 O ATOM 33 CG2 THR A 3 -1.457 -12.204 -13.958 1.00 0.00 C ATOM 0 H THR A 3 2.226 -11.188 -14.298 1.00 0.00 H new ATOM 0 HA THR A 3 -0.045 -9.438 -13.378 1.00 0.00 H new ATOM 0 HB THR A 3 0.239 -11.848 -15.060 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.678 -10.672 -15.960 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.993 -12.673 -14.783 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.933 -12.968 -13.384 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.167 -11.688 -13.312 1.00 0.00 H new ATOM 41 N TRP A 4 0.637 -10.060 -11.135 1.00 0.00 N ATOM 42 CA TRP A 4 0.710 -10.435 -9.711 1.00 0.00 C ATOM 43 C TRP A 4 -0.692 -10.667 -9.163 1.00 0.00 C ATOM 44 O TRP A 4 -1.505 -9.757 -9.082 1.00 0.00 O ATOM 45 CB TRP A 4 1.416 -9.342 -8.900 1.00 0.00 C ATOM 46 CG TRP A 4 2.910 -9.244 -9.221 1.00 0.00 C ATOM 47 CD1 TRP A 4 3.454 -8.803 -10.349 1.00 0.00 C ATOM 48 CD2 TRP A 4 3.955 -9.587 -8.369 1.00 0.00 C ATOM 49 NE1 TRP A 4 4.778 -8.841 -10.267 1.00 0.00 N ATOM 50 CE2 TRP A 4 5.140 -9.308 -9.071 1.00 0.00 C ATOM 51 CE3 TRP A 4 3.997 -10.237 -7.109 1.00 0.00 C ATOM 52 CZ2 TRP A 4 6.389 -9.673 -8.537 1.00 0.00 C ATOM 53 CZ3 TRP A 4 5.242 -10.629 -6.599 1.00 0.00 C ATOM 54 CH2 TRP A 4 6.428 -10.350 -7.301 1.00 0.00 C ATOM 0 H TRP A 4 0.693 -9.057 -11.310 1.00 0.00 H new ATOM 0 HA TRP A 4 1.286 -11.356 -9.624 1.00 0.00 H new ATOM 0 HB2 TRP A 4 0.941 -8.382 -9.101 1.00 0.00 H new ATOM 0 HB3 TRP A 4 1.289 -9.544 -7.837 1.00 0.00 H new ATOM 0 HD1 TRP A 4 2.898 -8.462 -11.210 1.00 0.00 H new ATOM 0 HE1 TRP A 4 5.421 -8.556 -11.006 1.00 0.00 H new ATOM 0 HE3 TRP A 4 3.089 -10.426 -6.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 7.302 -9.439 -9.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 5.291 -11.152 -5.655 1.00 0.00 H new ATOM 0 HH2 TRP A 4 7.378 -10.657 -6.889 1.00 0.00 H new ATOM 65 N THR A 5 -0.960 -11.933 -8.894 1.00 0.00 N ATOM 66 CA THR A 5 -2.305 -12.341 -8.452 1.00 0.00 C ATOM 67 C THR A 5 -2.256 -12.783 -6.979 1.00 0.00 C ATOM 68 O THR A 5 -1.276 -13.360 -6.513 1.00 0.00 O ATOM 69 CB THR A 5 -2.855 -13.452 -9.362 1.00 0.00 C ATOM 70 OG1 THR A 5 -2.636 -13.050 -10.724 1.00 0.00 O ATOM 71 CG2 THR A 5 -4.369 -13.626 -9.192 1.00 0.00 C ATOM 0 H THR A 5 -0.284 -12.694 -8.969 1.00 0.00 H new ATOM 0 HA THR A 5 -2.985 -11.492 -8.528 1.00 0.00 H new ATOM 0 HB THR A 5 -2.354 -14.385 -9.104 1.00 0.00 H new ATOM 0 HG1 THR A 5 -2.976 -13.742 -11.328 1.00 0.00 H new ATOM 0 HG21 THR A 5 -4.720 -14.420 -9.851 1.00 0.00 H new ATOM 0 HG22 THR A 5 -4.591 -13.888 -8.158 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.873 -12.694 -9.446 1.00 0.00 H new ATOM 79 N CYS A 6 -3.280 -12.361 -6.261 1.00 0.00 N ATOM 80 CA CYS A 6 -3.446 -12.658 -4.834 1.00 0.00 C ATOM 81 C CYS A 6 -4.799 -13.303 -4.539 1.00 0.00 C ATOM 82 O CYS A 6 -5.822 -12.972 -5.142 1.00 0.00 O ATOM 83 CB CYS A 6 -3.275 -11.380 -4.012 1.00 0.00 C ATOM 84 SG CYS A 6 -1.703 -11.398 -3.078 1.00 0.00 S ATOM 0 H CYS A 6 -4.034 -11.795 -6.649 1.00 0.00 H new ATOM 0 HA CYS A 6 -2.676 -13.376 -4.552 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -3.298 -10.514 -4.673 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -4.111 -11.275 -3.320 1.00 0.00 H new ATOM 89 N LEU A 7 -4.763 -14.228 -3.590 1.00 0.00 N ATOM 90 CA LEU A 7 -5.951 -14.997 -3.182 1.00 0.00 C ATOM 91 C LEU A 7 -6.450 -14.547 -1.804 1.00 0.00 C ATOM 92 O LEU A 7 -6.060 -15.058 -0.755 1.00 0.00 O ATOM 93 CB LEU A 7 -5.593 -16.492 -3.202 1.00 0.00 C ATOM 94 CG LEU A 7 -5.692 -17.046 -4.620 1.00 0.00 C ATOM 95 CD1 LEU A 7 -4.860 -18.322 -4.760 1.00 0.00 C ATOM 96 CD2 LEU A 7 -7.159 -17.324 -4.975 1.00 0.00 C ATOM 0 H LEU A 7 -3.916 -14.473 -3.077 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.769 -14.817 -3.880 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.583 -16.635 -2.819 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -6.265 -17.042 -2.543 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.296 -16.302 -5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.944 -18.701 -5.778 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.816 -18.101 -4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.227 -19.074 -4.061 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.219 -17.719 -5.989 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.571 -18.053 -4.277 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.730 -16.398 -4.912 1.00 0.00 H new ATOM 108 N ASN A 8 -7.194 -13.448 -1.851 1.00 0.00 N ATOM 109 CA ASN A 8 -7.774 -12.806 -0.659 1.00 0.00 C ATOM 110 C ASN A 8 -9.121 -13.464 -0.325 1.00 0.00 C ATOM 111 O ASN A 8 -9.847 -13.901 -1.212 1.00 0.00 O ATOM 112 CB ASN A 8 -7.994 -11.305 -0.901 1.00 0.00 C ATOM 113 CG ASN A 8 -6.764 -10.579 -1.443 1.00 0.00 C ATOM 114 OD1 ASN A 8 -6.171 -9.714 -0.661 1.00 0.00 O flip ATOM 115 ND2 ASN A 8 -6.336 -10.753 -2.573 1.00 0.00 N flip ATOM 0 H ASN A 8 -7.418 -12.967 -2.722 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.080 -12.931 0.172 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -8.818 -11.177 -1.603 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -8.297 -10.837 0.035 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -6.790 -11.425 -3.192 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -5.525 -10.227 -2.898 1.00 0.00 H new ATOM 122 N ASP A 9 -9.470 -13.410 0.956 1.00 0.00 N ATOM 123 CA ASP A 9 -10.750 -13.943 1.429 1.00 0.00 C ATOM 124 C ASP A 9 -11.824 -12.835 1.481 1.00 0.00 C ATOM 125 O ASP A 9 -11.492 -11.674 1.710 1.00 0.00 O ATOM 126 CB ASP A 9 -10.527 -14.598 2.787 1.00 0.00 C ATOM 127 CG ASP A 9 -10.929 -16.081 2.807 1.00 0.00 C ATOM 128 OD1 ASP A 9 -10.238 -16.864 2.139 1.00 0.00 O ATOM 129 OD2 ASP A 9 -11.880 -16.398 3.550 1.00 0.00 O ATOM 0 H ASP A 9 -8.887 -13.003 1.688 1.00 0.00 H new ATOM 0 HA ASP A 9 -11.124 -14.695 0.734 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -9.476 -14.508 3.060 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.100 -14.061 3.543 1.00 0.00 H new ATOM 134 N GLN A 10 -13.072 -13.167 1.187 1.00 0.00 N ATOM 135 CA GLN A 10 -14.215 -12.233 1.184 1.00 0.00 C ATOM 136 C GLN A 10 -15.455 -12.818 1.859 1.00 0.00 C ATOM 137 O GLN A 10 -15.949 -13.863 1.453 1.00 0.00 O ATOM 138 CB GLN A 10 -14.552 -11.805 -0.233 1.00 0.00 C ATOM 139 CG GLN A 10 -13.646 -10.644 -0.653 1.00 0.00 C ATOM 140 CD GLN A 10 -13.840 -10.258 -2.122 1.00 0.00 C ATOM 141 OE1 GLN A 10 -14.916 -10.270 -2.690 1.00 0.00 O ATOM 142 NE2 GLN A 10 -12.752 -9.883 -2.769 1.00 0.00 N ATOM 0 H GLN A 10 -13.337 -14.119 0.935 1.00 0.00 H new ATOM 0 HA GLN A 10 -13.908 -11.363 1.765 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -14.424 -12.644 -0.917 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -15.597 -11.503 -0.292 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -13.851 -9.779 -0.022 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -12.605 -10.920 -0.487 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -11.851 -9.874 -2.290 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -12.812 -9.602 -3.748 1.00 0.00 H new ATOM 151 N LYS A 11 -15.800 -12.213 3.001 1.00 0.00 N ATOM 152 CA LYS A 11 -16.961 -12.630 3.811 1.00 0.00 C ATOM 153 C LYS A 11 -18.206 -11.985 3.228 1.00 0.00 C ATOM 154 O LYS A 11 -18.563 -10.846 3.543 1.00 0.00 O ATOM 155 CB LYS A 11 -16.800 -12.232 5.280 1.00 0.00 C ATOM 156 CG LYS A 11 -17.952 -12.770 6.138 1.00 0.00 C ATOM 157 CD LYS A 11 -18.101 -11.880 7.377 1.00 0.00 C ATOM 158 CE LYS A 11 -17.854 -12.671 8.662 1.00 0.00 C ATOM 159 NZ LYS A 11 -16.939 -11.898 9.514 1.00 0.00 N ATOM 0 H LYS A 11 -15.287 -11.423 3.393 1.00 0.00 H new ATOM 0 HA LYS A 11 -17.042 -13.717 3.781 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -15.853 -12.615 5.660 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.761 -11.146 5.362 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -18.879 -12.777 5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -17.753 -13.800 6.435 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -17.397 -11.050 7.318 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -19.102 -11.449 7.399 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -18.794 -12.852 9.182 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -17.424 -13.646 8.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -16.759 -12.421 10.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -16.041 -11.747 9.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -17.369 -10.978 9.740 1.00 0.00 H new ATOM 173 N ASN A 12 -18.775 -12.715 2.285 1.00 0.00 N ATOM 174 CA ASN A 12 -19.993 -12.263 1.602 1.00 0.00 C ATOM 175 C ASN A 12 -21.132 -12.254 2.629 1.00 0.00 C ATOM 176 O ASN A 12 -21.328 -13.284 3.261 1.00 0.00 O ATOM 177 CB ASN A 12 -20.331 -13.212 0.450 1.00 0.00 C ATOM 178 CG ASN A 12 -21.000 -12.415 -0.662 1.00 0.00 C ATOM 179 OD1 ASN A 12 -20.647 -11.283 -0.967 1.00 0.00 O ATOM 180 ND2 ASN A 12 -22.024 -12.965 -1.262 1.00 0.00 N ATOM 0 H ASN A 12 -18.423 -13.619 1.970 1.00 0.00 H new ATOM 0 HA ASN A 12 -19.848 -11.265 1.188 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -19.426 -13.692 0.078 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -20.993 -14.006 0.797 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -22.529 -12.451 -1.984 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -22.318 -13.908 -1.008 1.00 0.00 H new ATOM 187 N PRO A 13 -21.854 -11.133 2.812 1.00 0.00 N ATOM 188 CA PRO A 13 -22.981 -11.063 3.760 1.00 0.00 C ATOM 189 C PRO A 13 -24.227 -11.842 3.298 1.00 0.00 C ATOM 190 O PRO A 13 -24.931 -12.408 4.122 1.00 0.00 O ATOM 191 CB PRO A 13 -23.256 -9.561 3.912 1.00 0.00 C ATOM 192 CG PRO A 13 -22.810 -8.974 2.577 1.00 0.00 C ATOM 193 CD PRO A 13 -21.615 -9.837 2.150 1.00 0.00 C ATOM 0 HA PRO A 13 -22.730 -11.541 4.707 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.311 -9.365 4.103 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -22.696 -9.134 4.744 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.611 -9.015 1.839 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -22.525 -7.927 2.680 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.568 -9.945 1.066 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -20.670 -9.395 2.467 1.00 0.00 H new ATOM 201 N LYS A 14 -24.373 -12.003 1.983 1.00 0.00 N ATOM 202 CA LYS A 14 -25.467 -12.776 1.363 1.00 0.00 C ATOM 203 C LYS A 14 -25.442 -14.238 1.837 1.00 0.00 C ATOM 204 O LYS A 14 -26.445 -14.799 2.257 1.00 0.00 O ATOM 205 CB LYS A 14 -25.332 -12.718 -0.170 1.00 0.00 C ATOM 206 CG LYS A 14 -26.424 -13.493 -0.927 1.00 0.00 C ATOM 207 CD LYS A 14 -27.753 -12.731 -0.974 1.00 0.00 C ATOM 208 CE LYS A 14 -28.892 -13.624 -1.468 1.00 0.00 C ATOM 209 NZ LYS A 14 -29.769 -13.948 -0.339 1.00 0.00 N ATOM 0 H LYS A 14 -23.730 -11.598 1.303 1.00 0.00 H new ATOM 0 HA LYS A 14 -26.418 -12.337 1.664 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -25.356 -11.675 -0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -24.357 -13.115 -0.453 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -26.086 -13.692 -1.944 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -26.579 -14.460 -0.447 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.991 -12.351 0.019 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.655 -11.867 -1.631 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -29.457 -13.116 -2.250 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -28.491 -14.537 -1.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -30.547 -14.556 -0.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -29.224 -14.448 0.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -30.160 -13.071 0.060 1.00 0.00 H new ATOM 223 N THR A 15 -24.244 -14.819 1.755 1.00 0.00 N ATOM 224 CA THR A 15 -24.014 -16.222 2.141 1.00 0.00 C ATOM 225 C THR A 15 -23.408 -16.369 3.544 1.00 0.00 C ATOM 226 O THR A 15 -23.166 -17.493 3.978 1.00 0.00 O ATOM 227 CB THR A 15 -23.102 -16.876 1.090 1.00 0.00 C ATOM 228 OG1 THR A 15 -21.928 -16.059 0.949 1.00 0.00 O ATOM 229 CG2 THR A 15 -23.812 -17.061 -0.251 1.00 0.00 C ATOM 0 H THR A 15 -23.408 -14.339 1.422 1.00 0.00 H new ATOM 0 HA THR A 15 -24.981 -16.723 2.178 1.00 0.00 H new ATOM 0 HB THR A 15 -22.826 -17.876 1.424 1.00 0.00 H new ATOM 0 HG1 THR A 15 -21.330 -16.458 0.284 1.00 0.00 H new ATOM 0 HG21 THR A 15 -23.130 -17.526 -0.963 1.00 0.00 H new ATOM 0 HG22 THR A 15 -24.685 -17.699 -0.115 1.00 0.00 H new ATOM 0 HG23 THR A 15 -24.128 -16.090 -0.633 1.00 0.00 H new ATOM 237 N ASN A 16 -23.102 -15.235 4.183 1.00 0.00 N ATOM 238 CA ASN A 16 -22.399 -15.118 5.479 1.00 0.00 C ATOM 239 C ASN A 16 -21.165 -16.031 5.587 1.00 0.00 C ATOM 240 O ASN A 16 -20.729 -16.438 6.664 1.00 0.00 O ATOM 241 CB ASN A 16 -23.407 -15.326 6.607 1.00 0.00 C ATOM 242 CG ASN A 16 -23.507 -14.119 7.530 1.00 0.00 C ATOM 243 OD1 ASN A 16 -22.947 -13.048 7.346 1.00 0.00 O ATOM 244 ND2 ASN A 16 -24.276 -14.305 8.584 1.00 0.00 N ATOM 0 H ASN A 16 -23.348 -14.324 3.796 1.00 0.00 H new ATOM 0 HA ASN A 16 -21.985 -14.113 5.563 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -24.388 -15.535 6.180 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -23.120 -16.202 7.189 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -24.409 -13.551 9.257 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -24.738 -15.203 8.726 1.00 0.00 H new ATOM 251 N LYS A 17 -20.571 -16.245 4.426 1.00 0.00 N ATOM 252 CA LYS A 17 -19.454 -17.174 4.245 1.00 0.00 C ATOM 253 C LYS A 17 -18.282 -16.492 3.546 1.00 0.00 C ATOM 254 O LYS A 17 -18.450 -15.584 2.718 1.00 0.00 O ATOM 255 CB LYS A 17 -19.901 -18.411 3.473 1.00 0.00 C ATOM 256 CG LYS A 17 -19.547 -19.642 4.321 1.00 0.00 C ATOM 257 CD LYS A 17 -19.227 -20.853 3.453 1.00 0.00 C ATOM 258 CE LYS A 17 -18.491 -21.899 4.304 1.00 0.00 C ATOM 259 NZ LYS A 17 -17.156 -22.133 3.729 1.00 0.00 N ATOM 0 H LYS A 17 -20.851 -15.774 3.565 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.116 -17.491 5.232 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -20.973 -18.375 3.280 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -19.404 -18.458 2.504 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -18.691 -19.413 4.955 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.380 -19.879 4.983 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -20.145 -21.277 3.046 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -18.610 -20.556 2.605 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -18.402 -21.551 5.333 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -19.058 -22.830 4.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -16.651 -22.841 4.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -17.254 -22.481 2.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -16.618 -21.243 3.726 1.00 0.00 H new ATOM 273 N TYR A 18 -17.115 -17.020 3.871 1.00 0.00 N ATOM 274 CA TYR A 18 -15.827 -16.523 3.378 1.00 0.00 C ATOM 275 C TYR A 18 -15.348 -17.319 2.165 1.00 0.00 C ATOM 276 O TYR A 18 -15.448 -18.544 2.120 1.00 0.00 O ATOM 277 CB TYR A 18 -14.809 -16.621 4.522 1.00 0.00 C ATOM 278 CG TYR A 18 -14.358 -15.258 5.049 1.00 0.00 C ATOM 279 CD1 TYR A 18 -13.761 -14.338 4.158 1.00 0.00 C ATOM 280 CD2 TYR A 18 -14.426 -14.987 6.427 1.00 0.00 C ATOM 281 CE1 TYR A 18 -13.220 -13.141 4.646 1.00 0.00 C ATOM 282 CE2 TYR A 18 -13.905 -13.778 6.922 1.00 0.00 C ATOM 283 CZ TYR A 18 -13.316 -12.859 6.024 1.00 0.00 C ATOM 284 OH TYR A 18 -12.941 -11.620 6.424 1.00 0.00 O ATOM 0 H TYR A 18 -17.026 -17.821 4.496 1.00 0.00 H new ATOM 0 HA TYR A 18 -15.937 -15.488 3.055 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -15.247 -17.193 5.340 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -13.937 -17.176 4.176 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -13.722 -14.557 3.101 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -14.875 -15.702 7.100 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -12.737 -12.445 3.976 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -13.954 -13.554 7.977 1.00 0.00 H new ATOM 0 HH TYR A 18 -13.052 -11.542 7.395 1.00 0.00 H new ATOM 294 N GLU A 19 -15.025 -16.566 1.117 1.00 0.00 N ATOM 295 CA GLU A 19 -14.611 -17.134 -0.182 1.00 0.00 C ATOM 296 C GLU A 19 -13.248 -16.580 -0.585 1.00 0.00 C ATOM 297 O GLU A 19 -12.944 -15.423 -0.293 1.00 0.00 O ATOM 298 CB GLU A 19 -15.615 -16.796 -1.292 1.00 0.00 C ATOM 299 CG GLU A 19 -17.075 -16.866 -0.831 1.00 0.00 C ATOM 300 CD GLU A 19 -18.099 -16.890 -1.969 1.00 0.00 C ATOM 301 OE1 GLU A 19 -17.973 -16.048 -2.881 1.00 0.00 O ATOM 302 OE2 GLU A 19 -19.024 -17.725 -1.851 1.00 0.00 O ATOM 0 H GLU A 19 -15.040 -15.546 1.134 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.565 -18.216 -0.061 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -15.407 -15.794 -1.667 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.471 -17.484 -2.125 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.208 -17.759 -0.221 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.282 -16.009 -0.191 1.00 0.00 H new ATOM 309 N THR A 20 -12.488 -17.359 -1.330 1.00 0.00 N ATOM 310 CA THR A 20 -11.130 -16.981 -1.739 1.00 0.00 C ATOM 311 C THR A 20 -11.126 -16.552 -3.210 1.00 0.00 C ATOM 312 O THR A 20 -11.149 -17.372 -4.126 1.00 0.00 O ATOM 313 CB THR A 20 -10.158 -18.136 -1.475 1.00 0.00 C ATOM 314 OG1 THR A 20 -10.421 -18.663 -0.171 1.00 0.00 O ATOM 315 CG2 THR A 20 -8.695 -17.681 -1.557 1.00 0.00 C ATOM 0 H THR A 20 -12.785 -18.272 -1.673 1.00 0.00 H new ATOM 0 HA THR A 20 -10.794 -16.130 -1.146 1.00 0.00 H new ATOM 0 HB THR A 20 -10.309 -18.897 -2.240 1.00 0.00 H new ATOM 0 HG1 THR A 20 -10.321 -17.952 0.496 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.039 -18.530 -1.364 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.492 -17.285 -2.552 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.513 -16.905 -0.814 1.00 0.00 H new ATOM 323 N LYS A 21 -11.227 -15.242 -3.368 1.00 0.00 N ATOM 324 CA LYS A 21 -11.274 -14.582 -4.685 1.00 0.00 C ATOM 325 C LYS A 21 -9.856 -14.403 -5.230 1.00 0.00 C ATOM 326 O LYS A 21 -8.873 -14.426 -4.479 1.00 0.00 O ATOM 327 CB LYS A 21 -11.988 -13.226 -4.581 1.00 0.00 C ATOM 328 CG LYS A 21 -13.334 -13.288 -3.840 1.00 0.00 C ATOM 329 CD LYS A 21 -14.557 -12.965 -4.702 1.00 0.00 C ATOM 330 CE LYS A 21 -15.095 -14.170 -5.480 1.00 0.00 C ATOM 331 NZ LYS A 21 -16.536 -14.299 -5.199 1.00 0.00 N ATOM 0 H LYS A 21 -11.280 -14.591 -2.585 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.837 -15.211 -5.374 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.334 -12.520 -4.069 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -12.154 -12.836 -5.585 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.456 -14.287 -3.421 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.304 -12.592 -3.002 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.348 -12.573 -4.063 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.296 -12.175 -5.407 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.927 -14.037 -6.549 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -14.568 -15.078 -5.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.003 -14.779 -5.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.672 -14.855 -4.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -16.951 -13.354 -5.073 1.00 0.00 H new ATOM 345 N ARG A 22 -9.769 -14.223 -6.542 1.00 0.00 N ATOM 346 CA ARG A 22 -8.480 -14.051 -7.243 1.00 0.00 C ATOM 347 C ARG A 22 -8.302 -12.607 -7.733 1.00 0.00 C ATOM 348 O ARG A 22 -8.865 -12.160 -8.731 1.00 0.00 O ATOM 349 CB ARG A 22 -8.391 -14.998 -8.439 1.00 0.00 C ATOM 350 CG ARG A 22 -7.244 -15.975 -8.241 1.00 0.00 C ATOM 351 CD ARG A 22 -7.662 -17.390 -8.632 1.00 0.00 C ATOM 352 NE ARG A 22 -8.793 -17.823 -7.780 1.00 0.00 N ATOM 353 CZ ARG A 22 -9.654 -18.797 -8.051 1.00 0.00 C ATOM 354 NH1 ARG A 22 -9.524 -19.544 -9.147 1.00 0.00 N ATOM 355 NH2 ARG A 22 -10.655 -19.053 -7.226 1.00 0.00 N ATOM 0 H ARG A 22 -10.581 -14.190 -7.158 1.00 0.00 H new ATOM 0 HA ARG A 22 -7.688 -14.283 -6.531 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.328 -15.542 -8.553 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -8.240 -14.427 -9.355 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -6.389 -15.665 -8.841 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -6.924 -15.961 -7.199 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -7.952 -17.418 -9.682 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.822 -18.074 -8.515 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.923 -17.325 -6.900 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.754 -19.372 -9.793 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.195 -20.288 -9.340 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.769 -18.501 -6.376 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.313 -19.802 -7.440 1.00 0.00 H new ATOM 369 N LEU A 23 -7.557 -11.869 -6.927 1.00 0.00 N ATOM 370 CA LEU A 23 -7.227 -10.466 -7.205 1.00 0.00 C ATOM 371 C LEU A 23 -5.962 -10.361 -8.054 1.00 0.00 C ATOM 372 O LEU A 23 -4.848 -10.502 -7.559 1.00 0.00 O ATOM 373 CB LEU A 23 -7.112 -9.711 -5.887 1.00 0.00 C ATOM 374 CG LEU A 23 -8.268 -8.712 -5.775 1.00 0.00 C ATOM 375 CD1 LEU A 23 -9.623 -9.388 -5.551 1.00 0.00 C ATOM 376 CD2 LEU A 23 -7.982 -7.788 -4.593 1.00 0.00 C ATOM 0 H LEU A 23 -7.159 -12.220 -6.056 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.024 -10.007 -7.790 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.137 -10.410 -5.051 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.157 -9.188 -5.836 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.331 -8.168 -6.718 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.401 -8.628 -5.480 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.840 -10.053 -6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.593 -9.965 -4.627 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -8.792 -7.066 -4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.906 -8.378 -3.680 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.044 -7.260 -4.763 1.00 0.00 H new ATOM 388 N LEU A 24 -6.191 -10.239 -9.350 1.00 0.00 N ATOM 389 CA LEU A 24 -5.119 -10.035 -10.340 1.00 0.00 C ATOM 390 C LEU A 24 -4.785 -8.540 -10.466 1.00 0.00 C ATOM 391 O LEU A 24 -5.646 -7.693 -10.656 1.00 0.00 O ATOM 392 CB LEU A 24 -5.496 -10.779 -11.635 1.00 0.00 C ATOM 393 CG LEU A 24 -4.994 -10.248 -12.998 1.00 0.00 C ATOM 394 CD1 LEU A 24 -5.884 -9.120 -13.533 1.00 0.00 C ATOM 395 CD2 LEU A 24 -3.521 -9.847 -12.994 1.00 0.00 C ATOM 0 H LEU A 24 -7.125 -10.277 -9.758 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.173 -10.475 -10.026 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.143 -11.805 -11.535 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.584 -10.820 -11.682 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.071 -11.090 -13.686 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.497 -8.775 -14.492 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.901 -9.490 -13.664 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.888 -8.292 -12.824 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.240 -9.485 -13.983 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.361 -9.058 -12.259 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.909 -10.712 -12.737 1.00 0.00 H new ATOM 407 N TYR A 25 -3.494 -8.300 -10.300 1.00 0.00 N ATOM 408 CA TYR A 25 -2.879 -6.977 -10.408 1.00 0.00 C ATOM 409 C TYR A 25 -1.861 -6.961 -11.543 1.00 0.00 C ATOM 410 O TYR A 25 -1.046 -7.861 -11.704 1.00 0.00 O ATOM 411 CB TYR A 25 -2.156 -6.633 -9.098 1.00 0.00 C ATOM 412 CG TYR A 25 -3.167 -6.323 -8.005 1.00 0.00 C ATOM 413 CD1 TYR A 25 -3.808 -7.367 -7.292 1.00 0.00 C ATOM 414 CD2 TYR A 25 -3.454 -4.963 -7.778 1.00 0.00 C ATOM 415 CE1 TYR A 25 -4.805 -7.021 -6.355 1.00 0.00 C ATOM 416 CE2 TYR A 25 -4.412 -4.651 -6.805 1.00 0.00 C ATOM 417 CZ TYR A 25 -5.075 -5.665 -6.102 1.00 0.00 C ATOM 418 OH TYR A 25 -6.017 -5.286 -5.184 1.00 0.00 O ATOM 0 H TYR A 25 -2.823 -9.036 -10.080 1.00 0.00 H new ATOM 0 HA TYR A 25 -3.663 -6.246 -10.607 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -1.524 -7.467 -8.793 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -1.500 -5.776 -9.250 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -3.541 -8.400 -7.461 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -2.952 -4.186 -8.336 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -5.356 -7.792 -5.837 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -4.642 -3.617 -6.594 1.00 0.00 H new ATOM 0 HH TYR A 25 -5.917 -4.331 -4.988 1.00 0.00 H new ATOM 428 N ASN A 26 -1.862 -5.839 -12.249 1.00 0.00 N ATOM 429 CA ASN A 26 -0.899 -5.636 -13.327 1.00 0.00 C ATOM 430 C ASN A 26 0.322 -4.921 -12.740 1.00 0.00 C ATOM 431 O ASN A 26 0.230 -3.782 -12.271 1.00 0.00 O ATOM 432 CB ASN A 26 -1.527 -4.759 -14.419 1.00 0.00 C ATOM 433 CG ASN A 26 -1.292 -5.377 -15.797 1.00 0.00 C ATOM 434 OD1 ASN A 26 -1.530 -6.541 -16.056 1.00 0.00 O ATOM 435 ND2 ASN A 26 -0.832 -4.584 -16.732 1.00 0.00 N ATOM 0 H ASN A 26 -2.508 -5.064 -12.100 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.610 -6.592 -13.763 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -2.597 -4.652 -14.239 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.096 -3.758 -14.384 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -0.675 -4.943 -17.674 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.631 -3.607 -16.519 1.00 0.00 H new ATOM 442 N GLN A 27 1.464 -5.565 -12.903 1.00 0.00 N ATOM 443 CA GLN A 27 2.760 -5.014 -12.458 1.00 0.00 C ATOM 444 C GLN A 27 3.047 -3.637 -13.093 1.00 0.00 C ATOM 445 O GLN A 27 3.645 -2.801 -12.434 1.00 0.00 O ATOM 446 CB GLN A 27 3.871 -6.000 -12.823 1.00 0.00 C ATOM 447 CG GLN A 27 5.137 -5.756 -12.010 1.00 0.00 C ATOM 448 CD GLN A 27 6.275 -5.050 -12.748 1.00 0.00 C ATOM 449 OE1 GLN A 27 6.126 -4.029 -13.398 1.00 0.00 O ATOM 450 NE2 GLN A 27 7.456 -5.591 -12.603 1.00 0.00 N ATOM 0 H GLN A 27 1.534 -6.482 -13.344 1.00 0.00 H new ATOM 0 HA GLN A 27 2.721 -4.872 -11.378 1.00 0.00 H new ATOM 0 HB2 GLN A 27 3.522 -7.019 -12.654 1.00 0.00 H new ATOM 0 HB3 GLN A 27 4.099 -5.913 -13.885 1.00 0.00 H new ATOM 0 HG2 GLN A 27 4.875 -5.164 -11.133 1.00 0.00 H new ATOM 0 HG3 GLN A 27 5.504 -6.716 -11.648 1.00 0.00 H new ATOM 0 HE21 GLN A 27 7.562 -6.445 -12.056 1.00 0.00 H new ATOM 0 HE22 GLN A 27 8.272 -5.159 -13.037 1.00 0.00 H new ATOM 459 N ASN A 28 2.378 -3.367 -14.210 1.00 0.00 N ATOM 460 CA ASN A 28 2.455 -2.109 -14.958 1.00 0.00 C ATOM 461 C ASN A 28 1.869 -0.962 -14.145 1.00 0.00 C ATOM 462 O ASN A 28 2.627 -0.238 -13.520 1.00 0.00 O ATOM 463 CB ASN A 28 1.711 -2.239 -16.297 1.00 0.00 C ATOM 464 CG ASN A 28 2.270 -1.218 -17.276 1.00 0.00 C ATOM 465 OD1 ASN A 28 2.048 -0.020 -17.182 1.00 0.00 O ATOM 466 ND2 ASN A 28 3.092 -1.709 -18.167 1.00 0.00 N ATOM 0 H ASN A 28 1.743 -4.041 -14.638 1.00 0.00 H new ATOM 0 HA ASN A 28 3.505 -1.893 -15.155 1.00 0.00 H new ATOM 0 HB2 ASN A 28 1.828 -3.246 -16.696 1.00 0.00 H new ATOM 0 HB3 ASN A 28 0.643 -2.076 -16.152 1.00 0.00 H new ATOM 0 HD21 ASN A 28 3.574 -1.086 -18.815 1.00 0.00 H new ATOM 0 HD22 ASN A 28 3.251 -2.715 -18.214 1.00 0.00 H new ATOM 473 N LYS A 29 0.558 -1.053 -13.895 1.00 0.00 N ATOM 474 CA LYS A 29 -0.138 -0.108 -12.998 1.00 0.00 C ATOM 475 C LYS A 29 0.462 -0.071 -11.592 1.00 0.00 C ATOM 476 O LYS A 29 0.494 0.998 -11.016 1.00 0.00 O ATOM 477 CB LYS A 29 -1.642 -0.388 -12.933 1.00 0.00 C ATOM 478 CG LYS A 29 -2.391 0.395 -14.015 1.00 0.00 C ATOM 479 CD LYS A 29 -2.693 -0.426 -15.265 1.00 0.00 C ATOM 480 CE LYS A 29 -1.854 0.048 -16.458 1.00 0.00 C ATOM 481 NZ LYS A 29 -2.706 0.021 -17.655 1.00 0.00 N ATOM 0 H LYS A 29 -0.047 -1.769 -14.298 1.00 0.00 H new ATOM 0 HA LYS A 29 0.009 0.879 -13.437 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.823 -1.455 -13.060 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.025 -0.114 -11.950 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.328 0.767 -13.600 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.799 1.266 -14.297 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -2.489 -1.479 -15.069 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.753 -0.346 -15.508 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -1.477 1.055 -16.282 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.986 -0.598 -16.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.157 0.339 -18.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.045 -0.949 -17.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.520 0.653 -17.516 1.00 0.00 H new ATOM 495 N ALA A 30 1.139 -1.125 -11.157 1.00 0.00 N ATOM 496 CA ALA A 30 1.865 -1.145 -9.873 1.00 0.00 C ATOM 497 C ALA A 30 3.177 -0.342 -9.912 1.00 0.00 C ATOM 498 O ALA A 30 3.274 0.706 -9.270 1.00 0.00 O ATOM 499 CB ALA A 30 2.079 -2.600 -9.464 1.00 0.00 C ATOM 0 H ALA A 30 1.207 -1.999 -11.679 1.00 0.00 H new ATOM 0 HA ALA A 30 1.262 -0.642 -9.117 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.615 -2.636 -8.516 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.113 -3.093 -9.354 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.662 -3.111 -10.230 1.00 0.00 H new ATOM 505 N GLU A 31 4.133 -0.770 -10.750 1.00 0.00 N ATOM 506 CA GLU A 31 5.388 -0.028 -10.989 1.00 0.00 C ATOM 507 C GLU A 31 5.132 1.397 -11.485 1.00 0.00 C ATOM 508 O GLU A 31 5.988 2.247 -11.346 1.00 0.00 O ATOM 509 CB GLU A 31 6.333 -0.788 -11.946 1.00 0.00 C ATOM 510 CG GLU A 31 5.884 -0.897 -13.407 1.00 0.00 C ATOM 511 CD GLU A 31 6.266 0.287 -14.295 1.00 0.00 C ATOM 512 OE1 GLU A 31 7.450 0.331 -14.685 1.00 0.00 O ATOM 513 OE2 GLU A 31 5.347 1.036 -14.683 1.00 0.00 O ATOM 0 H GLU A 31 4.062 -1.638 -11.282 1.00 0.00 H new ATOM 0 HA GLU A 31 5.888 0.050 -10.024 1.00 0.00 H new ATOM 0 HB2 GLU A 31 7.307 -0.298 -11.924 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.474 -1.796 -11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 31 6.311 -1.804 -13.835 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.800 -1.013 -13.430 1.00 0.00 H new ATOM 520 N SER A 32 3.975 1.647 -12.095 1.00 0.00 N ATOM 521 CA SER A 32 3.590 2.981 -12.601 1.00 0.00 C ATOM 522 C SER A 32 2.896 3.820 -11.529 1.00 0.00 C ATOM 523 O SER A 32 3.264 4.972 -11.324 1.00 0.00 O ATOM 524 CB SER A 32 2.695 2.842 -13.829 1.00 0.00 C ATOM 525 OG SER A 32 2.404 4.125 -14.390 1.00 0.00 O ATOM 0 H SER A 32 3.267 0.931 -12.258 1.00 0.00 H new ATOM 0 HA SER A 32 4.505 3.503 -12.882 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.186 2.217 -14.574 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.767 2.341 -13.554 1.00 0.00 H new ATOM 0 HG SER A 32 1.830 4.015 -15.177 1.00 0.00 H new ATOM 531 N ASN A 33 2.034 3.192 -10.731 1.00 0.00 N ATOM 532 CA ASN A 33 1.370 3.831 -9.565 1.00 0.00 C ATOM 533 C ASN A 33 2.378 4.332 -8.549 1.00 0.00 C ATOM 534 O ASN A 33 2.317 5.488 -8.147 1.00 0.00 O ATOM 535 CB ASN A 33 0.431 2.876 -8.829 1.00 0.00 C ATOM 536 CG ASN A 33 -0.990 2.836 -9.398 1.00 0.00 C ATOM 537 OD1 ASN A 33 -1.276 3.068 -10.565 1.00 0.00 O ATOM 538 ND2 ASN A 33 -1.929 2.546 -8.534 1.00 0.00 N ATOM 0 H ASN A 33 1.766 2.217 -10.865 1.00 0.00 H new ATOM 0 HA ASN A 33 0.801 4.660 -9.985 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.853 1.871 -8.862 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.383 3.167 -7.780 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.904 2.513 -8.832 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.686 2.353 -7.562 1.00 0.00 H new ATOM 545 N SER A 34 3.340 3.472 -8.214 1.00 0.00 N ATOM 546 CA SER A 34 4.445 3.846 -7.324 1.00 0.00 C ATOM 547 C SER A 34 5.250 5.025 -7.872 1.00 0.00 C ATOM 548 O SER A 34 5.371 6.021 -7.161 1.00 0.00 O ATOM 549 CB SER A 34 5.355 2.656 -7.017 1.00 0.00 C ATOM 550 OG SER A 34 5.943 2.132 -8.200 1.00 0.00 O ATOM 0 H SER A 34 3.378 2.508 -8.546 1.00 0.00 H new ATOM 0 HA SER A 34 3.993 4.168 -6.386 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.139 2.965 -6.326 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.780 1.876 -6.519 1.00 0.00 H new ATOM 0 HG SER A 34 5.259 1.672 -8.729 1.00 0.00 H new ATOM 556 N HIS A 35 5.402 5.064 -9.197 1.00 0.00 N ATOM 557 CA HIS A 35 6.095 6.131 -9.939 1.00 0.00 C ATOM 558 C HIS A 35 5.262 7.425 -10.102 1.00 0.00 C ATOM 559 O HIS A 35 5.800 8.491 -10.414 1.00 0.00 O ATOM 560 CB HIS A 35 6.566 5.606 -11.308 1.00 0.00 C ATOM 561 CG HIS A 35 7.677 4.537 -11.271 1.00 0.00 C ATOM 562 ND1 HIS A 35 8.218 3.997 -12.354 1.00 0.00 N ATOM 563 CD2 HIS A 35 8.124 3.853 -10.222 1.00 0.00 C ATOM 564 CE1 HIS A 35 8.986 2.967 -11.993 1.00 0.00 C ATOM 565 NE2 HIS A 35 8.907 2.869 -10.670 1.00 0.00 N ATOM 0 H HIS A 35 5.036 4.333 -9.807 1.00 0.00 H new ATOM 0 HA HIS A 35 6.959 6.413 -9.336 1.00 0.00 H new ATOM 0 HB2 HIS A 35 5.705 5.190 -11.832 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.921 6.451 -11.898 1.00 0.00 H new ATOM 0 HD2 HIS A 35 7.894 4.058 -9.187 1.00 0.00 H new ATOM 0 HE1 HIS A 35 9.562 2.333 -12.651 1.00 0.00 H new ATOM 0 HE2 HIS A 35 9.366 2.163 -10.095 1.00 0.00 H new ATOM 574 N HIS A 36 3.957 7.304 -9.886 1.00 0.00 N ATOM 575 CA HIS A 36 2.988 8.418 -9.878 1.00 0.00 C ATOM 576 C HIS A 36 2.791 8.990 -8.460 1.00 0.00 C ATOM 577 O HIS A 36 2.369 10.134 -8.286 1.00 0.00 O ATOM 578 CB HIS A 36 1.660 7.921 -10.458 1.00 0.00 C ATOM 579 CG HIS A 36 1.264 8.682 -11.723 1.00 0.00 C ATOM 580 ND1 HIS A 36 0.319 9.607 -11.797 1.00 0.00 N ATOM 581 CD2 HIS A 36 1.809 8.558 -12.929 1.00 0.00 C ATOM 582 CE1 HIS A 36 0.272 10.063 -13.047 1.00 0.00 C ATOM 583 NE2 HIS A 36 1.193 9.409 -13.744 1.00 0.00 N ATOM 0 H HIS A 36 3.519 6.401 -9.704 1.00 0.00 H new ATOM 0 HA HIS A 36 3.376 9.230 -10.493 1.00 0.00 H new ATOM 0 HB2 HIS A 36 1.739 6.858 -10.685 1.00 0.00 H new ATOM 0 HB3 HIS A 36 0.875 8.029 -9.710 1.00 0.00 H new ATOM 0 HD2 HIS A 36 2.610 7.886 -13.199 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -0.393 10.825 -13.425 1.00 0.00 H new ATOM 0 HE2 HIS A 36 1.394 9.537 -14.736 1.00 0.00 H new ATOM 592 N ALA A 37 3.121 8.168 -7.462 1.00 0.00 N ATOM 593 CA ALA A 37 3.094 8.520 -6.033 1.00 0.00 C ATOM 594 C ALA A 37 4.425 9.182 -5.594 1.00 0.00 C ATOM 595 O ALA A 37 5.487 8.796 -6.102 1.00 0.00 O ATOM 596 CB ALA A 37 2.848 7.243 -5.227 1.00 0.00 C ATOM 0 H ALA A 37 3.424 7.208 -7.627 1.00 0.00 H new ATOM 0 HA ALA A 37 2.296 9.241 -5.854 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.824 7.483 -4.164 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.894 6.805 -5.521 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.650 6.530 -5.421 1.00 0.00 H new ATOM 602 N PRO A 38 4.382 10.179 -4.698 1.00 0.00 N ATOM 603 CA PRO A 38 5.579 10.862 -4.201 1.00 0.00 C ATOM 604 C PRO A 38 6.352 9.922 -3.281 1.00 0.00 C ATOM 605 O PRO A 38 5.794 9.104 -2.566 1.00 0.00 O ATOM 606 CB PRO A 38 5.056 12.075 -3.421 1.00 0.00 C ATOM 607 CG PRO A 38 3.683 11.645 -2.929 1.00 0.00 C ATOM 608 CD PRO A 38 3.180 10.736 -4.049 1.00 0.00 C ATOM 0 HA PRO A 38 6.254 11.164 -5.002 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.715 12.327 -2.590 1.00 0.00 H new ATOM 0 HB3 PRO A 38 4.992 12.958 -4.056 1.00 0.00 H new ATOM 0 HG2 PRO A 38 3.743 11.116 -1.978 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.024 12.500 -2.777 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.549 9.941 -3.651 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.576 11.296 -4.763 1.00 0.00 H new ATOM 616 N LEU A 39 7.660 10.072 -3.307 1.00 0.00 N ATOM 617 CA LEU A 39 8.555 9.238 -2.507 1.00 0.00 C ATOM 618 C LEU A 39 8.798 9.817 -1.103 1.00 0.00 C ATOM 619 O LEU A 39 9.763 10.546 -0.863 1.00 0.00 O ATOM 620 CB LEU A 39 9.843 9.106 -3.297 1.00 0.00 C ATOM 621 CG LEU A 39 9.770 7.972 -4.304 1.00 0.00 C ATOM 622 CD1 LEU A 39 10.970 8.116 -5.235 1.00 0.00 C ATOM 623 CD2 LEU A 39 9.717 6.610 -3.588 1.00 0.00 C ATOM 0 H LEU A 39 8.138 10.769 -3.878 1.00 0.00 H new ATOM 0 HA LEU A 39 8.106 8.261 -2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.049 10.042 -3.817 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.674 8.932 -2.613 1.00 0.00 H new ATOM 0 HG LEU A 39 8.856 8.022 -4.896 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.954 7.317 -5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.925 9.081 -5.741 1.00 0.00 H new ATOM 0 HD13 LEU A 39 11.890 8.054 -4.654 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.665 5.812 -4.328 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.613 6.483 -2.980 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.836 6.569 -2.948 1.00 0.00 H new ATOM 635 N SER A 40 7.846 9.520 -0.240 1.00 0.00 N ATOM 636 CA SER A 40 7.831 10.067 1.126 1.00 0.00 C ATOM 637 C SER A 40 6.872 9.293 2.032 1.00 0.00 C ATOM 638 O SER A 40 5.672 9.213 1.777 1.00 0.00 O ATOM 639 CB SER A 40 7.473 11.563 1.115 1.00 0.00 C ATOM 640 OG SER A 40 6.381 11.825 0.235 1.00 0.00 O ATOM 0 H SER A 40 7.064 8.901 -0.451 1.00 0.00 H new ATOM 0 HA SER A 40 8.836 9.955 1.532 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.216 11.886 2.124 1.00 0.00 H new ATOM 0 HB3 SER A 40 8.341 12.145 0.805 1.00 0.00 H new ATOM 0 HG SER A 40 6.173 12.783 0.248 1.00 0.00 H new ATOM 646 N ASP A 41 7.461 8.723 3.075 1.00 0.00 N ATOM 647 CA ASP A 41 6.685 7.975 4.090 1.00 0.00 C ATOM 648 C ASP A 41 5.757 8.951 4.823 1.00 0.00 C ATOM 649 O ASP A 41 6.251 9.913 5.404 1.00 0.00 O ATOM 650 CB ASP A 41 7.630 7.304 5.088 1.00 0.00 C ATOM 651 CG ASP A 41 6.926 6.892 6.395 1.00 0.00 C ATOM 652 OD1 ASP A 41 5.931 6.144 6.282 1.00 0.00 O ATOM 653 OD2 ASP A 41 7.355 7.384 7.446 1.00 0.00 O ATOM 0 H ASP A 41 8.465 8.756 3.251 1.00 0.00 H new ATOM 0 HA ASP A 41 6.094 7.201 3.600 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.072 6.422 4.625 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.448 7.986 5.321 1.00 0.00 H new ATOM 658 N GLY A 42 4.494 8.535 4.947 1.00 0.00 N ATOM 659 CA GLY A 42 3.439 9.277 5.681 1.00 0.00 C ATOM 660 C GLY A 42 3.584 10.798 5.540 1.00 0.00 C ATOM 661 O GLY A 42 4.019 11.481 6.474 1.00 0.00 O ATOM 0 H GLY A 42 4.160 7.662 4.538 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.460 8.973 5.310 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.478 9.008 6.737 1.00 0.00 H new ATOM 665 N LYS A 43 3.424 11.246 4.298 1.00 0.00 N ATOM 666 CA LYS A 43 3.552 12.665 3.929 1.00 0.00 C ATOM 667 C LYS A 43 2.552 13.079 2.837 1.00 0.00 C ATOM 668 O LYS A 43 2.731 14.029 2.067 1.00 0.00 O ATOM 669 CB LYS A 43 4.998 12.936 3.478 1.00 0.00 C ATOM 670 CG LYS A 43 5.353 14.422 3.541 1.00 0.00 C ATOM 671 CD LYS A 43 5.684 14.857 4.965 1.00 0.00 C ATOM 672 CE LYS A 43 5.462 16.364 5.164 1.00 0.00 C ATOM 673 NZ LYS A 43 4.095 16.581 5.686 1.00 0.00 N ATOM 0 H LYS A 43 3.201 10.637 3.511 1.00 0.00 H new ATOM 0 HA LYS A 43 3.316 13.269 4.805 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.685 12.373 4.109 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.133 12.575 2.458 1.00 0.00 H new ATOM 0 HG2 LYS A 43 6.205 14.622 2.891 1.00 0.00 H new ATOM 0 HG3 LYS A 43 4.519 15.013 3.163 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.064 14.302 5.669 1.00 0.00 H new ATOM 0 HD3 LYS A 43 6.721 14.609 5.190 1.00 0.00 H new ATOM 0 HE2 LYS A 43 6.199 16.765 5.859 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.594 16.893 4.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.934 17.599 5.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.401 16.210 5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.988 16.087 6.595 1.00 0.00 H new ATOM 687 N THR A 44 1.440 12.366 2.822 1.00 0.00 N ATOM 688 CA THR A 44 0.406 12.551 1.793 1.00 0.00 C ATOM 689 C THR A 44 -0.945 12.394 2.472 1.00 0.00 C ATOM 690 O THR A 44 -1.039 11.974 3.620 1.00 0.00 O ATOM 691 CB THR A 44 0.579 11.522 0.662 1.00 0.00 C ATOM 692 OG1 THR A 44 1.922 11.050 0.647 1.00 0.00 O ATOM 693 CG2 THR A 44 0.292 12.130 -0.709 1.00 0.00 C ATOM 0 H THR A 44 1.220 11.647 3.511 1.00 0.00 H new ATOM 0 HA THR A 44 0.486 13.539 1.340 1.00 0.00 H new ATOM 0 HB THR A 44 -0.127 10.714 0.853 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.949 10.152 0.256 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.426 11.370 -1.479 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.734 12.498 -0.736 1.00 0.00 H new ATOM 0 HG23 THR A 44 0.979 12.956 -0.892 1.00 0.00 H new ATOM 701 N GLY A 45 -1.979 12.647 1.678 1.00 0.00 N ATOM 702 CA GLY A 45 -3.368 12.607 2.146 1.00 0.00 C ATOM 703 C GLY A 45 -3.741 11.300 2.855 1.00 0.00 C ATOM 704 O GLY A 45 -3.727 11.205 4.074 1.00 0.00 O ATOM 0 H GLY A 45 -1.883 12.886 0.691 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.537 13.441 2.827 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.033 12.751 1.295 1.00 0.00 H new ATOM 708 N SER A 46 -3.875 10.264 2.057 1.00 0.00 N ATOM 709 CA SER A 46 -4.157 8.912 2.579 1.00 0.00 C ATOM 710 C SER A 46 -3.020 8.314 3.443 1.00 0.00 C ATOM 711 O SER A 46 -3.137 7.178 3.907 1.00 0.00 O ATOM 712 CB SER A 46 -4.368 7.991 1.386 1.00 0.00 C ATOM 713 OG SER A 46 -3.100 7.818 0.759 1.00 0.00 O ATOM 0 H SER A 46 -3.796 10.315 1.041 1.00 0.00 H new ATOM 0 HA SER A 46 -5.032 8.996 3.223 1.00 0.00 H new ATOM 0 HB2 SER A 46 -4.773 7.031 1.707 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.086 8.422 0.689 1.00 0.00 H new ATOM 0 HG SER A 46 -2.681 6.997 1.090 1.00 0.00 H new ATOM 719 N SER A 47 -1.913 9.057 3.522 1.00 0.00 N ATOM 720 CA SER A 47 -0.655 8.757 4.250 1.00 0.00 C ATOM 721 C SER A 47 0.276 7.840 3.432 1.00 0.00 C ATOM 722 O SER A 47 1.290 7.326 3.898 1.00 0.00 O ATOM 723 CB SER A 47 -0.982 8.200 5.645 1.00 0.00 C ATOM 724 OG SER A 47 0.109 8.266 6.553 1.00 0.00 O ATOM 0 H SER A 47 -1.858 9.957 3.045 1.00 0.00 H new ATOM 0 HA SER A 47 -0.096 9.682 4.389 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.824 8.754 6.060 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.301 7.162 5.547 1.00 0.00 H new ATOM 0 HG SER A 47 -0.164 7.899 7.420 1.00 0.00 H new ATOM 730 N TYR A 48 0.000 7.828 2.127 1.00 0.00 N ATOM 731 CA TYR A 48 0.653 6.942 1.151 1.00 0.00 C ATOM 732 C TYR A 48 1.505 7.694 0.125 1.00 0.00 C ATOM 733 O TYR A 48 1.047 8.693 -0.416 1.00 0.00 O ATOM 734 CB TYR A 48 -0.406 6.093 0.440 1.00 0.00 C ATOM 735 CG TYR A 48 -1.268 5.225 1.367 1.00 0.00 C ATOM 736 CD1 TYR A 48 -0.760 4.662 2.561 1.00 0.00 C ATOM 737 CD2 TYR A 48 -2.617 5.081 1.016 1.00 0.00 C ATOM 738 CE1 TYR A 48 -1.635 3.978 3.424 1.00 0.00 C ATOM 739 CE2 TYR A 48 -3.503 4.401 1.860 1.00 0.00 C ATOM 740 CZ TYR A 48 -2.993 3.851 3.050 1.00 0.00 C ATOM 741 OH TYR A 48 -3.841 3.140 3.840 1.00 0.00 O ATOM 0 H TYR A 48 -0.696 8.444 1.707 1.00 0.00 H new ATOM 0 HA TYR A 48 1.338 6.303 1.708 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -1.061 6.755 -0.127 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.093 5.445 -0.281 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.287 4.756 2.807 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -2.976 5.498 0.087 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -1.277 3.559 4.353 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -4.548 4.302 1.605 1.00 0.00 H new ATOM 0 HH TYR A 48 -3.545 3.198 4.772 1.00 0.00 H new ATOM 751 N PRO A 49 2.645 7.104 -0.284 1.00 0.00 N ATOM 752 CA PRO A 49 3.127 5.781 0.158 1.00 0.00 C ATOM 753 C PRO A 49 3.763 5.822 1.537 1.00 0.00 C ATOM 754 O PRO A 49 4.471 6.756 1.909 1.00 0.00 O ATOM 755 CB PRO A 49 4.093 5.331 -0.930 1.00 0.00 C ATOM 756 CG PRO A 49 4.618 6.630 -1.508 1.00 0.00 C ATOM 757 CD PRO A 49 3.478 7.643 -1.356 1.00 0.00 C ATOM 0 HA PRO A 49 2.307 5.072 0.278 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.898 4.720 -0.522 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.590 4.730 -1.688 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.510 6.962 -0.977 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.897 6.508 -2.555 1.00 0.00 H new ATOM 0 HD2 PRO A 49 3.858 8.633 -1.103 1.00 0.00 H new ATOM 0 HD3 PRO A 49 2.913 7.746 -2.283 1.00 0.00 H new ATOM 765 N HIS A 50 3.232 4.928 2.351 1.00 0.00 N ATOM 766 CA HIS A 50 3.717 4.805 3.736 1.00 0.00 C ATOM 767 C HIS A 50 4.817 3.744 3.740 1.00 0.00 C ATOM 768 O HIS A 50 4.760 2.760 3.015 1.00 0.00 O ATOM 769 CB HIS A 50 2.565 4.472 4.694 1.00 0.00 C ATOM 770 CG HIS A 50 2.144 2.995 4.734 1.00 0.00 C ATOM 771 ND1 HIS A 50 2.476 2.151 5.702 1.00 0.00 N ATOM 772 CD2 HIS A 50 1.428 2.330 3.843 1.00 0.00 C ATOM 773 CE1 HIS A 50 1.972 0.959 5.414 1.00 0.00 C ATOM 774 NE2 HIS A 50 1.319 1.074 4.264 1.00 0.00 N ATOM 0 H HIS A 50 2.482 4.285 2.097 1.00 0.00 H new ATOM 0 HA HIS A 50 4.128 5.749 4.094 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.853 4.777 5.700 1.00 0.00 H new ATOM 0 HB3 HIS A 50 1.698 5.071 4.415 1.00 0.00 H new ATOM 0 HD1 HIS A 50 3.027 2.381 6.529 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.007 2.735 2.935 1.00 0.00 H new ATOM 0 HE1 HIS A 50 2.074 0.061 6.005 1.00 0.00 H new ATOM 783 N TRP A 51 5.870 4.061 4.483 1.00 0.00 N ATOM 784 CA TRP A 51 6.970 3.119 4.716 1.00 0.00 C ATOM 785 C TRP A 51 6.400 1.816 5.254 1.00 0.00 C ATOM 786 O TRP A 51 5.736 1.741 6.298 1.00 0.00 O ATOM 787 CB TRP A 51 7.993 3.689 5.693 1.00 0.00 C ATOM 788 CG TRP A 51 8.934 2.638 6.299 1.00 0.00 C ATOM 789 CD1 TRP A 51 9.806 1.851 5.669 1.00 0.00 C ATOM 790 CD2 TRP A 51 9.044 2.367 7.654 1.00 0.00 C ATOM 791 NE1 TRP A 51 10.497 1.124 6.552 1.00 0.00 N ATOM 792 CE2 TRP A 51 10.071 1.414 7.774 1.00 0.00 C ATOM 793 CE3 TRP A 51 8.409 2.909 8.798 1.00 0.00 C ATOM 794 CZ2 TRP A 51 10.484 0.974 9.047 1.00 0.00 C ATOM 795 CZ3 TRP A 51 8.849 2.495 10.068 1.00 0.00 C ATOM 796 CH2 TRP A 51 9.867 1.527 10.184 1.00 0.00 C ATOM 0 H TRP A 51 5.990 4.966 4.938 1.00 0.00 H new ATOM 0 HA TRP A 51 7.483 2.939 3.771 1.00 0.00 H new ATOM 0 HB2 TRP A 51 8.590 4.442 5.179 1.00 0.00 H new ATOM 0 HB3 TRP A 51 7.465 4.197 6.500 1.00 0.00 H new ATOM 0 HD1 TRP A 51 9.936 1.807 4.598 1.00 0.00 H new ATOM 0 HE1 TRP A 51 11.232 0.455 6.323 1.00 0.00 H new ATOM 0 HE3 TRP A 51 7.606 3.624 8.697 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 11.258 0.228 9.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 8.406 2.920 10.957 1.00 0.00 H new ATOM 0 HH2 TRP A 51 10.180 1.203 11.166 1.00 0.00 H new ATOM 807 N PHE A 52 6.710 0.814 4.465 1.00 0.00 N ATOM 808 CA PHE A 52 6.370 -0.568 4.767 1.00 0.00 C ATOM 809 C PHE A 52 7.466 -1.091 5.686 1.00 0.00 C ATOM 810 O PHE A 52 8.537 -1.513 5.247 1.00 0.00 O ATOM 811 CB PHE A 52 6.340 -1.373 3.464 1.00 0.00 C ATOM 812 CG PHE A 52 5.701 -2.745 3.665 1.00 0.00 C ATOM 813 CD1 PHE A 52 4.542 -2.896 4.459 1.00 0.00 C ATOM 814 CD2 PHE A 52 6.389 -3.877 3.158 1.00 0.00 C ATOM 815 CE1 PHE A 52 4.078 -4.176 4.800 1.00 0.00 C ATOM 816 CE2 PHE A 52 5.929 -5.165 3.495 1.00 0.00 C ATOM 817 CZ PHE A 52 4.787 -5.302 4.330 1.00 0.00 C ATOM 0 H PHE A 52 7.211 0.931 3.584 1.00 0.00 H new ATOM 0 HA PHE A 52 5.393 -0.653 5.243 1.00 0.00 H new ATOM 0 HB2 PHE A 52 5.784 -0.820 2.707 1.00 0.00 H new ATOM 0 HB3 PHE A 52 7.356 -1.496 3.088 1.00 0.00 H new ATOM 0 HD1 PHE A 52 4.010 -2.022 4.805 1.00 0.00 H new ATOM 0 HD2 PHE A 52 7.253 -3.753 2.523 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.195 -4.297 5.410 1.00 0.00 H new ATOM 0 HE2 PHE A 52 6.440 -6.041 3.122 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.454 -6.290 4.611 1.00 0.00 H new ATOM 827 N THR A 53 7.185 -0.899 6.965 1.00 0.00 N ATOM 828 CA THR A 53 8.007 -1.467 8.063 1.00 0.00 C ATOM 829 C THR A 53 8.447 -2.890 7.730 1.00 0.00 C ATOM 830 O THR A 53 9.572 -3.242 8.039 1.00 0.00 O ATOM 831 CB THR A 53 7.238 -1.500 9.402 1.00 0.00 C ATOM 832 OG1 THR A 53 6.120 -2.370 9.305 1.00 0.00 O ATOM 833 CG2 THR A 53 6.737 -0.131 9.855 1.00 0.00 C ATOM 0 H THR A 53 6.388 -0.350 7.288 1.00 0.00 H new ATOM 0 HA THR A 53 8.876 -0.817 8.166 1.00 0.00 H new ATOM 0 HB THR A 53 7.955 -1.854 10.143 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.641 -2.384 10.160 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.207 -0.233 10.802 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.585 0.542 9.984 1.00 0.00 H new ATOM 0 HG23 THR A 53 6.061 0.276 9.103 1.00 0.00 H new ATOM 841 N ASN A 54 7.587 -3.646 7.042 1.00 0.00 N ATOM 842 CA ASN A 54 7.809 -5.051 6.652 1.00 0.00 C ATOM 843 C ASN A 54 8.168 -5.919 7.879 1.00 0.00 C ATOM 844 O ASN A 54 8.935 -6.865 7.808 1.00 0.00 O ATOM 845 CB ASN A 54 8.882 -5.106 5.552 1.00 0.00 C ATOM 846 CG ASN A 54 9.041 -6.491 4.899 1.00 0.00 C ATOM 847 OD1 ASN A 54 8.145 -7.320 4.864 1.00 0.00 O ATOM 848 ND2 ASN A 54 10.205 -6.744 4.352 1.00 0.00 N ATOM 0 H ASN A 54 6.684 -3.289 6.728 1.00 0.00 H new ATOM 0 HA ASN A 54 6.888 -5.470 6.247 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.633 -4.378 4.780 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.839 -4.805 5.977 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.368 -7.640 3.892 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.947 -6.045 4.386 1.00 0.00 H new ATOM 855 N GLY A 55 7.716 -5.437 9.034 1.00 0.00 N ATOM 856 CA GLY A 55 8.035 -6.027 10.339 1.00 0.00 C ATOM 857 C GLY A 55 9.039 -5.213 11.160 1.00 0.00 C ATOM 858 O GLY A 55 8.982 -5.203 12.387 1.00 0.00 O ATOM 0 H GLY A 55 7.112 -4.618 9.095 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.114 -6.135 10.913 1.00 0.00 H new ATOM 0 HA3 GLY A 55 8.434 -7.030 10.186 1.00 0.00 H new ATOM 862 N TYR A 56 10.021 -4.642 10.460 1.00 0.00 N ATOM 863 CA TYR A 56 11.075 -3.782 11.055 1.00 0.00 C ATOM 864 C TYR A 56 10.483 -2.654 11.908 1.00 0.00 C ATOM 865 O TYR A 56 9.323 -2.277 11.756 1.00 0.00 O ATOM 866 CB TYR A 56 11.938 -3.208 9.930 1.00 0.00 C ATOM 867 CG TYR A 56 12.526 -4.308 9.034 1.00 0.00 C ATOM 868 CD1 TYR A 56 13.614 -5.036 9.531 1.00 0.00 C ATOM 869 CD2 TYR A 56 12.056 -4.508 7.712 1.00 0.00 C ATOM 870 CE1 TYR A 56 14.294 -5.930 8.691 1.00 0.00 C ATOM 871 CE2 TYR A 56 12.732 -5.411 6.862 1.00 0.00 C ATOM 872 CZ TYR A 56 13.847 -6.096 7.369 1.00 0.00 C ATOM 873 OH TYR A 56 14.628 -6.853 6.567 1.00 0.00 O ATOM 0 H TYR A 56 10.118 -4.758 9.451 1.00 0.00 H new ATOM 0 HA TYR A 56 11.685 -4.392 11.721 1.00 0.00 H new ATOM 0 HB2 TYR A 56 11.338 -2.529 9.324 1.00 0.00 H new ATOM 0 HB3 TYR A 56 12.748 -2.619 10.360 1.00 0.00 H new ATOM 0 HD1 TYR A 56 13.928 -4.910 10.557 1.00 0.00 H new ATOM 0 HD2 TYR A 56 11.187 -3.974 7.357 1.00 0.00 H new ATOM 0 HE1 TYR A 56 15.148 -6.482 9.055 1.00 0.00 H new ATOM 0 HE2 TYR A 56 12.399 -5.570 5.847 1.00 0.00 H new ATOM 0 HH TYR A 56 14.876 -6.338 5.771 1.00 0.00 H new ATOM 883 N ASP A 57 11.308 -2.144 12.812 1.00 0.00 N ATOM 884 CA ASP A 57 10.909 -1.032 13.689 1.00 0.00 C ATOM 885 C ASP A 57 11.321 0.361 13.184 1.00 0.00 C ATOM 886 O ASP A 57 10.775 1.371 13.605 1.00 0.00 O ATOM 887 CB ASP A 57 11.454 -1.266 15.095 1.00 0.00 C ATOM 888 CG ASP A 57 10.337 -1.525 16.110 1.00 0.00 C ATOM 889 OD1 ASP A 57 9.467 -2.378 15.821 1.00 0.00 O ATOM 890 OD2 ASP A 57 10.400 -0.878 17.180 1.00 0.00 O ATOM 0 H ASP A 57 12.260 -2.477 12.964 1.00 0.00 H new ATOM 0 HA ASP A 57 9.819 -1.028 13.693 1.00 0.00 H new ATOM 0 HB2 ASP A 57 12.136 -2.116 15.082 1.00 0.00 H new ATOM 0 HB3 ASP A 57 12.033 -0.397 15.408 1.00 0.00 H new ATOM 895 N GLY A 58 12.276 0.344 12.259 1.00 0.00 N ATOM 896 CA GLY A 58 12.902 1.559 11.683 1.00 0.00 C ATOM 897 C GLY A 58 14.422 1.568 11.780 1.00 0.00 C ATOM 898 O GLY A 58 15.035 2.626 11.915 1.00 0.00 O ATOM 0 H GLY A 58 12.652 -0.522 11.873 1.00 0.00 H new ATOM 0 HA2 GLY A 58 12.613 1.644 10.636 1.00 0.00 H new ATOM 0 HA3 GLY A 58 12.509 2.437 12.195 1.00 0.00 H new ATOM 1029 N THR A 67 7.175 -11.268 11.285 1.00 0.00 N ATOM 1030 CA THR A 67 7.346 -12.089 10.074 1.00 0.00 C ATOM 1031 C THR A 67 7.492 -11.238 8.792 1.00 0.00 C ATOM 1032 O THR A 67 6.490 -10.783 8.228 1.00 0.00 O ATOM 1033 CB THR A 67 6.246 -13.151 10.006 1.00 0.00 C ATOM 1034 OG1 THR A 67 6.536 -14.060 8.943 1.00 0.00 O ATOM 1035 CG2 THR A 67 4.829 -12.587 9.914 1.00 0.00 C ATOM 0 HA THR A 67 8.296 -12.620 10.140 1.00 0.00 H new ATOM 0 HB THR A 67 6.253 -13.685 10.956 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.835 -14.743 8.896 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.113 -13.408 9.870 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.624 -11.973 10.791 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.738 -11.977 9.015 1.00 0.00 H new ATOM 1043 N PRO A 68 8.728 -10.848 8.474 1.00 0.00 N ATOM 1044 CA PRO A 68 9.010 -10.038 7.271 1.00 0.00 C ATOM 1045 C PRO A 68 8.833 -10.895 6.019 1.00 0.00 C ATOM 1046 O PRO A 68 9.347 -12.003 5.918 1.00 0.00 O ATOM 1047 CB PRO A 68 10.442 -9.549 7.447 1.00 0.00 C ATOM 1048 CG PRO A 68 11.106 -10.572 8.362 1.00 0.00 C ATOM 1049 CD PRO A 68 9.968 -11.092 9.247 1.00 0.00 C ATOM 0 HA PRO A 68 8.331 -9.193 7.153 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.957 -9.486 6.488 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.466 -8.552 7.888 1.00 0.00 H new ATOM 0 HG2 PRO A 68 11.564 -11.379 7.789 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.896 -10.117 8.959 1.00 0.00 H new ATOM 0 HD2 PRO A 68 10.093 -12.153 9.465 1.00 0.00 H new ATOM 0 HD3 PRO A 68 9.944 -10.570 10.204 1.00 0.00 H new ATOM 1057 N ILE A 69 8.036 -10.363 5.094 1.00 0.00 N ATOM 1058 CA ILE A 69 7.815 -11.022 3.795 1.00 0.00 C ATOM 1059 C ILE A 69 9.155 -11.168 3.068 1.00 0.00 C ATOM 1060 O ILE A 69 9.856 -10.201 2.781 1.00 0.00 O ATOM 1061 CB ILE A 69 6.742 -10.278 2.962 1.00 0.00 C ATOM 1062 CG1 ILE A 69 5.394 -10.440 3.685 1.00 0.00 C ATOM 1063 CG2 ILE A 69 6.684 -10.800 1.511 1.00 0.00 C ATOM 1064 CD1 ILE A 69 4.259 -9.607 3.080 1.00 0.00 C ATOM 0 H ILE A 69 7.533 -9.484 5.212 1.00 0.00 H new ATOM 0 HA ILE A 69 7.415 -12.024 3.952 1.00 0.00 H new ATOM 0 HB ILE A 69 6.995 -9.221 2.885 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.108 -11.492 3.668 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.518 -10.160 4.731 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.920 -10.254 0.958 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.652 -10.653 1.033 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.439 -11.862 1.516 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.342 -9.776 3.645 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.521 -8.550 3.122 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.105 -9.902 2.042 1.00 0.00 H new ATOM 1076 N LYS A 70 9.383 -12.414 2.670 1.00 0.00 N ATOM 1077 CA LYS A 70 10.584 -12.781 1.898 1.00 0.00 C ATOM 1078 C LYS A 70 10.237 -12.757 0.398 1.00 0.00 C ATOM 1079 O LYS A 70 10.012 -13.765 -0.256 1.00 0.00 O ATOM 1080 CB LYS A 70 11.140 -14.132 2.379 1.00 0.00 C ATOM 1081 CG LYS A 70 10.139 -15.292 2.316 1.00 0.00 C ATOM 1082 CD LYS A 70 10.739 -16.520 1.632 1.00 0.00 C ATOM 1083 CE LYS A 70 11.120 -17.589 2.659 1.00 0.00 C ATOM 1084 NZ LYS A 70 12.574 -17.811 2.643 1.00 0.00 N ATOM 0 H LYS A 70 8.756 -13.195 2.865 1.00 0.00 H new ATOM 0 HA LYS A 70 11.383 -12.058 2.060 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.011 -14.387 1.775 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.486 -14.023 3.407 1.00 0.00 H new ATOM 0 HG2 LYS A 70 9.823 -15.556 3.325 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.247 -14.974 1.776 1.00 0.00 H new ATOM 0 HD2 LYS A 70 10.022 -16.932 0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.621 -16.228 1.061 1.00 0.00 H new ATOM 0 HE2 LYS A 70 10.803 -17.277 3.654 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.600 -18.520 2.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 12.822 -18.538 3.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 12.866 -18.128 1.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.063 -16.924 2.877 1.00 0.00 H new ATOM 1098 N PHE A 71 10.196 -11.530 -0.123 1.00 0.00 N ATOM 1099 CA PHE A 71 9.971 -11.265 -1.561 1.00 0.00 C ATOM 1100 C PHE A 71 10.799 -12.159 -2.492 1.00 0.00 C ATOM 1101 O PHE A 71 10.343 -12.609 -3.532 1.00 0.00 O ATOM 1102 CB PHE A 71 10.281 -9.800 -1.897 1.00 0.00 C ATOM 1103 CG PHE A 71 9.360 -8.804 -1.204 1.00 0.00 C ATOM 1104 CD1 PHE A 71 9.694 -8.307 0.075 1.00 0.00 C ATOM 1105 CD2 PHE A 71 8.137 -8.462 -1.825 1.00 0.00 C ATOM 1106 CE1 PHE A 71 8.775 -7.486 0.768 1.00 0.00 C ATOM 1107 CE2 PHE A 71 7.209 -7.655 -1.135 1.00 0.00 C ATOM 1108 CZ PHE A 71 7.531 -7.183 0.160 1.00 0.00 C ATOM 0 H PHE A 71 10.317 -10.684 0.434 1.00 0.00 H new ATOM 0 HA PHE A 71 8.919 -11.492 -1.733 1.00 0.00 H new ATOM 0 HB2 PHE A 71 11.312 -9.583 -1.618 1.00 0.00 H new ATOM 0 HB3 PHE A 71 10.207 -9.660 -2.975 1.00 0.00 H new ATOM 0 HD1 PHE A 71 10.646 -8.553 0.521 1.00 0.00 H new ATOM 0 HD2 PHE A 71 7.915 -8.816 -2.821 1.00 0.00 H new ATOM 0 HE1 PHE A 71 9.017 -7.096 1.745 1.00 0.00 H new ATOM 0 HE2 PHE A 71 6.263 -7.400 -1.590 1.00 0.00 H new ATOM 0 HZ PHE A 71 6.814 -6.579 0.696 1.00 0.00 H new ATOM 1118 N GLY A 72 12.010 -12.442 -1.999 1.00 0.00 N ATOM 1119 CA GLY A 72 13.022 -13.280 -2.691 1.00 0.00 C ATOM 1120 C GLY A 72 14.179 -12.444 -3.238 1.00 0.00 C ATOM 1121 O GLY A 72 14.925 -12.872 -4.111 1.00 0.00 O ATOM 0 H GLY A 72 12.329 -12.095 -1.095 1.00 0.00 H new ATOM 0 HA2 GLY A 72 13.410 -14.027 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 72 12.547 -13.821 -3.509 1.00 0.00 H new ATOM 1125 N LYS A 73 14.344 -11.258 -2.657 1.00 0.00 N ATOM 1126 CA LYS A 73 15.428 -10.330 -2.995 1.00 0.00 C ATOM 1127 C LYS A 73 16.373 -10.131 -1.800 1.00 0.00 C ATOM 1128 O LYS A 73 16.040 -10.487 -0.676 1.00 0.00 O ATOM 1129 CB LYS A 73 14.841 -8.996 -3.470 1.00 0.00 C ATOM 1130 CG LYS A 73 14.536 -9.049 -4.965 1.00 0.00 C ATOM 1131 CD LYS A 73 15.500 -8.114 -5.712 1.00 0.00 C ATOM 1132 CE LYS A 73 15.961 -8.736 -7.029 1.00 0.00 C ATOM 1133 NZ LYS A 73 15.322 -8.106 -8.187 1.00 0.00 N ATOM 0 H LYS A 73 13.722 -10.907 -1.929 1.00 0.00 H new ATOM 0 HA LYS A 73 16.017 -10.756 -3.807 1.00 0.00 H new ATOM 0 HB2 LYS A 73 13.930 -8.774 -2.914 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.544 -8.189 -3.264 1.00 0.00 H new ATOM 0 HG2 LYS A 73 14.642 -10.069 -5.334 1.00 0.00 H new ATOM 0 HG3 LYS A 73 13.504 -8.749 -5.149 1.00 0.00 H new ATOM 0 HD2 LYS A 73 15.008 -7.162 -5.909 1.00 0.00 H new ATOM 0 HD3 LYS A 73 16.365 -7.902 -5.084 1.00 0.00 H new ATOM 0 HE2 LYS A 73 17.043 -8.641 -7.116 1.00 0.00 H new ATOM 0 HE3 LYS A 73 15.734 -9.802 -7.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 15.662 -8.558 -9.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 14.290 -8.219 -8.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 15.559 -7.094 -8.206 1.00 0.00 H new ATOM 1147 N SER A 74 17.502 -9.506 -2.097 1.00 0.00 N ATOM 1148 CA SER A 74 18.538 -9.150 -1.096 1.00 0.00 C ATOM 1149 C SER A 74 18.481 -7.683 -0.673 1.00 0.00 C ATOM 1150 O SER A 74 18.843 -7.348 0.456 1.00 0.00 O ATOM 1151 CB SER A 74 19.944 -9.490 -1.590 1.00 0.00 C ATOM 1152 OG SER A 74 20.334 -10.730 -1.022 1.00 0.00 O ATOM 0 H SER A 74 17.743 -9.221 -3.046 1.00 0.00 H new ATOM 0 HA SER A 74 18.314 -9.756 -0.218 1.00 0.00 H new ATOM 0 HB2 SER A 74 19.959 -9.551 -2.678 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.645 -8.706 -1.305 1.00 0.00 H new ATOM 0 HG SER A 74 21.234 -10.963 -1.331 1.00 0.00 H new ATOM 1158 N ASP A 75 17.921 -6.851 -1.549 1.00 0.00 N ATOM 1159 CA ASP A 75 17.725 -5.401 -1.298 1.00 0.00 C ATOM 1160 C ASP A 75 16.394 -5.124 -0.596 1.00 0.00 C ATOM 1161 O ASP A 75 16.331 -4.473 0.435 1.00 0.00 O ATOM 1162 CB ASP A 75 17.754 -4.567 -2.582 1.00 0.00 C ATOM 1163 CG ASP A 75 19.105 -4.617 -3.301 1.00 0.00 C ATOM 1164 OD1 ASP A 75 19.992 -3.835 -2.903 1.00 0.00 O ATOM 1165 OD2 ASP A 75 19.190 -5.452 -4.231 1.00 0.00 O ATOM 0 H ASP A 75 17.584 -7.154 -2.463 1.00 0.00 H new ATOM 0 HA ASP A 75 18.560 -5.109 -0.661 1.00 0.00 H new ATOM 0 HB2 ASP A 75 16.976 -4.924 -3.257 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.516 -3.531 -2.341 1.00 0.00 H new ATOM 1170 N CYS A 76 15.320 -5.735 -1.073 1.00 0.00 N ATOM 1171 CA CYS A 76 14.008 -5.586 -0.409 1.00 0.00 C ATOM 1172 C CYS A 76 14.000 -6.244 0.984 1.00 0.00 C ATOM 1173 O CYS A 76 13.333 -5.787 1.900 1.00 0.00 O ATOM 1174 CB CYS A 76 12.917 -6.211 -1.273 1.00 0.00 C ATOM 1175 SG CYS A 76 13.060 -5.816 -3.049 1.00 0.00 S ATOM 0 H CYS A 76 15.316 -6.331 -1.901 1.00 0.00 H new ATOM 0 HA CYS A 76 13.818 -4.520 -0.282 1.00 0.00 H new ATOM 0 HB2 CYS A 76 12.945 -7.294 -1.149 1.00 0.00 H new ATOM 0 HB3 CYS A 76 11.945 -5.874 -0.913 1.00 0.00 H new ATOM 1180 N ASP A 77 14.811 -7.302 1.117 1.00 0.00 N ATOM 1181 CA ASP A 77 15.046 -7.999 2.391 1.00 0.00 C ATOM 1182 C ASP A 77 16.089 -7.285 3.271 1.00 0.00 C ATOM 1183 O ASP A 77 16.256 -7.682 4.423 1.00 0.00 O ATOM 1184 CB ASP A 77 15.500 -9.435 2.105 1.00 0.00 C ATOM 1185 CG ASP A 77 15.749 -10.266 3.377 1.00 0.00 C ATOM 1186 OD1 ASP A 77 14.739 -10.587 4.037 1.00 0.00 O ATOM 1187 OD2 ASP A 77 16.936 -10.565 3.626 1.00 0.00 O ATOM 0 H ASP A 77 15.329 -7.703 0.335 1.00 0.00 H new ATOM 0 HA ASP A 77 14.108 -8.000 2.946 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.744 -9.933 1.498 1.00 0.00 H new ATOM 0 HB3 ASP A 77 16.415 -9.407 1.514 1.00 0.00 H new ATOM 1192 N ARG A 78 16.876 -6.372 2.695 1.00 0.00 N ATOM 1193 CA ARG A 78 17.922 -5.615 3.415 1.00 0.00 C ATOM 1194 C ARG A 78 17.308 -4.864 4.618 1.00 0.00 C ATOM 1195 O ARG A 78 16.102 -4.557 4.586 1.00 0.00 O ATOM 1196 CB ARG A 78 18.643 -4.662 2.440 1.00 0.00 C ATOM 1197 CG ARG A 78 18.129 -3.215 2.430 1.00 0.00 C ATOM 1198 CD ARG A 78 18.740 -2.428 1.280 1.00 0.00 C ATOM 1199 NE ARG A 78 17.631 -1.842 0.505 1.00 0.00 N ATOM 1200 CZ ARG A 78 17.789 -1.034 -0.544 1.00 0.00 C ATOM 1201 NH1 ARG A 78 18.993 -0.642 -0.931 1.00 0.00 N ATOM 1202 NH2 ARG A 78 16.745 -0.573 -1.198 1.00 0.00 N ATOM 0 H ARG A 78 16.810 -6.130 1.706 1.00 0.00 H new ATOM 0 HA ARG A 78 18.666 -6.306 3.813 1.00 0.00 H new ATOM 0 HB2 ARG A 78 19.704 -4.651 2.688 1.00 0.00 H new ATOM 0 HB3 ARG A 78 18.556 -5.067 1.432 1.00 0.00 H new ATOM 0 HG2 ARG A 78 17.043 -3.212 2.341 1.00 0.00 H new ATOM 0 HG3 ARG A 78 18.373 -2.732 3.376 1.00 0.00 H new ATOM 0 HD2 ARG A 78 19.399 -1.646 1.658 1.00 0.00 H new ATOM 0 HD3 ARG A 78 19.346 -3.079 0.650 1.00 0.00 H new ATOM 0 HE ARG A 78 16.679 -2.070 0.791 1.00 0.00 H new ATOM 0 HH11 ARG A 78 19.820 -0.958 -0.424 1.00 0.00 H new ATOM 0 HH12 ARG A 78 19.094 -0.024 -1.736 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.804 -0.833 -0.904 1.00 0.00 H new ATOM 0 HH22 ARG A 78 16.877 0.044 -1.999 1.00 0.00 H new ATOM 1216 N PRO A 79 18.135 -4.408 5.572 1.00 0.00 N ATOM 1217 CA PRO A 79 17.677 -3.540 6.663 1.00 0.00 C ATOM 1218 C PRO A 79 17.292 -2.138 6.164 1.00 0.00 C ATOM 1219 O PRO A 79 18.139 -1.409 5.645 1.00 0.00 O ATOM 1220 CB PRO A 79 18.827 -3.518 7.660 1.00 0.00 C ATOM 1221 CG PRO A 79 20.065 -3.762 6.803 1.00 0.00 C ATOM 1222 CD PRO A 79 19.562 -4.757 5.751 1.00 0.00 C ATOM 0 HA PRO A 79 16.763 -3.915 7.125 1.00 0.00 H new ATOM 0 HB2 PRO A 79 18.885 -2.562 8.181 1.00 0.00 H new ATOM 0 HB3 PRO A 79 18.710 -4.290 8.421 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.429 -2.841 6.347 1.00 0.00 H new ATOM 0 HG3 PRO A 79 20.887 -4.174 7.388 1.00 0.00 H new ATOM 0 HD2 PRO A 79 20.115 -4.662 4.817 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.681 -5.787 6.088 1.00 0.00 H new ATOM 1230 N PRO A 80 16.008 -1.778 6.261 1.00 0.00 N ATOM 1231 CA PRO A 80 15.490 -0.477 5.832 1.00 0.00 C ATOM 1232 C PRO A 80 15.846 0.583 6.875 1.00 0.00 C ATOM 1233 O PRO A 80 15.552 0.464 8.066 1.00 0.00 O ATOM 1234 CB PRO A 80 13.988 -0.696 5.721 1.00 0.00 C ATOM 1235 CG PRO A 80 13.673 -1.705 6.801 1.00 0.00 C ATOM 1236 CD PRO A 80 14.910 -2.607 6.800 1.00 0.00 C ATOM 0 HA PRO A 80 15.908 -0.123 4.890 1.00 0.00 H new ATOM 0 HB2 PRO A 80 13.439 0.233 5.873 1.00 0.00 H new ATOM 0 HB3 PRO A 80 13.713 -1.071 4.735 1.00 0.00 H new ATOM 0 HG2 PRO A 80 13.523 -1.227 7.769 1.00 0.00 H new ATOM 0 HG3 PRO A 80 12.765 -2.265 6.578 1.00 0.00 H new ATOM 0 HD2 PRO A 80 15.141 -2.956 7.806 1.00 0.00 H new ATOM 0 HD3 PRO A 80 14.749 -3.492 6.184 1.00 0.00 H new ATOM 1244 N LYS A 81 16.386 1.680 6.348 1.00 0.00 N ATOM 1245 CA LYS A 81 16.858 2.774 7.211 1.00 0.00 C ATOM 1246 C LYS A 81 15.837 3.918 7.231 1.00 0.00 C ATOM 1247 O LYS A 81 15.980 4.948 6.569 1.00 0.00 O ATOM 1248 CB LYS A 81 18.228 3.213 6.693 1.00 0.00 C ATOM 1249 CG LYS A 81 19.114 3.726 7.830 1.00 0.00 C ATOM 1250 CD LYS A 81 20.378 2.866 7.900 1.00 0.00 C ATOM 1251 CE LYS A 81 21.423 3.458 8.850 1.00 0.00 C ATOM 1252 NZ LYS A 81 22.045 4.646 8.250 1.00 0.00 N ATOM 0 H LYS A 81 16.509 1.839 5.348 1.00 0.00 H new ATOM 0 HA LYS A 81 16.961 2.446 8.245 1.00 0.00 H new ATOM 0 HB2 LYS A 81 18.718 2.375 6.198 1.00 0.00 H new ATOM 0 HB3 LYS A 81 18.103 3.996 5.945 1.00 0.00 H new ATOM 0 HG2 LYS A 81 19.377 4.770 7.661 1.00 0.00 H new ATOM 0 HG3 LYS A 81 18.575 3.682 8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 81 20.115 1.861 8.231 1.00 0.00 H new ATOM 0 HD3 LYS A 81 20.807 2.771 6.903 1.00 0.00 H new ATOM 0 HE2 LYS A 81 20.954 3.724 9.797 1.00 0.00 H new ATOM 0 HE3 LYS A 81 22.187 2.712 9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 22.883 4.916 8.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 22.330 4.433 7.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 21.363 5.431 8.248 1.00 0.00 H new ATOM 1266 N HIS A 82 14.790 3.694 8.013 1.00 0.00 N ATOM 1267 CA HIS A 82 13.703 4.677 8.154 1.00 0.00 C ATOM 1268 C HIS A 82 14.149 5.830 9.072 1.00 0.00 C ATOM 1269 O HIS A 82 14.981 5.662 9.949 1.00 0.00 O ATOM 1270 CB HIS A 82 12.444 3.998 8.664 1.00 0.00 C ATOM 1271 CG HIS A 82 11.283 4.972 8.829 1.00 0.00 C ATOM 1272 ND1 HIS A 82 10.914 5.544 9.971 1.00 0.00 N ATOM 1273 CD2 HIS A 82 10.428 5.377 7.892 1.00 0.00 C ATOM 1274 CE1 HIS A 82 9.831 6.263 9.758 1.00 0.00 C ATOM 1275 NE2 HIS A 82 9.532 6.148 8.475 1.00 0.00 N ATOM 0 H HIS A 82 14.662 2.844 8.562 1.00 0.00 H new ATOM 0 HA HIS A 82 13.471 5.104 7.178 1.00 0.00 H new ATOM 0 HB2 HIS A 82 12.155 3.207 7.972 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.654 3.522 9.622 1.00 0.00 H new ATOM 0 HD2 HIS A 82 10.462 5.120 6.844 1.00 0.00 H new ATOM 0 HE1 HIS A 82 9.289 6.839 10.494 1.00 0.00 H new ATOM 0 HE2 HIS A 82 8.736 6.586 8.011 1.00 0.00 H new ATOM 1284 N SER A 83 13.589 7.002 8.794 1.00 0.00 N ATOM 1285 CA SER A 83 13.937 8.233 9.527 1.00 0.00 C ATOM 1286 C SER A 83 12.697 8.822 10.230 1.00 0.00 C ATOM 1287 O SER A 83 11.864 8.076 10.719 1.00 0.00 O ATOM 1288 CB SER A 83 14.649 9.189 8.563 1.00 0.00 C ATOM 1289 OG SER A 83 15.138 10.333 9.267 1.00 0.00 O ATOM 0 H SER A 83 12.888 7.135 8.065 1.00 0.00 H new ATOM 0 HA SER A 83 14.634 8.026 10.339 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.476 8.674 8.074 1.00 0.00 H new ATOM 0 HB3 SER A 83 13.961 9.504 7.778 1.00 0.00 H new ATOM 0 HG SER A 83 15.592 10.934 8.640 1.00 0.00 H new ATOM 1295 N LYS A 84 12.599 10.140 10.398 1.00 0.00 N ATOM 1296 CA LYS A 84 11.403 10.784 10.985 1.00 0.00 C ATOM 1297 C LYS A 84 10.168 10.712 10.074 1.00 0.00 C ATOM 1298 O LYS A 84 9.127 10.184 10.428 1.00 0.00 O ATOM 1299 CB LYS A 84 11.744 12.233 11.325 1.00 0.00 C ATOM 1300 CG LYS A 84 12.228 12.436 12.767 1.00 0.00 C ATOM 1301 CD LYS A 84 11.061 12.782 13.686 1.00 0.00 C ATOM 1302 CE LYS A 84 11.570 13.422 14.979 1.00 0.00 C ATOM 1303 NZ LYS A 84 11.066 12.675 16.125 1.00 0.00 N ATOM 0 H LYS A 84 13.335 10.796 10.136 1.00 0.00 H new ATOM 0 HA LYS A 84 11.135 10.235 11.887 1.00 0.00 H new ATOM 0 HB2 LYS A 84 12.516 12.585 10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.863 12.852 11.157 1.00 0.00 H new ATOM 0 HG2 LYS A 84 12.720 11.530 13.121 1.00 0.00 H new ATOM 0 HG3 LYS A 84 12.970 13.234 12.798 1.00 0.00 H new ATOM 0 HD2 LYS A 84 10.381 13.465 13.178 1.00 0.00 H new ATOM 0 HD3 LYS A 84 10.493 11.881 13.918 1.00 0.00 H new ATOM 0 HE2 LYS A 84 12.660 13.430 14.988 1.00 0.00 H new ATOM 0 HE3 LYS A 84 11.243 14.460 15.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 11.413 13.111 17.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 10.026 12.689 16.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 11.399 11.691 16.072 1.00 0.00 H new ATOM 1317 N ASP A 85 10.393 11.134 8.839 1.00 0.00 N ATOM 1318 CA ASP A 85 9.385 11.142 7.754 1.00 0.00 C ATOM 1319 C ASP A 85 9.744 10.183 6.602 1.00 0.00 C ATOM 1320 O ASP A 85 9.315 10.336 5.468 1.00 0.00 O ATOM 1321 CB ASP A 85 9.116 12.597 7.285 1.00 0.00 C ATOM 1322 CG ASP A 85 10.330 13.546 7.266 1.00 0.00 C ATOM 1323 OD1 ASP A 85 10.857 13.841 8.363 1.00 0.00 O ATOM 1324 OD2 ASP A 85 10.823 13.842 6.150 1.00 0.00 O ATOM 0 H ASP A 85 11.300 11.492 8.541 1.00 0.00 H new ATOM 0 HA ASP A 85 8.450 10.751 8.154 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.696 12.560 6.280 1.00 0.00 H new ATOM 0 HB3 ASP A 85 8.354 13.030 7.933 1.00 0.00 H new ATOM 1329 N GLY A 86 10.583 9.201 6.953 1.00 0.00 N ATOM 1330 CA GLY A 86 11.157 8.199 6.033 1.00 0.00 C ATOM 1331 C GLY A 86 11.590 8.794 4.695 1.00 0.00 C ATOM 1332 O GLY A 86 10.929 8.604 3.677 1.00 0.00 O ATOM 0 H GLY A 86 10.894 9.074 7.916 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.016 7.727 6.509 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.421 7.415 5.854 1.00 0.00 H new ATOM 1336 N ASN A 87 12.539 9.712 4.828 1.00 0.00 N ATOM 1337 CA ASN A 87 13.136 10.479 3.711 1.00 0.00 C ATOM 1338 C ASN A 87 14.600 10.797 4.021 1.00 0.00 C ATOM 1339 O ASN A 87 15.498 10.293 3.332 1.00 0.00 O ATOM 1340 CB ASN A 87 12.308 11.761 3.468 1.00 0.00 C ATOM 1341 CG ASN A 87 12.971 12.722 2.467 1.00 0.00 C ATOM 1342 OD1 ASN A 87 13.827 12.345 1.678 1.00 0.00 O ATOM 1343 ND2 ASN A 87 12.698 13.999 2.596 1.00 0.00 N ATOM 0 H ASN A 87 12.934 9.960 5.735 1.00 0.00 H new ATOM 0 HA ASN A 87 13.115 9.885 2.797 1.00 0.00 H new ATOM 0 HB2 ASN A 87 11.320 11.485 3.099 1.00 0.00 H new ATOM 0 HB3 ASN A 87 12.161 12.277 4.417 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.201 14.687 2.036 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.983 14.303 3.256 1.00 0.00 H new ATOM 1350 N GLY A 88 14.805 11.439 5.173 1.00 0.00 N ATOM 1351 CA GLY A 88 16.123 11.892 5.679 1.00 0.00 C ATOM 1352 C GLY A 88 16.903 12.579 4.559 1.00 0.00 C ATOM 1353 O GLY A 88 16.450 13.570 3.985 1.00 0.00 O ATOM 0 H GLY A 88 14.040 11.670 5.807 1.00 0.00 H new ATOM 0 HA2 GLY A 88 15.985 12.580 6.513 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.688 11.041 6.059 1.00 0.00 H new ATOM 1357 N LYS A 89 17.976 11.900 4.176 1.00 0.00 N ATOM 1358 CA LYS A 89 18.800 12.305 3.022 1.00 0.00 C ATOM 1359 C LYS A 89 18.504 11.434 1.784 1.00 0.00 C ATOM 1360 O LYS A 89 18.225 11.957 0.715 1.00 0.00 O ATOM 1361 CB LYS A 89 20.285 12.255 3.422 1.00 0.00 C ATOM 1362 CG LYS A 89 21.164 12.845 2.307 1.00 0.00 C ATOM 1363 CD LYS A 89 22.603 13.051 2.778 1.00 0.00 C ATOM 1364 CE LYS A 89 23.424 13.648 1.637 1.00 0.00 C ATOM 1365 NZ LYS A 89 24.814 13.808 2.078 1.00 0.00 N ATOM 0 H LYS A 89 18.306 11.057 4.646 1.00 0.00 H new ATOM 0 HA LYS A 89 18.549 13.328 2.741 1.00 0.00 H new ATOM 0 HB2 LYS A 89 20.438 12.812 4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 89 20.580 11.224 3.619 1.00 0.00 H new ATOM 0 HG2 LYS A 89 21.154 12.179 1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 89 20.747 13.798 1.979 1.00 0.00 H new ATOM 0 HD2 LYS A 89 22.624 13.714 3.643 1.00 0.00 H new ATOM 0 HD3 LYS A 89 23.034 12.101 3.094 1.00 0.00 H new ATOM 0 HE2 LYS A 89 23.379 12.999 0.762 1.00 0.00 H new ATOM 0 HE3 LYS A 89 23.010 14.612 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 25.379 14.214 1.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 24.846 14.443 2.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 25.204 12.880 2.341 1.00 0.00 H new ATOM 1379 N THR A 90 18.645 10.124 1.959 1.00 0.00 N ATOM 1380 CA THR A 90 18.432 9.124 0.899 1.00 0.00 C ATOM 1381 C THR A 90 18.045 7.764 1.494 1.00 0.00 C ATOM 1382 O THR A 90 18.796 6.783 1.490 1.00 0.00 O ATOM 1383 CB THR A 90 19.666 9.025 -0.030 1.00 0.00 C ATOM 1384 OG1 THR A 90 19.389 8.099 -1.085 1.00 0.00 O ATOM 1385 CG2 THR A 90 20.989 8.701 0.687 1.00 0.00 C ATOM 0 H THR A 90 18.915 9.713 2.853 1.00 0.00 H new ATOM 0 HA THR A 90 17.595 9.453 0.283 1.00 0.00 H new ATOM 0 HB THR A 90 19.831 10.020 -0.442 1.00 0.00 H new ATOM 0 HG1 THR A 90 20.168 8.035 -1.677 1.00 0.00 H new ATOM 0 HG21 THR A 90 21.796 8.652 -0.044 1.00 0.00 H new ATOM 0 HG22 THR A 90 21.207 9.480 1.417 1.00 0.00 H new ATOM 0 HG23 THR A 90 20.901 7.741 1.196 1.00 0.00 H new ATOM 1393 N ASP A 91 16.917 7.765 2.207 1.00 0.00 N ATOM 1394 CA ASP A 91 16.381 6.542 2.820 1.00 0.00 C ATOM 1395 C ASP A 91 16.322 5.410 1.766 1.00 0.00 C ATOM 1396 O ASP A 91 16.085 5.669 0.585 1.00 0.00 O ATOM 1397 CB ASP A 91 15.000 6.861 3.393 1.00 0.00 C ATOM 1398 CG ASP A 91 14.457 5.806 4.358 1.00 0.00 C ATOM 1399 OD1 ASP A 91 14.847 4.631 4.223 1.00 0.00 O ATOM 1400 OD2 ASP A 91 13.630 6.207 5.204 1.00 0.00 O ATOM 0 H ASP A 91 16.354 8.599 2.376 1.00 0.00 H new ATOM 0 HA ASP A 91 17.025 6.196 3.628 1.00 0.00 H new ATOM 0 HB2 ASP A 91 15.047 7.819 3.911 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.296 6.978 2.569 1.00 0.00 H new ATOM 1405 N HIS A 92 16.722 4.214 2.150 1.00 0.00 N ATOM 1406 CA HIS A 92 16.694 3.047 1.246 1.00 0.00 C ATOM 1407 C HIS A 92 15.784 1.911 1.772 1.00 0.00 C ATOM 1408 O HIS A 92 15.973 0.716 1.549 1.00 0.00 O ATOM 1409 CB HIS A 92 18.134 2.586 0.970 1.00 0.00 C ATOM 1410 CG HIS A 92 18.792 1.948 2.198 1.00 0.00 C ATOM 1411 ND1 HIS A 92 18.711 0.666 2.515 1.00 0.00 N ATOM 1412 CD2 HIS A 92 19.536 2.553 3.125 1.00 0.00 C ATOM 1413 CE1 HIS A 92 19.390 0.459 3.630 1.00 0.00 C ATOM 1414 NE2 HIS A 92 19.897 1.628 4.007 1.00 0.00 N ATOM 0 H HIS A 92 17.075 4.009 3.085 1.00 0.00 H new ATOM 0 HA HIS A 92 16.243 3.345 0.299 1.00 0.00 H new ATOM 0 HB2 HIS A 92 18.131 1.868 0.149 1.00 0.00 H new ATOM 0 HB3 HIS A 92 18.729 3.439 0.645 1.00 0.00 H new ATOM 0 HD2 HIS A 92 19.797 3.601 3.153 1.00 0.00 H new ATOM 0 HE1 HIS A 92 19.510 -0.485 4.140 1.00 0.00 H new ATOM 0 HE2 HIS A 92 20.469 1.788 4.836 1.00 0.00 H new ATOM 1423 N TYR A 93 14.760 2.351 2.475 1.00 0.00 N ATOM 1424 CA TYR A 93 13.711 1.500 3.067 1.00 0.00 C ATOM 1425 C TYR A 93 12.801 0.835 2.017 1.00 0.00 C ATOM 1426 O TYR A 93 12.987 1.036 0.819 1.00 0.00 O ATOM 1427 CB TYR A 93 12.917 2.338 4.087 1.00 0.00 C ATOM 1428 CG TYR A 93 12.152 3.551 3.539 1.00 0.00 C ATOM 1429 CD1 TYR A 93 12.197 3.889 2.167 1.00 0.00 C ATOM 1430 CD2 TYR A 93 11.393 4.328 4.434 1.00 0.00 C ATOM 1431 CE1 TYR A 93 11.483 4.990 1.693 1.00 0.00 C ATOM 1432 CE2 TYR A 93 10.646 5.416 3.954 1.00 0.00 C ATOM 1433 CZ TYR A 93 10.702 5.732 2.588 1.00 0.00 C ATOM 1434 OH TYR A 93 9.847 6.648 2.066 1.00 0.00 O ATOM 0 H TYR A 93 14.617 3.343 2.665 1.00 0.00 H new ATOM 0 HA TYR A 93 14.190 0.664 3.577 1.00 0.00 H new ATOM 0 HB2 TYR A 93 12.202 1.681 4.583 1.00 0.00 H new ATOM 0 HB3 TYR A 93 13.610 2.690 4.851 1.00 0.00 H new ATOM 0 HD1 TYR A 93 12.785 3.294 1.484 1.00 0.00 H new ATOM 0 HD2 TYR A 93 11.385 4.088 5.487 1.00 0.00 H new ATOM 0 HE1 TYR A 93 11.532 5.266 0.650 1.00 0.00 H new ATOM 0 HE2 TYR A 93 10.037 6.001 4.627 1.00 0.00 H new ATOM 0 HH TYR A 93 10.007 7.520 2.483 1.00 0.00 H new ATOM 1444 N LEU A 94 11.727 0.225 2.507 1.00 0.00 N ATOM 1445 CA LEU A 94 10.654 -0.304 1.658 1.00 0.00 C ATOM 1446 C LEU A 94 9.362 0.466 1.917 1.00 0.00 C ATOM 1447 O LEU A 94 9.026 0.744 3.068 1.00 0.00 O ATOM 1448 CB LEU A 94 10.412 -1.796 1.907 1.00 0.00 C ATOM 1449 CG LEU A 94 11.278 -2.673 1.006 1.00 0.00 C ATOM 1450 CD1 LEU A 94 10.860 -4.121 1.237 1.00 0.00 C ATOM 1451 CD2 LEU A 94 11.017 -2.429 -0.479 1.00 0.00 C ATOM 0 H LEU A 94 11.571 0.081 3.505 1.00 0.00 H new ATOM 0 HA LEU A 94 10.965 -0.180 0.621 1.00 0.00 H new ATOM 0 HB2 LEU A 94 10.623 -2.028 2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 94 9.361 -2.027 1.735 1.00 0.00 H new ATOM 0 HG LEU A 94 12.319 -2.451 1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 94 11.460 -4.778 0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 94 11.014 -4.382 2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 94 9.806 -4.240 0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 94 11.660 -3.079 -1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 94 9.973 -2.646 -0.705 1.00 0.00 H new ATOM 0 HD23 LEU A 94 11.232 -1.388 -0.720 1.00 0.00 H new ATOM 1463 N LEU A 95 8.744 0.930 0.843 1.00 0.00 N ATOM 1464 CA LEU A 95 7.464 1.655 0.911 1.00 0.00 C ATOM 1465 C LEU A 95 6.346 0.747 0.393 1.00 0.00 C ATOM 1466 O LEU A 95 6.576 -0.183 -0.373 1.00 0.00 O ATOM 1467 CB LEU A 95 7.400 2.966 0.106 1.00 0.00 C ATOM 1468 CG LEU A 95 8.697 3.767 0.084 1.00 0.00 C ATOM 1469 CD1 LEU A 95 9.674 3.192 -0.944 1.00 0.00 C ATOM 1470 CD2 LEU A 95 8.414 5.201 -0.322 1.00 0.00 C ATOM 0 H LEU A 95 9.106 0.820 -0.104 1.00 0.00 H new ATOM 0 HA LEU A 95 7.352 1.926 1.961 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.116 2.732 -0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.610 3.592 0.520 1.00 0.00 H new ATOM 0 HG LEU A 95 9.128 3.719 1.084 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.592 3.780 -0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.905 2.158 -0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.222 3.228 -1.935 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.346 5.766 -0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.966 5.216 -1.316 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.726 5.652 0.393 1.00 0.00 H new ATOM 1482 N GLU A 96 5.163 1.007 0.931 1.00 0.00 N ATOM 1483 CA GLU A 96 3.920 0.308 0.594 1.00 0.00 C ATOM 1484 C GLU A 96 2.844 1.297 0.131 1.00 0.00 C ATOM 1485 O GLU A 96 2.411 2.179 0.875 1.00 0.00 O ATOM 1486 CB GLU A 96 3.471 -0.494 1.818 1.00 0.00 C ATOM 1487 CG GLU A 96 2.088 -1.108 1.660 1.00 0.00 C ATOM 1488 CD GLU A 96 1.967 -2.542 2.159 1.00 0.00 C ATOM 1489 OE1 GLU A 96 1.719 -2.710 3.379 1.00 0.00 O ATOM 1490 OE2 GLU A 96 2.024 -3.435 1.311 1.00 0.00 O ATOM 0 H GLU A 96 5.032 1.732 1.637 1.00 0.00 H new ATOM 0 HA GLU A 96 4.088 -0.376 -0.238 1.00 0.00 H new ATOM 0 HB2 GLU A 96 4.194 -1.287 2.009 1.00 0.00 H new ATOM 0 HB3 GLU A 96 3.474 0.157 2.692 1.00 0.00 H new ATOM 0 HG2 GLU A 96 1.368 -0.490 2.195 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.811 -1.080 0.606 1.00 0.00 H new ATOM 1497 N PHE A 97 2.431 1.075 -1.102 1.00 0.00 N ATOM 1498 CA PHE A 97 1.360 1.852 -1.728 1.00 0.00 C ATOM 1499 C PHE A 97 0.157 0.945 -2.059 1.00 0.00 C ATOM 1500 O PHE A 97 0.366 -0.125 -2.621 1.00 0.00 O ATOM 1501 CB PHE A 97 1.953 2.490 -2.993 1.00 0.00 C ATOM 1502 CG PHE A 97 0.955 3.393 -3.731 1.00 0.00 C ATOM 1503 CD1 PHE A 97 0.034 2.805 -4.639 1.00 0.00 C ATOM 1504 CD2 PHE A 97 0.914 4.760 -3.419 1.00 0.00 C ATOM 1505 CE1 PHE A 97 -0.971 3.606 -5.222 1.00 0.00 C ATOM 1506 CE2 PHE A 97 -0.082 5.558 -4.012 1.00 0.00 C ATOM 1507 CZ PHE A 97 -1.022 4.977 -4.900 1.00 0.00 C ATOM 0 H PHE A 97 2.824 0.352 -1.705 1.00 0.00 H new ATOM 0 HA PHE A 97 0.988 2.626 -1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.832 3.075 -2.721 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.290 1.703 -3.667 1.00 0.00 H new ATOM 0 HD1 PHE A 97 0.102 1.755 -4.881 1.00 0.00 H new ATOM 0 HD2 PHE A 97 1.632 5.191 -2.737 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -1.689 3.175 -5.904 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -0.130 6.614 -3.790 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.791 5.596 -5.338 1.00 0.00 H new ATOM 1517 N PRO A 98 -1.086 1.419 -1.824 1.00 0.00 N ATOM 1518 CA PRO A 98 -2.320 0.699 -2.185 1.00 0.00 C ATOM 1519 C PRO A 98 -2.554 0.663 -3.701 1.00 0.00 C ATOM 1520 O PRO A 98 -3.092 1.582 -4.309 1.00 0.00 O ATOM 1521 CB PRO A 98 -3.439 1.430 -1.438 1.00 0.00 C ATOM 1522 CG PRO A 98 -2.918 2.858 -1.420 1.00 0.00 C ATOM 1523 CD PRO A 98 -1.419 2.677 -1.142 1.00 0.00 C ATOM 0 HA PRO A 98 -2.269 -0.352 -1.900 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -4.396 1.350 -1.954 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -3.585 1.035 -0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -3.094 3.363 -2.370 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -3.402 3.454 -0.647 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.836 3.511 -1.533 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -1.214 2.619 -0.073 1.00 0.00 H new ATOM 1531 N THR A 99 -1.997 -0.388 -4.295 1.00 0.00 N ATOM 1532 CA THR A 99 -2.104 -0.600 -5.754 1.00 0.00 C ATOM 1533 C THR A 99 -3.431 -1.287 -6.074 1.00 0.00 C ATOM 1534 O THR A 99 -3.796 -2.254 -5.409 1.00 0.00 O ATOM 1535 CB THR A 99 -0.914 -1.367 -6.336 1.00 0.00 C ATOM 1536 OG1 THR A 99 -0.998 -1.290 -7.761 1.00 0.00 O ATOM 1537 CG2 THR A 99 -0.790 -2.827 -5.900 1.00 0.00 C ATOM 0 H THR A 99 -1.468 -1.107 -3.802 1.00 0.00 H new ATOM 0 HA THR A 99 -2.082 0.378 -6.235 1.00 0.00 H new ATOM 0 HB THR A 99 -0.016 -0.891 -5.942 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.343 -1.900 -8.161 1.00 0.00 H new ATOM 0 HG21 THR A 99 0.086 -3.274 -6.371 1.00 0.00 H new ATOM 0 HG22 THR A 99 -0.684 -2.875 -4.816 1.00 0.00 H new ATOM 0 HG23 THR A 99 -1.683 -3.374 -6.202 1.00 0.00 H new ATOM 1545 N PHE A 100 -4.234 -0.587 -6.843 1.00 0.00 N ATOM 1546 CA PHE A 100 -5.571 -1.065 -7.249 1.00 0.00 C ATOM 1547 C PHE A 100 -5.531 -1.904 -8.536 1.00 0.00 C ATOM 1548 O PHE A 100 -4.736 -1.588 -9.422 1.00 0.00 O ATOM 1549 CB PHE A 100 -6.516 0.135 -7.366 1.00 0.00 C ATOM 1550 CG PHE A 100 -6.939 0.638 -5.975 1.00 0.00 C ATOM 1551 CD1 PHE A 100 -5.978 1.140 -5.071 1.00 0.00 C ATOM 1552 CD2 PHE A 100 -8.301 0.607 -5.614 1.00 0.00 C ATOM 1553 CE1 PHE A 100 -6.371 1.612 -3.801 1.00 0.00 C ATOM 1554 CE2 PHE A 100 -8.716 1.127 -4.369 1.00 0.00 C ATOM 1555 CZ PHE A 100 -7.738 1.626 -3.469 1.00 0.00 C ATOM 0 H PHE A 100 -3.995 0.332 -7.214 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.949 -1.740 -6.481 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -6.024 0.939 -7.914 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.399 -0.147 -7.939 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -4.936 1.163 -5.353 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.029 0.185 -6.291 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -5.632 1.958 -3.093 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.763 1.145 -4.105 1.00 0.00 H new ATOM 0 HZ PHE A 100 -8.049 2.023 -2.514 1.00 0.00 H new ATOM 1565 N PRO A 101 -6.414 -2.914 -8.688 1.00 0.00 N ATOM 1566 CA PRO A 101 -6.421 -3.804 -9.872 1.00 0.00 C ATOM 1567 C PRO A 101 -7.004 -3.127 -11.113 1.00 0.00 C ATOM 1568 O PRO A 101 -6.386 -3.173 -12.169 1.00 0.00 O ATOM 1569 CB PRO A 101 -7.199 -5.042 -9.438 1.00 0.00 C ATOM 1570 CG PRO A 101 -8.168 -4.520 -8.385 1.00 0.00 C ATOM 1571 CD PRO A 101 -7.467 -3.331 -7.729 1.00 0.00 C ATOM 0 HA PRO A 101 -5.410 -4.068 -10.182 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.728 -5.495 -10.277 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -6.538 -5.805 -9.028 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -9.112 -4.217 -8.838 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.400 -5.291 -7.651 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -8.168 -2.519 -7.538 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.035 -3.611 -6.769 1.00 0.00 H new ATOM 1579 N ASP A 102 -8.097 -2.370 -10.912 1.00 0.00 N ATOM 1580 CA ASP A 102 -8.709 -1.493 -11.931 1.00 0.00 C ATOM 1581 C ASP A 102 -7.677 -0.658 -12.700 1.00 0.00 C ATOM 1582 O ASP A 102 -7.896 -0.285 -13.852 1.00 0.00 O ATOM 1583 CB ASP A 102 -9.710 -0.527 -11.280 1.00 0.00 C ATOM 1584 CG ASP A 102 -11.151 -1.032 -11.309 1.00 0.00 C ATOM 1585 OD1 ASP A 102 -11.415 -1.999 -10.562 1.00 0.00 O ATOM 1586 OD2 ASP A 102 -11.960 -0.370 -11.993 1.00 0.00 O ATOM 0 H ASP A 102 -8.591 -2.349 -10.020 1.00 0.00 H new ATOM 0 HA ASP A 102 -9.209 -2.159 -12.635 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -9.415 -0.354 -10.245 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.660 0.434 -11.791 1.00 0.00 H new ATOM 1591 N GLY A 103 -6.611 -0.317 -11.973 1.00 0.00 N ATOM 1592 CA GLY A 103 -5.492 0.482 -12.504 1.00 0.00 C ATOM 1593 C GLY A 103 -5.703 1.981 -12.302 1.00 0.00 C ATOM 1594 O GLY A 103 -4.966 2.798 -12.842 1.00 0.00 O ATOM 0 H GLY A 103 -6.494 -0.585 -10.996 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -4.567 0.178 -12.014 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.373 0.274 -13.567 1.00 0.00 H new ATOM 1598 N HIS A 104 -6.666 2.305 -11.445 1.00 0.00 N ATOM 1599 CA HIS A 104 -6.921 3.679 -11.045 1.00 0.00 C ATOM 1600 C HIS A 104 -5.985 4.017 -9.884 1.00 0.00 C ATOM 1601 O HIS A 104 -5.805 3.233 -8.948 1.00 0.00 O ATOM 1602 CB HIS A 104 -8.406 3.918 -10.709 1.00 0.00 C ATOM 1603 CG HIS A 104 -8.933 3.287 -9.414 1.00 0.00 C ATOM 1604 ND1 HIS A 104 -9.759 2.256 -9.310 1.00 0.00 N ATOM 1605 CD2 HIS A 104 -8.721 3.762 -8.192 1.00 0.00 C ATOM 1606 CE1 HIS A 104 -10.042 2.079 -8.020 1.00 0.00 C ATOM 1607 NE2 HIS A 104 -9.383 3.002 -7.334 1.00 0.00 N ATOM 0 H HIS A 104 -7.288 1.623 -11.011 1.00 0.00 H new ATOM 0 HA HIS A 104 -6.713 4.353 -11.876 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -8.573 4.994 -10.655 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -9.006 3.543 -11.538 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -8.114 4.619 -7.942 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -10.691 1.321 -7.608 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -9.386 3.108 -6.320 1.00 0.00 H new ATOM 1616 N ASP A 105 -5.231 5.069 -10.121 1.00 0.00 N ATOM 1617 CA ASP A 105 -4.369 5.671 -9.085 1.00 0.00 C ATOM 1618 C ASP A 105 -5.255 6.300 -8.001 1.00 0.00 C ATOM 1619 O ASP A 105 -5.666 7.454 -8.096 1.00 0.00 O ATOM 1620 CB ASP A 105 -3.419 6.701 -9.707 1.00 0.00 C ATOM 1621 CG ASP A 105 -4.089 7.671 -10.700 1.00 0.00 C ATOM 1622 OD1 ASP A 105 -4.680 8.675 -10.259 1.00 0.00 O ATOM 1623 OD2 ASP A 105 -4.099 7.298 -11.889 1.00 0.00 O ATOM 0 H ASP A 105 -5.187 5.540 -11.025 1.00 0.00 H new ATOM 0 HA ASP A 105 -3.750 4.900 -8.626 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -2.958 7.281 -8.907 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.616 6.172 -10.221 1.00 0.00 H new ATOM 1628 N TYR A 106 -5.711 5.431 -7.107 1.00 0.00 N ATOM 1629 CA TYR A 106 -6.504 5.825 -5.921 1.00 0.00 C ATOM 1630 C TYR A 106 -6.007 7.170 -5.384 1.00 0.00 C ATOM 1631 O TYR A 106 -4.802 7.426 -5.410 1.00 0.00 O ATOM 1632 CB TYR A 106 -6.314 4.731 -4.873 1.00 0.00 C ATOM 1633 CG TYR A 106 -6.556 5.113 -3.415 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -7.863 5.369 -2.920 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -5.413 5.268 -2.605 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -8.009 5.813 -1.591 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -5.562 5.716 -1.290 1.00 0.00 C ATOM 1638 CZ TYR A 106 -6.856 5.996 -0.811 1.00 0.00 C ATOM 1639 OH TYR A 106 -6.953 6.451 0.460 1.00 0.00 O ATOM 0 H TYR A 106 -5.547 4.426 -7.173 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.558 5.937 -6.173 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -6.981 3.906 -5.121 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -5.295 4.354 -4.959 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.728 5.226 -3.551 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -4.432 5.043 -2.997 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.988 6.009 -1.180 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -4.700 5.845 -0.652 1.00 0.00 H new ATOM 0 HH TYR A 106 -7.510 5.839 0.985 1.00 0.00 H new ATOM 1649 N LYS A 107 -6.964 7.955 -4.931 1.00 0.00 N ATOM 1650 CA LYS A 107 -6.716 9.267 -4.306 1.00 0.00 C ATOM 1651 C LYS A 107 -5.909 9.121 -2.994 1.00 0.00 C ATOM 1652 O LYS A 107 -6.331 9.435 -1.886 1.00 0.00 O ATOM 1653 CB LYS A 107 -8.055 10.002 -4.126 1.00 0.00 C ATOM 1654 CG LYS A 107 -9.028 9.208 -3.247 1.00 0.00 C ATOM 1655 CD LYS A 107 -10.421 9.091 -3.854 1.00 0.00 C ATOM 1656 CE LYS A 107 -11.320 10.242 -3.428 1.00 0.00 C ATOM 1657 NZ LYS A 107 -12.503 9.650 -2.788 1.00 0.00 N ATOM 0 H LYS A 107 -7.953 7.709 -4.981 1.00 0.00 H new ATOM 0 HA LYS A 107 -6.092 9.878 -4.959 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.876 10.979 -3.678 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.507 10.177 -5.102 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -8.625 8.209 -3.080 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.102 9.689 -2.271 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -10.344 9.073 -4.941 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -10.872 8.146 -3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -10.798 10.903 -2.736 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -11.609 10.845 -4.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -13.147 10.407 -2.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -12.993 9.033 -3.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.208 9.090 -1.963 1.00 0.00 H new ATOM 1671 N PHE A 108 -4.643 8.783 -3.194 1.00 0.00 N ATOM 1672 CA PHE A 108 -3.660 8.610 -2.108 1.00 0.00 C ATOM 1673 C PHE A 108 -3.232 9.937 -1.461 1.00 0.00 C ATOM 1674 O PHE A 108 -2.507 10.003 -0.472 1.00 0.00 O ATOM 1675 CB PHE A 108 -2.482 7.750 -2.561 1.00 0.00 C ATOM 1676 CG PHE A 108 -1.594 8.474 -3.564 1.00 0.00 C ATOM 1677 CD1 PHE A 108 -0.682 9.423 -3.060 1.00 0.00 C ATOM 1678 CD2 PHE A 108 -1.787 8.314 -4.962 1.00 0.00 C ATOM 1679 CE1 PHE A 108 0.008 10.259 -3.956 1.00 0.00 C ATOM 1680 CE2 PHE A 108 -1.046 9.106 -5.866 1.00 0.00 C ATOM 1681 CZ PHE A 108 -0.162 10.083 -5.348 1.00 0.00 C ATOM 0 H PHE A 108 -4.255 8.617 -4.122 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.161 8.064 -1.308 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -1.888 7.464 -1.693 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -2.857 6.830 -3.008 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.515 9.507 -1.996 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -2.498 7.590 -5.332 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.664 11.031 -3.582 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -1.152 8.969 -6.932 1.00 0.00 H new ATOM 0 HZ PHE A 108 0.394 10.707 -6.031 1.00 0.00 H new ATOM 1691 N ASP A 109 -3.688 11.000 -2.100 1.00 0.00 N ATOM 1692 CA ASP A 109 -3.487 12.383 -1.671 1.00 0.00 C ATOM 1693 C ASP A 109 -4.723 12.944 -0.925 1.00 0.00 C ATOM 1694 O ASP A 109 -4.617 13.988 -0.293 1.00 0.00 O ATOM 1695 CB ASP A 109 -3.118 13.203 -2.914 1.00 0.00 C ATOM 1696 CG ASP A 109 -3.169 14.709 -2.667 1.00 0.00 C ATOM 1697 OD1 ASP A 109 -2.323 15.192 -1.873 1.00 0.00 O ATOM 1698 OD2 ASP A 109 -4.115 15.314 -3.220 1.00 0.00 O ATOM 0 H ASP A 109 -4.228 10.927 -2.962 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.676 12.441 -0.945 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.116 12.927 -3.241 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.799 12.950 -3.726 1.00 0.00 H new ATOM 1703 N SER A 110 -5.833 12.208 -0.940 1.00 0.00 N ATOM 1704 CA SER A 110 -7.080 12.675 -0.292 1.00 0.00 C ATOM 1705 C SER A 110 -7.110 12.203 1.168 1.00 0.00 C ATOM 1706 O SER A 110 -7.249 11.009 1.433 1.00 0.00 O ATOM 1707 CB SER A 110 -8.300 12.111 -1.018 1.00 0.00 C ATOM 1708 OG SER A 110 -9.208 13.178 -1.283 1.00 0.00 O ATOM 0 H SER A 110 -5.905 11.294 -1.386 1.00 0.00 H new ATOM 0 HA SER A 110 -7.106 13.764 -0.334 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.998 11.632 -1.949 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.782 11.347 -0.409 1.00 0.00 H new ATOM 0 HG SER A 110 -9.995 12.829 -1.751 1.00 0.00 H new ATOM 1714 N LYS A 111 -6.644 13.107 2.028 1.00 0.00 N ATOM 1715 CA LYS A 111 -6.604 12.853 3.490 1.00 0.00 C ATOM 1716 C LYS A 111 -7.990 12.605 4.068 1.00 0.00 C ATOM 1717 O LYS A 111 -8.302 11.502 4.520 1.00 0.00 O ATOM 1718 CB LYS A 111 -5.919 14.026 4.226 1.00 0.00 C ATOM 1719 CG LYS A 111 -5.117 13.517 5.415 1.00 0.00 C ATOM 1720 CD LYS A 111 -5.292 14.414 6.637 1.00 0.00 C ATOM 1721 CE LYS A 111 -4.051 14.371 7.523 1.00 0.00 C ATOM 1722 NZ LYS A 111 -4.310 15.264 8.659 1.00 0.00 N ATOM 0 H LYS A 111 -6.287 14.022 1.752 1.00 0.00 H new ATOM 0 HA LYS A 111 -6.020 11.946 3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.262 14.560 3.539 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -6.671 14.738 4.566 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.432 12.503 5.660 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -4.061 13.467 5.148 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.481 15.439 6.317 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -6.163 14.093 7.208 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -3.856 13.355 7.866 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.170 14.695 6.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -3.486 15.266 9.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -4.481 16.229 8.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.147 14.930 9.179 1.00 0.00 H new ATOM 1736 N LYS A 112 -8.780 13.667 4.031 1.00 0.00 N ATOM 1737 CA LYS A 112 -10.181 13.622 4.469 1.00 0.00 C ATOM 1738 C LYS A 112 -11.093 14.252 3.406 1.00 0.00 C ATOM 1739 O LYS A 112 -10.802 15.349 2.918 1.00 0.00 O ATOM 1740 CB LYS A 112 -10.320 14.200 5.880 1.00 0.00 C ATOM 1741 CG LYS A 112 -10.196 15.716 5.899 1.00 0.00 C ATOM 1742 CD LYS A 112 -9.524 16.222 7.158 1.00 0.00 C ATOM 1743 CE LYS A 112 -9.448 17.739 7.034 1.00 0.00 C ATOM 1744 NZ LYS A 112 -8.570 18.234 8.091 1.00 0.00 N ATOM 0 H LYS A 112 -8.478 14.583 3.700 1.00 0.00 H new ATOM 0 HA LYS A 112 -10.521 12.590 4.556 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -11.286 13.912 6.295 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -9.555 13.767 6.524 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -9.626 16.043 5.029 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -11.188 16.161 5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -10.092 15.934 8.043 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.528 15.792 7.265 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.063 18.023 6.055 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.441 18.179 7.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -8.501 19.270 8.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -8.959 17.968 9.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -7.624 17.817 7.980 1.00 0.00 H new ATOM 1758 N PRO A 113 -12.074 13.471 2.932 1.00 0.00 N ATOM 1759 CA PRO A 113 -12.263 12.050 3.295 1.00 0.00 C ATOM 1760 C PRO A 113 -11.253 11.149 2.553 1.00 0.00 C ATOM 1761 O PRO A 113 -10.401 11.613 1.799 1.00 0.00 O ATOM 1762 CB PRO A 113 -13.710 11.761 2.933 1.00 0.00 C ATOM 1763 CG PRO A 113 -13.983 12.695 1.753 1.00 0.00 C ATOM 1764 CD PRO A 113 -13.153 13.941 2.045 1.00 0.00 C ATOM 0 HA PRO A 113 -12.077 11.846 4.349 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -13.853 10.716 2.658 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -14.380 11.965 3.768 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -13.690 12.236 0.809 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.043 12.935 1.675 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -12.752 14.374 1.128 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.753 14.713 2.526 1.00 0.00 H new ATOM 1772 N LYS A 114 -11.356 9.860 2.864 1.00 0.00 N ATOM 1773 CA LYS A 114 -10.451 8.833 2.343 1.00 0.00 C ATOM 1774 C LYS A 114 -11.172 7.486 2.392 1.00 0.00 C ATOM 1775 O LYS A 114 -11.577 7.015 3.458 1.00 0.00 O ATOM 1776 CB LYS A 114 -9.195 8.809 3.226 1.00 0.00 C ATOM 1777 CG LYS A 114 -8.230 7.719 2.781 1.00 0.00 C ATOM 1778 CD LYS A 114 -7.529 7.091 3.975 1.00 0.00 C ATOM 1779 CE LYS A 114 -6.744 5.865 3.520 1.00 0.00 C ATOM 1780 NZ LYS A 114 -5.697 5.619 4.511 1.00 0.00 N ATOM 0 H LYS A 114 -12.074 9.493 3.489 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.161 9.042 1.313 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -8.698 9.778 3.183 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.481 8.644 4.265 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -8.772 6.952 2.228 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.490 8.139 2.100 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -6.857 7.814 4.437 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -8.261 6.807 4.731 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.401 5.000 3.434 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.308 6.033 2.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.252 4.698 4.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.979 6.369 4.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.115 5.615 5.464 1.00 0.00 H new ATOM 1794 N GLU A 115 -11.437 6.973 1.203 1.00 0.00 N ATOM 1795 CA GLU A 115 -12.028 5.630 1.043 1.00 0.00 C ATOM 1796 C GLU A 115 -11.036 4.585 1.575 1.00 0.00 C ATOM 1797 O GLU A 115 -9.819 4.763 1.468 1.00 0.00 O ATOM 1798 CB GLU A 115 -12.349 5.358 -0.425 1.00 0.00 C ATOM 1799 CG GLU A 115 -13.104 4.034 -0.613 1.00 0.00 C ATOM 1800 CD GLU A 115 -13.340 3.696 -2.080 1.00 0.00 C ATOM 1801 OE1 GLU A 115 -14.228 4.343 -2.672 1.00 0.00 O ATOM 1802 OE2 GLU A 115 -12.638 2.790 -2.580 1.00 0.00 O ATOM 0 H GLU A 115 -11.256 7.458 0.324 1.00 0.00 H new ATOM 0 HA GLU A 115 -12.959 5.573 1.607 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.949 6.177 -0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -11.423 5.332 -1.000 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.539 3.228 -0.145 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.063 4.091 -0.098 1.00 0.00 H new ATOM 1809 N ASN A 116 -11.606 3.503 2.090 1.00 0.00 N ATOM 1810 CA ASN A 116 -10.849 2.326 2.569 1.00 0.00 C ATOM 1811 C ASN A 116 -9.766 1.910 1.557 1.00 0.00 C ATOM 1812 O ASN A 116 -10.018 1.998 0.350 1.00 0.00 O ATOM 1813 CB ASN A 116 -11.824 1.161 2.779 1.00 0.00 C ATOM 1814 CG ASN A 116 -11.332 0.308 3.945 1.00 0.00 C ATOM 1815 OD1 ASN A 116 -10.816 -0.786 3.811 1.00 0.00 O ATOM 1816 ND2 ASN A 116 -11.412 0.878 5.125 1.00 0.00 N ATOM 0 H ASN A 116 -12.616 3.405 2.193 1.00 0.00 H new ATOM 0 HA ASN A 116 -10.356 2.586 3.506 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -12.825 1.540 2.985 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -11.892 0.558 1.873 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -11.038 0.403 5.947 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -11.848 1.795 5.220 1.00 0.00 H new ATOM 1823 N PRO A 117 -8.546 1.624 2.039 1.00 0.00 N ATOM 1824 CA PRO A 117 -7.442 1.231 1.167 1.00 0.00 C ATOM 1825 C PRO A 117 -7.681 -0.152 0.524 1.00 0.00 C ATOM 1826 O PRO A 117 -8.639 -0.845 0.861 1.00 0.00 O ATOM 1827 CB PRO A 117 -6.204 1.264 2.063 1.00 0.00 C ATOM 1828 CG PRO A 117 -6.756 0.979 3.457 1.00 0.00 C ATOM 1829 CD PRO A 117 -8.122 1.669 3.459 1.00 0.00 C ATOM 0 HA PRO A 117 -7.330 1.903 0.316 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.472 0.515 1.762 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.705 2.232 2.021 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.849 -0.092 3.639 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -6.105 1.379 4.234 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.831 1.150 4.104 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -8.051 2.694 3.823 1.00 0.00 H new ATOM 1837 N GLY A 118 -6.835 -0.440 -0.461 1.00 0.00 N ATOM 1838 CA GLY A 118 -6.846 -1.711 -1.208 1.00 0.00 C ATOM 1839 C GLY A 118 -6.221 -2.854 -0.387 1.00 0.00 C ATOM 1840 O GLY A 118 -5.430 -2.559 0.517 1.00 0.00 O ATOM 0 H GLY A 118 -6.110 0.206 -0.773 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -7.871 -1.970 -1.472 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.297 -1.590 -2.142 1.00 0.00 H new ATOM 1844 N PRO A 119 -6.550 -4.108 -0.701 1.00 0.00 N ATOM 1845 CA PRO A 119 -5.944 -5.277 -0.037 1.00 0.00 C ATOM 1846 C PRO A 119 -4.505 -5.502 -0.520 1.00 0.00 C ATOM 1847 O PRO A 119 -3.591 -5.561 0.299 1.00 0.00 O ATOM 1848 CB PRO A 119 -6.888 -6.445 -0.331 1.00 0.00 C ATOM 1849 CG PRO A 119 -7.573 -6.056 -1.639 1.00 0.00 C ATOM 1850 CD PRO A 119 -7.601 -4.534 -1.662 1.00 0.00 C ATOM 0 HA PRO A 119 -5.843 -5.145 1.040 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -6.341 -7.383 -0.432 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -7.612 -6.583 0.472 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -7.028 -6.449 -2.497 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -8.582 -6.466 -1.688 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -7.398 -4.152 -2.662 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -8.580 -4.154 -1.369 1.00 0.00 H new ATOM 1858 N ALA A 120 -4.317 -5.662 -1.834 1.00 0.00 N ATOM 1859 CA ALA A 120 -2.976 -5.774 -2.414 1.00 0.00 C ATOM 1860 C ALA A 120 -2.314 -4.417 -2.638 1.00 0.00 C ATOM 1861 O ALA A 120 -2.924 -3.406 -2.977 1.00 0.00 O ATOM 1862 CB ALA A 120 -2.957 -6.601 -3.693 1.00 0.00 C ATOM 0 H ALA A 120 -5.075 -5.717 -2.514 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.385 -6.307 -1.669 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.939 -6.651 -4.079 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.314 -7.609 -3.480 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -3.605 -6.136 -4.436 1.00 0.00 H new ATOM 1868 N ARG A 121 -1.060 -4.437 -2.222 1.00 0.00 N ATOM 1869 CA ARG A 121 -0.195 -3.251 -2.234 1.00 0.00 C ATOM 1870 C ARG A 121 1.163 -3.535 -2.860 1.00 0.00 C ATOM 1871 O ARG A 121 1.764 -4.594 -2.642 1.00 0.00 O ATOM 1872 CB ARG A 121 -0.050 -2.696 -0.823 1.00 0.00 C ATOM 1873 CG ARG A 121 -1.383 -2.347 -0.157 1.00 0.00 C ATOM 1874 CD ARG A 121 -1.211 -1.106 0.728 1.00 0.00 C ATOM 1875 NE ARG A 121 -2.157 -1.109 1.856 1.00 0.00 N ATOM 1876 CZ ARG A 121 -2.057 -1.903 2.930 1.00 0.00 C ATOM 1877 NH1 ARG A 121 -1.140 -2.854 3.007 1.00 0.00 N ATOM 1878 NH2 ARG A 121 -2.953 -1.826 3.888 1.00 0.00 N ATOM 0 H ARG A 121 -0.603 -5.275 -1.863 1.00 0.00 H new ATOM 0 HA ARG A 121 -0.672 -2.497 -2.860 1.00 0.00 H new ATOM 0 HB2 ARG A 121 0.473 -3.427 -0.207 1.00 0.00 H new ATOM 0 HB3 ARG A 121 0.574 -1.803 -0.856 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -2.142 -2.161 -0.917 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.732 -3.188 0.443 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.190 -1.069 1.109 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.361 -0.208 0.129 1.00 0.00 H new ATOM 0 HE ARG A 121 -2.944 -0.461 1.817 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -0.487 -2.996 2.236 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -1.086 -3.445 3.837 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -3.724 -1.162 3.813 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -2.878 -2.430 4.706 1.00 0.00 H new ATOM 1892 N VAL A 122 1.594 -2.558 -3.646 1.00 0.00 N ATOM 1893 CA VAL A 122 2.886 -2.597 -4.344 1.00 0.00 C ATOM 1894 C VAL A 122 4.006 -2.205 -3.367 1.00 0.00 C ATOM 1895 O VAL A 122 3.897 -1.216 -2.637 1.00 0.00 O ATOM 1896 CB VAL A 122 2.879 -1.735 -5.620 1.00 0.00 C ATOM 1897 CG1 VAL A 122 2.646 -0.240 -5.379 1.00 0.00 C ATOM 1898 CG2 VAL A 122 4.149 -1.932 -6.444 1.00 0.00 C ATOM 0 H VAL A 122 1.059 -1.708 -3.823 1.00 0.00 H new ATOM 0 HA VAL A 122 3.074 -3.615 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 122 2.018 -2.096 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.657 0.288 -6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.680 -0.096 -4.895 1.00 0.00 H new ATOM 0 HG13 VAL A 122 3.435 0.152 -4.738 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.105 -1.307 -7.336 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.017 -1.652 -5.847 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.233 -2.978 -6.738 1.00 0.00 H new ATOM 1908 N ILE A 123 5.008 -3.069 -3.349 1.00 0.00 N ATOM 1909 CA ILE A 123 6.208 -2.868 -2.532 1.00 0.00 C ATOM 1910 C ILE A 123 7.386 -2.573 -3.454 1.00 0.00 C ATOM 1911 O ILE A 123 7.593 -3.199 -4.499 1.00 0.00 O ATOM 1912 CB ILE A 123 6.495 -4.089 -1.640 1.00 0.00 C ATOM 1913 CG1 ILE A 123 5.264 -4.522 -0.840 1.00 0.00 C ATOM 1914 CG2 ILE A 123 7.696 -3.840 -0.709 1.00 0.00 C ATOM 1915 CD1 ILE A 123 4.708 -3.441 0.082 1.00 0.00 C ATOM 0 H ILE A 123 5.019 -3.929 -3.897 1.00 0.00 H new ATOM 0 HA ILE A 123 6.047 -2.022 -1.863 1.00 0.00 H new ATOM 0 HB ILE A 123 6.752 -4.910 -2.309 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.482 -4.829 -1.535 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.521 -5.397 -0.243 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.869 -4.723 -0.094 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.584 -3.635 -1.307 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.487 -2.985 -0.066 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.838 -3.827 0.612 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.472 -3.149 0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.417 -2.573 -0.509 1.00 0.00 H new ATOM 1927 N TYR A 124 8.185 -1.650 -2.927 1.00 0.00 N ATOM 1928 CA TYR A 124 9.330 -1.079 -3.644 1.00 0.00 C ATOM 1929 C TYR A 124 10.178 -0.211 -2.728 1.00 0.00 C ATOM 1930 O TYR A 124 9.712 0.235 -1.673 1.00 0.00 O ATOM 1931 CB TYR A 124 8.828 -0.222 -4.830 1.00 0.00 C ATOM 1932 CG TYR A 124 7.894 0.921 -4.394 1.00 0.00 C ATOM 1933 CD1 TYR A 124 6.545 0.657 -4.054 1.00 0.00 C ATOM 1934 CD2 TYR A 124 8.437 2.215 -4.312 1.00 0.00 C ATOM 1935 CE1 TYR A 124 5.732 1.705 -3.594 1.00 0.00 C ATOM 1936 CE2 TYR A 124 7.622 3.267 -3.866 1.00 0.00 C ATOM 1937 CZ TYR A 124 6.283 3.000 -3.535 1.00 0.00 C ATOM 1938 OH TYR A 124 5.463 4.047 -3.309 1.00 0.00 O ATOM 0 H TYR A 124 8.060 -1.273 -1.988 1.00 0.00 H new ATOM 0 HA TYR A 124 9.943 -1.903 -4.008 1.00 0.00 H new ATOM 0 HB2 TYR A 124 9.685 0.198 -5.356 1.00 0.00 H new ATOM 0 HB3 TYR A 124 8.302 -0.863 -5.538 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.145 -0.342 -4.148 1.00 0.00 H new ATOM 0 HD2 TYR A 124 9.465 2.397 -4.588 1.00 0.00 H new ATOM 0 HE1 TYR A 124 4.711 1.523 -3.293 1.00 0.00 H new ATOM 0 HE2 TYR A 124 8.019 4.268 -3.778 1.00 0.00 H new ATOM 0 HH TYR A 124 5.631 4.744 -3.977 1.00 0.00 H new ATOM 1948 N THR A 125 11.463 -0.198 -3.045 1.00 0.00 N ATOM 1949 CA THR A 125 12.470 0.577 -2.298 1.00 0.00 C ATOM 1950 C THR A 125 12.403 2.066 -2.681 1.00 0.00 C ATOM 1951 O THR A 125 11.455 2.505 -3.319 1.00 0.00 O ATOM 1952 CB THR A 125 13.861 -0.016 -2.535 1.00 0.00 C ATOM 1953 OG1 THR A 125 14.273 0.253 -3.875 1.00 0.00 O ATOM 1954 CG2 THR A 125 13.948 -1.514 -2.219 1.00 0.00 C ATOM 0 H THR A 125 11.849 -0.723 -3.829 1.00 0.00 H new ATOM 0 HA THR A 125 12.257 0.513 -1.231 1.00 0.00 H new ATOM 0 HB THR A 125 14.542 0.469 -1.836 1.00 0.00 H new ATOM 0 HG1 THR A 125 15.164 -0.125 -4.025 1.00 0.00 H new ATOM 0 HG21 THR A 125 14.961 -1.868 -2.409 1.00 0.00 H new ATOM 0 HG22 THR A 125 13.696 -1.680 -1.172 1.00 0.00 H new ATOM 0 HG23 THR A 125 13.248 -2.060 -2.851 1.00 0.00 H new ATOM 1962 N TYR A 126 13.446 2.829 -2.351 1.00 0.00 N ATOM 1963 CA TYR A 126 13.524 4.290 -2.622 1.00 0.00 C ATOM 1964 C TYR A 126 14.963 4.816 -2.473 1.00 0.00 C ATOM 1965 O TYR A 126 15.752 4.165 -1.783 1.00 0.00 O ATOM 1966 CB TYR A 126 12.541 5.015 -1.679 1.00 0.00 C ATOM 1967 CG TYR A 126 12.860 6.460 -1.300 1.00 0.00 C ATOM 1968 CD1 TYR A 126 12.575 7.523 -2.177 1.00 0.00 C ATOM 1969 CD2 TYR A 126 13.544 6.703 -0.101 1.00 0.00 C ATOM 1970 CE1 TYR A 126 13.014 8.826 -1.887 1.00 0.00 C ATOM 1971 CE2 TYR A 126 13.987 7.996 0.215 1.00 0.00 C ATOM 1972 CZ TYR A 126 13.716 9.043 -0.693 1.00 0.00 C ATOM 1973 OH TYR A 126 14.123 10.297 -0.407 1.00 0.00 O ATOM 0 H TYR A 126 14.274 2.460 -1.884 1.00 0.00 H new ATOM 0 HA TYR A 126 13.239 4.488 -3.655 1.00 0.00 H new ATOM 0 HB2 TYR A 126 11.556 5.000 -2.145 1.00 0.00 H new ATOM 0 HB3 TYR A 126 12.468 4.435 -0.759 1.00 0.00 H new ATOM 0 HD1 TYR A 126 12.014 7.336 -3.081 1.00 0.00 H new ATOM 0 HD2 TYR A 126 13.731 5.889 0.584 1.00 0.00 H new ATOM 0 HE1 TYR A 126 12.815 9.641 -2.568 1.00 0.00 H new ATOM 0 HE2 TYR A 126 14.524 8.187 1.133 1.00 0.00 H new ATOM 0 HH TYR A 126 13.728 10.583 0.443 1.00 0.00 H new ATOM 1983 N PRO A 127 15.368 5.782 -3.318 1.00 0.00 N ATOM 1984 CA PRO A 127 14.627 6.276 -4.514 1.00 0.00 C ATOM 1985 C PRO A 127 14.640 5.343 -5.716 1.00 0.00 C ATOM 1986 O PRO A 127 13.823 5.495 -6.623 1.00 0.00 O ATOM 1987 CB PRO A 127 15.233 7.655 -4.828 1.00 0.00 C ATOM 1988 CG PRO A 127 16.657 7.552 -4.278 1.00 0.00 C ATOM 1989 CD PRO A 127 16.576 6.592 -3.089 1.00 0.00 C ATOM 0 HA PRO A 127 13.562 6.333 -4.287 1.00 0.00 H new ATOM 0 HB2 PRO A 127 15.230 7.861 -5.898 1.00 0.00 H new ATOM 0 HB3 PRO A 127 14.674 8.458 -4.348 1.00 0.00 H new ATOM 0 HG2 PRO A 127 17.343 7.177 -5.037 1.00 0.00 H new ATOM 0 HG3 PRO A 127 17.028 8.529 -3.967 1.00 0.00 H new ATOM 0 HD2 PRO A 127 17.465 5.963 -3.031 1.00 0.00 H new ATOM 0 HD3 PRO A 127 16.510 7.138 -2.148 1.00 0.00 H new ATOM 1997 N ASN A 128 15.429 4.283 -5.572 1.00 0.00 N ATOM 1998 CA ASN A 128 15.529 3.176 -6.537 1.00 0.00 C ATOM 1999 C ASN A 128 14.142 2.706 -7.023 1.00 0.00 C ATOM 2000 O ASN A 128 13.952 2.539 -8.227 1.00 0.00 O ATOM 2001 CB ASN A 128 16.263 2.016 -5.868 1.00 0.00 C ATOM 2002 CG ASN A 128 17.630 1.813 -6.512 1.00 0.00 C ATOM 2003 OD1 ASN A 128 17.835 1.004 -7.400 1.00 0.00 O ATOM 2004 ND2 ASN A 128 18.602 2.563 -6.056 1.00 0.00 N ATOM 0 H ASN A 128 16.036 4.160 -4.761 1.00 0.00 H new ATOM 0 HA ASN A 128 16.076 3.527 -7.412 1.00 0.00 H new ATOM 0 HB2 ASN A 128 16.381 2.217 -4.803 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.673 1.104 -5.956 1.00 0.00 H new ATOM 0 HD21 ASN A 128 19.541 2.473 -6.444 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.420 3.237 -5.313 1.00 0.00 H new ATOM 2011 N LYS A 129 13.219 2.551 -6.071 1.00 0.00 N ATOM 2012 CA LYS A 129 11.842 2.092 -6.343 1.00 0.00 C ATOM 2013 C LYS A 129 11.840 0.718 -7.028 1.00 0.00 C ATOM 2014 O LYS A 129 10.931 0.408 -7.798 1.00 0.00 O ATOM 2015 CB LYS A 129 11.031 3.116 -7.137 1.00 0.00 C ATOM 2016 CG LYS A 129 10.686 4.347 -6.318 1.00 0.00 C ATOM 2017 CD LYS A 129 9.925 5.364 -7.183 1.00 0.00 C ATOM 2018 CE LYS A 129 8.481 5.529 -6.705 1.00 0.00 C ATOM 2019 NZ LYS A 129 8.069 6.923 -6.900 1.00 0.00 N ATOM 0 H LYS A 129 13.399 2.739 -5.085 1.00 0.00 H new ATOM 0 HA LYS A 129 11.347 1.986 -5.378 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.596 3.417 -8.019 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.112 2.650 -7.492 1.00 0.00 H new ATOM 0 HG2 LYS A 129 10.078 4.063 -5.459 1.00 0.00 H new ATOM 0 HG3 LYS A 129 11.597 4.800 -5.928 1.00 0.00 H new ATOM 0 HD2 LYS A 129 10.434 6.327 -7.149 1.00 0.00 H new ATOM 0 HD3 LYS A 129 9.931 5.037 -8.223 1.00 0.00 H new ATOM 0 HE2 LYS A 129 7.822 4.861 -7.260 1.00 0.00 H new ATOM 0 HE3 LYS A 129 8.399 5.256 -5.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 7.620 7.277 -6.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 8.903 7.504 -7.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.391 6.978 -7.687 1.00 0.00 H new ATOM 2033 N VAL A 130 12.866 -0.063 -6.698 1.00 0.00 N ATOM 2034 CA VAL A 130 13.080 -1.417 -7.221 1.00 0.00 C ATOM 2035 C VAL A 130 11.896 -2.276 -6.761 1.00 0.00 C ATOM 2036 O VAL A 130 11.774 -2.637 -5.589 1.00 0.00 O ATOM 2037 CB VAL A 130 14.425 -2.027 -6.755 1.00 0.00 C ATOM 2038 CG1 VAL A 130 14.623 -3.464 -7.266 1.00 0.00 C ATOM 2039 CG2 VAL A 130 15.607 -1.212 -7.283 1.00 0.00 C ATOM 0 H VAL A 130 13.591 0.232 -6.044 1.00 0.00 H new ATOM 0 HA VAL A 130 13.136 -1.382 -8.309 1.00 0.00 H new ATOM 0 HB VAL A 130 14.388 -2.018 -5.666 1.00 0.00 H new ATOM 0 HG11 VAL A 130 15.580 -3.847 -6.912 1.00 0.00 H new ATOM 0 HG12 VAL A 130 13.818 -4.097 -6.892 1.00 0.00 H new ATOM 0 HG13 VAL A 130 14.611 -3.467 -8.356 1.00 0.00 H new ATOM 0 HG21 VAL A 130 16.540 -1.661 -6.942 1.00 0.00 H new ATOM 0 HG22 VAL A 130 15.585 -1.204 -8.373 1.00 0.00 H new ATOM 0 HG23 VAL A 130 15.539 -0.190 -6.911 1.00 0.00 H new ATOM 2049 N PHE A 131 10.946 -2.327 -7.694 1.00 0.00 N ATOM 2050 CA PHE A 131 9.708 -3.088 -7.562 1.00 0.00 C ATOM 2051 C PHE A 131 10.076 -4.538 -7.251 1.00 0.00 C ATOM 2052 O PHE A 131 10.756 -5.212 -8.024 1.00 0.00 O ATOM 2053 CB PHE A 131 8.919 -2.931 -8.880 1.00 0.00 C ATOM 2054 CG PHE A 131 7.785 -3.955 -9.020 1.00 0.00 C ATOM 2055 CD1 PHE A 131 6.541 -3.698 -8.399 1.00 0.00 C ATOM 2056 CD2 PHE A 131 8.111 -5.229 -9.526 1.00 0.00 C ATOM 2057 CE1 PHE A 131 5.628 -4.761 -8.254 1.00 0.00 C ATOM 2058 CE2 PHE A 131 7.209 -6.301 -9.348 1.00 0.00 C ATOM 2059 CZ PHE A 131 5.973 -6.044 -8.720 1.00 0.00 C ATOM 0 H PHE A 131 11.019 -1.829 -8.581 1.00 0.00 H new ATOM 0 HA PHE A 131 9.074 -2.731 -6.750 1.00 0.00 H new ATOM 0 HB2 PHE A 131 8.502 -1.925 -8.931 1.00 0.00 H new ATOM 0 HB3 PHE A 131 9.603 -3.036 -9.722 1.00 0.00 H new ATOM 0 HD1 PHE A 131 6.296 -2.708 -8.043 1.00 0.00 H new ATOM 0 HD2 PHE A 131 9.044 -5.385 -10.046 1.00 0.00 H new ATOM 0 HE1 PHE A 131 4.668 -4.593 -7.788 1.00 0.00 H new ATOM 0 HE2 PHE A 131 7.460 -7.296 -9.685 1.00 0.00 H new ATOM 0 HZ PHE A 131 5.271 -6.855 -8.593 1.00 0.00 H new ATOM 2069 N CYS A 132 9.784 -4.900 -6.008 1.00 0.00 N ATOM 2070 CA CYS A 132 10.042 -6.261 -5.551 1.00 0.00 C ATOM 2071 C CYS A 132 8.872 -7.173 -5.919 1.00 0.00 C ATOM 2072 O CYS A 132 8.993 -8.018 -6.813 1.00 0.00 O ATOM 2073 CB CYS A 132 10.295 -6.267 -4.053 1.00 0.00 C ATOM 2074 SG CYS A 132 11.798 -7.240 -3.757 1.00 0.00 S ATOM 0 H CYS A 132 9.375 -4.282 -5.307 1.00 0.00 H new ATOM 0 HA CYS A 132 10.934 -6.643 -6.048 1.00 0.00 H new ATOM 0 HB2 CYS A 132 10.417 -5.250 -3.681 1.00 0.00 H new ATOM 0 HB3 CYS A 132 9.447 -6.701 -3.523 1.00 0.00 H new ATOM 2079 N GLY A 133 7.735 -6.809 -5.353 1.00 0.00 N ATOM 2080 CA GLY A 133 6.469 -7.495 -5.577 1.00 0.00 C ATOM 2081 C GLY A 133 5.254 -6.757 -5.038 1.00 0.00 C ATOM 2082 O GLY A 133 5.286 -5.567 -4.730 1.00 0.00 O ATOM 0 H GLY A 133 7.661 -6.017 -4.715 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.339 -7.652 -6.648 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.516 -8.480 -5.114 1.00 0.00 H new ATOM 2086 N ILE A 134 4.187 -7.534 -4.991 1.00 0.00 N ATOM 2087 CA ILE A 134 2.897 -7.093 -4.444 1.00 0.00 C ATOM 2088 C ILE A 134 2.480 -8.064 -3.342 1.00 0.00 C ATOM 2089 O ILE A 134 2.710 -9.266 -3.416 1.00 0.00 O ATOM 2090 CB ILE A 134 1.837 -6.954 -5.559 1.00 0.00 C ATOM 2091 CG1 ILE A 134 2.152 -5.741 -6.420 1.00 0.00 C ATOM 2092 CG2 ILE A 134 0.404 -6.744 -5.037 1.00 0.00 C ATOM 2093 CD1 ILE A 134 2.555 -6.152 -7.830 1.00 0.00 C ATOM 0 H ILE A 134 4.181 -8.496 -5.331 1.00 0.00 H new ATOM 0 HA ILE A 134 2.992 -6.099 -4.007 1.00 0.00 H new ATOM 0 HB ILE A 134 1.879 -7.894 -6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 134 1.280 -5.088 -6.465 1.00 0.00 H new ATOM 0 HG13 ILE A 134 2.957 -5.167 -5.962 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -0.281 -6.655 -5.880 1.00 0.00 H new ATOM 0 HG22 ILE A 134 0.113 -7.595 -4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 134 0.364 -5.833 -4.440 1.00 0.00 H new ATOM 0 HD11 ILE A 134 2.774 -5.262 -8.420 1.00 0.00 H new ATOM 0 HD12 ILE A 134 3.442 -6.784 -7.785 1.00 0.00 H new ATOM 0 HD13 ILE A 134 1.739 -6.704 -8.295 1.00 0.00 H new ATOM 2105 N ILE A 135 2.000 -7.454 -2.275 1.00 0.00 N ATOM 2106 CA ILE A 135 1.525 -8.199 -1.102 1.00 0.00 C ATOM 2107 C ILE A 135 0.090 -7.797 -0.764 1.00 0.00 C ATOM 2108 O ILE A 135 -0.275 -6.625 -0.853 1.00 0.00 O ATOM 2109 CB ILE A 135 2.453 -7.962 0.094 1.00 0.00 C ATOM 2110 CG1 ILE A 135 2.534 -6.474 0.420 1.00 0.00 C ATOM 2111 CG2 ILE A 135 3.844 -8.523 -0.193 1.00 0.00 C ATOM 2112 CD1 ILE A 135 2.972 -6.252 1.853 1.00 0.00 C ATOM 0 H ILE A 135 1.924 -6.441 -2.187 1.00 0.00 H new ATOM 0 HA ILE A 135 1.536 -9.264 -1.336 1.00 0.00 H new ATOM 0 HB ILE A 135 2.042 -8.482 0.959 1.00 0.00 H new ATOM 0 HG12 ILE A 135 3.236 -5.988 -0.257 1.00 0.00 H new ATOM 0 HG13 ILE A 135 1.561 -6.010 0.258 1.00 0.00 H new ATOM 0 HG21 ILE A 135 4.492 -8.347 0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.773 -9.594 -0.380 1.00 0.00 H new ATOM 0 HG23 ILE A 135 4.262 -8.029 -1.070 1.00 0.00 H new ATOM 0 HD11 ILE A 135 3.021 -5.182 2.057 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.255 -6.718 2.529 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.956 -6.696 2.006 1.00 0.00 H new ATOM 2124 N ALA A 136 -0.708 -8.788 -0.409 1.00 0.00 N ATOM 2125 CA ALA A 136 -2.121 -8.604 -0.058 1.00 0.00 C ATOM 2126 C ALA A 136 -2.500 -9.354 1.204 1.00 0.00 C ATOM 2127 O ALA A 136 -1.941 -10.405 1.500 1.00 0.00 O ATOM 2128 CB ALA A 136 -3.030 -9.102 -1.171 1.00 0.00 C ATOM 0 H ALA A 136 -0.398 -9.758 -0.353 1.00 0.00 H new ATOM 0 HA ALA A 136 -2.251 -7.533 0.099 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -4.071 -8.954 -0.884 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -2.823 -8.547 -2.086 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.848 -10.163 -1.342 1.00 0.00 H new ATOM 2134 N HIS A 137 -3.611 -8.930 1.793 1.00 0.00 N ATOM 2135 CA HIS A 137 -4.132 -9.573 3.008 1.00 0.00 C ATOM 2136 C HIS A 137 -5.041 -10.730 2.614 1.00 0.00 C ATOM 2137 O HIS A 137 -6.109 -10.538 2.016 1.00 0.00 O ATOM 2138 CB HIS A 137 -4.920 -8.560 3.837 1.00 0.00 C ATOM 2139 CG HIS A 137 -4.109 -7.323 4.213 1.00 0.00 C ATOM 2140 ND1 HIS A 137 -3.605 -7.045 5.413 1.00 0.00 N ATOM 2141 CD2 HIS A 137 -3.896 -6.279 3.424 1.00 0.00 C ATOM 2142 CE1 HIS A 137 -3.130 -5.806 5.382 1.00 0.00 C ATOM 2143 NE2 HIS A 137 -3.277 -5.352 4.140 1.00 0.00 N ATOM 0 H HIS A 137 -4.172 -8.147 1.456 1.00 0.00 H new ATOM 0 HA HIS A 137 -3.300 -9.947 3.604 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -5.802 -8.250 3.276 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -5.274 -9.044 4.747 1.00 0.00 H new ATOM 0 HD1 HIS A 137 -3.587 -7.674 6.216 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -4.177 -6.199 2.384 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -2.702 -5.265 6.213 1.00 0.00 H new ATOM 2152 N THR A 138 -4.660 -11.920 3.049 1.00 0.00 N ATOM 2153 CA THR A 138 -5.391 -13.177 2.782 1.00 0.00 C ATOM 2154 C THR A 138 -6.609 -13.368 3.693 1.00 0.00 C ATOM 2155 O THR A 138 -7.001 -14.482 4.056 1.00 0.00 O ATOM 2156 CB THR A 138 -4.426 -14.353 2.919 1.00 0.00 C ATOM 2157 OG1 THR A 138 -3.540 -14.110 4.026 1.00 0.00 O ATOM 2158 CG2 THR A 138 -3.682 -14.589 1.606 1.00 0.00 C ATOM 0 H THR A 138 -3.819 -12.056 3.610 1.00 0.00 H new ATOM 0 HA THR A 138 -5.781 -13.125 1.765 1.00 0.00 H new ATOM 0 HB THR A 138 -4.977 -15.270 3.129 1.00 0.00 H new ATOM 0 HG1 THR A 138 -2.919 -14.863 4.120 1.00 0.00 H new ATOM 0 HG21 THR A 138 -2.999 -15.430 1.721 1.00 0.00 H new ATOM 0 HG22 THR A 138 -4.400 -14.810 0.816 1.00 0.00 H new ATOM 0 HG23 THR A 138 -3.116 -13.695 1.343 1.00 0.00 H new ATOM 2166 N LYS A 139 -7.326 -12.260 3.856 1.00 0.00 N ATOM 2167 CA LYS A 139 -8.532 -12.102 4.702 1.00 0.00 C ATOM 2168 C LYS A 139 -9.069 -10.674 4.599 1.00 0.00 C ATOM 2169 O LYS A 139 -8.782 -9.802 5.424 1.00 0.00 O ATOM 2170 CB LYS A 139 -8.243 -12.509 6.157 1.00 0.00 C ATOM 2171 CG LYS A 139 -9.513 -12.399 6.990 1.00 0.00 C ATOM 2172 CD LYS A 139 -9.581 -13.454 8.084 1.00 0.00 C ATOM 2173 CE LYS A 139 -10.905 -13.244 8.815 1.00 0.00 C ATOM 2174 NZ LYS A 139 -11.027 -14.233 9.888 1.00 0.00 N ATOM 0 H LYS A 139 -7.077 -11.393 3.380 1.00 0.00 H new ATOM 0 HA LYS A 139 -9.308 -12.773 4.335 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -7.864 -13.531 6.189 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -7.467 -11.868 6.575 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -9.564 -11.408 7.441 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -10.381 -12.498 6.339 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -9.529 -14.456 7.659 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -8.740 -13.354 8.770 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -10.950 -12.236 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -11.738 -13.341 8.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -11.928 -14.093 10.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -11.001 -15.190 9.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -10.238 -14.119 10.556 1.00 0.00 H new ATOM 2188 N GLU A 140 -9.879 -10.452 3.556 1.00 0.00 N ATOM 2189 CA GLU A 140 -10.548 -9.160 3.268 1.00 0.00 C ATOM 2190 C GLU A 140 -9.528 -8.042 2.967 1.00 0.00 C ATOM 2191 O GLU A 140 -9.038 -7.944 1.844 1.00 0.00 O ATOM 2192 CB GLU A 140 -11.547 -8.827 4.375 1.00 0.00 C ATOM 2193 CG GLU A 140 -12.980 -9.127 3.969 1.00 0.00 C ATOM 2194 CD GLU A 140 -13.774 -7.818 3.956 1.00 0.00 C ATOM 2195 OE1 GLU A 140 -13.477 -6.989 3.066 1.00 0.00 O ATOM 2196 OE2 GLU A 140 -14.609 -7.671 4.869 1.00 0.00 O ATOM 0 H GLU A 140 -10.097 -11.175 2.870 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.129 -9.251 2.350 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.298 -9.398 5.269 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -11.459 -7.772 4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.003 -9.592 2.984 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -13.430 -9.834 4.666 1.00 0.00 H new ATOM 2203 N ASN A 141 -9.083 -7.414 4.046 1.00 0.00 N ATOM 2204 CA ASN A 141 -8.051 -6.372 4.057 1.00 0.00 C ATOM 2205 C ASN A 141 -7.325 -6.307 5.422 1.00 0.00 C ATOM 2206 O ASN A 141 -6.958 -5.255 5.926 1.00 0.00 O ATOM 2207 CB ASN A 141 -8.716 -5.039 3.700 1.00 0.00 C ATOM 2208 CG ASN A 141 -7.701 -3.944 3.392 1.00 0.00 C ATOM 2209 OD1 ASN A 141 -6.503 -4.133 3.299 1.00 0.00 O ATOM 2210 ND2 ASN A 141 -8.207 -2.753 3.158 1.00 0.00 N ATOM 0 H ASN A 141 -9.442 -7.621 4.978 1.00 0.00 H new ATOM 0 HA ASN A 141 -7.282 -6.604 3.320 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -9.366 -5.181 2.837 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -9.350 -4.720 4.527 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -7.594 -1.981 2.897 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -9.213 -2.601 3.238 1.00 0.00 H new ATOM 2217 N GLN A 142 -7.228 -7.468 6.070 1.00 0.00 N ATOM 2218 CA GLN A 142 -6.576 -7.582 7.387 1.00 0.00 C ATOM 2219 C GLN A 142 -5.851 -8.928 7.526 1.00 0.00 C ATOM 2220 O GLN A 142 -6.011 -9.840 6.713 1.00 0.00 O ATOM 2221 CB GLN A 142 -7.610 -7.392 8.488 1.00 0.00 C ATOM 2222 CG GLN A 142 -7.008 -6.513 9.591 1.00 0.00 C ATOM 2223 CD GLN A 142 -7.714 -6.750 10.926 1.00 0.00 C ATOM 2224 OE1 GLN A 142 -8.432 -5.927 11.469 1.00 0.00 O ATOM 2225 NE2 GLN A 142 -7.457 -7.906 11.513 1.00 0.00 N ATOM 0 H GLN A 142 -7.592 -8.349 5.708 1.00 0.00 H new ATOM 0 HA GLN A 142 -5.823 -6.799 7.479 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -8.509 -6.926 8.084 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -7.907 -8.358 8.896 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -5.945 -6.730 9.694 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -7.094 -5.463 9.312 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -6.856 -8.589 11.053 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -7.860 -8.115 12.426 1.00 0.00 H new ATOM 2234 N GLY A 143 -5.017 -8.981 8.555 1.00 0.00 N ATOM 2235 CA GLY A 143 -4.162 -10.135 8.860 1.00 0.00 C ATOM 2236 C GLY A 143 -2.864 -10.068 8.054 1.00 0.00 C ATOM 2237 O GLY A 143 -2.641 -9.114 7.293 1.00 0.00 O ATOM 0 H GLY A 143 -4.909 -8.213 9.217 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.935 -10.155 9.926 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.693 -11.059 8.630 1.00 0.00 H new ATOM 2241 N GLU A 144 -2.030 -11.075 8.261 1.00 0.00 N ATOM 2242 CA GLU A 144 -0.718 -11.175 7.592 1.00 0.00 C ATOM 2243 C GLU A 144 -0.843 -11.042 6.071 1.00 0.00 C ATOM 2244 O GLU A 144 -1.758 -11.593 5.454 1.00 0.00 O ATOM 2245 CB GLU A 144 -0.070 -12.523 7.939 1.00 0.00 C ATOM 2246 CG GLU A 144 1.381 -12.293 8.364 1.00 0.00 C ATOM 2247 CD GLU A 144 2.347 -13.184 7.578 1.00 0.00 C ATOM 2248 OE1 GLU A 144 2.604 -12.831 6.405 1.00 0.00 O ATOM 2249 OE2 GLU A 144 2.822 -14.186 8.175 1.00 0.00 O ATOM 0 H GLU A 144 -2.231 -11.850 8.893 1.00 0.00 H new ATOM 0 HA GLU A 144 -0.096 -10.354 7.948 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -0.623 -13.009 8.742 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -0.107 -13.190 7.077 1.00 0.00 H new ATOM 0 HG2 GLU A 144 1.644 -11.246 8.211 1.00 0.00 H new ATOM 0 HG3 GLU A 144 1.485 -12.495 9.430 1.00 0.00 H new ATOM 2256 N LEU A 145 0.009 -10.185 5.534 1.00 0.00 N ATOM 2257 CA LEU A 145 0.058 -9.923 4.091 1.00 0.00 C ATOM 2258 C LEU A 145 0.837 -11.033 3.404 1.00 0.00 C ATOM 2259 O LEU A 145 1.964 -11.354 3.783 1.00 0.00 O ATOM 2260 CB LEU A 145 0.710 -8.579 3.773 1.00 0.00 C ATOM 2261 CG LEU A 145 -0.184 -7.422 4.222 1.00 0.00 C ATOM 2262 CD1 LEU A 145 0.363 -6.795 5.504 1.00 0.00 C ATOM 2263 CD2 LEU A 145 -0.288 -6.381 3.112 1.00 0.00 C ATOM 0 H LEU A 145 0.687 -9.649 6.077 1.00 0.00 H new ATOM 0 HA LEU A 145 -0.968 -9.890 3.725 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.677 -8.512 4.271 1.00 0.00 H new ATOM 0 HB3 LEU A 145 0.898 -8.505 2.702 1.00 0.00 H new ATOM 0 HG LEU A 145 -1.183 -7.806 4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -0.283 -5.973 5.812 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.394 -7.547 6.292 1.00 0.00 H new ATOM 0 HD13 LEU A 145 1.369 -6.417 5.324 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -0.927 -5.561 3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 145 0.705 -5.997 2.879 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -0.717 -6.840 2.221 1.00 0.00 H new ATOM 2275 N LYS A 146 0.138 -11.751 2.545 1.00 0.00 N ATOM 2276 CA LYS A 146 0.769 -12.776 1.714 1.00 0.00 C ATOM 2277 C LYS A 146 1.226 -12.165 0.392 1.00 0.00 C ATOM 2278 O LYS A 146 0.501 -11.414 -0.273 1.00 0.00 O ATOM 2279 CB LYS A 146 -0.203 -13.934 1.510 1.00 0.00 C ATOM 2280 CG LYS A 146 0.387 -15.122 0.743 1.00 0.00 C ATOM 2281 CD LYS A 146 -0.071 -16.450 1.353 1.00 0.00 C ATOM 2282 CE LYS A 146 0.787 -16.877 2.546 1.00 0.00 C ATOM 2283 NZ LYS A 146 2.021 -17.519 2.053 1.00 0.00 N ATOM 0 H LYS A 146 -0.866 -11.648 2.400 1.00 0.00 H new ATOM 0 HA LYS A 146 1.655 -13.170 2.211 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -0.548 -14.280 2.484 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -1.079 -13.568 0.974 1.00 0.00 H new ATOM 0 HG2 LYS A 146 0.081 -15.073 -0.302 1.00 0.00 H new ATOM 0 HG3 LYS A 146 1.475 -15.066 0.760 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -1.110 -16.360 1.671 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -0.037 -17.227 0.589 1.00 0.00 H new ATOM 0 HE2 LYS A 146 1.034 -16.011 3.160 1.00 0.00 H new ATOM 0 HE3 LYS A 146 0.231 -17.569 3.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 2.607 -17.811 2.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 1.775 -18.354 1.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 2.552 -16.845 1.466 1.00 0.00 H new ATOM 2297 N LEU A 147 2.519 -12.373 0.165 1.00 0.00 N ATOM 2298 CA LEU A 147 3.196 -11.988 -1.078 1.00 0.00 C ATOM 2299 C LEU A 147 2.516 -12.698 -2.247 1.00 0.00 C ATOM 2300 O LEU A 147 2.514 -13.934 -2.326 1.00 0.00 O ATOM 2301 CB LEU A 147 4.677 -12.370 -0.987 1.00 0.00 C ATOM 2302 CG LEU A 147 5.430 -12.150 -2.313 1.00 0.00 C ATOM 2303 CD1 LEU A 147 5.654 -10.668 -2.615 1.00 0.00 C ATOM 2304 CD2 LEU A 147 6.751 -12.913 -2.273 1.00 0.00 C ATOM 0 H LEU A 147 3.137 -12.818 0.844 1.00 0.00 H new ATOM 0 HA LEU A 147 3.130 -10.911 -1.234 1.00 0.00 H new ATOM 0 HB2 LEU A 147 5.152 -11.782 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.761 -13.417 -0.696 1.00 0.00 H new ATOM 0 HG LEU A 147 4.813 -12.535 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU A 147 6.188 -10.566 -3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.691 -10.162 -2.686 1.00 0.00 H new ATOM 0 HD13 LEU A 147 6.242 -10.218 -1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 147 7.288 -12.761 -3.209 1.00 0.00 H new ATOM 0 HD22 LEU A 147 7.357 -12.548 -1.444 1.00 0.00 H new ATOM 0 HD23 LEU A 147 6.553 -13.976 -2.137 1.00 0.00 H new ATOM 2316 N CYS A 148 1.824 -11.883 -3.032 1.00 0.00 N ATOM 2317 CA CYS A 148 1.176 -12.323 -4.280 1.00 0.00 C ATOM 2318 C CYS A 148 2.210 -13.039 -5.160 1.00 0.00 C ATOM 2319 O CYS A 148 3.425 -12.907 -4.988 1.00 0.00 O ATOM 2320 CB CYS A 148 0.599 -11.131 -5.054 1.00 0.00 C ATOM 2321 SG CYS A 148 -0.512 -10.061 -4.064 1.00 0.00 S ATOM 0 H CYS A 148 1.690 -10.893 -2.828 1.00 0.00 H new ATOM 0 HA CYS A 148 0.359 -12.998 -4.024 1.00 0.00 H new ATOM 0 HB2 CYS A 148 1.422 -10.527 -5.436 1.00 0.00 H new ATOM 0 HB3 CYS A 148 0.050 -11.505 -5.919 1.00 0.00 H new ATOM 2326 N SER A 149 1.684 -13.813 -6.088 1.00 0.00 N ATOM 2327 CA SER A 149 2.521 -14.626 -6.978 1.00 0.00 C ATOM 2328 C SER A 149 1.958 -14.605 -8.400 1.00 0.00 C ATOM 2329 O SER A 149 0.754 -14.591 -8.629 1.00 0.00 O ATOM 2330 CB SER A 149 2.651 -16.065 -6.475 1.00 0.00 C ATOM 2331 OG SER A 149 1.359 -16.690 -6.447 1.00 0.00 O ATOM 0 H SER A 149 0.682 -13.903 -6.253 1.00 0.00 H new ATOM 0 HA SER A 149 3.520 -14.190 -6.984 1.00 0.00 H new ATOM 0 HB2 SER A 149 3.323 -16.627 -7.124 1.00 0.00 H new ATOM 0 HB3 SER A 149 3.090 -16.073 -5.478 1.00 0.00 H new ATOM 0 HG SER A 149 1.448 -17.612 -6.126 1.00 0.00 H new ATOM 2337 N HIS A 150 2.885 -14.306 -9.296 1.00 0.00 N ATOM 2338 CA HIS A 150 2.583 -14.279 -10.727 1.00 0.00 C ATOM 2339 C HIS A 150 2.884 -15.602 -11.457 1.00 0.00 C ATOM 2340 O HIS A 150 3.096 -16.608 -10.744 1.00 0.00 O ATOM 2341 CB HIS A 150 3.320 -13.088 -11.351 1.00 0.00 C ATOM 2342 CG HIS A 150 4.821 -13.088 -11.111 1.00 0.00 C ATOM 2343 ND1 HIS A 150 5.742 -13.623 -11.897 1.00 0.00 N ATOM 2344 CD2 HIS A 150 5.439 -12.430 -10.139 1.00 0.00 C ATOM 2345 CE1 HIS A 150 6.941 -13.268 -11.428 1.00 0.00 C ATOM 2346 NE2 HIS A 150 6.741 -12.538 -10.341 1.00 0.00 N ATOM 2347 OXT HIS A 150 2.972 -15.577 -12.707 1.00 0.00 O ATOM 0 H HIS A 150 3.852 -14.078 -9.063 1.00 0.00 H new ATOM 0 HA HIS A 150 1.506 -14.157 -10.846 1.00 0.00 H new ATOM 0 HB2 HIS A 150 3.135 -13.083 -12.425 1.00 0.00 H new ATOM 0 HB3 HIS A 150 2.900 -12.165 -10.951 1.00 0.00 H new ATOM 0 HD2 HIS A 150 4.963 -11.900 -9.327 1.00 0.00 H new ATOM 0 HE1 HIS A 150 7.898 -13.528 -11.856 1.00 0.00 H new ATOM 0 HE2 HIS A 150 7.470 -12.128 -9.757 1.00 0.00 H new