USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 916 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 135 THR OG1 : rot 91:sc= 2.07 USER MOD Set 1.2: A 136 ASN : amide:sc= -0.625 K(o=1.4,f=-0.074) USER MOD Set 2.1: A 91 THR OG1 : rot 139:sc= 1.5 USER MOD Set 2.2: A 112 TYR OH : rot -102:sc= 0.09 USER MOD Set 3.1: A 29 ASN : amide:sc= 0.0531 K(o=1.3,f=-4.4!) USER MOD Set 3.2: A 30 THR OG1 : rot 71:sc= 1.27 USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : A 34 THR OG1 : rot 3:sc= 0.685 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= -0.0596 USER MOD Single : A 40 GLN : amide:sc= -0.893 K(o=-0.89,f=-2.2) USER MOD Single : A 41 THR OG1 : rot 31:sc= 0.0565 USER MOD Single : A 42 TYR OH : rot 75:sc= 1.23 USER MOD Single : A 46 THR OG1 : rot 65:sc= 0.75 USER MOD Single : A 47 GLN : amide:sc= -0.379 X(o=-0.38,f=0) USER MOD Single : A 50 TYR OH : rot 170:sc= -0.0266 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -120:sc= 0.704 USER MOD Single : A 61 ASN : amide:sc= 0.902 K(o=0.9,f=0) USER MOD Single : A 64 MET CE :methyl -123:sc= -1.29 (180deg=-1.97) USER MOD Single : A 68 LYS NZ :NH3+ 177:sc= 0.803 (180deg=0.792) USER MOD Single : A 75 ASN :FLIP amide:sc=-0.00726 F(o=-0.98,f=-0.0073) USER MOD Single : A 79 LYS NZ :NH3+ -163:sc= -0.878! (180deg=-1.84!) USER MOD Single : A 81 GLN : amide:sc= -0.0755 X(o=-0.076,f=-0.38) USER MOD Single : A 82 LYS NZ :NH3+ 160:sc= 0.00357 (180deg=0) USER MOD Single : A 87 HIS : no HE2:sc= -0.628 K(o=-0.63,f=-1.5) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.791 USER MOD Single : A 97 THR OG1 : rot 79:sc= -2.49 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot 30:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 134:sc= 0.233 (180deg=-2.29!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.0273 X(o=-0.027,f=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -77:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.371 -0.912 2.709 1.00 0.00 N ATOM 2 CA ASP A 20 29.752 -2.081 2.178 1.00 0.00 C ATOM 3 C ASP A 20 28.908 -2.716 3.256 1.00 0.00 C ATOM 4 O ASP A 20 29.379 -2.941 4.391 1.00 0.00 O ATOM 5 CB ASP A 20 30.816 -3.076 1.706 1.00 0.00 C ATOM 6 CG ASP A 20 31.732 -2.502 0.654 1.00 0.00 C ATOM 7 OD1 ASP A 20 32.586 -1.662 0.993 1.00 0.00 O ATOM 8 OD2 ASP A 20 31.612 -2.874 -0.530 1.00 0.00 O ATOM 0 HA ASP A 20 29.129 -1.807 1.327 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.410 -3.398 2.561 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.325 -3.964 1.307 1.00 0.00 H new ATOM 13 N CYS A 21 27.692 -2.972 2.934 1.00 0.00 N ATOM 14 CA CYS A 21 26.750 -3.571 3.841 1.00 0.00 C ATOM 15 C CYS A 21 27.077 -5.032 3.989 1.00 0.00 C ATOM 16 O CYS A 21 27.425 -5.683 3.026 1.00 0.00 O ATOM 17 CB CYS A 21 25.338 -3.395 3.296 1.00 0.00 C ATOM 18 SG CYS A 21 24.883 -1.661 3.015 1.00 0.00 S ATOM 0 H CYS A 21 27.304 -2.770 2.013 1.00 0.00 H new ATOM 0 HA CYS A 21 26.810 -3.089 4.817 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.248 -3.943 2.358 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.629 -3.840 3.994 1.00 0.00 H new ATOM 23 N ASN A 22 27.008 -5.535 5.195 1.00 0.00 N ATOM 24 CA ASN A 22 27.322 -6.940 5.473 1.00 0.00 C ATOM 25 C ASN A 22 26.041 -7.736 5.614 1.00 0.00 C ATOM 26 O ASN A 22 26.046 -8.893 6.063 1.00 0.00 O ATOM 27 CB ASN A 22 28.162 -7.073 6.765 1.00 0.00 C ATOM 28 CG ASN A 22 29.626 -6.653 6.646 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.927 -5.714 5.794 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.484 -7.171 7.352 1.00 0.00 N flip ATOM 0 H ASN A 22 26.735 -4.997 6.018 1.00 0.00 H new ATOM 0 HA ASN A 22 27.905 -7.331 4.639 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.693 -6.474 7.545 1.00 0.00 H new ATOM 0 HB3 ASN A 22 28.126 -8.111 7.095 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.226 -7.904 8.012 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.455 -6.868 7.279 1.00 0.00 H new ATOM 37 N GLU A 23 24.962 -7.144 5.171 1.00 0.00 N ATOM 38 CA GLU A 23 23.656 -7.710 5.329 1.00 0.00 C ATOM 39 C GLU A 23 22.773 -7.348 4.151 1.00 0.00 C ATOM 40 O GLU A 23 23.021 -6.341 3.460 1.00 0.00 O ATOM 41 CB GLU A 23 23.048 -7.179 6.628 1.00 0.00 C ATOM 42 CG GLU A 23 22.952 -5.665 6.661 1.00 0.00 C ATOM 43 CD GLU A 23 22.653 -5.124 8.025 1.00 0.00 C ATOM 44 OE1 GLU A 23 23.601 -4.944 8.819 1.00 0.00 O ATOM 45 OE2 GLU A 23 21.482 -4.852 8.341 1.00 0.00 O ATOM 0 H GLU A 23 24.970 -6.247 4.686 1.00 0.00 H new ATOM 0 HA GLU A 23 23.731 -8.797 5.371 1.00 0.00 H new ATOM 0 HB2 GLU A 23 22.053 -7.604 6.757 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.651 -7.518 7.470 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.891 -5.240 6.306 1.00 0.00 H new ATOM 0 HG3 GLU A 23 22.174 -5.341 5.970 1.00 0.00 H new ATOM 52 N LEU A 24 21.787 -8.178 3.912 1.00 0.00 N ATOM 53 CA LEU A 24 20.769 -7.931 2.913 1.00 0.00 C ATOM 54 C LEU A 24 19.801 -6.887 3.413 1.00 0.00 C ATOM 55 O LEU A 24 19.577 -6.784 4.642 1.00 0.00 O ATOM 56 CB LEU A 24 20.018 -9.230 2.585 1.00 0.00 C ATOM 57 CG LEU A 24 20.705 -10.193 1.621 1.00 0.00 C ATOM 58 CD1 LEU A 24 19.871 -11.436 1.419 1.00 0.00 C ATOM 59 CD2 LEU A 24 20.919 -9.499 0.303 1.00 0.00 C ATOM 0 H LEU A 24 21.665 -9.058 4.412 1.00 0.00 H new ATOM 0 HA LEU A 24 21.249 -7.566 2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 24 19.830 -9.760 3.519 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.047 -8.965 2.167 1.00 0.00 H new ATOM 0 HG LEU A 24 21.664 -10.493 2.042 1.00 0.00 H new ATOM 0 HD11 LEU A 24 20.381 -12.108 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 24 19.729 -11.939 2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 24 18.900 -11.160 1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 24 21.410 -10.181 -0.392 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.957 -9.193 -0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.546 -8.620 0.452 1.00 0.00 H new ATOM 71 N PRO A 25 19.207 -6.092 2.494 1.00 0.00 N ATOM 72 CA PRO A 25 18.237 -5.063 2.848 1.00 0.00 C ATOM 73 C PRO A 25 17.054 -5.688 3.570 1.00 0.00 C ATOM 74 O PRO A 25 16.623 -6.806 3.223 1.00 0.00 O ATOM 75 CB PRO A 25 17.797 -4.493 1.492 1.00 0.00 C ATOM 76 CG PRO A 25 18.146 -5.552 0.518 1.00 0.00 C ATOM 77 CD PRO A 25 19.405 -6.156 1.034 1.00 0.00 C ATOM 0 HA PRO A 25 18.645 -4.302 3.513 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.729 -4.277 1.479 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.313 -3.560 1.267 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.353 -6.296 0.445 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.288 -5.138 -0.480 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.537 -7.180 0.686 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.285 -5.596 0.718 1.00 0.00 H new ATOM 85 N PRO A 26 16.518 -5.012 4.571 1.00 0.00 N ATOM 86 CA PRO A 26 15.451 -5.564 5.379 1.00 0.00 C ATOM 87 C PRO A 26 14.154 -5.670 4.598 1.00 0.00 C ATOM 88 O PRO A 26 13.873 -4.838 3.715 1.00 0.00 O ATOM 89 CB PRO A 26 15.307 -4.555 6.525 1.00 0.00 C ATOM 90 CG PRO A 26 15.800 -3.266 5.966 1.00 0.00 C ATOM 91 CD PRO A 26 16.864 -3.625 4.967 1.00 0.00 C ATOM 0 HA PRO A 26 15.672 -6.576 5.719 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.270 -4.473 6.851 1.00 0.00 H new ATOM 0 HB3 PRO A 26 15.891 -4.858 7.394 1.00 0.00 H new ATOM 0 HG2 PRO A 26 14.990 -2.712 5.491 1.00 0.00 H new ATOM 0 HG3 PRO A 26 16.203 -2.629 6.753 1.00 0.00 H new ATOM 0 HD2 PRO A 26 16.855 -2.950 4.111 1.00 0.00 H new ATOM 0 HD3 PRO A 26 17.860 -3.570 5.405 1.00 0.00 H new ATOM 99 N ARG A 27 13.391 -6.704 4.863 1.00 0.00 N ATOM 100 CA ARG A 27 12.104 -6.790 4.264 1.00 0.00 C ATOM 101 C ARG A 27 11.202 -5.838 4.996 1.00 0.00 C ATOM 102 O ARG A 27 11.291 -5.688 6.226 1.00 0.00 O ATOM 103 CB ARG A 27 11.531 -8.200 4.245 1.00 0.00 C ATOM 104 CG ARG A 27 11.336 -8.825 5.593 1.00 0.00 C ATOM 105 CD ARG A 27 10.676 -10.157 5.450 1.00 0.00 C ATOM 106 NE ARG A 27 9.302 -10.061 4.927 1.00 0.00 N ATOM 107 CZ ARG A 27 8.584 -11.099 4.492 1.00 0.00 C ATOM 108 NH1 ARG A 27 9.103 -12.321 4.519 1.00 0.00 N ATOM 109 NH2 ARG A 27 7.352 -10.910 4.024 1.00 0.00 N ATOM 0 H ARG A 27 13.642 -7.478 5.479 1.00 0.00 H new ATOM 0 HA ARG A 27 12.189 -6.518 3.212 1.00 0.00 H new ATOM 0 HB2 ARG A 27 10.571 -8.178 3.729 1.00 0.00 H new ATOM 0 HB3 ARG A 27 12.193 -8.837 3.659 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.298 -8.939 6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 27 10.727 -8.174 6.220 1.00 0.00 H new ATOM 0 HD2 ARG A 27 11.270 -10.782 4.784 1.00 0.00 H new ATOM 0 HD3 ARG A 27 10.657 -10.654 6.420 1.00 0.00 H new ATOM 0 HE ARG A 27 8.870 -9.138 4.895 1.00 0.00 H new ATOM 0 HH11 ARG A 27 10.049 -12.466 4.872 1.00 0.00 H new ATOM 0 HH12 ARG A 27 8.556 -13.115 4.187 1.00 0.00 H new ATOM 0 HH21 ARG A 27 6.955 -9.971 3.997 1.00 0.00 H new ATOM 0 HH22 ARG A 27 6.805 -11.704 3.692 1.00 0.00 H new ATOM 123 N ARG A 28 10.363 -5.208 4.278 1.00 0.00 N ATOM 124 CA ARG A 28 9.567 -4.150 4.811 1.00 0.00 C ATOM 125 C ARG A 28 8.193 -4.651 5.177 1.00 0.00 C ATOM 126 O ARG A 28 7.787 -5.733 4.749 1.00 0.00 O ATOM 127 CB ARG A 28 9.462 -3.062 3.773 1.00 0.00 C ATOM 128 CG ARG A 28 10.767 -2.359 3.430 1.00 0.00 C ATOM 129 CD ARG A 28 11.179 -1.457 4.541 1.00 0.00 C ATOM 130 NE ARG A 28 10.073 -0.572 4.886 1.00 0.00 N ATOM 131 CZ ARG A 28 9.877 -0.017 6.055 1.00 0.00 C ATOM 132 NH1 ARG A 28 10.818 -0.068 6.986 1.00 0.00 N ATOM 133 NH2 ARG A 28 8.749 0.615 6.279 1.00 0.00 N ATOM 0 H ARG A 28 10.197 -5.404 3.291 1.00 0.00 H new ATOM 0 HA ARG A 28 10.035 -3.761 5.716 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.050 -3.493 2.860 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.749 -2.316 4.124 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.547 -3.097 3.244 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.647 -1.784 2.512 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.473 -2.045 5.411 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.049 -0.871 4.244 1.00 0.00 H new ATOM 0 HE ARG A 28 9.393 -0.368 4.153 1.00 0.00 H new ATOM 0 HH11 ARG A 28 11.701 -0.542 6.794 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.660 0.366 7.895 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.040 0.668 5.547 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.581 1.053 7.185 1.00 0.00 H new ATOM 147 N ASN A 29 7.506 -3.906 5.987 1.00 0.00 N ATOM 148 CA ASN A 29 6.143 -4.234 6.367 1.00 0.00 C ATOM 149 C ASN A 29 5.189 -3.848 5.242 1.00 0.00 C ATOM 150 O ASN A 29 4.268 -4.599 4.892 1.00 0.00 O ATOM 151 CB ASN A 29 5.731 -3.534 7.702 1.00 0.00 C ATOM 152 CG ASN A 29 5.784 -1.999 7.661 1.00 0.00 C ATOM 153 OD1 ASN A 29 6.600 -1.408 6.962 1.00 0.00 O ATOM 154 ND2 ASN A 29 4.914 -1.354 8.399 1.00 0.00 N ATOM 0 H ASN A 29 7.864 -3.050 6.410 1.00 0.00 H new ATOM 0 HA ASN A 29 6.086 -5.309 6.535 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.718 -3.843 7.962 1.00 0.00 H new ATOM 0 HB3 ASN A 29 6.386 -3.886 8.499 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.904 -0.334 8.402 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.247 -1.872 8.971 1.00 0.00 H new ATOM 161 N THR A 30 5.422 -2.697 4.668 1.00 0.00 N ATOM 162 CA THR A 30 4.616 -2.199 3.596 1.00 0.00 C ATOM 163 C THR A 30 5.285 -2.359 2.235 1.00 0.00 C ATOM 164 O THR A 30 4.658 -2.142 1.214 1.00 0.00 O ATOM 165 CB THR A 30 4.211 -0.728 3.862 1.00 0.00 C ATOM 166 OG1 THR A 30 5.312 -0.013 4.470 1.00 0.00 O ATOM 167 CG2 THR A 30 2.999 -0.664 4.781 1.00 0.00 C ATOM 0 H THR A 30 6.185 -2.076 4.938 1.00 0.00 H new ATOM 0 HA THR A 30 3.711 -2.806 3.561 1.00 0.00 H new ATOM 0 HB THR A 30 3.958 -0.265 2.908 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.022 0.120 3.807 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.730 0.378 4.956 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.161 -1.182 4.315 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.237 -1.142 5.731 1.00 0.00 H new ATOM 175 N GLU A 31 6.540 -2.770 2.220 1.00 0.00 N ATOM 176 CA GLU A 31 7.240 -2.928 0.968 1.00 0.00 C ATOM 177 C GLU A 31 7.904 -4.312 0.886 1.00 0.00 C ATOM 178 O GLU A 31 8.018 -5.027 1.885 1.00 0.00 O ATOM 179 CB GLU A 31 8.289 -1.820 0.711 1.00 0.00 C ATOM 180 CG GLU A 31 7.841 -0.377 0.978 1.00 0.00 C ATOM 181 CD GLU A 31 8.186 0.116 2.378 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.621 -0.380 3.375 1.00 0.00 O ATOM 183 OE2 GLU A 31 9.067 0.983 2.511 1.00 0.00 O ATOM 0 H GLU A 31 7.086 -2.997 3.051 1.00 0.00 H new ATOM 0 HA GLU A 31 6.486 -2.838 0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.162 -2.026 1.331 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.612 -1.890 -0.328 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.306 0.281 0.244 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.763 -0.306 0.832 1.00 0.00 H new ATOM 190 N ILE A 32 8.322 -4.675 -0.298 1.00 0.00 N ATOM 191 CA ILE A 32 8.944 -5.978 -0.590 1.00 0.00 C ATOM 192 C ILE A 32 10.042 -5.708 -1.558 1.00 0.00 C ATOM 193 O ILE A 32 9.946 -4.803 -2.367 1.00 0.00 O ATOM 194 CB ILE A 32 7.906 -6.944 -1.271 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.557 -6.955 -0.514 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.466 -8.360 -1.357 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.422 -7.646 -1.255 1.00 0.00 C ATOM 0 H ILE A 32 8.246 -4.072 -1.118 1.00 0.00 H new ATOM 0 HA ILE A 32 9.301 -6.446 0.327 1.00 0.00 H new ATOM 0 HB ILE A 32 7.726 -6.570 -2.279 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.699 -7.448 0.448 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.264 -5.926 -0.305 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.733 -9.013 -1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.382 -8.354 -1.948 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.684 -8.727 -0.354 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.516 -7.606 -0.651 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.247 -7.141 -2.205 1.00 0.00 H new ATOM 0 HD13 ILE A 32 5.689 -8.686 -1.441 1.00 0.00 H new ATOM 209 N LEU A 33 11.076 -6.452 -1.452 1.00 0.00 N ATOM 210 CA LEU A 33 12.182 -6.316 -2.327 1.00 0.00 C ATOM 211 C LEU A 33 11.851 -6.792 -3.709 1.00 0.00 C ATOM 212 O LEU A 33 11.160 -7.803 -3.892 1.00 0.00 O ATOM 213 CB LEU A 33 13.347 -7.118 -1.834 1.00 0.00 C ATOM 214 CG LEU A 33 14.234 -6.543 -0.768 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.906 -5.246 -1.166 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.608 -6.456 0.577 1.00 0.00 C ATOM 0 H LEU A 33 11.183 -7.182 -0.748 1.00 0.00 H new ATOM 0 HA LEU A 33 12.432 -5.255 -2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 33 12.958 -8.066 -1.461 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.975 -7.347 -2.695 1.00 0.00 H new ATOM 0 HG LEU A 33 15.027 -7.285 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.530 -4.893 -0.345 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.526 -5.413 -2.047 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.147 -4.498 -1.393 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.321 -6.029 1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.723 -5.821 0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.320 -7.453 0.910 1.00 0.00 H new ATOM 228 N THR A 34 12.331 -6.073 -4.656 1.00 0.00 N ATOM 229 CA THR A 34 12.235 -6.467 -6.015 1.00 0.00 C ATOM 230 C THR A 34 13.610 -6.445 -6.630 1.00 0.00 C ATOM 231 O THR A 34 14.174 -5.383 -6.905 1.00 0.00 O ATOM 232 CB THR A 34 11.205 -5.651 -6.832 1.00 0.00 C ATOM 233 OG1 THR A 34 11.325 -4.239 -6.575 1.00 0.00 O ATOM 234 CG2 THR A 34 9.783 -6.116 -6.551 1.00 0.00 C ATOM 0 H THR A 34 12.808 -5.183 -4.509 1.00 0.00 H new ATOM 0 HA THR A 34 11.844 -7.484 -6.042 1.00 0.00 H new ATOM 0 HB THR A 34 11.424 -5.825 -7.885 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.072 -4.081 -5.960 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.083 -5.523 -7.140 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.684 -7.168 -6.820 1.00 0.00 H new ATOM 0 HG23 THR A 34 9.562 -5.991 -5.491 1.00 0.00 H new ATOM 242 N GLY A 35 14.170 -7.610 -6.746 1.00 0.00 N ATOM 243 CA GLY A 35 15.489 -7.783 -7.242 1.00 0.00 C ATOM 244 C GLY A 35 15.921 -9.175 -6.941 1.00 0.00 C ATOM 245 O GLY A 35 15.065 -10.030 -6.684 1.00 0.00 O ATOM 0 H GLY A 35 13.707 -8.483 -6.491 1.00 0.00 H new ATOM 0 HA2 GLY A 35 15.518 -7.600 -8.316 1.00 0.00 H new ATOM 0 HA3 GLY A 35 16.166 -7.066 -6.778 1.00 0.00 H new ATOM 249 N SER A 36 17.186 -9.424 -6.945 1.00 0.00 N ATOM 250 CA SER A 36 17.678 -10.739 -6.640 1.00 0.00 C ATOM 251 C SER A 36 18.757 -10.643 -5.584 1.00 0.00 C ATOM 252 O SER A 36 19.818 -10.053 -5.805 1.00 0.00 O ATOM 253 CB SER A 36 18.174 -11.434 -7.905 1.00 0.00 C ATOM 254 OG SER A 36 17.134 -11.516 -8.875 1.00 0.00 O ATOM 0 H SER A 36 17.908 -8.735 -7.156 1.00 0.00 H new ATOM 0 HA SER A 36 16.868 -11.349 -6.240 1.00 0.00 H new ATOM 0 HB2 SER A 36 19.021 -10.887 -8.318 1.00 0.00 H new ATOM 0 HB3 SER A 36 18.530 -12.435 -7.660 1.00 0.00 H new ATOM 0 HG SER A 36 17.471 -11.963 -9.679 1.00 0.00 H new ATOM 260 N TRP A 37 18.471 -11.192 -4.437 1.00 0.00 N ATOM 261 CA TRP A 37 19.347 -11.106 -3.307 1.00 0.00 C ATOM 262 C TRP A 37 19.748 -12.478 -2.858 1.00 0.00 C ATOM 263 O TRP A 37 18.891 -13.345 -2.670 1.00 0.00 O ATOM 264 CB TRP A 37 18.629 -10.428 -2.165 1.00 0.00 C ATOM 265 CG TRP A 37 18.115 -9.068 -2.477 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.815 -8.716 -2.584 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.882 -7.888 -2.755 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.708 -7.389 -2.860 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.964 -6.852 -2.988 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.250 -7.603 -2.820 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.363 -5.553 -3.278 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.648 -6.314 -3.111 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.706 -5.303 -3.339 1.00 0.00 C ATOM 0 H TRP A 37 17.614 -11.717 -4.260 1.00 0.00 H new ATOM 0 HA TRP A 37 20.231 -10.538 -3.595 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.793 -11.056 -1.855 1.00 0.00 H new ATOM 0 HB3 TRP A 37 19.309 -10.359 -1.316 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.981 -9.392 -2.467 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.833 -6.874 -2.957 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.982 -8.378 -2.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.639 -4.770 -3.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.701 -6.081 -3.164 1.00 0.00 H new ATOM 0 HH2 TRP A 37 20.048 -4.304 -3.568 1.00 0.00 H new ATOM 284 N SER A 38 21.027 -12.707 -2.714 1.00 0.00 N ATOM 285 CA SER A 38 21.504 -13.985 -2.235 1.00 0.00 C ATOM 286 C SER A 38 22.800 -13.831 -1.436 1.00 0.00 C ATOM 287 O SER A 38 23.414 -14.824 -1.041 1.00 0.00 O ATOM 288 CB SER A 38 21.733 -14.927 -3.424 1.00 0.00 C ATOM 289 OG SER A 38 20.541 -15.070 -4.198 1.00 0.00 O ATOM 0 H SER A 38 21.760 -12.028 -2.920 1.00 0.00 H new ATOM 0 HA SER A 38 20.748 -14.406 -1.572 1.00 0.00 H new ATOM 0 HB2 SER A 38 22.535 -14.538 -4.052 1.00 0.00 H new ATOM 0 HB3 SER A 38 22.056 -15.903 -3.063 1.00 0.00 H new ATOM 0 HG SER A 38 20.711 -15.673 -4.951 1.00 0.00 H new ATOM 295 N ASP A 39 23.209 -12.602 -1.151 1.00 0.00 N ATOM 296 CA ASP A 39 24.504 -12.417 -0.501 1.00 0.00 C ATOM 297 C ASP A 39 24.393 -11.716 0.810 1.00 0.00 C ATOM 298 O ASP A 39 23.311 -11.515 1.332 1.00 0.00 O ATOM 299 CB ASP A 39 25.524 -11.684 -1.396 1.00 0.00 C ATOM 300 CG ASP A 39 25.761 -12.344 -2.717 1.00 0.00 C ATOM 301 OD1 ASP A 39 26.514 -13.326 -2.768 1.00 0.00 O ATOM 302 OD2 ASP A 39 25.184 -11.889 -3.741 1.00 0.00 O ATOM 0 H ASP A 39 22.689 -11.747 -1.349 1.00 0.00 H new ATOM 0 HA ASP A 39 24.873 -13.427 -0.321 1.00 0.00 H new ATOM 0 HB2 ASP A 39 25.175 -10.666 -1.568 1.00 0.00 H new ATOM 0 HB3 ASP A 39 26.472 -11.610 -0.863 1.00 0.00 H new ATOM 307 N GLN A 40 25.525 -11.406 1.367 1.00 0.00 N ATOM 308 CA GLN A 40 25.592 -10.690 2.595 1.00 0.00 C ATOM 309 C GLN A 40 26.170 -9.344 2.307 1.00 0.00 C ATOM 310 O GLN A 40 25.525 -8.325 2.484 1.00 0.00 O ATOM 311 CB GLN A 40 26.488 -11.395 3.641 1.00 0.00 C ATOM 312 CG GLN A 40 26.229 -12.885 3.873 1.00 0.00 C ATOM 313 CD GLN A 40 26.705 -13.749 2.712 1.00 0.00 C ATOM 314 OE1 GLN A 40 27.652 -13.394 2.005 1.00 0.00 O ATOM 315 NE2 GLN A 40 26.065 -14.851 2.499 1.00 0.00 N ATOM 0 H GLN A 40 26.435 -11.648 0.974 1.00 0.00 H new ATOM 0 HA GLN A 40 24.586 -10.627 3.011 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.527 -11.273 3.336 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.372 -10.877 4.593 1.00 0.00 H new ATOM 0 HG2 GLN A 40 26.734 -13.200 4.786 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.162 -13.045 4.027 1.00 0.00 H new ATOM 0 HE21 GLN A 40 25.287 -15.114 3.104 1.00 0.00 H new ATOM 0 HE22 GLN A 40 26.338 -15.458 1.726 1.00 0.00 H new ATOM 324 N THR A 41 27.372 -9.349 1.815 1.00 0.00 N ATOM 325 CA THR A 41 28.077 -8.153 1.591 1.00 0.00 C ATOM 326 C THR A 41 27.761 -7.536 0.239 1.00 0.00 C ATOM 327 O THR A 41 27.891 -8.182 -0.811 1.00 0.00 O ATOM 328 CB THR A 41 29.572 -8.394 1.776 1.00 0.00 C ATOM 329 OG1 THR A 41 29.990 -9.496 0.946 1.00 0.00 O ATOM 330 CG2 THR A 41 29.853 -8.735 3.232 1.00 0.00 C ATOM 0 H THR A 41 27.882 -10.195 1.561 1.00 0.00 H new ATOM 0 HA THR A 41 27.749 -7.422 2.330 1.00 0.00 H new ATOM 0 HB THR A 41 30.119 -7.494 1.495 1.00 0.00 H new ATOM 0 HG1 THR A 41 29.432 -9.529 0.141 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.921 -8.908 3.366 1.00 0.00 H new ATOM 0 HG22 THR A 41 29.537 -7.907 3.867 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.303 -9.635 3.508 1.00 0.00 H new ATOM 338 N TYR A 42 27.302 -6.317 0.281 1.00 0.00 N ATOM 339 CA TYR A 42 27.006 -5.558 -0.896 1.00 0.00 C ATOM 340 C TYR A 42 27.713 -4.235 -0.853 1.00 0.00 C ATOM 341 O TYR A 42 27.747 -3.583 0.187 1.00 0.00 O ATOM 342 CB TYR A 42 25.498 -5.392 -1.128 1.00 0.00 C ATOM 343 CG TYR A 42 24.859 -6.651 -1.646 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.883 -6.943 -3.003 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.264 -7.555 -0.793 1.00 0.00 C ATOM 346 CE1 TYR A 42 24.331 -8.103 -3.493 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.706 -8.714 -1.274 1.00 0.00 C ATOM 348 CZ TYR A 42 23.739 -8.991 -2.618 1.00 0.00 C ATOM 349 OH TYR A 42 23.173 -10.173 -3.087 1.00 0.00 O ATOM 0 H TYR A 42 27.121 -5.816 1.151 1.00 0.00 H new ATOM 0 HA TYR A 42 27.379 -6.120 -1.752 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.018 -5.102 -0.193 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.329 -4.582 -1.838 1.00 0.00 H new ATOM 0 HD1 TYR A 42 25.344 -6.246 -3.687 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.236 -7.350 0.267 1.00 0.00 H new ATOM 0 HE1 TYR A 42 24.360 -8.317 -4.551 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.240 -9.410 -0.592 1.00 0.00 H new ATOM 0 HH TYR A 42 23.884 -10.809 -3.313 1.00 0.00 H new ATOM 359 N PRO A 43 28.307 -3.843 -1.980 1.00 0.00 N ATOM 360 CA PRO A 43 29.102 -2.622 -2.086 1.00 0.00 C ATOM 361 C PRO A 43 28.312 -1.350 -1.775 1.00 0.00 C ATOM 362 O PRO A 43 27.101 -1.256 -2.068 1.00 0.00 O ATOM 363 CB PRO A 43 29.583 -2.616 -3.547 1.00 0.00 C ATOM 364 CG PRO A 43 28.698 -3.582 -4.262 1.00 0.00 C ATOM 365 CD PRO A 43 28.256 -4.582 -3.247 1.00 0.00 C ATOM 0 HA PRO A 43 29.912 -2.622 -1.356 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.507 -1.619 -3.981 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.629 -2.916 -3.617 1.00 0.00 H new ATOM 0 HG2 PRO A 43 27.842 -3.071 -4.702 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.233 -4.068 -5.078 1.00 0.00 H new ATOM 0 HD2 PRO A 43 27.251 -4.947 -3.457 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.913 -5.451 -3.230 1.00 0.00 H new ATOM 373 N GLU A 44 28.989 -0.394 -1.179 1.00 0.00 N ATOM 374 CA GLU A 44 28.412 0.887 -0.849 1.00 0.00 C ATOM 375 C GLU A 44 28.006 1.579 -2.152 1.00 0.00 C ATOM 376 O GLU A 44 28.845 1.822 -3.019 1.00 0.00 O ATOM 377 CB GLU A 44 29.437 1.755 -0.121 1.00 0.00 C ATOM 378 CG GLU A 44 28.828 2.991 0.504 1.00 0.00 C ATOM 379 CD GLU A 44 29.830 4.069 0.833 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.267 4.795 -0.095 1.00 0.00 O ATOM 381 OE2 GLU A 44 30.138 4.260 2.016 1.00 0.00 O ATOM 0 H GLU A 44 29.968 -0.487 -0.907 1.00 0.00 H new ATOM 0 HA GLU A 44 27.547 0.744 -0.201 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.920 1.162 0.656 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.215 2.055 -0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.081 3.399 -0.177 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.305 2.704 1.417 1.00 0.00 H new ATOM 388 N GLY A 45 26.752 1.884 -2.288 1.00 0.00 N ATOM 389 CA GLY A 45 26.263 2.447 -3.515 1.00 0.00 C ATOM 390 C GLY A 45 25.373 1.474 -4.241 1.00 0.00 C ATOM 391 O GLY A 45 25.078 1.643 -5.423 1.00 0.00 O ATOM 0 H GLY A 45 26.045 1.753 -1.565 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.710 3.362 -3.304 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.103 2.722 -4.153 1.00 0.00 H new ATOM 395 N THR A 46 24.979 0.425 -3.552 1.00 0.00 N ATOM 396 CA THR A 46 24.062 -0.535 -4.131 1.00 0.00 C ATOM 397 C THR A 46 22.625 -0.198 -3.804 1.00 0.00 C ATOM 398 O THR A 46 22.229 -0.244 -2.653 1.00 0.00 O ATOM 399 CB THR A 46 24.402 -1.977 -3.724 1.00 0.00 C ATOM 400 OG1 THR A 46 25.748 -2.264 -4.099 1.00 0.00 O ATOM 401 CG2 THR A 46 23.460 -2.990 -4.366 1.00 0.00 C ATOM 0 H THR A 46 25.275 0.215 -2.599 1.00 0.00 H new ATOM 0 HA THR A 46 24.180 -0.470 -5.213 1.00 0.00 H new ATOM 0 HB THR A 46 24.283 -2.060 -2.644 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.359 -1.698 -3.583 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.737 -3.996 -4.050 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.436 -2.782 -4.056 1.00 0.00 H new ATOM 0 HG23 THR A 46 23.532 -2.917 -5.451 1.00 0.00 H new ATOM 409 N GLN A 47 21.869 0.162 -4.823 1.00 0.00 N ATOM 410 CA GLN A 47 20.491 0.550 -4.655 1.00 0.00 C ATOM 411 C GLN A 47 19.565 -0.671 -4.669 1.00 0.00 C ATOM 412 O GLN A 47 19.865 -1.690 -5.290 1.00 0.00 O ATOM 413 CB GLN A 47 20.102 1.599 -5.712 1.00 0.00 C ATOM 414 CG GLN A 47 20.127 1.089 -7.148 1.00 0.00 C ATOM 415 CD GLN A 47 20.108 2.206 -8.185 1.00 0.00 C ATOM 416 OE1 GLN A 47 20.661 2.061 -9.279 1.00 0.00 O ATOM 417 NE2 GLN A 47 19.498 3.314 -7.868 1.00 0.00 N ATOM 0 H GLN A 47 22.197 0.192 -5.788 1.00 0.00 H new ATOM 0 HA GLN A 47 20.372 1.013 -3.676 1.00 0.00 H new ATOM 0 HB2 GLN A 47 19.101 1.968 -5.488 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.780 2.448 -5.630 1.00 0.00 H new ATOM 0 HG2 GLN A 47 21.020 0.481 -7.295 1.00 0.00 H new ATOM 0 HG3 GLN A 47 19.268 0.438 -7.310 1.00 0.00 H new ATOM 0 HE21 GLN A 47 19.049 3.406 -6.957 1.00 0.00 H new ATOM 0 HE22 GLN A 47 19.470 4.088 -8.531 1.00 0.00 H new ATOM 426 N ALA A 48 18.485 -0.567 -3.948 1.00 0.00 N ATOM 427 CA ALA A 48 17.502 -1.616 -3.820 1.00 0.00 C ATOM 428 C ALA A 48 16.139 -1.061 -4.175 1.00 0.00 C ATOM 429 O ALA A 48 15.773 0.032 -3.724 1.00 0.00 O ATOM 430 CB ALA A 48 17.488 -2.148 -2.396 1.00 0.00 C ATOM 0 H ALA A 48 18.253 0.272 -3.416 1.00 0.00 H new ATOM 0 HA ALA A 48 17.753 -2.434 -4.495 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.743 -2.939 -2.310 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.471 -2.547 -2.147 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.240 -1.340 -1.708 1.00 0.00 H new ATOM 436 N ILE A 49 15.406 -1.787 -4.977 1.00 0.00 N ATOM 437 CA ILE A 49 14.101 -1.354 -5.424 1.00 0.00 C ATOM 438 C ILE A 49 13.031 -2.095 -4.640 1.00 0.00 C ATOM 439 O ILE A 49 13.077 -3.335 -4.525 1.00 0.00 O ATOM 440 CB ILE A 49 13.924 -1.639 -6.934 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.070 -0.992 -7.718 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.577 -1.101 -7.425 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.097 -1.356 -9.182 1.00 0.00 C ATOM 0 H ILE A 49 15.693 -2.696 -5.341 1.00 0.00 H new ATOM 0 HA ILE A 49 14.008 -0.281 -5.257 1.00 0.00 H new ATOM 0 HB ILE A 49 13.943 -2.717 -7.096 1.00 0.00 H new ATOM 0 HG12 ILE A 49 14.993 0.091 -7.625 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.017 -1.284 -7.264 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.468 -1.310 -8.489 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.770 -1.585 -6.876 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.533 -0.024 -7.260 1.00 0.00 H new ATOM 0 HD11 ILE A 49 15.937 -0.858 -9.665 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.206 -2.435 -9.287 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.167 -1.038 -9.653 1.00 0.00 H new ATOM 455 N TYR A 50 12.103 -1.365 -4.087 1.00 0.00 N ATOM 456 CA TYR A 50 11.035 -1.947 -3.323 1.00 0.00 C ATOM 457 C TYR A 50 9.675 -1.824 -4.003 1.00 0.00 C ATOM 458 O TYR A 50 9.325 -0.781 -4.574 1.00 0.00 O ATOM 459 CB TYR A 50 10.963 -1.342 -1.925 1.00 0.00 C ATOM 460 CG TYR A 50 12.034 -1.795 -0.966 1.00 0.00 C ATOM 461 CD1 TYR A 50 13.270 -1.170 -0.912 1.00 0.00 C ATOM 462 CD2 TYR A 50 11.791 -2.836 -0.085 1.00 0.00 C ATOM 463 CE1 TYR A 50 14.227 -1.575 -0.011 1.00 0.00 C ATOM 464 CE2 TYR A 50 12.737 -3.232 0.822 1.00 0.00 C ATOM 465 CZ TYR A 50 13.952 -2.601 0.859 1.00 0.00 C ATOM 466 OH TYR A 50 14.895 -3.000 1.772 1.00 0.00 O ATOM 0 H TYR A 50 12.066 -0.348 -4.153 1.00 0.00 H new ATOM 0 HA TYR A 50 11.270 -3.009 -3.250 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.015 -0.257 -2.015 1.00 0.00 H new ATOM 0 HB3 TYR A 50 9.990 -1.580 -1.495 1.00 0.00 H new ATOM 0 HD1 TYR A 50 13.484 -0.354 -1.586 1.00 0.00 H new ATOM 0 HD2 TYR A 50 10.838 -3.344 -0.114 1.00 0.00 H new ATOM 0 HE1 TYR A 50 15.191 -1.088 0.012 1.00 0.00 H new ATOM 0 HE2 TYR A 50 12.526 -4.040 1.507 1.00 0.00 H new ATOM 0 HH TYR A 50 14.490 -3.624 2.409 1.00 0.00 H new ATOM 476 N LYS A 51 8.944 -2.907 -3.938 1.00 0.00 N ATOM 477 CA LYS A 51 7.571 -3.006 -4.365 1.00 0.00 C ATOM 478 C LYS A 51 6.735 -2.542 -3.208 1.00 0.00 C ATOM 479 O LYS A 51 6.868 -3.066 -2.113 1.00 0.00 O ATOM 480 CB LYS A 51 7.248 -4.486 -4.697 1.00 0.00 C ATOM 481 CG LYS A 51 5.770 -4.846 -4.930 1.00 0.00 C ATOM 482 CD LYS A 51 5.153 -4.081 -6.082 1.00 0.00 C ATOM 483 CE LYS A 51 3.743 -4.562 -6.372 1.00 0.00 C ATOM 484 NZ LYS A 51 3.147 -3.894 -7.554 1.00 0.00 N ATOM 0 H LYS A 51 9.307 -3.786 -3.568 1.00 0.00 H new ATOM 0 HA LYS A 51 7.376 -2.406 -5.253 1.00 0.00 H new ATOM 0 HB2 LYS A 51 7.808 -4.762 -5.590 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.622 -5.105 -3.882 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.688 -5.915 -5.125 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.204 -4.643 -4.021 1.00 0.00 H new ATOM 0 HD2 LYS A 51 5.135 -3.017 -5.846 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.770 -4.200 -6.972 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.757 -5.639 -6.536 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.114 -4.380 -5.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.185 -4.257 -7.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.107 -2.868 -7.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 3.730 -4.088 -8.393 1.00 0.00 H new ATOM 498 N CYS A 52 5.879 -1.605 -3.448 1.00 0.00 N ATOM 499 CA CYS A 52 5.058 -1.005 -2.402 1.00 0.00 C ATOM 500 C CYS A 52 3.880 -1.875 -1.979 1.00 0.00 C ATOM 501 O CYS A 52 3.033 -1.415 -1.268 1.00 0.00 O ATOM 502 CB CYS A 52 4.523 0.318 -2.899 1.00 0.00 C ATOM 503 SG CYS A 52 5.780 1.615 -3.122 1.00 0.00 S ATOM 0 H CYS A 52 5.714 -1.218 -4.377 1.00 0.00 H new ATOM 0 HA CYS A 52 5.699 -0.884 -1.529 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.017 0.155 -3.851 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.772 0.677 -2.196 1.00 0.00 H new ATOM 508 N ARG A 53 3.885 -3.142 -2.378 1.00 0.00 N ATOM 509 CA ARG A 53 2.742 -4.065 -2.185 1.00 0.00 C ATOM 510 C ARG A 53 1.554 -3.666 -3.086 1.00 0.00 C ATOM 511 O ARG A 53 1.376 -2.486 -3.444 1.00 0.00 O ATOM 512 CB ARG A 53 2.241 -4.160 -0.707 1.00 0.00 C ATOM 513 CG ARG A 53 3.067 -4.982 0.258 1.00 0.00 C ATOM 514 CD ARG A 53 2.438 -4.930 1.657 1.00 0.00 C ATOM 515 NE ARG A 53 1.001 -5.320 1.646 1.00 0.00 N ATOM 516 CZ ARG A 53 0.102 -5.075 2.631 1.00 0.00 C ATOM 517 NH1 ARG A 53 0.489 -4.517 3.778 1.00 0.00 N ATOM 518 NH2 ARG A 53 -1.181 -5.389 2.450 1.00 0.00 N ATOM 0 H ARG A 53 4.681 -3.573 -2.849 1.00 0.00 H new ATOM 0 HA ARG A 53 3.124 -5.048 -2.462 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.169 -3.147 -0.310 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.231 -4.570 -0.720 1.00 0.00 H new ATOM 0 HG2 ARG A 53 3.125 -6.015 -0.087 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.087 -4.601 0.294 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.987 -5.594 2.325 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.535 -3.922 2.059 1.00 0.00 H new ATOM 0 HE ARG A 53 0.662 -5.817 0.822 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.469 -4.271 3.920 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -0.194 -4.336 4.513 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -1.484 -5.812 1.573 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -1.860 -5.206 3.189 1.00 0.00 H new ATOM 532 N PRO A 54 0.748 -4.636 -3.499 1.00 0.00 N ATOM 533 CA PRO A 54 -0.446 -4.358 -4.260 1.00 0.00 C ATOM 534 C PRO A 54 -1.481 -3.671 -3.371 1.00 0.00 C ATOM 535 O PRO A 54 -1.875 -4.195 -2.329 1.00 0.00 O ATOM 536 CB PRO A 54 -0.928 -5.735 -4.719 1.00 0.00 C ATOM 537 CG PRO A 54 -0.336 -6.701 -3.758 1.00 0.00 C ATOM 538 CD PRO A 54 0.932 -6.079 -3.252 1.00 0.00 C ATOM 0 HA PRO A 54 -0.274 -3.688 -5.103 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -2.016 -5.792 -4.713 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.603 -5.945 -5.738 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -1.024 -6.901 -2.937 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -0.133 -7.655 -4.244 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.083 -6.286 -2.192 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.804 -6.466 -3.779 1.00 0.00 H new ATOM 546 N GLY A 55 -1.876 -2.492 -3.753 1.00 0.00 N ATOM 547 CA GLY A 55 -2.812 -1.741 -2.954 1.00 0.00 C ATOM 548 C GLY A 55 -2.180 -0.472 -2.472 1.00 0.00 C ATOM 549 O GLY A 55 -2.843 0.432 -1.979 1.00 0.00 O ATOM 0 H GLY A 55 -1.569 -2.028 -4.608 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.701 -1.512 -3.541 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.137 -2.340 -2.103 1.00 0.00 H new ATOM 553 N TYR A 56 -0.898 -0.405 -2.594 1.00 0.00 N ATOM 554 CA TYR A 56 -0.190 0.793 -2.278 1.00 0.00 C ATOM 555 C TYR A 56 0.431 1.320 -3.551 1.00 0.00 C ATOM 556 O TYR A 56 0.536 0.595 -4.554 1.00 0.00 O ATOM 557 CB TYR A 56 0.899 0.567 -1.236 1.00 0.00 C ATOM 558 CG TYR A 56 0.455 0.016 0.111 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.245 -1.343 0.288 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.293 0.847 1.208 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.119 -1.857 1.511 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.062 0.336 2.443 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.269 -1.018 2.585 1.00 0.00 C ATOM 564 OH TYR A 56 -0.603 -1.542 3.818 1.00 0.00 O ATOM 0 H TYR A 56 -0.311 -1.175 -2.914 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.894 1.508 -1.853 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.635 -0.117 -1.657 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.407 1.516 -1.064 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.370 -2.011 -0.551 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.446 1.910 1.097 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.286 -2.918 1.625 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.176 0.995 3.291 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.670 -0.817 4.474 1.00 0.00 H new ATOM 574 N ARG A 57 0.824 2.544 -3.520 1.00 0.00 N ATOM 575 CA ARG A 57 1.423 3.203 -4.640 1.00 0.00 C ATOM 576 C ARG A 57 2.362 4.256 -4.129 1.00 0.00 C ATOM 577 O ARG A 57 2.498 4.434 -2.911 1.00 0.00 O ATOM 578 CB ARG A 57 0.358 3.868 -5.510 1.00 0.00 C ATOM 579 CG ARG A 57 -0.511 4.864 -4.756 1.00 0.00 C ATOM 580 CD ARG A 57 -1.421 5.632 -5.684 1.00 0.00 C ATOM 581 NE ARG A 57 -2.300 4.772 -6.472 1.00 0.00 N ATOM 582 CZ ARG A 57 -3.326 5.206 -7.211 1.00 0.00 C ATOM 583 NH1 ARG A 57 -3.648 6.510 -7.228 1.00 0.00 N ATOM 584 NH2 ARG A 57 -4.030 4.335 -7.917 1.00 0.00 N ATOM 0 H ARG A 57 0.738 3.137 -2.694 1.00 0.00 H new ATOM 0 HA ARG A 57 1.956 2.467 -5.242 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.846 4.380 -6.339 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.280 3.097 -5.942 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.111 4.335 -4.015 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.125 5.562 -4.212 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.029 6.321 -5.098 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.815 6.236 -6.359 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.118 3.768 -6.457 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.108 7.176 -6.675 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.432 6.834 -7.794 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.787 3.345 -7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.815 4.654 -8.485 1.00 0.00 H new ATOM 598 N SER A 58 2.978 4.957 -5.033 1.00 0.00 N ATOM 599 CA SER A 58 3.870 6.013 -4.709 1.00 0.00 C ATOM 600 C SER A 58 4.207 6.771 -5.970 1.00 0.00 C ATOM 601 O SER A 58 3.996 6.262 -7.086 1.00 0.00 O ATOM 602 CB SER A 58 5.127 5.441 -4.070 1.00 0.00 C ATOM 603 OG SER A 58 5.728 4.449 -4.891 1.00 0.00 O ATOM 0 H SER A 58 2.868 4.802 -6.035 1.00 0.00 H new ATOM 0 HA SER A 58 3.405 6.695 -3.998 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.841 6.244 -3.888 1.00 0.00 H new ATOM 0 HB3 SER A 58 4.879 5.010 -3.100 1.00 0.00 H new ATOM 0 HG SER A 58 5.763 3.599 -4.404 1.00 0.00 H new ATOM 609 N LEU A 59 4.705 7.972 -5.817 1.00 0.00 N ATOM 610 CA LEU A 59 5.117 8.772 -6.955 1.00 0.00 C ATOM 611 C LEU A 59 6.482 8.301 -7.455 1.00 0.00 C ATOM 612 O LEU A 59 6.929 8.662 -8.539 1.00 0.00 O ATOM 613 CB LEU A 59 5.139 10.243 -6.570 1.00 0.00 C ATOM 614 CG LEU A 59 3.787 10.839 -6.157 1.00 0.00 C ATOM 615 CD1 LEU A 59 3.951 12.280 -5.733 1.00 0.00 C ATOM 616 CD2 LEU A 59 2.773 10.730 -7.291 1.00 0.00 C ATOM 0 H LEU A 59 4.838 8.424 -4.912 1.00 0.00 H new ATOM 0 HA LEU A 59 4.402 8.649 -7.769 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.841 10.374 -5.746 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.526 10.815 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 59 3.411 10.267 -5.309 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.982 12.687 -5.443 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.635 12.334 -4.886 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.354 12.860 -6.563 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.823 11.160 -6.972 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.142 11.271 -8.162 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.628 9.681 -7.550 1.00 0.00 H new ATOM 628 N GLY A 60 7.122 7.506 -6.634 1.00 0.00 N ATOM 629 CA GLY A 60 8.363 6.871 -6.953 1.00 0.00 C ATOM 630 C GLY A 60 8.560 5.743 -5.987 1.00 0.00 C ATOM 631 O GLY A 60 8.134 5.859 -4.833 1.00 0.00 O ATOM 0 H GLY A 60 6.779 7.281 -5.700 1.00 0.00 H new ATOM 0 HA2 GLY A 60 8.350 6.499 -7.977 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.186 7.583 -6.883 1.00 0.00 H new ATOM 635 N ASN A 61 9.139 4.657 -6.430 1.00 0.00 N ATOM 636 CA ASN A 61 9.347 3.487 -5.571 1.00 0.00 C ATOM 637 C ASN A 61 10.323 3.791 -4.465 1.00 0.00 C ATOM 638 O ASN A 61 11.151 4.711 -4.588 1.00 0.00 O ATOM 639 CB ASN A 61 9.847 2.273 -6.381 1.00 0.00 C ATOM 640 CG ASN A 61 8.765 1.632 -7.224 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.525 2.032 -8.362 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.140 0.609 -6.705 1.00 0.00 N ATOM 0 H ASN A 61 9.482 4.544 -7.384 1.00 0.00 H new ATOM 0 HA ASN A 61 8.380 3.239 -5.133 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.664 2.589 -7.029 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.253 1.529 -5.695 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.429 0.117 -7.247 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.363 0.302 -5.758 1.00 0.00 H new ATOM 649 N VAL A 62 10.216 3.063 -3.376 1.00 0.00 N ATOM 650 CA VAL A 62 11.163 3.202 -2.307 1.00 0.00 C ATOM 651 C VAL A 62 12.474 2.608 -2.756 1.00 0.00 C ATOM 652 O VAL A 62 12.623 1.389 -2.875 1.00 0.00 O ATOM 653 CB VAL A 62 10.685 2.540 -0.989 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.775 2.585 0.077 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.455 3.251 -0.479 1.00 0.00 C ATOM 0 H VAL A 62 9.483 2.372 -3.213 1.00 0.00 H new ATOM 0 HA VAL A 62 11.277 4.263 -2.084 1.00 0.00 H new ATOM 0 HB VAL A 62 10.451 1.496 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.411 2.114 0.990 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.656 2.052 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 62 12.038 3.622 0.285 1.00 0.00 H new ATOM 0 HG21 VAL A 62 9.122 2.783 0.447 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.692 4.298 -0.292 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.662 3.186 -1.224 1.00 0.00 H new ATOM 665 N ILE A 63 13.363 3.469 -3.116 1.00 0.00 N ATOM 666 CA ILE A 63 14.652 3.070 -3.531 1.00 0.00 C ATOM 667 C ILE A 63 15.582 3.270 -2.379 1.00 0.00 C ATOM 668 O ILE A 63 15.721 4.389 -1.858 1.00 0.00 O ATOM 669 CB ILE A 63 15.141 3.874 -4.773 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.135 3.737 -5.929 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.536 3.415 -5.220 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.890 2.315 -6.383 1.00 0.00 C ATOM 0 H ILE A 63 13.208 4.477 -3.129 1.00 0.00 H new ATOM 0 HA ILE A 63 14.626 2.023 -3.832 1.00 0.00 H new ATOM 0 HB ILE A 63 15.209 4.924 -4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.186 4.175 -5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 63 14.495 4.319 -6.778 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.849 3.995 -6.088 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.247 3.566 -4.407 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.504 2.357 -5.482 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.169 2.313 -7.200 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.827 1.876 -6.725 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.498 1.730 -5.551 1.00 0.00 H new ATOM 684 N MET A 64 16.157 2.212 -1.935 1.00 0.00 N ATOM 685 CA MET A 64 17.114 2.275 -0.868 1.00 0.00 C ATOM 686 C MET A 64 18.465 2.043 -1.431 1.00 0.00 C ATOM 687 O MET A 64 18.583 1.731 -2.600 1.00 0.00 O ATOM 688 CB MET A 64 16.795 1.298 0.267 1.00 0.00 C ATOM 689 CG MET A 64 15.575 1.710 1.076 1.00 0.00 C ATOM 690 SD MET A 64 15.184 0.601 2.449 1.00 0.00 S ATOM 691 CE MET A 64 16.684 0.709 3.421 1.00 0.00 C ATOM 0 H MET A 64 15.984 1.273 -2.295 1.00 0.00 H new ATOM 0 HA MET A 64 17.071 3.266 -0.416 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.629 0.305 -0.151 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.657 1.225 0.930 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.736 2.714 1.470 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.713 1.763 0.411 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.105 -0.288 3.552 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.406 1.344 2.907 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.455 1.137 4.397 1.00 0.00 H new ATOM 701 N VAL A 65 19.469 2.227 -0.658 1.00 0.00 N ATOM 702 CA VAL A 65 20.805 2.021 -1.131 1.00 0.00 C ATOM 703 C VAL A 65 21.723 1.722 0.042 1.00 0.00 C ATOM 704 O VAL A 65 21.484 2.170 1.169 1.00 0.00 O ATOM 705 CB VAL A 65 21.331 3.247 -1.980 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.619 4.421 -1.140 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.551 2.932 -2.800 1.00 0.00 C ATOM 0 H VAL A 65 19.400 2.523 0.316 1.00 0.00 H new ATOM 0 HA VAL A 65 20.800 1.163 -1.803 1.00 0.00 H new ATOM 0 HB VAL A 65 20.512 3.474 -2.662 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.977 5.238 -1.767 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.710 4.731 -0.624 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.383 4.165 -0.406 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.855 3.819 -3.356 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.362 2.621 -2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.322 2.127 -3.499 1.00 0.00 H new ATOM 717 N CYS A 66 22.682 0.907 -0.215 1.00 0.00 N ATOM 718 CA CYS A 66 23.688 0.551 0.734 1.00 0.00 C ATOM 719 C CYS A 66 24.648 1.708 0.884 1.00 0.00 C ATOM 720 O CYS A 66 25.226 2.152 -0.111 1.00 0.00 O ATOM 721 CB CYS A 66 24.437 -0.661 0.210 1.00 0.00 C ATOM 722 SG CYS A 66 25.792 -1.207 1.261 1.00 0.00 S ATOM 0 H CYS A 66 22.797 0.452 -1.120 1.00 0.00 H new ATOM 0 HA CYS A 66 23.238 0.321 1.700 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.733 -1.484 0.089 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.831 -0.430 -0.780 1.00 0.00 H new ATOM 727 N ARG A 67 24.807 2.211 2.081 1.00 0.00 N ATOM 728 CA ARG A 67 25.701 3.307 2.323 1.00 0.00 C ATOM 729 C ARG A 67 26.210 3.291 3.757 1.00 0.00 C ATOM 730 O ARG A 67 25.434 3.226 4.698 1.00 0.00 O ATOM 731 CB ARG A 67 25.035 4.644 1.948 1.00 0.00 C ATOM 732 CG ARG A 67 25.848 5.881 2.280 1.00 0.00 C ATOM 733 CD ARG A 67 25.242 7.124 1.658 1.00 0.00 C ATOM 734 NE ARG A 67 25.437 7.164 0.206 1.00 0.00 N ATOM 735 CZ ARG A 67 24.559 7.641 -0.685 1.00 0.00 C ATOM 736 NH1 ARG A 67 23.315 7.952 -0.317 1.00 0.00 N ATOM 737 NH2 ARG A 67 24.923 7.783 -1.951 1.00 0.00 N ATOM 0 H ARG A 67 24.321 1.872 2.911 1.00 0.00 H new ATOM 0 HA ARG A 67 26.574 3.193 1.681 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.826 4.641 0.878 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.075 4.710 2.460 1.00 0.00 H new ATOM 0 HG2 ARG A 67 25.902 6.003 3.362 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.870 5.754 1.922 1.00 0.00 H new ATOM 0 HD2 ARG A 67 24.176 7.158 1.881 1.00 0.00 H new ATOM 0 HD3 ARG A 67 25.690 8.010 2.108 1.00 0.00 H new ATOM 0 HE ARG A 67 26.317 6.797 -0.157 1.00 0.00 H new ATOM 0 HH11 ARG A 67 23.024 7.827 0.653 1.00 0.00 H new ATOM 0 HH12 ARG A 67 22.655 8.315 -1.005 1.00 0.00 H new ATOM 0 HH21 ARG A 67 25.867 7.529 -2.242 1.00 0.00 H new ATOM 0 HH22 ARG A 67 24.259 8.146 -2.635 1.00 0.00 H new ATOM 751 N LYS A 68 27.541 3.286 3.898 1.00 0.00 N ATOM 752 CA LYS A 68 28.256 3.304 5.198 1.00 0.00 C ATOM 753 C LYS A 68 28.082 2.014 5.974 1.00 0.00 C ATOM 754 O LYS A 68 28.484 1.898 7.136 1.00 0.00 O ATOM 755 CB LYS A 68 27.897 4.526 6.041 1.00 0.00 C ATOM 756 CG LYS A 68 28.120 5.836 5.287 1.00 0.00 C ATOM 757 CD LYS A 68 29.517 5.912 4.676 1.00 0.00 C ATOM 758 CE LYS A 68 29.625 7.040 3.669 1.00 0.00 C ATOM 759 NZ LYS A 68 30.853 6.912 2.857 1.00 0.00 N ATOM 0 H LYS A 68 28.173 3.269 3.098 1.00 0.00 H new ATOM 0 HA LYS A 68 29.316 3.385 4.959 1.00 0.00 H new ATOM 0 HB2 LYS A 68 26.853 4.459 6.348 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.497 4.526 6.951 1.00 0.00 H new ATOM 0 HG2 LYS A 68 27.374 5.932 4.499 1.00 0.00 H new ATOM 0 HG3 LYS A 68 27.975 6.675 5.967 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.253 6.058 5.467 1.00 0.00 H new ATOM 0 HD3 LYS A 68 29.754 4.966 4.190 1.00 0.00 H new ATOM 0 HE2 LYS A 68 28.752 7.034 3.017 1.00 0.00 H new ATOM 0 HE3 LYS A 68 29.628 7.998 4.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 30.877 7.667 2.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 31.687 6.992 3.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 30.861 5.986 2.383 1.00 0.00 H new ATOM 773 N GLY A 69 27.557 1.034 5.312 1.00 0.00 N ATOM 774 CA GLY A 69 27.364 -0.247 5.910 1.00 0.00 C ATOM 775 C GLY A 69 25.928 -0.512 6.235 1.00 0.00 C ATOM 776 O GLY A 69 25.557 -1.652 6.540 1.00 0.00 O ATOM 0 H GLY A 69 27.250 1.099 4.342 1.00 0.00 H new ATOM 0 HA2 GLY A 69 27.730 -1.020 5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 69 27.959 -0.313 6.821 1.00 0.00 H new ATOM 780 N GLU A 70 25.112 0.512 6.179 1.00 0.00 N ATOM 781 CA GLU A 70 23.713 0.340 6.447 1.00 0.00 C ATOM 782 C GLU A 70 22.894 0.615 5.202 1.00 0.00 C ATOM 783 O GLU A 70 23.360 1.268 4.261 1.00 0.00 O ATOM 784 CB GLU A 70 23.251 1.208 7.632 1.00 0.00 C ATOM 785 CG GLU A 70 23.586 2.686 7.505 1.00 0.00 C ATOM 786 CD GLU A 70 23.079 3.504 8.668 1.00 0.00 C ATOM 787 OE1 GLU A 70 23.378 3.166 9.824 1.00 0.00 O ATOM 788 OE2 GLU A 70 22.412 4.535 8.450 1.00 0.00 O ATOM 0 H GLU A 70 25.394 1.466 5.952 1.00 0.00 H new ATOM 0 HA GLU A 70 23.551 -0.699 6.734 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.172 1.102 7.743 1.00 0.00 H new ATOM 0 HB3 GLU A 70 23.705 0.824 8.545 1.00 0.00 H new ATOM 0 HG2 GLU A 70 24.667 2.803 7.428 1.00 0.00 H new ATOM 0 HG3 GLU A 70 23.157 3.073 6.581 1.00 0.00 H new ATOM 795 N TRP A 71 21.709 0.089 5.177 1.00 0.00 N ATOM 796 CA TRP A 71 20.812 0.322 4.087 1.00 0.00 C ATOM 797 C TRP A 71 19.971 1.522 4.407 1.00 0.00 C ATOM 798 O TRP A 71 19.196 1.522 5.362 1.00 0.00 O ATOM 799 CB TRP A 71 19.961 -0.922 3.768 1.00 0.00 C ATOM 800 CG TRP A 71 20.739 -2.045 3.128 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.418 -3.051 3.755 1.00 0.00 C ATOM 802 CD2 TRP A 71 20.906 -2.267 1.720 1.00 0.00 C ATOM 803 NE1 TRP A 71 21.994 -3.882 2.819 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.703 -3.417 1.565 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.458 -1.602 0.577 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.067 -3.912 0.304 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.815 -2.095 -0.660 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.612 -3.235 -0.788 1.00 0.00 C ATOM 0 H TRP A 71 21.336 -0.514 5.911 1.00 0.00 H new ATOM 0 HA TRP A 71 21.385 0.523 3.182 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.507 -1.286 4.690 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.146 -0.633 3.104 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.492 -3.176 4.825 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.549 -4.712 3.027 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.843 -0.718 0.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.683 -4.794 0.203 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.471 -1.589 -1.550 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.874 -3.588 -1.775 1.00 0.00 H new ATOM 819 N VAL A 72 20.139 2.538 3.630 1.00 0.00 N ATOM 820 CA VAL A 72 19.484 3.801 3.846 1.00 0.00 C ATOM 821 C VAL A 72 18.593 4.103 2.677 1.00 0.00 C ATOM 822 O VAL A 72 18.641 3.409 1.667 1.00 0.00 O ATOM 823 CB VAL A 72 20.510 4.955 4.013 1.00 0.00 C ATOM 824 CG1 VAL A 72 21.366 4.743 5.240 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.387 5.092 2.776 1.00 0.00 C ATOM 0 H VAL A 72 20.745 2.522 2.810 1.00 0.00 H new ATOM 0 HA VAL A 72 18.901 3.727 4.764 1.00 0.00 H new ATOM 0 HB VAL A 72 19.948 5.880 4.139 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.076 5.564 5.335 1.00 0.00 H new ATOM 0 HG12 VAL A 72 20.731 4.709 6.125 1.00 0.00 H new ATOM 0 HG13 VAL A 72 21.909 3.803 5.147 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.096 5.907 2.921 1.00 0.00 H new ATOM 0 HG22 VAL A 72 21.932 4.162 2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 72 20.762 5.304 1.909 1.00 0.00 H new ATOM 835 N ALA A 73 17.799 5.118 2.794 1.00 0.00 N ATOM 836 CA ALA A 73 16.926 5.486 1.728 1.00 0.00 C ATOM 837 C ALA A 73 17.637 6.400 0.747 1.00 0.00 C ATOM 838 O ALA A 73 18.149 7.470 1.129 1.00 0.00 O ATOM 839 CB ALA A 73 15.654 6.133 2.261 1.00 0.00 C ATOM 0 H ALA A 73 17.737 5.710 3.623 1.00 0.00 H new ATOM 0 HA ALA A 73 16.636 4.580 1.196 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.006 6.404 1.427 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.133 5.430 2.911 1.00 0.00 H new ATOM 0 HB3 ALA A 73 15.911 7.029 2.826 1.00 0.00 H new ATOM 845 N LEU A 74 17.728 5.939 -0.491 1.00 0.00 N ATOM 846 CA LEU A 74 18.252 6.724 -1.593 1.00 0.00 C ATOM 847 C LEU A 74 17.255 7.820 -1.806 1.00 0.00 C ATOM 848 O LEU A 74 17.601 8.994 -1.884 1.00 0.00 O ATOM 849 CB LEU A 74 18.306 5.843 -2.858 1.00 0.00 C ATOM 850 CG LEU A 74 19.022 6.377 -4.132 1.00 0.00 C ATOM 851 CD1 LEU A 74 18.441 7.665 -4.701 1.00 0.00 C ATOM 852 CD2 LEU A 74 20.522 6.470 -3.946 1.00 0.00 C ATOM 0 H LEU A 74 17.436 4.999 -0.759 1.00 0.00 H new ATOM 0 HA LEU A 74 19.252 7.107 -1.389 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.786 4.904 -2.582 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.279 5.606 -3.135 1.00 0.00 H new ATOM 0 HG LEU A 74 18.823 5.622 -4.893 1.00 0.00 H new ATOM 0 HD11 LEU A 74 19.005 7.959 -5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.398 7.505 -4.972 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.504 8.455 -3.952 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.979 6.847 -4.861 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.745 7.148 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.923 5.482 -3.721 1.00 0.00 H new ATOM 864 N ASN A 75 16.011 7.409 -1.894 1.00 0.00 N ATOM 865 CA ASN A 75 14.917 8.315 -2.063 1.00 0.00 C ATOM 866 C ASN A 75 14.109 8.390 -0.775 1.00 0.00 C ATOM 867 O ASN A 75 13.193 7.605 -0.574 1.00 0.00 O ATOM 868 CB ASN A 75 13.986 7.893 -3.214 1.00 0.00 C ATOM 869 CG ASN A 75 14.546 8.067 -4.616 1.00 0.00 C ATOM 870 OD1 ASN A 75 15.323 9.089 -4.834 1.00 0.00 O flip ATOM 871 ND2 ASN A 75 14.220 7.295 -5.513 1.00 0.00 N flip ATOM 0 H ASN A 75 15.736 6.428 -1.849 1.00 0.00 H new ATOM 0 HA ASN A 75 15.338 9.290 -2.309 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.722 6.845 -3.076 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.063 8.467 -3.138 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.610 6.504 -5.308 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.559 7.445 -6.463 1.00 0.00 H new ATOM 878 N PRO A 76 14.461 9.303 0.137 1.00 0.00 N ATOM 879 CA PRO A 76 13.753 9.455 1.424 1.00 0.00 C ATOM 880 C PRO A 76 12.464 10.241 1.260 1.00 0.00 C ATOM 881 O PRO A 76 11.534 10.170 2.079 1.00 0.00 O ATOM 882 CB PRO A 76 14.747 10.254 2.252 1.00 0.00 C ATOM 883 CG PRO A 76 15.505 11.068 1.257 1.00 0.00 C ATOM 884 CD PRO A 76 15.602 10.241 0.025 1.00 0.00 C ATOM 0 HA PRO A 76 13.464 8.501 1.865 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.238 10.889 2.977 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.411 9.598 2.814 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.993 12.009 1.054 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.496 11.319 1.635 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.530 10.853 -0.874 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.553 9.710 -0.026 1.00 0.00 H new ATOM 892 N LEU A 77 12.413 10.967 0.174 1.00 0.00 N ATOM 893 CA LEU A 77 11.307 11.807 -0.156 1.00 0.00 C ATOM 894 C LEU A 77 10.165 10.959 -0.622 1.00 0.00 C ATOM 895 O LEU A 77 8.998 11.264 -0.412 1.00 0.00 O ATOM 896 CB LEU A 77 11.742 12.744 -1.236 1.00 0.00 C ATOM 897 CG LEU A 77 12.989 13.548 -0.903 1.00 0.00 C ATOM 898 CD1 LEU A 77 13.198 14.560 -1.945 1.00 0.00 C ATOM 899 CD2 LEU A 77 12.879 14.207 0.464 1.00 0.00 C ATOM 0 H LEU A 77 13.162 10.986 -0.519 1.00 0.00 H new ATOM 0 HA LEU A 77 10.979 12.378 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.925 12.172 -2.145 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.926 13.434 -1.453 1.00 0.00 H new ATOM 0 HG LEU A 77 13.843 12.872 -0.868 1.00 0.00 H new ATOM 0 HD11 LEU A 77 14.091 15.141 -1.714 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.325 14.068 -2.909 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.334 15.223 -1.987 1.00 0.00 H new ATOM 0 HD21 LEU A 77 13.788 14.773 0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.022 14.880 0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.749 13.441 1.228 1.00 0.00 H new ATOM 911 N ARG A 78 10.531 9.851 -1.197 1.00 0.00 N ATOM 912 CA ARG A 78 9.588 8.877 -1.699 1.00 0.00 C ATOM 913 C ARG A 78 9.169 7.958 -0.555 1.00 0.00 C ATOM 914 O ARG A 78 9.861 7.892 0.475 1.00 0.00 O ATOM 915 CB ARG A 78 10.219 8.060 -2.822 1.00 0.00 C ATOM 916 CG ARG A 78 10.707 8.862 -4.038 1.00 0.00 C ATOM 917 CD ARG A 78 9.585 9.424 -4.914 1.00 0.00 C ATOM 918 NE ARG A 78 8.837 10.553 -4.337 1.00 0.00 N ATOM 919 CZ ARG A 78 8.280 11.537 -5.073 1.00 0.00 C ATOM 920 NH1 ARG A 78 8.515 11.615 -6.388 1.00 0.00 N ATOM 921 NH2 ARG A 78 7.519 12.454 -4.494 1.00 0.00 N ATOM 0 H ARG A 78 11.507 9.588 -1.336 1.00 0.00 H new ATOM 0 HA ARG A 78 8.713 9.390 -2.098 1.00 0.00 H new ATOM 0 HB2 ARG A 78 11.064 7.506 -2.413 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.491 7.324 -3.164 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.327 9.687 -3.689 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.343 8.222 -4.649 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.014 9.742 -5.864 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.883 8.620 -5.135 1.00 0.00 H new ATOM 0 HE ARG A 78 8.734 10.594 -3.323 1.00 0.00 H new ATOM 0 HH11 ARG A 78 9.118 10.928 -6.840 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.091 12.362 -6.939 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.352 12.418 -3.488 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.100 13.196 -5.054 1.00 0.00 H new ATOM 935 N LYS A 79 8.027 7.310 -0.705 1.00 0.00 N ATOM 936 CA LYS A 79 7.479 6.391 0.295 1.00 0.00 C ATOM 937 C LYS A 79 6.229 5.760 -0.256 1.00 0.00 C ATOM 938 O LYS A 79 5.602 6.325 -1.147 1.00 0.00 O ATOM 939 CB LYS A 79 7.181 7.137 1.601 1.00 0.00 C ATOM 940 CG LYS A 79 6.225 8.306 1.444 1.00 0.00 C ATOM 941 CD LYS A 79 6.358 9.325 2.582 1.00 0.00 C ATOM 942 CE LYS A 79 7.638 10.200 2.482 1.00 0.00 C ATOM 943 NZ LYS A 79 8.929 9.455 2.667 1.00 0.00 N ATOM 0 H LYS A 79 7.441 7.404 -1.534 1.00 0.00 H new ATOM 0 HA LYS A 79 8.209 5.612 0.516 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.763 6.434 2.321 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.119 7.502 2.020 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.414 8.802 0.492 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.201 7.933 1.411 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.482 9.974 2.582 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.363 8.796 3.535 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.653 10.687 1.507 1.00 0.00 H new ATOM 0 HE3 LYS A 79 7.580 10.990 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 9.693 10.130 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.835 8.788 3.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 9.155 8.930 1.798 1.00 0.00 H new ATOM 957 N CYS A 80 5.874 4.615 0.242 1.00 0.00 N ATOM 958 CA CYS A 80 4.718 3.919 -0.267 1.00 0.00 C ATOM 959 C CYS A 80 3.481 4.259 0.551 1.00 0.00 C ATOM 960 O CYS A 80 3.475 4.116 1.774 1.00 0.00 O ATOM 961 CB CYS A 80 4.974 2.417 -0.292 1.00 0.00 C ATOM 962 SG CYS A 80 6.470 1.943 -1.241 1.00 0.00 S ATOM 0 H CYS A 80 6.363 4.138 0.999 1.00 0.00 H new ATOM 0 HA CYS A 80 4.535 4.246 -1.290 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.074 2.057 0.732 1.00 0.00 H new ATOM 0 HB3 CYS A 80 4.107 1.916 -0.723 1.00 0.00 H new ATOM 967 N GLN A 81 2.465 4.745 -0.121 1.00 0.00 N ATOM 968 CA GLN A 81 1.214 5.131 0.505 1.00 0.00 C ATOM 969 C GLN A 81 0.101 4.311 -0.099 1.00 0.00 C ATOM 970 O GLN A 81 0.283 3.715 -1.150 1.00 0.00 O ATOM 971 CB GLN A 81 0.955 6.627 0.304 1.00 0.00 C ATOM 972 CG GLN A 81 1.988 7.517 0.974 1.00 0.00 C ATOM 973 CD GLN A 81 1.768 8.990 0.721 1.00 0.00 C ATOM 974 OE1 GLN A 81 0.644 9.449 0.525 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.837 9.742 0.732 1.00 0.00 N ATOM 0 H GLN A 81 2.480 4.887 -1.131 1.00 0.00 H new ATOM 0 HA GLN A 81 1.264 4.945 1.578 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.938 6.844 -0.764 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.032 6.872 0.695 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.971 7.334 2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.980 7.240 0.619 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.753 9.324 0.898 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.756 10.746 0.574 1.00 0.00 H new ATOM 984 N LYS A 82 -1.036 4.283 0.542 1.00 0.00 N ATOM 985 CA LYS A 82 -2.149 3.467 0.085 1.00 0.00 C ATOM 986 C LYS A 82 -2.791 4.068 -1.145 1.00 0.00 C ATOM 987 O LYS A 82 -2.749 5.281 -1.341 1.00 0.00 O ATOM 988 CB LYS A 82 -3.190 3.345 1.179 1.00 0.00 C ATOM 989 CG LYS A 82 -2.671 2.746 2.458 1.00 0.00 C ATOM 990 CD LYS A 82 -3.779 2.582 3.454 1.00 0.00 C ATOM 991 CE LYS A 82 -3.284 1.956 4.725 1.00 0.00 C ATOM 992 NZ LYS A 82 -4.395 1.579 5.621 1.00 0.00 N ATOM 0 H LYS A 82 -1.225 4.817 1.390 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.760 2.480 -0.166 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.595 4.334 1.392 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.016 2.734 0.813 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.214 1.778 2.253 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.892 3.385 2.875 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.220 3.554 3.673 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.567 1.964 3.025 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.693 1.072 4.488 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.623 2.653 5.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.064 0.868 6.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.730 2.421 6.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.175 1.182 5.059 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.360 3.238 -1.975 1.00 0.00 N ATOM 1007 CA ARG A 83 -4.051 3.736 -3.134 1.00 0.00 C ATOM 1008 C ARG A 83 -5.454 4.167 -2.741 1.00 0.00 C ATOM 1009 O ARG A 83 -6.054 3.585 -1.834 1.00 0.00 O ATOM 1010 CB ARG A 83 -4.171 2.689 -4.239 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.983 1.475 -3.841 1.00 0.00 C ATOM 1012 CD ARG A 83 -5.517 0.760 -5.044 1.00 0.00 C ATOM 1013 NE ARG A 83 -6.420 1.638 -5.793 1.00 0.00 N ATOM 1014 CZ ARG A 83 -6.357 1.882 -7.097 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -5.446 1.280 -7.848 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -7.197 2.742 -7.643 1.00 0.00 N ATOM 0 H ARG A 83 -3.360 2.223 -1.873 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.467 4.574 -3.516 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.627 3.149 -5.115 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.172 2.367 -4.532 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.363 0.795 -3.257 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.810 1.782 -3.201 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.693 0.442 -5.683 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.047 -0.141 -4.735 1.00 0.00 H new ATOM 0 HE ARG A 83 -7.161 2.102 -5.267 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.788 0.625 -7.425 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.403 1.472 -8.849 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -7.890 3.216 -7.064 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -7.153 2.933 -8.644 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.972 5.198 -3.379 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.345 5.604 -3.206 1.00 0.00 C ATOM 1032 C PRO A 84 -8.291 4.710 -4.031 1.00 0.00 C ATOM 1033 O PRO A 84 -7.894 4.122 -5.057 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.361 7.036 -3.742 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.274 7.069 -4.755 1.00 0.00 C ATOM 1036 CD PRO A 84 -5.237 6.087 -4.289 1.00 0.00 C ATOM 0 HA PRO A 84 -7.682 5.527 -2.172 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.325 7.282 -4.187 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -7.183 7.759 -2.946 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.652 6.798 -5.741 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.852 8.070 -4.840 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.806 5.535 -5.124 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.414 6.588 -3.779 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.499 4.568 -3.569 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.501 3.800 -4.295 1.00 0.00 C ATOM 1046 C CYS A 85 -11.593 4.685 -4.850 1.00 0.00 C ATOM 1047 O CYS A 85 -12.426 4.228 -5.644 1.00 0.00 O ATOM 1048 CB CYS A 85 -11.107 2.692 -3.429 1.00 0.00 C ATOM 1049 SG CYS A 85 -10.040 1.244 -3.196 1.00 0.00 S ATOM 0 H CYS A 85 -9.827 4.971 -2.691 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.984 3.332 -5.133 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.352 3.107 -2.451 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -12.044 2.367 -3.882 1.00 0.00 H new ATOM 1054 N GLY A 86 -11.593 5.941 -4.454 1.00 0.00 N ATOM 1055 CA GLY A 86 -12.612 6.842 -4.907 1.00 0.00 C ATOM 1056 C GLY A 86 -13.896 6.664 -4.137 1.00 0.00 C ATOM 1057 O GLY A 86 -14.001 5.767 -3.291 1.00 0.00 O ATOM 0 H GLY A 86 -10.902 6.351 -3.825 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.263 7.869 -4.800 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -12.798 6.677 -5.968 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.856 7.499 -4.410 1.00 0.00 N ATOM 1062 CA HIS A 87 -16.158 7.410 -3.778 1.00 0.00 C ATOM 1063 C HIS A 87 -16.897 6.178 -4.344 1.00 0.00 C ATOM 1064 O HIS A 87 -17.037 6.046 -5.564 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.950 8.713 -4.032 1.00 0.00 C ATOM 1066 CG HIS A 87 -18.279 8.809 -3.333 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -19.466 8.999 -3.992 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -18.592 8.784 -2.017 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -20.446 9.091 -3.122 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -19.945 8.960 -1.918 1.00 0.00 N ATOM 0 H HIS A 87 -14.767 8.265 -5.077 1.00 0.00 H new ATOM 0 HA HIS A 87 -16.054 7.291 -2.699 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -16.335 9.558 -3.723 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -17.115 8.814 -5.105 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -19.572 9.060 -5.005 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -17.902 8.650 -1.197 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -21.488 9.248 -3.359 1.00 0.00 H new ATOM 1079 N PRO A 88 -17.321 5.244 -3.472 1.00 0.00 N ATOM 1080 CA PRO A 88 -18.001 4.006 -3.888 1.00 0.00 C ATOM 1081 C PRO A 88 -19.416 4.251 -4.427 1.00 0.00 C ATOM 1082 O PRO A 88 -20.422 4.164 -3.684 1.00 0.00 O ATOM 1083 CB PRO A 88 -18.023 3.169 -2.601 1.00 0.00 C ATOM 1084 CG PRO A 88 -17.973 4.161 -1.496 1.00 0.00 C ATOM 1085 CD PRO A 88 -17.156 5.309 -2.006 1.00 0.00 C ATOM 0 HA PRO A 88 -17.490 3.516 -4.716 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.924 2.558 -2.543 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.173 2.488 -2.559 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.975 4.488 -1.220 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.522 3.728 -0.603 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.510 6.259 -1.607 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.109 5.213 -1.718 1.00 0.00 H new ATOM 1093 N GLY A 89 -19.482 4.598 -5.702 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.736 4.878 -6.358 1.00 0.00 C ATOM 1095 C GLY A 89 -21.401 6.073 -5.742 1.00 0.00 C ATOM 1096 O GLY A 89 -20.728 7.012 -5.366 1.00 0.00 O ATOM 0 H GLY A 89 -18.665 4.692 -6.306 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.565 5.058 -7.419 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -21.393 4.011 -6.283 1.00 0.00 H new ATOM 1100 N ASP A 90 -22.695 6.036 -5.633 1.00 0.00 N ATOM 1101 CA ASP A 90 -23.444 7.074 -4.952 1.00 0.00 C ATOM 1102 C ASP A 90 -24.626 6.416 -4.295 1.00 0.00 C ATOM 1103 O ASP A 90 -25.309 5.611 -4.928 1.00 0.00 O ATOM 1104 CB ASP A 90 -23.919 8.159 -5.933 1.00 0.00 C ATOM 1105 CG ASP A 90 -24.605 9.324 -5.239 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.899 10.257 -4.775 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -25.847 9.340 -5.143 1.00 0.00 O ATOM 0 H ASP A 90 -23.273 5.286 -6.012 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.809 7.566 -4.215 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -23.064 8.531 -6.497 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -24.607 7.715 -6.653 1.00 0.00 H new ATOM 1112 N THR A 91 -24.840 6.679 -3.041 1.00 0.00 N ATOM 1113 CA THR A 91 -25.948 6.086 -2.351 1.00 0.00 C ATOM 1114 C THR A 91 -26.810 7.160 -1.652 1.00 0.00 C ATOM 1115 O THR A 91 -26.436 7.712 -0.608 1.00 0.00 O ATOM 1116 CB THR A 91 -25.502 4.949 -1.369 1.00 0.00 C ATOM 1117 OG1 THR A 91 -26.615 4.477 -0.615 1.00 0.00 O ATOM 1118 CG2 THR A 91 -24.379 5.389 -0.428 1.00 0.00 C ATOM 0 H THR A 91 -24.263 7.300 -2.474 1.00 0.00 H new ATOM 0 HA THR A 91 -26.575 5.605 -3.102 1.00 0.00 H new ATOM 0 HB THR A 91 -25.108 4.139 -1.984 1.00 0.00 H new ATOM 0 HG1 THR A 91 -26.569 3.501 -0.539 1.00 0.00 H new ATOM 0 HG21 THR A 91 -24.110 4.562 0.229 1.00 0.00 H new ATOM 0 HG22 THR A 91 -23.509 5.685 -1.014 1.00 0.00 H new ATOM 0 HG23 THR A 91 -24.717 6.234 0.172 1.00 0.00 H new ATOM 1126 N PRO A 92 -27.931 7.546 -2.279 1.00 0.00 N ATOM 1127 CA PRO A 92 -28.851 8.522 -1.708 1.00 0.00 C ATOM 1128 C PRO A 92 -29.598 8.004 -0.463 1.00 0.00 C ATOM 1129 O PRO A 92 -29.767 8.739 0.514 1.00 0.00 O ATOM 1130 CB PRO A 92 -29.855 8.799 -2.843 1.00 0.00 C ATOM 1131 CG PRO A 92 -29.206 8.273 -4.077 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.351 7.131 -3.633 1.00 0.00 C ATOM 0 HA PRO A 92 -28.311 9.405 -1.365 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -30.807 8.302 -2.656 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -30.064 9.865 -2.932 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -29.952 7.945 -4.801 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -28.608 9.044 -4.563 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -28.906 6.193 -3.615 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -27.497 6.984 -4.294 1.00 0.00 H new ATOM 1140 N PHE A 93 -30.005 6.749 -0.476 1.00 0.00 N ATOM 1141 CA PHE A 93 -30.838 6.215 0.604 1.00 0.00 C ATOM 1142 C PHE A 93 -30.033 5.439 1.639 1.00 0.00 C ATOM 1143 O PHE A 93 -30.482 5.260 2.772 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.974 5.343 0.047 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.919 6.082 -0.868 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -33.984 6.802 -0.352 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -32.738 6.058 -2.241 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -34.849 7.482 -1.189 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -33.599 6.735 -3.082 1.00 0.00 C ATOM 1150 CZ PHE A 93 -34.656 7.448 -2.557 1.00 0.00 C ATOM 0 H PHE A 93 -29.779 6.079 -1.212 1.00 0.00 H new ATOM 0 HA PHE A 93 -31.271 7.076 1.113 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.541 4.503 -0.496 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.541 4.927 0.880 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -34.140 6.832 0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.912 5.502 -2.660 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -35.675 8.040 -0.774 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -33.445 6.706 -4.151 1.00 0.00 H new ATOM 0 HZ PHE A 93 -35.331 7.978 -3.213 1.00 0.00 H new ATOM 1160 N GLY A 94 -28.861 4.992 1.267 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.056 4.230 2.182 1.00 0.00 C ATOM 1162 C GLY A 94 -26.830 4.987 2.608 1.00 0.00 C ATOM 1163 O GLY A 94 -26.587 6.100 2.148 1.00 0.00 O ATOM 0 H GLY A 94 -28.447 5.141 0.347 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -28.648 3.973 3.060 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -27.760 3.292 1.712 1.00 0.00 H new ATOM 1167 N THR A 95 -26.072 4.406 3.482 1.00 0.00 N ATOM 1168 CA THR A 95 -24.860 5.002 3.981 1.00 0.00 C ATOM 1169 C THR A 95 -23.754 3.956 3.991 1.00 0.00 C ATOM 1170 O THR A 95 -24.008 2.782 3.670 1.00 0.00 O ATOM 1171 CB THR A 95 -25.070 5.575 5.409 1.00 0.00 C ATOM 1172 OG1 THR A 95 -25.786 4.627 6.226 1.00 0.00 O ATOM 1173 CG2 THR A 95 -25.819 6.898 5.376 1.00 0.00 C ATOM 0 H THR A 95 -26.275 3.489 3.880 1.00 0.00 H new ATOM 0 HA THR A 95 -24.578 5.827 3.328 1.00 0.00 H new ATOM 0 HB THR A 95 -24.086 5.755 5.841 1.00 0.00 H new ATOM 0 HG1 THR A 95 -25.911 4.998 7.124 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.948 7.269 6.393 1.00 0.00 H new ATOM 0 HG22 THR A 95 -25.250 7.624 4.794 1.00 0.00 H new ATOM 0 HG23 THR A 95 -26.797 6.751 4.917 1.00 0.00 H new ATOM 1181 N PHE A 96 -22.557 4.347 4.334 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.459 3.407 4.415 1.00 0.00 C ATOM 1183 C PHE A 96 -20.457 3.856 5.449 1.00 0.00 C ATOM 1184 O PHE A 96 -20.334 5.051 5.717 1.00 0.00 O ATOM 1185 CB PHE A 96 -20.771 3.172 3.041 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.141 4.391 2.415 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -18.880 4.818 2.812 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -20.803 5.101 1.429 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.302 5.928 2.240 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.225 6.212 0.849 1.00 0.00 C ATOM 1191 CZ PHE A 96 -18.974 6.627 1.256 1.00 0.00 C ATOM 0 H PHE A 96 -22.311 5.310 4.563 1.00 0.00 H new ATOM 0 HA PHE A 96 -21.879 2.449 4.721 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.002 2.410 3.165 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.510 2.770 2.348 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.348 4.273 3.578 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -21.784 4.782 1.109 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.323 6.253 2.560 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -20.751 6.755 0.078 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.520 7.498 0.806 1.00 0.00 H new ATOM 1201 N THR A 97 -19.780 2.925 6.036 1.00 0.00 N ATOM 1202 CA THR A 97 -18.765 3.217 6.996 1.00 0.00 C ATOM 1203 C THR A 97 -17.415 3.084 6.332 1.00 0.00 C ATOM 1204 O THR A 97 -17.330 2.635 5.200 1.00 0.00 O ATOM 1205 CB THR A 97 -18.839 2.180 8.098 1.00 0.00 C ATOM 1206 OG1 THR A 97 -18.686 0.939 7.508 1.00 0.00 O ATOM 1207 CG2 THR A 97 -20.150 2.235 8.856 1.00 0.00 C ATOM 0 H THR A 97 -19.917 1.929 5.861 1.00 0.00 H new ATOM 0 HA THR A 97 -18.903 4.223 7.392 1.00 0.00 H new ATOM 0 HB THR A 97 -18.053 2.377 8.827 1.00 0.00 H new ATOM 0 HG1 THR A 97 -17.737 0.780 7.323 1.00 0.00 H new ATOM 0 HG21 THR A 97 -20.152 1.472 9.634 1.00 0.00 H new ATOM 0 HG22 THR A 97 -20.266 3.218 9.311 1.00 0.00 H new ATOM 0 HG23 THR A 97 -20.976 2.054 8.168 1.00 0.00 H new ATOM 1215 N LEU A 98 -16.384 3.485 7.021 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.031 3.296 6.589 1.00 0.00 C ATOM 1217 C LEU A 98 -14.216 2.964 7.808 1.00 0.00 C ATOM 1218 O LEU A 98 -14.389 3.582 8.847 1.00 0.00 O ATOM 1219 CB LEU A 98 -14.496 4.552 5.919 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.190 4.970 4.624 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.633 6.275 4.144 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.010 3.911 3.552 1.00 0.00 C ATOM 0 H LEU A 98 -16.464 3.963 7.919 1.00 0.00 H new ATOM 0 HA LEU A 98 -14.976 2.491 5.856 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -14.568 5.376 6.628 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -13.437 4.404 5.708 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.255 5.083 4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -15.133 6.566 3.220 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.796 7.041 4.902 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.564 6.169 3.960 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.512 4.229 2.638 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -13.947 3.772 3.353 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.441 2.970 3.894 1.00 0.00 H new ATOM 1234 N THR A 99 -13.348 2.006 7.705 1.00 0.00 N ATOM 1235 CA THR A 99 -12.608 1.590 8.874 1.00 0.00 C ATOM 1236 C THR A 99 -11.089 1.900 8.787 1.00 0.00 C ATOM 1237 O THR A 99 -10.584 2.719 9.562 1.00 0.00 O ATOM 1238 CB THR A 99 -12.926 0.098 9.298 1.00 0.00 C ATOM 1239 OG1 THR A 99 -12.177 -0.269 10.455 1.00 0.00 O ATOM 1240 CG2 THR A 99 -12.642 -0.896 8.181 1.00 0.00 C ATOM 0 H THR A 99 -13.131 1.501 6.846 1.00 0.00 H new ATOM 0 HA THR A 99 -12.971 2.212 9.692 1.00 0.00 H new ATOM 0 HB THR A 99 -13.992 0.061 9.521 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.389 -1.193 10.702 1.00 0.00 H new ATOM 0 HG21 THR A 99 -12.876 -1.904 8.523 1.00 0.00 H new ATOM 0 HG22 THR A 99 -13.257 -0.655 7.314 1.00 0.00 H new ATOM 0 HG23 THR A 99 -11.589 -0.842 7.905 1.00 0.00 H new ATOM 1248 N GLY A 100 -10.380 1.314 7.820 1.00 0.00 N ATOM 1249 CA GLY A 100 -8.935 1.500 7.725 1.00 0.00 C ATOM 1250 C GLY A 100 -8.530 2.788 7.042 1.00 0.00 C ATOM 1251 O GLY A 100 -7.831 2.768 6.033 1.00 0.00 O ATOM 0 H GLY A 100 -10.780 0.713 7.099 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.509 1.482 8.728 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -8.505 0.660 7.180 1.00 0.00 H new ATOM 1255 N GLY A 101 -9.009 3.894 7.556 1.00 0.00 N ATOM 1256 CA GLY A 101 -8.635 5.172 7.020 1.00 0.00 C ATOM 1257 C GLY A 101 -9.630 6.241 7.351 1.00 0.00 C ATOM 1258 O GLY A 101 -9.278 7.261 7.912 1.00 0.00 O ATOM 0 H GLY A 101 -9.657 3.932 8.343 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.658 5.455 7.411 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -8.535 5.094 5.937 1.00 0.00 H new ATOM 1262 N ASN A 102 -10.880 5.999 6.939 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.039 6.909 7.126 1.00 0.00 C ATOM 1264 C ASN A 102 -12.074 7.838 5.982 1.00 0.00 C ATOM 1265 O ASN A 102 -12.754 8.858 5.966 1.00 0.00 O ATOM 1266 CB ASN A 102 -12.111 7.632 8.494 1.00 0.00 C ATOM 1267 CG ASN A 102 -12.583 6.727 9.618 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -11.787 6.053 10.276 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -13.877 6.717 9.867 1.00 0.00 N ATOM 0 H ASN A 102 -11.131 5.140 6.450 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.939 6.295 7.150 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.126 8.027 8.742 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -12.786 8.484 8.413 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -14.246 6.140 10.623 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -14.509 7.286 9.304 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.380 7.401 4.989 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.266 8.028 3.762 1.00 0.00 C ATOM 1278 C VAL A 103 -11.276 6.922 2.759 1.00 0.00 C ATOM 1279 O VAL A 103 -11.640 5.789 3.079 1.00 0.00 O ATOM 1280 CB VAL A 103 -9.957 8.833 3.697 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -8.664 8.042 3.591 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -10.031 10.064 2.843 1.00 0.00 C ATOM 0 H VAL A 103 -10.848 6.532 5.039 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.072 8.738 3.578 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.873 9.214 4.715 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.819 8.729 3.553 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.564 7.391 4.459 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.681 7.438 2.684 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -9.067 10.572 2.852 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.283 9.783 1.821 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.797 10.733 3.235 1.00 0.00 H new ATOM 1292 N PHE A 104 -10.840 7.202 1.637 1.00 0.00 N ATOM 1293 CA PHE A 104 -10.887 6.248 0.566 1.00 0.00 C ATOM 1294 C PHE A 104 -9.503 5.800 0.192 1.00 0.00 C ATOM 1295 O PHE A 104 -8.868 6.380 -0.686 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.647 6.790 -0.647 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.022 7.273 -0.306 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.966 6.400 0.200 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.361 8.601 -0.463 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.220 6.838 0.538 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.618 9.049 -0.124 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.552 8.166 0.377 1.00 0.00 C ATOM 0 H PHE A 104 -10.426 8.101 1.389 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.439 5.378 0.922 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.079 7.609 -1.089 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.719 6.008 -1.403 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.712 5.358 0.331 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.633 9.296 -0.856 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.948 6.143 0.930 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -14.873 10.091 -0.250 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.539 8.514 0.642 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.029 4.805 0.888 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.734 4.229 0.646 1.00 0.00 C ATOM 1314 C GLU A 105 -7.749 2.776 1.043 1.00 0.00 C ATOM 1315 O GLU A 105 -8.627 2.352 1.836 1.00 0.00 O ATOM 1316 CB GLU A 105 -6.590 5.001 1.344 1.00 0.00 C ATOM 1317 CG GLU A 105 -6.697 5.128 2.860 1.00 0.00 C ATOM 1318 CD GLU A 105 -5.508 5.870 3.457 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -5.102 6.923 2.905 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -4.940 5.417 4.481 1.00 0.00 O ATOM 0 H GLU A 105 -9.540 4.363 1.653 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.527 4.307 -0.421 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.648 4.508 1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.542 6.003 0.918 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.617 5.653 3.116 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.764 4.134 3.303 1.00 0.00 H new ATOM 1327 N TYR A 106 -6.841 2.021 0.437 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.685 0.577 0.626 1.00 0.00 C ATOM 1329 C TYR A 106 -6.733 0.180 2.090 1.00 0.00 C ATOM 1330 O TYR A 106 -5.887 0.571 2.886 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.381 0.104 -0.058 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.972 -1.337 0.194 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.551 -2.372 -0.506 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.973 -1.648 1.112 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.162 -3.679 -0.307 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.579 -2.954 1.326 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.175 -3.967 0.614 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.776 -5.272 0.813 1.00 0.00 O ATOM 0 H TYR A 106 -6.167 2.408 -0.224 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.530 0.075 0.154 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.488 0.246 -1.133 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.568 0.752 0.270 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.326 -2.155 -1.226 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.497 -0.853 1.667 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.628 -4.475 -0.869 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.808 -3.178 2.048 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.889 -5.779 -0.018 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.736 -0.571 2.438 1.00 0.00 N ATOM 1349 CA GLY A 107 -7.862 -0.996 3.794 1.00 0.00 C ATOM 1350 C GLY A 107 -9.203 -0.661 4.369 1.00 0.00 C ATOM 1351 O GLY A 107 -9.629 -1.263 5.361 1.00 0.00 O ATOM 0 H GLY A 107 -8.469 -0.897 1.808 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.702 -2.073 3.852 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.083 -0.526 4.394 1.00 0.00 H new ATOM 1355 N VAL A 108 -9.892 0.311 3.790 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.217 0.615 4.280 1.00 0.00 C ATOM 1357 C VAL A 108 -12.231 -0.383 3.782 1.00 0.00 C ATOM 1358 O VAL A 108 -12.205 -0.819 2.632 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.750 2.062 3.993 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -10.916 3.129 4.629 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -11.942 2.331 2.519 1.00 0.00 C ATOM 0 H VAL A 108 -9.567 0.881 3.009 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.096 0.551 5.361 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.733 2.102 4.462 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.336 4.107 4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.907 2.988 5.710 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -9.897 3.070 4.247 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.312 3.347 2.380 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -10.989 2.218 2.001 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -12.663 1.623 2.111 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.074 -0.764 4.664 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.190 -1.572 4.350 1.00 0.00 C ATOM 1373 C LYS A 109 -15.362 -0.655 4.428 1.00 0.00 C ATOM 1374 O LYS A 109 -15.666 -0.147 5.509 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.351 -2.729 5.362 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.526 -3.652 5.057 1.00 0.00 C ATOM 1377 CD LYS A 109 -15.759 -4.761 6.114 1.00 0.00 C ATOM 1378 CE LYS A 109 -14.686 -5.887 6.145 1.00 0.00 C ATOM 1379 NZ LYS A 109 -13.349 -5.463 6.655 1.00 0.00 N ATOM 0 H LYS A 109 -13.006 -0.516 5.651 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.083 -2.035 3.369 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.433 -3.317 5.377 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.478 -2.311 6.361 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.432 -3.052 4.972 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.362 -4.120 4.087 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.803 -4.297 7.099 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -16.733 -5.215 5.931 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.054 -6.703 6.766 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -14.566 -6.283 5.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -12.999 -6.166 7.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -12.682 -5.389 5.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -13.433 -4.538 7.123 1.00 0.00 H new ATOM 1393 N ALA A 110 -15.950 -0.365 3.310 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.086 0.481 3.292 1.00 0.00 C ATOM 1395 C ALA A 110 -18.287 -0.360 3.643 1.00 0.00 C ATOM 1396 O ALA A 110 -18.848 -1.045 2.772 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.266 1.154 1.931 1.00 0.00 C ATOM 0 H ALA A 110 -15.655 -0.708 2.396 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.960 1.285 4.017 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.147 1.795 1.956 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.386 1.756 1.703 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.393 0.392 1.162 1.00 0.00 H new ATOM 1403 N VAL A 111 -18.629 -0.410 4.911 1.00 0.00 N ATOM 1404 CA VAL A 111 -19.735 -1.229 5.310 1.00 0.00 C ATOM 1405 C VAL A 111 -21.019 -0.463 5.048 1.00 0.00 C ATOM 1406 O VAL A 111 -21.194 0.659 5.495 1.00 0.00 O ATOM 1407 CB VAL A 111 -19.648 -1.787 6.783 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -18.245 -2.030 7.340 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -20.649 -1.240 7.784 1.00 0.00 C ATOM 0 H VAL A 111 -18.165 0.097 5.664 1.00 0.00 H new ATOM 0 HA VAL A 111 -19.711 -2.135 4.705 1.00 0.00 H new ATOM 0 HB VAL A 111 -20.018 -2.799 6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -18.319 -2.412 8.358 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -17.727 -2.758 6.716 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -17.688 -1.093 7.344 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -20.482 -1.704 8.756 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -20.524 -0.161 7.871 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -21.661 -1.462 7.445 1.00 0.00 H new ATOM 1419 N TYR A 112 -21.880 -1.047 4.307 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.057 -0.374 3.863 1.00 0.00 C ATOM 1421 C TYR A 112 -24.110 -0.477 4.944 1.00 0.00 C ATOM 1422 O TYR A 112 -24.351 -1.554 5.503 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.513 -1.009 2.554 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.460 -0.195 1.702 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -25.775 -0.003 2.066 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.031 0.333 0.492 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -26.639 0.684 1.257 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -24.890 1.035 -0.319 1.00 0.00 C ATOM 1429 CZ TYR A 112 -26.194 1.205 0.067 1.00 0.00 C ATOM 1430 OH TYR A 112 -27.069 1.868 -0.762 1.00 0.00 O ATOM 0 H TYR A 112 -21.796 -2.011 3.984 1.00 0.00 H new ATOM 0 HA TYR A 112 -22.869 0.684 3.678 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.628 -1.236 1.959 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -23.994 -1.959 2.785 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.130 -0.401 3.005 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.006 0.190 0.183 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -27.669 0.816 1.554 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -24.540 1.449 -1.253 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.330 1.279 -1.501 1.00 0.00 H new ATOM 1440 N THR A 113 -24.686 0.636 5.269 1.00 0.00 N ATOM 1441 CA THR A 113 -25.683 0.689 6.284 1.00 0.00 C ATOM 1442 C THR A 113 -26.938 1.280 5.681 1.00 0.00 C ATOM 1443 O THR A 113 -26.863 2.104 4.761 1.00 0.00 O ATOM 1444 CB THR A 113 -25.238 1.595 7.428 1.00 0.00 C ATOM 1445 OG1 THR A 113 -23.792 1.598 7.520 1.00 0.00 O ATOM 1446 CG2 THR A 113 -25.791 1.072 8.736 1.00 0.00 C ATOM 0 H THR A 113 -24.476 1.535 4.835 1.00 0.00 H new ATOM 0 HA THR A 113 -25.855 -0.317 6.668 1.00 0.00 H new ATOM 0 HB THR A 113 -25.605 2.603 7.237 1.00 0.00 H new ATOM 0 HG1 THR A 113 -23.512 2.183 8.255 1.00 0.00 H new ATOM 0 HG21 THR A 113 -25.472 1.721 9.551 1.00 0.00 H new ATOM 0 HG22 THR A 113 -26.880 1.056 8.690 1.00 0.00 H new ATOM 0 HG23 THR A 113 -25.420 0.062 8.910 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.054 0.892 6.180 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.302 1.382 5.692 1.00 0.00 C ATOM 1456 C CYS A 114 -30.185 1.861 6.808 1.00 0.00 C ATOM 1457 O CYS A 114 -30.103 1.359 7.937 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.008 0.334 4.852 1.00 0.00 C ATOM 1459 SG CYS A 114 -29.373 0.194 3.161 1.00 0.00 S ATOM 0 H CYS A 114 -28.134 0.221 6.944 1.00 0.00 H new ATOM 0 HA CYS A 114 -29.088 2.240 5.054 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -29.916 -0.634 5.345 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.071 0.572 4.811 1.00 0.00 H new ATOM 1464 N ASN A 115 -30.992 2.856 6.491 1.00 0.00 N ATOM 1465 CA ASN A 115 -31.974 3.451 7.411 1.00 0.00 C ATOM 1466 C ASN A 115 -32.989 2.431 7.926 1.00 0.00 C ATOM 1467 O ASN A 115 -33.034 1.300 7.452 1.00 0.00 O ATOM 1468 CB ASN A 115 -32.716 4.611 6.727 1.00 0.00 C ATOM 1469 CG ASN A 115 -31.876 5.860 6.555 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -30.651 5.800 6.479 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -32.518 6.992 6.461 1.00 0.00 N ATOM 0 H ASN A 115 -30.992 3.291 5.568 1.00 0.00 H new ATOM 0 HA ASN A 115 -31.413 3.822 8.269 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -33.063 4.281 5.748 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -33.602 4.858 7.312 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -32.002 7.861 6.320 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -33.536 7.008 6.528 1.00 0.00 H new ATOM 1478 N GLU A 116 -33.823 2.880 8.864 1.00 0.00 N ATOM 1479 CA GLU A 116 -34.839 2.074 9.568 1.00 0.00 C ATOM 1480 C GLU A 116 -35.640 1.149 8.640 1.00 0.00 C ATOM 1481 O GLU A 116 -35.711 -0.067 8.857 1.00 0.00 O ATOM 1482 CB GLU A 116 -35.786 3.016 10.319 1.00 0.00 C ATOM 1483 CG GLU A 116 -36.860 2.320 11.129 1.00 0.00 C ATOM 1484 CD GLU A 116 -37.819 3.292 11.757 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -38.831 3.641 11.126 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -37.585 3.729 12.892 1.00 0.00 O ATOM 0 H GLU A 116 -33.815 3.853 9.171 1.00 0.00 H new ATOM 0 HA GLU A 116 -34.310 1.419 10.261 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -35.197 3.645 10.986 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -36.266 3.678 9.598 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -37.411 1.634 10.485 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -36.392 1.719 11.909 1.00 0.00 H new ATOM 1493 N GLY A 117 -36.196 1.712 7.617 1.00 0.00 N ATOM 1494 CA GLY A 117 -37.026 0.952 6.714 1.00 0.00 C ATOM 1495 C GLY A 117 -36.272 0.408 5.537 1.00 0.00 C ATOM 1496 O GLY A 117 -36.856 0.141 4.495 1.00 0.00 O ATOM 0 H GLY A 117 -36.095 2.698 7.378 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -37.483 0.126 7.259 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -37.838 1.585 6.356 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.975 0.274 5.679 1.00 0.00 N ATOM 1501 CA TYR A 118 -34.155 -0.239 4.614 1.00 0.00 C ATOM 1502 C TYR A 118 -33.178 -1.283 5.113 1.00 0.00 C ATOM 1503 O TYR A 118 -32.917 -1.399 6.320 1.00 0.00 O ATOM 1504 CB TYR A 118 -33.383 0.891 3.927 1.00 0.00 C ATOM 1505 CG TYR A 118 -34.247 1.916 3.278 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -34.689 3.007 3.994 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -34.636 1.792 1.958 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -35.486 3.946 3.427 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -35.442 2.735 1.374 1.00 0.00 C ATOM 1510 CZ TYR A 118 -35.866 3.815 2.113 1.00 0.00 C ATOM 1511 OH TYR A 118 -36.682 4.765 1.539 1.00 0.00 O ATOM 0 H TYR A 118 -34.465 0.516 6.528 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.826 -0.708 3.895 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -32.748 1.382 4.664 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -32.723 0.459 3.174 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -34.395 3.116 5.027 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -34.302 0.943 1.380 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -35.821 4.794 4.006 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -35.742 2.631 0.342 1.00 0.00 H new ATOM 0 HH TYR A 118 -36.856 4.525 0.605 1.00 0.00 H new ATOM 1521 N GLN A 119 -32.695 -2.047 4.192 1.00 0.00 N ATOM 1522 CA GLN A 119 -31.673 -3.023 4.347 1.00 0.00 C ATOM 1523 C GLN A 119 -31.103 -3.168 2.961 1.00 0.00 C ATOM 1524 O GLN A 119 -31.257 -2.252 2.176 1.00 0.00 O ATOM 1525 CB GLN A 119 -32.222 -4.337 4.895 1.00 0.00 C ATOM 1526 CG GLN A 119 -33.348 -4.940 4.099 1.00 0.00 C ATOM 1527 CD GLN A 119 -33.906 -6.179 4.749 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -33.449 -7.291 4.489 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -34.871 -6.007 5.595 1.00 0.00 N ATOM 0 H GLN A 119 -33.035 -1.999 3.231 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.915 -2.730 5.073 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -31.407 -5.059 4.948 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -32.567 -4.171 5.915 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -34.143 -4.204 3.983 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -32.992 -5.186 3.098 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -35.223 -5.068 5.784 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -35.280 -6.810 6.073 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.492 -4.245 2.614 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.878 -4.276 1.317 1.00 0.00 C ATOM 1540 C LEU A 120 -30.012 -5.572 0.570 1.00 0.00 C ATOM 1541 O LEU A 120 -30.012 -6.660 1.149 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.428 -3.787 1.409 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.660 -4.259 2.639 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -27.300 -5.740 2.570 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -26.443 -3.409 2.881 1.00 0.00 C ATOM 0 H LEU A 120 -30.400 -5.090 3.178 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.447 -3.583 0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -27.893 -4.116 0.518 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.428 -2.697 1.396 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.328 -4.140 3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.754 -6.024 3.470 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -28.212 -6.333 2.496 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.676 -5.922 1.695 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -25.917 -3.770 3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -25.782 -3.466 2.016 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -26.747 -2.374 3.038 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.188 -5.433 -0.709 1.00 0.00 N ATOM 1558 CA LEU A 121 -30.167 -6.537 -1.601 1.00 0.00 C ATOM 1559 C LEU A 121 -28.751 -6.821 -1.934 1.00 0.00 C ATOM 1560 O LEU A 121 -27.954 -5.896 -2.196 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.980 -6.299 -2.872 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.498 -6.453 -2.773 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.893 -7.862 -2.387 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -33.099 -5.455 -1.831 1.00 0.00 C ATOM 0 H LEU A 121 -30.352 -4.534 -1.162 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.636 -7.389 -1.109 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.766 -5.290 -3.225 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.620 -6.988 -3.636 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.899 -6.254 -3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.979 -7.932 -2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -32.525 -8.562 -3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -32.459 -8.109 -1.418 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -34.179 -5.598 -1.789 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.676 -5.593 -0.836 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.880 -4.446 -2.181 1.00 0.00 H new ATOM 1576 N GLY A 122 -28.441 -8.049 -1.908 1.00 0.00 N ATOM 1577 CA GLY A 122 -27.110 -8.490 -2.078 1.00 0.00 C ATOM 1578 C GLY A 122 -26.698 -9.223 -0.841 1.00 0.00 C ATOM 1579 O GLY A 122 -27.220 -8.950 0.245 1.00 0.00 O ATOM 0 H GLY A 122 -29.116 -8.801 -1.765 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -27.034 -9.141 -2.949 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -26.448 -7.642 -2.255 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.801 -10.144 -0.968 1.00 0.00 N ATOM 1584 CA GLU A 123 -25.408 -10.952 0.165 1.00 0.00 C ATOM 1585 C GLU A 123 -24.265 -10.337 0.923 1.00 0.00 C ATOM 1586 O GLU A 123 -23.947 -10.746 2.037 1.00 0.00 O ATOM 1587 CB GLU A 123 -25.055 -12.348 -0.285 1.00 0.00 C ATOM 1588 CG GLU A 123 -26.233 -13.125 -0.826 1.00 0.00 C ATOM 1589 CD GLU A 123 -25.857 -14.511 -1.216 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -25.402 -14.708 -2.351 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -25.992 -15.441 -0.381 1.00 0.00 O ATOM 0 H GLU A 123 -25.320 -10.365 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.259 -11.002 0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -24.285 -12.289 -1.054 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -24.625 -12.894 0.555 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -27.020 -13.162 -0.072 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -26.644 -12.604 -1.691 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.652 -9.370 0.331 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.535 -8.721 0.931 1.00 0.00 C ATOM 1600 C ILE A 124 -22.954 -7.308 1.300 1.00 0.00 C ATOM 1601 O ILE A 124 -23.289 -6.508 0.434 1.00 0.00 O ATOM 1602 CB ILE A 124 -21.331 -8.699 -0.044 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -21.011 -10.127 -0.551 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -20.112 -8.095 0.627 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -20.610 -11.113 0.529 1.00 0.00 C ATOM 0 H ILE A 124 -23.911 -9.005 -0.586 1.00 0.00 H new ATOM 0 HA ILE A 124 -22.222 -9.261 1.824 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.599 -8.080 -0.900 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.886 -10.517 -1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.206 -10.065 -1.283 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.277 -8.088 -0.074 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.335 -7.074 0.935 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.847 -8.688 1.502 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -20.406 -12.084 0.078 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.715 -10.753 1.036 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -21.421 -11.212 1.251 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.949 -7.007 2.580 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.403 -5.701 3.070 1.00 0.00 C ATOM 1619 C ASN A 125 -22.245 -4.719 3.167 1.00 0.00 C ATOM 1620 O ASN A 125 -22.302 -3.731 3.894 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.125 -5.823 4.443 1.00 0.00 C ATOM 1622 CG ASN A 125 -23.230 -6.176 5.632 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -23.008 -7.344 5.932 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -22.748 -5.177 6.333 1.00 0.00 N ATOM 0 H ASN A 125 -22.636 -7.645 3.312 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.121 -5.318 2.345 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.625 -4.878 4.656 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.902 -6.583 4.358 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -22.171 -5.361 7.153 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -22.951 -4.216 6.058 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.238 -4.944 2.382 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.057 -4.113 2.416 1.00 0.00 C ATOM 1633 C TYR A 126 -19.333 -4.201 1.094 1.00 0.00 C ATOM 1634 O TYR A 126 -19.746 -4.924 0.198 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.096 -4.500 3.592 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.292 -5.792 3.398 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.052 -5.768 2.754 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -18.765 -7.009 3.849 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -16.306 -6.909 2.560 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -18.027 -8.174 3.660 1.00 0.00 C ATOM 1641 CZ TYR A 126 -16.800 -8.118 3.014 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.071 -9.279 2.818 1.00 0.00 O ATOM 0 H TYR A 126 -21.203 -5.702 1.700 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.378 -3.086 2.590 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.397 -3.679 3.750 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -19.687 -4.595 4.503 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -16.666 -4.824 2.397 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -19.718 -7.057 4.354 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -15.350 -6.860 2.061 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -18.409 -9.120 4.015 1.00 0.00 H new ATOM 0 HH TYR A 126 -16.559 -10.040 3.198 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.279 -3.444 0.998 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.388 -3.411 -0.135 1.00 0.00 C ATOM 1654 C ARG A 127 -16.052 -2.875 0.352 1.00 0.00 C ATOM 1655 O ARG A 127 -16.001 -1.861 1.042 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.995 -2.556 -1.248 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.651 -1.302 -0.738 1.00 0.00 C ATOM 1658 CD ARG A 127 -19.490 -0.657 -1.789 1.00 0.00 C ATOM 1659 NE ARG A 127 -20.311 0.419 -1.219 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.842 1.395 -1.932 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -20.629 1.435 -3.225 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -21.590 2.345 -1.350 1.00 0.00 N ATOM 0 H ARG A 127 -18.001 -2.802 1.740 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.236 -4.404 -0.558 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.213 -2.287 -1.958 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -18.731 -3.148 -1.793 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -19.270 -1.540 0.127 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -17.887 -0.602 -0.401 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.850 -0.254 -2.574 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.134 -1.403 -2.254 1.00 0.00 H new ATOM 0 HE ARG A 127 -20.481 0.412 -0.213 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.058 0.717 -3.670 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -21.034 2.184 -3.786 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.755 2.319 -0.344 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.994 3.093 -1.914 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.002 -3.569 0.067 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.706 -3.210 0.578 1.00 0.00 C ATOM 1678 C GLU A 128 -12.836 -2.550 -0.461 1.00 0.00 C ATOM 1679 O GLU A 128 -12.893 -2.899 -1.633 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.010 -4.433 1.176 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.518 -4.819 2.526 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.688 -5.883 3.177 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -12.810 -7.058 2.822 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -11.903 -5.552 4.088 1.00 0.00 O ATOM 0 H GLU A 128 -15.009 -4.400 -0.524 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.864 -2.473 1.365 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.133 -5.277 0.497 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -11.941 -4.233 1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.538 -3.938 3.167 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.546 -5.171 2.435 1.00 0.00 H new ATOM 1691 N CYS A 129 -12.073 -1.566 -0.028 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.097 -0.915 -0.870 1.00 0.00 C ATOM 1693 C CYS A 129 -9.889 -1.800 -0.884 1.00 0.00 C ATOM 1694 O CYS A 129 -9.103 -1.833 0.082 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.739 0.469 -0.328 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.454 1.384 -1.264 1.00 0.00 S ATOM 0 H CYS A 129 -12.115 -1.196 0.922 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.492 -0.767 -1.875 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.645 1.075 -0.304 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.402 0.359 0.703 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.790 -2.562 -1.919 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.787 -3.556 -2.039 1.00 0.00 C ATOM 1703 C ASP A 130 -7.684 -3.069 -3.007 1.00 0.00 C ATOM 1704 O ASP A 130 -7.537 -1.866 -3.237 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.470 -4.857 -2.512 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.596 -6.096 -2.414 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.526 -6.706 -1.334 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -7.952 -6.474 -3.422 1.00 0.00 O ATOM 0 H ASP A 130 -10.419 -2.508 -2.720 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.296 -3.751 -1.086 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.372 -5.016 -1.920 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.786 -4.731 -3.548 1.00 0.00 H new ATOM 1713 N THR A 131 -6.940 -3.993 -3.555 1.00 0.00 N ATOM 1714 CA THR A 131 -5.774 -3.738 -4.353 1.00 0.00 C ATOM 1715 C THR A 131 -6.087 -3.010 -5.656 1.00 0.00 C ATOM 1716 O THR A 131 -5.313 -2.166 -6.104 1.00 0.00 O ATOM 1717 CB THR A 131 -5.055 -5.068 -4.639 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.985 -6.023 -5.213 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.533 -5.638 -3.358 1.00 0.00 C ATOM 0 H THR A 131 -7.141 -4.988 -3.452 1.00 0.00 H new ATOM 0 HA THR A 131 -5.126 -3.073 -3.782 1.00 0.00 H new ATOM 0 HB THR A 131 -4.238 -4.880 -5.335 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.552 -6.393 -4.505 1.00 0.00 H new ATOM 0 HG21 THR A 131 -4.024 -6.580 -3.560 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.832 -4.936 -2.906 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.363 -5.814 -2.673 1.00 0.00 H new ATOM 1727 N ASP A 132 -7.178 -3.357 -6.269 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.600 -2.696 -7.492 1.00 0.00 C ATOM 1729 C ASP A 132 -8.605 -1.614 -7.183 1.00 0.00 C ATOM 1730 O ASP A 132 -8.624 -0.558 -7.831 1.00 0.00 O ATOM 1731 CB ASP A 132 -8.191 -3.684 -8.497 1.00 0.00 C ATOM 1732 CG ASP A 132 -8.650 -3.008 -9.777 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -7.803 -2.699 -10.643 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -9.870 -2.795 -9.968 1.00 0.00 O ATOM 0 H ASP A 132 -7.803 -4.097 -5.949 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.714 -2.250 -7.944 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.446 -4.442 -8.738 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -9.035 -4.201 -8.040 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.410 -1.856 -6.184 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.426 -0.912 -5.822 1.00 0.00 C ATOM 1741 C GLY A 133 -11.498 -1.549 -4.985 1.00 0.00 C ATOM 1742 O GLY A 133 -11.222 -2.496 -4.256 1.00 0.00 O ATOM 0 H GLY A 133 -9.380 -2.698 -5.609 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.976 -0.086 -5.271 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -10.870 -0.490 -6.724 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.714 -1.055 -5.103 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.833 -1.556 -4.318 1.00 0.00 C ATOM 1748 C TRP A 134 -14.243 -2.920 -4.787 1.00 0.00 C ATOM 1749 O TRP A 134 -14.422 -3.147 -5.996 1.00 0.00 O ATOM 1750 CB TRP A 134 -15.056 -0.629 -4.384 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.814 0.743 -3.861 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.697 1.892 -4.586 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.655 1.111 -2.493 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.477 2.949 -3.743 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.446 2.494 -2.456 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.671 0.401 -1.293 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.252 3.184 -1.274 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.478 1.089 -0.119 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.271 2.469 -0.118 1.00 0.00 C ATOM 0 H TRP A 134 -12.958 -0.298 -5.742 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.486 -1.600 -3.286 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.387 -0.557 -5.420 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.871 -1.082 -3.820 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.767 1.959 -5.662 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -14.356 3.920 -4.031 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.832 -0.667 -1.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -14.091 4.252 -1.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.487 0.553 0.818 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.123 2.980 0.822 1.00 0.00 H new ATOM 1770 N THR A 135 -14.363 -3.815 -3.866 1.00 0.00 N ATOM 1771 CA THR A 135 -14.823 -5.129 -4.155 1.00 0.00 C ATOM 1772 C THR A 135 -16.345 -5.117 -4.274 1.00 0.00 C ATOM 1773 O THR A 135 -16.998 -4.126 -3.915 1.00 0.00 O ATOM 1774 CB THR A 135 -14.412 -6.105 -3.027 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.950 -5.652 -1.766 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.900 -6.208 -2.920 1.00 0.00 C ATOM 0 H THR A 135 -14.143 -3.653 -2.883 1.00 0.00 H new ATOM 0 HA THR A 135 -14.376 -5.459 -5.092 1.00 0.00 H new ATOM 0 HB THR A 135 -14.813 -7.090 -3.268 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.831 -6.056 -1.622 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.638 -6.900 -2.120 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.493 -6.573 -3.863 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.483 -5.225 -2.700 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.881 -6.196 -4.788 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.313 -6.439 -4.859 1.00 0.00 C ATOM 1786 C ASN A 136 -19.020 -5.513 -5.852 1.00 0.00 C ATOM 1787 O ASN A 136 -18.890 -5.714 -7.069 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.980 -6.425 -3.450 1.00 0.00 C ATOM 1789 CG ASN A 136 -18.299 -7.378 -2.469 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -17.382 -6.988 -1.730 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -18.708 -8.614 -2.471 1.00 0.00 N ATOM 0 H ASN A 136 -16.324 -6.954 -5.181 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.436 -7.448 -5.252 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.950 -5.412 -3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -20.031 -6.698 -3.547 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -18.272 -9.297 -1.851 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.465 -8.900 -3.092 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.689 -4.478 -5.343 1.00 0.00 N ATOM 1799 CA ASP A 137 -20.490 -3.502 -6.117 1.00 0.00 C ATOM 1800 C ASP A 137 -21.245 -2.695 -5.062 1.00 0.00 C ATOM 1801 O ASP A 137 -20.817 -2.671 -3.907 1.00 0.00 O ATOM 1802 CB ASP A 137 -21.497 -4.223 -7.076 1.00 0.00 C ATOM 1803 CG ASP A 137 -22.123 -3.303 -8.134 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -21.532 -3.118 -9.220 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -23.227 -2.761 -7.901 1.00 0.00 O ATOM 0 H ASP A 137 -19.694 -4.280 -4.342 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.861 -2.878 -6.751 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -20.981 -5.040 -7.580 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -22.294 -4.669 -6.480 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.335 -2.064 -5.416 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.110 -1.288 -4.478 1.00 0.00 C ATOM 1812 C ILE A 138 -24.336 -2.099 -4.070 1.00 0.00 C ATOM 1813 O ILE A 138 -25.226 -2.306 -4.901 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.608 0.034 -5.133 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -22.434 0.823 -5.699 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.384 0.894 -4.111 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -22.846 1.965 -6.569 1.00 0.00 C ATOM 0 H ILE A 138 -22.712 -2.073 -6.364 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.482 -1.052 -3.619 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.283 -0.225 -5.949 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -21.832 1.204 -4.874 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.798 0.150 -6.274 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.722 1.812 -4.591 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -25.247 0.336 -3.746 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.732 1.141 -3.274 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -21.959 2.481 -6.936 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.423 1.589 -7.414 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -23.457 2.660 -5.993 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.382 -2.641 -2.828 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.576 -3.316 -2.336 1.00 0.00 C ATOM 1831 C PRO A 139 -26.762 -2.343 -2.372 1.00 0.00 C ATOM 1832 O PRO A 139 -26.628 -1.160 -2.022 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.225 -3.736 -0.897 1.00 0.00 C ATOM 1834 CG PRO A 139 -23.970 -3.011 -0.559 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.284 -2.682 -1.853 1.00 0.00 C ATOM 0 HA PRO A 139 -25.863 -4.179 -2.936 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.026 -3.474 -0.206 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -25.085 -4.815 -0.827 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.190 -2.102 0.002 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.328 -3.627 0.071 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -22.762 -1.727 -1.798 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.542 -3.436 -2.116 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.883 -2.830 -2.806 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.034 -1.989 -3.067 1.00 0.00 C ATOM 1845 C ILE A 140 -29.814 -1.758 -1.780 1.00 0.00 C ATOM 1846 O ILE A 140 -30.352 -2.705 -1.211 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.980 -2.607 -4.165 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.271 -2.820 -5.534 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.230 -1.762 -4.360 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.287 -3.981 -5.595 1.00 0.00 C ATOM 0 H ILE A 140 -28.037 -3.821 -2.993 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.665 -1.037 -3.448 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.264 -3.590 -3.788 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -30.034 -2.974 -6.297 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.740 -1.904 -5.794 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.861 -2.216 -5.124 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.781 -1.705 -3.421 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -30.945 -0.758 -4.675 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -27.852 -4.037 -6.593 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.495 -3.826 -4.862 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.809 -4.912 -5.374 1.00 0.00 H new ATOM 1862 N CYS A 141 -29.859 -0.519 -1.330 1.00 0.00 N ATOM 1863 CA CYS A 141 -30.537 -0.160 -0.093 1.00 0.00 C ATOM 1864 C CYS A 141 -32.056 -0.172 -0.309 1.00 0.00 C ATOM 1865 O CYS A 141 -32.631 0.774 -0.878 1.00 0.00 O ATOM 1866 CB CYS A 141 -30.071 1.213 0.386 1.00 0.00 C ATOM 1867 SG CYS A 141 -30.449 1.576 2.131 1.00 0.00 S ATOM 0 H CYS A 141 -29.427 0.270 -1.810 1.00 0.00 H new ATOM 0 HA CYS A 141 -30.288 -0.892 0.675 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -28.994 1.289 0.238 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -30.533 1.977 -0.239 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.666 -1.252 0.115 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.070 -1.553 -0.058 1.00 0.00 C ATOM 1874 C GLU A 142 -34.498 -2.511 1.064 1.00 0.00 C ATOM 1875 O GLU A 142 -34.549 -3.739 0.829 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.269 -2.225 -1.441 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.366 -1.287 -2.632 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.662 -0.533 -2.674 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.639 -1.046 -3.268 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -35.745 0.595 -2.153 1.00 0.00 O ATOM 1881 OXT GLU A 142 -34.720 -2.057 2.193 1.00 0.00 O ATOM 0 H GLU A 142 -32.170 -1.987 0.619 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.673 -0.646 -0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.440 -2.911 -1.611 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -35.177 -2.826 -1.403 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -33.539 -0.578 -2.598 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -34.255 -1.862 -3.551 1.00 0.00 H new