USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=32 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 91 THR OG1 : rot 156:sc= 1.92 USER MOD Set 1.2: A 112 TYR OH : rot 42:sc= 0.757 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.936 F(o=-2.9!,f=-0.94) USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 30 THR OG1 : rot 17:sc= 1.18 USER MOD Single : A 34 THR OG1 : rot 120:sc= -1.22 USER MOD Single : A 36 SER OG : rot 41:sc= 0.153 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN :FLIP amide:sc= -0.0622 F(o=-1.1!,f=-0.062) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot -85:sc= 0.154 USER MOD Single : A 46 THR OG1 : rot 85:sc= 0.305 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 50 TYR OH : rot 167:sc= 0.729 USER MOD Single : A 51 LYS NZ :NH3+ -106:sc= -0.267 (180deg=-1.77!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 100:sc= 1.05 USER MOD Single : A 61 ASN : amide:sc= 0.79 K(o=0.79,f=0) USER MOD Single : A 64 MET CE :methyl -117:sc= -1.36 (180deg=-2.04) USER MOD Single : A 68 LYS NZ :NH3+ -172:sc=-0.00487 (180deg=-0.0752) USER MOD Single : A 75 ASN :FLIP amide:sc=-0.00755 F(o=-0.69,f=-0.0076) USER MOD Single : A 79 LYS NZ :NH3+ -134:sc= -1.39 (180deg=-2.7!) USER MOD Single : A 81 GLN : amide:sc= -0.0304 K(o=-0.03,f=-0.84) USER MOD Single : A 82 LYS NZ :NH3+ 171:sc= 2.02 (180deg=1.94) USER MOD Single : A 87 HIS : no HD1:sc= -0.0922 X(o=-0.092,f=-0.54) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 78:sc= -3.22! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN :FLIP amide:sc= 0 F(o=-0.63,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.0962 USER MOD Single : A 115 ASN : amide:sc= -0.033 X(o=-0.033,f=-0.033) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 125 ASN : amide:sc= 0.00722 K(o=0.0072,f=-2.2!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -56:sc= 1.22 USER MOD Single : A 135 THR OG1 : rot 170:sc= 0.784 USER MOD Single : A 136 ASN : amide:sc= -0.509 X(o=-0.51,f=-0.061) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.532 -1.027 2.941 1.00 0.00 N ATOM 2 CA ASP A 20 29.957 -2.237 2.366 1.00 0.00 C ATOM 3 C ASP A 20 29.001 -2.891 3.348 1.00 0.00 C ATOM 4 O ASP A 20 29.313 -3.077 4.533 1.00 0.00 O ATOM 5 CB ASP A 20 31.036 -3.246 1.896 1.00 0.00 C ATOM 6 CG ASP A 20 31.952 -3.741 3.002 1.00 0.00 C ATOM 7 OD1 ASP A 20 32.963 -3.057 3.297 1.00 0.00 O ATOM 8 OD2 ASP A 20 31.704 -4.812 3.577 1.00 0.00 O ATOM 0 HA ASP A 20 29.402 -1.934 1.478 1.00 0.00 H new ATOM 0 HB2 ASP A 20 30.541 -4.103 1.439 1.00 0.00 H new ATOM 0 HB3 ASP A 20 31.642 -2.777 1.121 1.00 0.00 H new ATOM 13 N CYS A 21 27.838 -3.196 2.870 1.00 0.00 N ATOM 14 CA CYS A 21 26.813 -3.811 3.668 1.00 0.00 C ATOM 15 C CYS A 21 27.034 -5.294 3.671 1.00 0.00 C ATOM 16 O CYS A 21 27.303 -5.869 2.644 1.00 0.00 O ATOM 17 CB CYS A 21 25.435 -3.480 3.103 1.00 0.00 C ATOM 18 SG CYS A 21 25.086 -1.696 3.019 1.00 0.00 S ATOM 0 H CYS A 21 27.564 -3.025 1.902 1.00 0.00 H new ATOM 0 HA CYS A 21 26.860 -3.431 4.688 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.351 -3.905 2.103 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.675 -3.961 3.719 1.00 0.00 H new ATOM 23 N ASN A 22 26.966 -5.898 4.827 1.00 0.00 N ATOM 24 CA ASN A 22 27.195 -7.339 4.981 1.00 0.00 C ATOM 25 C ASN A 22 25.870 -8.042 5.238 1.00 0.00 C ATOM 26 O ASN A 22 25.813 -9.141 5.802 1.00 0.00 O ATOM 27 CB ASN A 22 28.172 -7.605 6.145 1.00 0.00 C ATOM 28 CG ASN A 22 29.628 -7.234 5.863 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.845 -6.224 5.068 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.547 -7.855 6.388 1.00 0.00 N flip ATOM 0 H ASN A 22 26.751 -5.417 5.701 1.00 0.00 H new ATOM 0 HA ASN A 22 27.636 -7.729 4.064 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.833 -7.048 7.018 1.00 0.00 H new ATOM 0 HB3 ASN A 22 28.126 -8.663 6.404 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.344 -8.641 7.006 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.514 -7.585 6.207 1.00 0.00 H new ATOM 37 N GLU A 23 24.830 -7.434 4.735 1.00 0.00 N ATOM 38 CA GLU A 23 23.456 -7.852 4.934 1.00 0.00 C ATOM 39 C GLU A 23 22.659 -7.271 3.828 1.00 0.00 C ATOM 40 O GLU A 23 23.112 -6.338 3.140 1.00 0.00 O ATOM 41 CB GLU A 23 22.968 -7.333 6.281 1.00 0.00 C ATOM 42 CG GLU A 23 23.040 -5.807 6.351 1.00 0.00 C ATOM 43 CD GLU A 23 22.809 -5.230 7.711 1.00 0.00 C ATOM 44 OE1 GLU A 23 21.652 -5.015 8.104 1.00 0.00 O ATOM 45 OE2 GLU A 23 23.792 -4.929 8.403 1.00 0.00 O ATOM 0 H GLU A 23 24.913 -6.601 4.152 1.00 0.00 H new ATOM 0 HA GLU A 23 23.361 -8.938 4.934 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.941 -7.658 6.447 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.572 -7.764 7.079 1.00 0.00 H new ATOM 0 HG2 GLU A 23 24.020 -5.487 5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 23 22.302 -5.391 5.665 1.00 0.00 H new ATOM 52 N LEU A 24 21.512 -7.818 3.648 1.00 0.00 N ATOM 53 CA LEU A 24 20.676 -7.502 2.583 1.00 0.00 C ATOM 54 C LEU A 24 19.611 -6.545 3.025 1.00 0.00 C ATOM 55 O LEU A 24 19.341 -6.412 4.234 1.00 0.00 O ATOM 56 CB LEU A 24 20.101 -8.818 2.007 1.00 0.00 C ATOM 57 CG LEU A 24 21.173 -9.821 1.622 1.00 0.00 C ATOM 58 CD1 LEU A 24 22.330 -9.174 0.961 1.00 0.00 C ATOM 59 CD2 LEU A 24 21.544 -10.621 2.783 1.00 0.00 C ATOM 0 H LEU A 24 21.128 -8.526 4.274 1.00 0.00 H new ATOM 0 HA LEU A 24 21.229 -6.997 1.791 1.00 0.00 H new ATOM 0 HB2 LEU A 24 19.437 -9.270 2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.495 -8.589 1.130 1.00 0.00 H new ATOM 0 HG LEU A 24 20.765 -10.501 0.874 1.00 0.00 H new ATOM 0 HD11 LEU A 24 23.072 -9.930 0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 24 21.996 -8.670 0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 24 22.775 -8.445 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 24 22.314 -11.339 2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 24 21.928 -9.968 3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 24 20.668 -11.155 3.152 1.00 0.00 H new ATOM 71 N PRO A 25 19.045 -5.832 2.084 1.00 0.00 N ATOM 72 CA PRO A 25 17.984 -4.878 2.347 1.00 0.00 C ATOM 73 C PRO A 25 16.771 -5.576 2.972 1.00 0.00 C ATOM 74 O PRO A 25 16.363 -6.653 2.519 1.00 0.00 O ATOM 75 CB PRO A 25 17.644 -4.317 0.964 1.00 0.00 C ATOM 76 CG PRO A 25 18.199 -5.306 0.000 1.00 0.00 C ATOM 77 CD PRO A 25 19.385 -5.915 0.670 1.00 0.00 C ATOM 0 HA PRO A 25 18.278 -4.101 3.052 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.567 -4.204 0.838 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.087 -3.332 0.818 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.458 -6.066 -0.248 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.485 -4.822 -0.934 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.542 -6.946 0.353 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.301 -5.369 0.443 1.00 0.00 H new ATOM 85 N PRO A 26 16.218 -5.004 4.036 1.00 0.00 N ATOM 86 CA PRO A 26 15.085 -5.593 4.751 1.00 0.00 C ATOM 87 C PRO A 26 13.784 -5.454 3.975 1.00 0.00 C ATOM 88 O PRO A 26 13.713 -4.758 2.968 1.00 0.00 O ATOM 89 CB PRO A 26 15.026 -4.765 6.038 1.00 0.00 C ATOM 90 CG PRO A 26 15.566 -3.434 5.648 1.00 0.00 C ATOM 91 CD PRO A 26 16.638 -3.712 4.635 1.00 0.00 C ATOM 0 HA PRO A 26 15.209 -6.663 4.915 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.005 -4.685 6.413 1.00 0.00 H new ATOM 0 HB3 PRO A 26 15.622 -5.219 6.830 1.00 0.00 H new ATOM 0 HG2 PRO A 26 14.784 -2.802 5.227 1.00 0.00 H new ATOM 0 HG3 PRO A 26 15.971 -2.907 6.512 1.00 0.00 H new ATOM 0 HD2 PRO A 26 16.698 -2.922 3.886 1.00 0.00 H new ATOM 0 HD3 PRO A 26 17.621 -3.785 5.100 1.00 0.00 H new ATOM 99 N ARG A 27 12.772 -6.105 4.439 1.00 0.00 N ATOM 100 CA ARG A 27 11.489 -6.008 3.836 1.00 0.00 C ATOM 101 C ARG A 27 10.562 -5.415 4.844 1.00 0.00 C ATOM 102 O ARG A 27 10.632 -5.746 6.025 1.00 0.00 O ATOM 103 CB ARG A 27 10.972 -7.348 3.234 1.00 0.00 C ATOM 104 CG ARG A 27 10.688 -8.518 4.180 1.00 0.00 C ATOM 105 CD ARG A 27 11.921 -9.042 4.862 1.00 0.00 C ATOM 106 NE ARG A 27 13.029 -9.321 3.930 1.00 0.00 N ATOM 107 CZ ARG A 27 14.333 -9.253 4.276 1.00 0.00 C ATOM 108 NH1 ARG A 27 14.679 -9.019 5.542 1.00 0.00 N ATOM 109 NH2 ARG A 27 15.278 -9.413 3.373 1.00 0.00 N ATOM 0 H ARG A 27 12.813 -6.722 5.251 1.00 0.00 H new ATOM 0 HA ARG A 27 11.550 -5.358 2.963 1.00 0.00 H new ATOM 0 HB2 ARG A 27 10.053 -7.133 2.689 1.00 0.00 H new ATOM 0 HB3 ARG A 27 11.705 -7.686 2.501 1.00 0.00 H new ATOM 0 HG2 ARG A 27 9.970 -8.199 4.936 1.00 0.00 H new ATOM 0 HG3 ARG A 27 10.221 -9.326 3.617 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.254 -8.316 5.604 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.669 -9.956 5.400 1.00 0.00 H new ATOM 0 HE ARG A 27 12.798 -9.580 2.971 1.00 0.00 H new ATOM 0 HH11 ARG A 27 13.958 -8.891 6.252 1.00 0.00 H new ATOM 0 HH12 ARG A 27 15.664 -8.968 5.800 1.00 0.00 H new ATOM 0 HH21 ARG A 27 15.029 -9.590 2.400 1.00 0.00 H new ATOM 0 HH22 ARG A 27 16.259 -9.359 3.647 1.00 0.00 H new ATOM 123 N ARG A 28 9.726 -4.545 4.409 1.00 0.00 N ATOM 124 CA ARG A 28 8.936 -3.765 5.317 1.00 0.00 C ATOM 125 C ARG A 28 7.481 -4.151 5.160 1.00 0.00 C ATOM 126 O ARG A 28 7.158 -5.040 4.361 1.00 0.00 O ATOM 127 CB ARG A 28 9.153 -2.273 5.035 1.00 0.00 C ATOM 128 CG ARG A 28 10.623 -1.890 4.845 1.00 0.00 C ATOM 129 CD ARG A 28 10.809 -0.398 4.656 1.00 0.00 C ATOM 130 NE ARG A 28 10.668 0.346 5.913 1.00 0.00 N ATOM 131 CZ ARG A 28 10.337 1.639 6.016 1.00 0.00 C ATOM 132 NH1 ARG A 28 9.808 2.286 4.982 1.00 0.00 N ATOM 133 NH2 ARG A 28 10.466 2.260 7.184 1.00 0.00 N ATOM 0 H ARG A 28 9.563 -4.347 3.422 1.00 0.00 H new ATOM 0 HA ARG A 28 9.237 -3.959 6.346 1.00 0.00 H new ATOM 0 HB2 ARG A 28 8.596 -1.997 4.140 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.739 -1.693 5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.197 -2.218 5.712 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.024 -2.416 3.979 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.795 -0.208 4.233 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.077 -0.032 3.936 1.00 0.00 H new ATOM 0 HE ARG A 28 10.836 -0.164 6.780 1.00 0.00 H new ATOM 0 HH11 ARG A 28 9.651 1.797 4.101 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.559 3.271 5.070 1.00 0.00 H new ATOM 0 HH21 ARG A 28 10.816 1.751 7.996 1.00 0.00 H new ATOM 0 HH22 ARG A 28 10.215 3.245 7.268 1.00 0.00 H new ATOM 147 N ASN A 29 6.603 -3.487 5.874 1.00 0.00 N ATOM 148 CA ASN A 29 5.193 -3.842 5.848 1.00 0.00 C ATOM 149 C ASN A 29 4.558 -3.412 4.540 1.00 0.00 C ATOM 150 O ASN A 29 3.583 -3.998 4.092 1.00 0.00 O ATOM 151 CB ASN A 29 4.434 -3.215 7.021 1.00 0.00 C ATOM 152 CG ASN A 29 3.025 -3.786 7.174 1.00 0.00 C ATOM 153 OD1 ASN A 29 2.776 -4.953 6.866 1.00 0.00 O ATOM 154 ND2 ASN A 29 2.105 -2.979 7.620 1.00 0.00 N ATOM 0 H ASN A 29 6.833 -2.700 6.480 1.00 0.00 H new ATOM 0 HA ASN A 29 5.129 -4.926 5.939 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.993 -3.381 7.942 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.372 -2.136 6.876 1.00 0.00 H new ATOM 0 HD21 ASN A 29 1.145 -3.307 7.723 1.00 0.00 H new ATOM 0 HD22 ASN A 29 2.345 -2.019 7.866 1.00 0.00 H new ATOM 161 N THR A 30 5.101 -2.393 3.930 1.00 0.00 N ATOM 162 CA THR A 30 4.575 -1.923 2.681 1.00 0.00 C ATOM 163 C THR A 30 5.574 -2.053 1.533 1.00 0.00 C ATOM 164 O THR A 30 5.260 -1.720 0.404 1.00 0.00 O ATOM 165 CB THR A 30 4.028 -0.472 2.797 1.00 0.00 C ATOM 166 OG1 THR A 30 4.983 0.389 3.443 1.00 0.00 O ATOM 167 CG2 THR A 30 2.738 -0.452 3.589 1.00 0.00 C ATOM 0 H THR A 30 5.907 -1.874 4.279 1.00 0.00 H new ATOM 0 HA THR A 30 3.736 -2.575 2.438 1.00 0.00 H new ATOM 0 HB THR A 30 3.844 -0.110 1.786 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.867 -0.034 3.428 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.370 0.572 3.660 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.994 -1.071 3.088 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.920 -0.842 4.590 1.00 0.00 H new ATOM 175 N GLU A 31 6.765 -2.577 1.816 1.00 0.00 N ATOM 176 CA GLU A 31 7.792 -2.658 0.795 1.00 0.00 C ATOM 177 C GLU A 31 8.452 -4.012 0.753 1.00 0.00 C ATOM 178 O GLU A 31 8.749 -4.616 1.785 1.00 0.00 O ATOM 179 CB GLU A 31 8.882 -1.597 0.959 1.00 0.00 C ATOM 180 CG GLU A 31 8.404 -0.171 0.976 1.00 0.00 C ATOM 181 CD GLU A 31 8.223 0.389 2.371 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.450 -0.166 3.176 1.00 0.00 O ATOM 183 OE2 GLU A 31 8.854 1.405 2.699 1.00 0.00 O ATOM 0 H GLU A 31 7.034 -2.944 2.729 1.00 0.00 H new ATOM 0 HA GLU A 31 7.263 -2.480 -0.141 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.418 -1.793 1.888 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.600 -1.711 0.147 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.118 0.449 0.434 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.456 -0.108 0.442 1.00 0.00 H new ATOM 190 N ILE A 32 8.709 -4.453 -0.446 1.00 0.00 N ATOM 191 CA ILE A 32 9.341 -5.739 -0.733 1.00 0.00 C ATOM 192 C ILE A 32 10.305 -5.478 -1.832 1.00 0.00 C ATOM 193 O ILE A 32 10.069 -4.628 -2.677 1.00 0.00 O ATOM 194 CB ILE A 32 8.298 -6.792 -1.237 1.00 0.00 C ATOM 195 CG1 ILE A 32 7.039 -6.820 -0.351 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.925 -8.187 -1.310 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.923 -7.684 -0.899 1.00 0.00 C ATOM 0 H ILE A 32 8.483 -3.921 -1.287 1.00 0.00 H new ATOM 0 HA ILE A 32 9.809 -6.137 0.167 1.00 0.00 H new ATOM 0 HB ILE A 32 7.994 -6.489 -2.239 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.312 -7.182 0.640 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.670 -5.802 -0.228 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.182 -8.902 -1.663 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.769 -8.171 -2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.271 -8.482 -0.320 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.071 -7.653 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.621 -7.310 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.272 -8.712 -0.995 1.00 0.00 H new ATOM 209 N LEU A 33 11.376 -6.167 -1.800 1.00 0.00 N ATOM 210 CA LEU A 33 12.394 -6.039 -2.776 1.00 0.00 C ATOM 211 C LEU A 33 11.930 -6.517 -4.120 1.00 0.00 C ATOM 212 O LEU A 33 11.182 -7.494 -4.224 1.00 0.00 O ATOM 213 CB LEU A 33 13.594 -6.837 -2.365 1.00 0.00 C ATOM 214 CG LEU A 33 14.485 -6.270 -1.299 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.997 -4.891 -1.647 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.915 -6.351 0.097 1.00 0.00 C ATOM 0 H LEU A 33 11.580 -6.856 -1.076 1.00 0.00 H new ATOM 0 HA LEU A 33 12.649 -4.982 -2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.246 -7.813 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.202 -7.007 -3.253 1.00 0.00 H new ATOM 0 HG LEU A 33 15.353 -6.929 -1.277 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.636 -4.527 -0.843 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.570 -4.939 -2.573 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.154 -4.212 -1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.623 -5.919 0.805 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.977 -5.798 0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.733 -7.394 0.356 1.00 0.00 H new ATOM 228 N THR A 34 12.354 -5.842 -5.134 1.00 0.00 N ATOM 229 CA THR A 34 12.020 -6.243 -6.476 1.00 0.00 C ATOM 230 C THR A 34 13.090 -7.185 -7.007 1.00 0.00 C ATOM 231 O THR A 34 12.826 -8.062 -7.841 1.00 0.00 O ATOM 232 CB THR A 34 11.893 -5.025 -7.398 1.00 0.00 C ATOM 233 OG1 THR A 34 13.072 -4.222 -7.291 1.00 0.00 O ATOM 234 CG2 THR A 34 10.678 -4.192 -7.038 1.00 0.00 C ATOM 0 H THR A 34 12.935 -5.006 -5.068 1.00 0.00 H new ATOM 0 HA THR A 34 11.058 -6.755 -6.455 1.00 0.00 H new ATOM 0 HB THR A 34 11.774 -5.379 -8.422 1.00 0.00 H new ATOM 0 HG1 THR A 34 13.504 -4.157 -8.168 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.613 -3.335 -7.708 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.778 -4.799 -7.137 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.768 -3.842 -6.010 1.00 0.00 H new ATOM 242 N GLY A 35 14.290 -7.006 -6.495 1.00 0.00 N ATOM 243 CA GLY A 35 15.411 -7.801 -6.895 1.00 0.00 C ATOM 244 C GLY A 35 15.619 -8.990 -5.992 1.00 0.00 C ATOM 245 O GLY A 35 14.905 -9.163 -4.986 1.00 0.00 O ATOM 0 H GLY A 35 14.506 -6.302 -5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 35 15.263 -8.146 -7.918 1.00 0.00 H new ATOM 0 HA3 GLY A 35 16.310 -7.185 -6.894 1.00 0.00 H new ATOM 249 N SER A 36 16.586 -9.779 -6.331 1.00 0.00 N ATOM 250 CA SER A 36 16.909 -10.982 -5.624 1.00 0.00 C ATOM 251 C SER A 36 18.283 -10.857 -4.963 1.00 0.00 C ATOM 252 O SER A 36 19.304 -10.752 -5.654 1.00 0.00 O ATOM 253 CB SER A 36 16.873 -12.137 -6.618 1.00 0.00 C ATOM 254 OG SER A 36 17.604 -11.799 -7.811 1.00 0.00 O ATOM 0 H SER A 36 17.193 -9.602 -7.131 1.00 0.00 H new ATOM 0 HA SER A 36 16.186 -11.165 -4.829 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.302 -13.030 -6.163 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.840 -12.373 -6.872 1.00 0.00 H new ATOM 0 HG SER A 36 18.422 -11.317 -7.568 1.00 0.00 H new ATOM 260 N TRP A 37 18.309 -10.873 -3.656 1.00 0.00 N ATOM 261 CA TRP A 37 19.541 -10.689 -2.911 1.00 0.00 C ATOM 262 C TRP A 37 19.895 -11.987 -2.266 1.00 0.00 C ATOM 263 O TRP A 37 19.193 -12.455 -1.367 1.00 0.00 O ATOM 264 CB TRP A 37 19.361 -9.608 -1.834 1.00 0.00 C ATOM 265 CG TRP A 37 18.714 -8.372 -2.379 1.00 0.00 C ATOM 266 CD1 TRP A 37 17.378 -8.139 -2.473 1.00 0.00 C ATOM 267 CD2 TRP A 37 19.360 -7.216 -2.927 1.00 0.00 C ATOM 268 NE1 TRP A 37 17.153 -6.928 -3.052 1.00 0.00 N ATOM 269 CE2 TRP A 37 18.346 -6.332 -3.330 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.688 -6.838 -3.110 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.615 -5.100 -3.908 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.956 -5.612 -3.681 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.922 -4.755 -4.073 1.00 0.00 C ATOM 0 H TRP A 37 17.483 -11.013 -3.074 1.00 0.00 H new ATOM 0 HA TRP A 37 20.335 -10.370 -3.586 1.00 0.00 H new ATOM 0 HB2 TRP A 37 18.755 -10.005 -1.020 1.00 0.00 H new ATOM 0 HB3 TRP A 37 20.333 -9.352 -1.412 1.00 0.00 H new ATOM 0 HD1 TRP A 37 16.607 -8.817 -2.137 1.00 0.00 H new ATOM 0 HE1 TRP A 37 16.235 -6.529 -3.247 1.00 0.00 H new ATOM 0 HE3 TRP A 37 21.493 -7.493 -2.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.818 -4.439 -4.216 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.982 -5.308 -3.828 1.00 0.00 H new ATOM 0 HH2 TRP A 37 20.165 -3.800 -4.516 1.00 0.00 H new ATOM 284 N SER A 38 20.936 -12.595 -2.728 1.00 0.00 N ATOM 285 CA SER A 38 21.312 -13.866 -2.193 1.00 0.00 C ATOM 286 C SER A 38 22.652 -13.780 -1.514 1.00 0.00 C ATOM 287 O SER A 38 23.180 -14.780 -1.031 1.00 0.00 O ATOM 288 CB SER A 38 21.350 -14.899 -3.307 1.00 0.00 C ATOM 289 OG SER A 38 20.141 -14.890 -4.073 1.00 0.00 O ATOM 0 H SER A 38 21.539 -12.238 -3.469 1.00 0.00 H new ATOM 0 HA SER A 38 20.573 -14.168 -1.450 1.00 0.00 H new ATOM 0 HB2 SER A 38 22.198 -14.698 -3.962 1.00 0.00 H new ATOM 0 HB3 SER A 38 21.504 -15.890 -2.880 1.00 0.00 H new ATOM 0 HG SER A 38 20.198 -15.564 -4.782 1.00 0.00 H new ATOM 295 N ASP A 39 23.201 -12.602 -1.457 1.00 0.00 N ATOM 296 CA ASP A 39 24.505 -12.456 -0.862 1.00 0.00 C ATOM 297 C ASP A 39 24.393 -11.913 0.509 1.00 0.00 C ATOM 298 O ASP A 39 23.416 -12.162 1.174 1.00 0.00 O ATOM 299 CB ASP A 39 25.492 -11.637 -1.725 1.00 0.00 C ATOM 300 CG ASP A 39 25.775 -12.210 -3.092 1.00 0.00 C ATOM 301 OD1 ASP A 39 26.415 -13.270 -3.186 1.00 0.00 O ATOM 302 OD2 ASP A 39 25.391 -11.576 -4.100 1.00 0.00 O ATOM 0 H ASP A 39 22.780 -11.741 -1.807 1.00 0.00 H new ATOM 0 HA ASP A 39 24.935 -13.456 -0.806 1.00 0.00 H new ATOM 0 HB2 ASP A 39 25.095 -10.629 -1.846 1.00 0.00 H new ATOM 0 HB3 ASP A 39 26.434 -11.546 -1.184 1.00 0.00 H new ATOM 307 N GLN A 40 25.448 -11.312 0.975 1.00 0.00 N ATOM 308 CA GLN A 40 25.443 -10.556 2.190 1.00 0.00 C ATOM 309 C GLN A 40 26.144 -9.283 1.916 1.00 0.00 C ATOM 310 O GLN A 40 25.577 -8.209 2.027 1.00 0.00 O ATOM 311 CB GLN A 40 26.132 -11.259 3.354 1.00 0.00 C ATOM 312 CG GLN A 40 25.471 -12.526 3.830 1.00 0.00 C ATOM 313 CD GLN A 40 26.044 -13.010 5.143 1.00 0.00 C ATOM 314 OE1 GLN A 40 26.400 -12.098 6.016 1.00 0.00 O flip ATOM 315 NE2 GLN A 40 26.103 -14.208 5.396 1.00 0.00 N flip ATOM 0 H GLN A 40 26.355 -11.335 0.510 1.00 0.00 H new ATOM 0 HA GLN A 40 24.406 -10.412 2.492 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.155 -11.492 3.060 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.191 -10.564 4.192 1.00 0.00 H new ATOM 0 HG2 GLN A 40 24.401 -12.355 3.944 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.591 -13.303 3.075 1.00 0.00 H new ATOM 0 HE21 GLN A 40 25.818 -14.892 4.695 1.00 0.00 H new ATOM 0 HE22 GLN A 40 26.437 -14.521 6.308 1.00 0.00 H new ATOM 324 N THR A 41 27.365 -9.415 1.507 1.00 0.00 N ATOM 325 CA THR A 41 28.191 -8.310 1.259 1.00 0.00 C ATOM 326 C THR A 41 27.912 -7.702 -0.111 1.00 0.00 C ATOM 327 O THR A 41 27.939 -8.386 -1.153 1.00 0.00 O ATOM 328 CB THR A 41 29.671 -8.688 1.449 1.00 0.00 C ATOM 329 OG1 THR A 41 30.023 -9.762 0.565 1.00 0.00 O ATOM 330 CG2 THR A 41 29.892 -9.159 2.874 1.00 0.00 C ATOM 0 H THR A 41 27.811 -10.317 1.337 1.00 0.00 H new ATOM 0 HA THR A 41 27.960 -7.535 1.989 1.00 0.00 H new ATOM 0 HB THR A 41 30.285 -7.813 1.234 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.967 -9.994 0.692 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.940 -9.427 3.010 1.00 0.00 H new ATOM 0 HG22 THR A 41 29.629 -8.359 3.566 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.266 -10.030 3.071 1.00 0.00 H new ATOM 338 N TYR A 42 27.551 -6.456 -0.078 1.00 0.00 N ATOM 339 CA TYR A 42 27.301 -5.669 -1.242 1.00 0.00 C ATOM 340 C TYR A 42 28.073 -4.386 -1.142 1.00 0.00 C ATOM 341 O TYR A 42 28.239 -3.847 -0.039 1.00 0.00 O ATOM 342 CB TYR A 42 25.802 -5.384 -1.439 1.00 0.00 C ATOM 343 CG TYR A 42 25.042 -6.519 -2.075 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.523 -7.546 -1.320 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.851 -6.558 -3.449 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.832 -8.579 -1.909 1.00 0.00 C ATOM 347 CE2 TYR A 42 24.157 -7.589 -4.043 1.00 0.00 C ATOM 348 CZ TYR A 42 23.650 -8.601 -3.260 1.00 0.00 C ATOM 349 OH TYR A 42 22.948 -9.640 -3.827 1.00 0.00 O ATOM 0 H TYR A 42 27.418 -5.942 0.793 1.00 0.00 H new ATOM 0 HA TYR A 42 27.630 -6.234 -2.114 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.355 -5.158 -0.471 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.690 -4.493 -2.057 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.660 -7.541 -0.249 1.00 0.00 H new ATOM 0 HD2 TYR A 42 25.254 -5.766 -4.063 1.00 0.00 H new ATOM 0 HE1 TYR A 42 23.432 -9.376 -1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 42 24.012 -7.603 -5.113 1.00 0.00 H new ATOM 0 HH TYR A 42 23.553 -10.394 -3.989 1.00 0.00 H new ATOM 359 N PRO A 43 28.560 -3.882 -2.273 1.00 0.00 N ATOM 360 CA PRO A 43 29.352 -2.667 -2.311 1.00 0.00 C ATOM 361 C PRO A 43 28.514 -1.455 -1.930 1.00 0.00 C ATOM 362 O PRO A 43 27.300 -1.384 -2.267 1.00 0.00 O ATOM 363 CB PRO A 43 29.800 -2.574 -3.780 1.00 0.00 C ATOM 364 CG PRO A 43 28.797 -3.373 -4.540 1.00 0.00 C ATOM 365 CD PRO A 43 28.349 -4.456 -3.614 1.00 0.00 C ATOM 0 HA PRO A 43 30.186 -2.687 -1.609 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.821 -1.539 -4.122 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.805 -2.974 -3.912 1.00 0.00 H new ATOM 0 HG2 PRO A 43 27.957 -2.752 -4.850 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.236 -3.791 -5.446 1.00 0.00 H new ATOM 0 HD2 PRO A 43 27.303 -4.715 -3.778 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.929 -5.368 -3.755 1.00 0.00 H new ATOM 373 N GLU A 44 29.127 -0.520 -1.227 1.00 0.00 N ATOM 374 CA GLU A 44 28.450 0.683 -0.824 1.00 0.00 C ATOM 375 C GLU A 44 28.054 1.453 -2.079 1.00 0.00 C ATOM 376 O GLU A 44 28.823 1.509 -3.053 1.00 0.00 O ATOM 377 CB GLU A 44 29.353 1.542 0.054 1.00 0.00 C ATOM 378 CG GLU A 44 28.629 2.694 0.714 1.00 0.00 C ATOM 379 CD GLU A 44 29.544 3.675 1.382 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.607 4.001 0.823 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.219 4.142 2.474 1.00 0.00 O ATOM 0 H GLU A 44 30.100 -0.579 -0.925 1.00 0.00 H new ATOM 0 HA GLU A 44 27.564 0.427 -0.242 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.801 0.915 0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.169 1.935 -0.552 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.035 3.216 -0.036 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.932 2.299 1.453 1.00 0.00 H new ATOM 388 N GLY A 45 26.872 2.000 -2.074 1.00 0.00 N ATOM 389 CA GLY A 45 26.388 2.693 -3.231 1.00 0.00 C ATOM 390 C GLY A 45 25.403 1.848 -4.001 1.00 0.00 C ATOM 391 O GLY A 45 24.889 2.260 -5.043 1.00 0.00 O ATOM 0 H GLY A 45 26.228 1.979 -1.283 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.912 3.625 -2.927 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.226 2.958 -3.876 1.00 0.00 H new ATOM 395 N THR A 46 25.126 0.667 -3.489 1.00 0.00 N ATOM 396 CA THR A 46 24.178 -0.219 -4.131 1.00 0.00 C ATOM 397 C THR A 46 22.763 0.083 -3.723 1.00 0.00 C ATOM 398 O THR A 46 22.417 -0.009 -2.559 1.00 0.00 O ATOM 399 CB THR A 46 24.524 -1.710 -3.930 1.00 0.00 C ATOM 400 OG1 THR A 46 25.795 -1.999 -4.519 1.00 0.00 O ATOM 401 CG2 THR A 46 23.455 -2.637 -4.507 1.00 0.00 C ATOM 0 H THR A 46 25.542 0.299 -2.633 1.00 0.00 H new ATOM 0 HA THR A 46 24.257 -0.025 -5.201 1.00 0.00 H new ATOM 0 HB THR A 46 24.565 -1.893 -2.856 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.508 -1.778 -3.884 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.745 -3.675 -4.340 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.502 -2.443 -4.016 1.00 0.00 H new ATOM 0 HG23 THR A 46 23.355 -2.456 -5.577 1.00 0.00 H new ATOM 409 N GLN A 47 21.968 0.467 -4.695 1.00 0.00 N ATOM 410 CA GLN A 47 20.606 0.831 -4.472 1.00 0.00 C ATOM 411 C GLN A 47 19.695 -0.395 -4.492 1.00 0.00 C ATOM 412 O GLN A 47 19.978 -1.390 -5.164 1.00 0.00 O ATOM 413 CB GLN A 47 20.173 1.874 -5.504 1.00 0.00 C ATOM 414 CG GLN A 47 20.141 1.367 -6.934 1.00 0.00 C ATOM 415 CD GLN A 47 19.937 2.469 -7.948 1.00 0.00 C ATOM 416 OE1 GLN A 47 19.319 3.549 -7.551 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 20.381 2.358 -9.083 1.00 0.00 N flip ATOM 0 H GLN A 47 22.261 0.533 -5.670 1.00 0.00 H new ATOM 0 HA GLN A 47 20.518 1.273 -3.480 1.00 0.00 H new ATOM 0 HB2 GLN A 47 19.181 2.239 -5.239 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.851 2.725 -5.449 1.00 0.00 H new ATOM 0 HG2 GLN A 47 21.076 0.850 -7.151 1.00 0.00 H new ATOM 0 HG3 GLN A 47 19.340 0.635 -7.036 1.00 0.00 H new ATOM 0 HE21 GLN A 47 20.859 1.501 -9.362 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.273 3.122 -9.750 1.00 0.00 H new ATOM 426 N ALA A 48 18.641 -0.318 -3.746 1.00 0.00 N ATOM 427 CA ALA A 48 17.669 -1.360 -3.652 1.00 0.00 C ATOM 428 C ALA A 48 16.336 -0.809 -4.071 1.00 0.00 C ATOM 429 O ALA A 48 15.925 0.260 -3.613 1.00 0.00 O ATOM 430 CB ALA A 48 17.597 -1.901 -2.236 1.00 0.00 C ATOM 0 H ALA A 48 18.426 0.495 -3.168 1.00 0.00 H new ATOM 0 HA ALA A 48 17.952 -2.184 -4.307 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.850 -2.694 -2.187 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.570 -2.300 -1.949 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.319 -1.098 -1.553 1.00 0.00 H new ATOM 436 N ILE A 49 15.687 -1.504 -4.950 1.00 0.00 N ATOM 437 CA ILE A 49 14.412 -1.086 -5.467 1.00 0.00 C ATOM 438 C ILE A 49 13.321 -1.863 -4.745 1.00 0.00 C ATOM 439 O ILE A 49 13.438 -3.090 -4.555 1.00 0.00 O ATOM 440 CB ILE A 49 14.332 -1.367 -6.989 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.537 -0.734 -7.701 1.00 0.00 C ATOM 442 CG2 ILE A 49 13.025 -0.816 -7.570 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.667 -1.123 -9.157 1.00 0.00 C ATOM 0 H ILE A 49 16.025 -2.386 -5.336 1.00 0.00 H new ATOM 0 HA ILE A 49 14.283 -0.016 -5.306 1.00 0.00 H new ATOM 0 HB ILE A 49 14.351 -2.445 -7.147 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.458 0.351 -7.631 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.448 -1.022 -7.176 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.987 -1.023 -8.640 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.178 -1.294 -7.078 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.980 0.261 -7.407 1.00 0.00 H new ATOM 0 HD11 ILE A 49 16.541 -0.635 -9.587 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.779 -2.204 -9.236 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.774 -0.810 -9.698 1.00 0.00 H new ATOM 455 N TYR A 50 12.314 -1.167 -4.300 1.00 0.00 N ATOM 456 CA TYR A 50 11.216 -1.786 -3.608 1.00 0.00 C ATOM 457 C TYR A 50 9.911 -1.642 -4.347 1.00 0.00 C ATOM 458 O TYR A 50 9.644 -0.619 -5.008 1.00 0.00 O ATOM 459 CB TYR A 50 11.053 -1.203 -2.215 1.00 0.00 C ATOM 460 CG TYR A 50 12.098 -1.623 -1.223 1.00 0.00 C ATOM 461 CD1 TYR A 50 13.286 -0.932 -1.090 1.00 0.00 C ATOM 462 CD2 TYR A 50 11.882 -2.711 -0.405 1.00 0.00 C ATOM 463 CE1 TYR A 50 14.222 -1.316 -0.166 1.00 0.00 C ATOM 464 CE2 TYR A 50 12.804 -3.093 0.523 1.00 0.00 C ATOM 465 CZ TYR A 50 13.975 -2.391 0.642 1.00 0.00 C ATOM 466 OH TYR A 50 14.903 -2.773 1.571 1.00 0.00 O ATOM 0 H TYR A 50 12.229 -0.156 -4.406 1.00 0.00 H new ATOM 0 HA TYR A 50 11.461 -2.846 -3.544 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.061 -0.116 -2.290 1.00 0.00 H new ATOM 0 HB3 TYR A 50 10.074 -1.489 -1.831 1.00 0.00 H new ATOM 0 HD1 TYR A 50 13.480 -0.078 -1.722 1.00 0.00 H new ATOM 0 HD2 TYR A 50 10.964 -3.272 -0.501 1.00 0.00 H new ATOM 0 HE1 TYR A 50 15.151 -0.772 -0.076 1.00 0.00 H new ATOM 0 HE2 TYR A 50 12.613 -3.944 1.161 1.00 0.00 H new ATOM 0 HH TYR A 50 14.499 -3.413 2.193 1.00 0.00 H new ATOM 476 N LYS A 51 9.118 -2.680 -4.252 1.00 0.00 N ATOM 477 CA LYS A 51 7.773 -2.679 -4.723 1.00 0.00 C ATOM 478 C LYS A 51 6.917 -2.317 -3.538 1.00 0.00 C ATOM 479 O LYS A 51 7.194 -2.752 -2.410 1.00 0.00 O ATOM 480 CB LYS A 51 7.353 -4.057 -5.297 1.00 0.00 C ATOM 481 CG LYS A 51 7.392 -5.200 -4.310 1.00 0.00 C ATOM 482 CD LYS A 51 6.991 -6.563 -4.901 1.00 0.00 C ATOM 483 CE LYS A 51 5.533 -6.644 -5.403 1.00 0.00 C ATOM 484 NZ LYS A 51 5.336 -6.070 -6.757 1.00 0.00 N ATOM 0 H LYS A 51 9.405 -3.565 -3.834 1.00 0.00 H new ATOM 0 HA LYS A 51 7.658 -1.968 -5.541 1.00 0.00 H new ATOM 0 HB2 LYS A 51 6.341 -3.975 -5.695 1.00 0.00 H new ATOM 0 HB3 LYS A 51 8.006 -4.299 -6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 51 8.399 -5.277 -3.901 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.727 -4.969 -3.478 1.00 0.00 H new ATOM 0 HD2 LYS A 51 7.660 -6.795 -5.730 1.00 0.00 H new ATOM 0 HD3 LYS A 51 7.143 -7.331 -4.143 1.00 0.00 H new ATOM 0 HE2 LYS A 51 5.218 -7.688 -5.411 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.886 -6.121 -4.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.848 -5.155 -6.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 6.260 -5.932 -7.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.761 -6.721 -7.330 1.00 0.00 H new ATOM 498 N CYS A 52 5.904 -1.566 -3.769 1.00 0.00 N ATOM 499 CA CYS A 52 5.037 -1.080 -2.704 1.00 0.00 C ATOM 500 C CYS A 52 3.932 -2.050 -2.367 1.00 0.00 C ATOM 501 O CYS A 52 2.905 -1.653 -1.860 1.00 0.00 O ATOM 502 CB CYS A 52 4.433 0.242 -3.118 1.00 0.00 C ATOM 503 SG CYS A 52 5.612 1.614 -3.121 1.00 0.00 S ATOM 0 H CYS A 52 5.632 -1.256 -4.702 1.00 0.00 H new ATOM 0 HA CYS A 52 5.651 -0.964 -1.811 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.007 0.139 -4.116 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.611 0.483 -2.443 1.00 0.00 H new ATOM 508 N ARG A 53 4.181 -3.330 -2.592 1.00 0.00 N ATOM 509 CA ARG A 53 3.159 -4.377 -2.427 1.00 0.00 C ATOM 510 C ARG A 53 1.971 -4.149 -3.391 1.00 0.00 C ATOM 511 O ARG A 53 1.859 -3.098 -4.045 1.00 0.00 O ATOM 512 CB ARG A 53 2.632 -4.454 -0.959 1.00 0.00 C ATOM 513 CG ARG A 53 3.529 -5.174 0.017 1.00 0.00 C ATOM 514 CD ARG A 53 2.925 -5.181 1.414 1.00 0.00 C ATOM 515 NE ARG A 53 1.568 -5.768 1.465 1.00 0.00 N ATOM 516 CZ ARG A 53 0.704 -5.627 2.496 1.00 0.00 C ATOM 517 NH1 ARG A 53 1.070 -4.985 3.616 1.00 0.00 N ATOM 518 NH2 ARG A 53 -0.509 -6.150 2.410 1.00 0.00 N ATOM 0 H ARG A 53 5.090 -3.682 -2.893 1.00 0.00 H new ATOM 0 HA ARG A 53 3.641 -5.325 -2.667 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.470 -3.439 -0.596 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.661 -4.949 -0.966 1.00 0.00 H new ATOM 0 HG2 ARG A 53 3.688 -6.199 -0.319 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.506 -4.691 0.042 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.580 -5.740 2.082 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.885 -4.158 1.789 1.00 0.00 H new ATOM 0 HE ARG A 53 1.261 -6.320 0.664 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.010 -4.596 3.697 1.00 0.00 H new ATOM 0 HH12 ARG A 53 0.409 -4.886 4.386 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.788 -6.656 1.569 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -1.165 -6.047 3.184 1.00 0.00 H new ATOM 532 N PRO A 54 1.113 -5.129 -3.558 1.00 0.00 N ATOM 533 CA PRO A 54 -0.100 -4.919 -4.287 1.00 0.00 C ATOM 534 C PRO A 54 -1.111 -4.166 -3.405 1.00 0.00 C ATOM 535 O PRO A 54 -1.473 -4.630 -2.318 1.00 0.00 O ATOM 536 CB PRO A 54 -0.577 -6.335 -4.622 1.00 0.00 C ATOM 537 CG PRO A 54 0.030 -7.218 -3.588 1.00 0.00 C ATOM 538 CD PRO A 54 1.275 -6.532 -3.108 1.00 0.00 C ATOM 0 HA PRO A 54 0.026 -4.314 -5.185 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.665 -6.397 -4.601 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.260 -6.629 -5.623 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.664 -7.381 -2.763 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.265 -8.197 -4.005 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.371 -6.594 -2.024 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.170 -6.986 -3.534 1.00 0.00 H new ATOM 546 N GLY A 55 -1.501 -2.982 -3.830 1.00 0.00 N ATOM 547 CA GLY A 55 -2.476 -2.226 -3.075 1.00 0.00 C ATOM 548 C GLY A 55 -1.967 -0.878 -2.638 1.00 0.00 C ATOM 549 O GLY A 55 -2.743 0.038 -2.391 1.00 0.00 O ATOM 0 H GLY A 55 -1.164 -2.529 -4.680 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.371 -2.091 -3.682 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.770 -2.799 -2.196 1.00 0.00 H new ATOM 553 N TYR A 56 -0.689 -0.734 -2.549 1.00 0.00 N ATOM 554 CA TYR A 56 -0.127 0.536 -2.181 1.00 0.00 C ATOM 555 C TYR A 56 0.409 1.221 -3.412 1.00 0.00 C ATOM 556 O TYR A 56 0.277 0.701 -4.526 1.00 0.00 O ATOM 557 CB TYR A 56 0.938 0.384 -1.093 1.00 0.00 C ATOM 558 CG TYR A 56 0.396 -0.133 0.222 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.287 -1.497 0.475 1.00 0.00 C ATOM 560 CD2 TYR A 56 -0.021 0.747 1.202 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.227 -1.960 1.672 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.529 0.295 2.399 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.633 -1.055 2.629 1.00 0.00 C ATOM 564 OH TYR A 56 -1.150 -1.497 3.822 1.00 0.00 O ATOM 0 H TYR A 56 -0.008 -1.473 -2.724 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.909 1.162 -1.752 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.713 -0.295 -1.448 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.413 1.350 -0.925 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.609 -2.204 -0.275 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.053 1.810 1.026 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.310 -3.021 1.856 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.845 0.999 3.154 1.00 0.00 H new ATOM 0 HH TYR A 56 -1.385 -0.728 4.382 1.00 0.00 H new ATOM 574 N ARG A 57 0.939 2.382 -3.236 1.00 0.00 N ATOM 575 CA ARG A 57 1.492 3.162 -4.305 1.00 0.00 C ATOM 576 C ARG A 57 2.510 4.105 -3.710 1.00 0.00 C ATOM 577 O ARG A 57 2.786 4.047 -2.516 1.00 0.00 O ATOM 578 CB ARG A 57 0.400 4.001 -5.010 1.00 0.00 C ATOM 579 CG ARG A 57 -0.279 5.007 -4.087 1.00 0.00 C ATOM 580 CD ARG A 57 -1.082 6.033 -4.845 1.00 0.00 C ATOM 581 NE ARG A 57 -1.681 7.009 -3.929 1.00 0.00 N ATOM 582 CZ ARG A 57 -2.159 8.213 -4.280 1.00 0.00 C ATOM 583 NH1 ARG A 57 -2.098 8.624 -5.548 1.00 0.00 N ATOM 584 NH2 ARG A 57 -2.690 9.004 -3.354 1.00 0.00 N ATOM 0 H ARG A 57 1.005 2.833 -2.323 1.00 0.00 H new ATOM 0 HA ARG A 57 1.940 2.493 -5.039 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.847 4.533 -5.850 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.354 3.330 -5.422 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.933 4.477 -3.395 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.477 5.513 -3.487 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.440 6.546 -5.561 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.866 5.537 -5.418 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.739 6.752 -2.944 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.685 8.021 -6.260 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.464 9.541 -5.805 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.733 8.695 -2.383 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.055 9.920 -3.614 1.00 0.00 H new ATOM 598 N SER A 58 3.029 4.954 -4.522 1.00 0.00 N ATOM 599 CA SER A 58 3.924 5.983 -4.129 1.00 0.00 C ATOM 600 C SER A 58 4.107 6.838 -5.349 1.00 0.00 C ATOM 601 O SER A 58 3.677 6.446 -6.443 1.00 0.00 O ATOM 602 CB SER A 58 5.263 5.383 -3.637 1.00 0.00 C ATOM 603 OG SER A 58 6.137 6.380 -3.133 1.00 0.00 O ATOM 0 H SER A 58 2.833 4.951 -5.523 1.00 0.00 H new ATOM 0 HA SER A 58 3.539 6.570 -3.295 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.066 4.646 -2.859 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.748 4.857 -4.459 1.00 0.00 H new ATOM 0 HG SER A 58 6.099 6.384 -2.154 1.00 0.00 H new ATOM 609 N LEU A 59 4.705 7.978 -5.197 1.00 0.00 N ATOM 610 CA LEU A 59 4.944 8.868 -6.316 1.00 0.00 C ATOM 611 C LEU A 59 6.275 8.519 -6.991 1.00 0.00 C ATOM 612 O LEU A 59 6.810 9.275 -7.804 1.00 0.00 O ATOM 613 CB LEU A 59 4.912 10.313 -5.838 1.00 0.00 C ATOM 614 CG LEU A 59 3.574 10.806 -5.267 1.00 0.00 C ATOM 615 CD1 LEU A 59 3.701 12.232 -4.772 1.00 0.00 C ATOM 616 CD2 LEU A 59 2.470 10.704 -6.310 1.00 0.00 C ATOM 0 H LEU A 59 5.045 8.328 -4.301 1.00 0.00 H new ATOM 0 HA LEU A 59 4.157 8.744 -7.060 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.679 10.439 -5.073 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.187 10.957 -6.673 1.00 0.00 H new ATOM 0 HG LEU A 59 3.309 10.167 -4.424 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.744 12.565 -4.371 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.458 12.279 -3.990 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.993 12.880 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.532 11.059 -5.883 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.729 11.315 -7.175 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.358 9.665 -6.620 1.00 0.00 H new ATOM 628 N GLY A 60 6.765 7.362 -6.650 1.00 0.00 N ATOM 629 CA GLY A 60 7.957 6.802 -7.186 1.00 0.00 C ATOM 630 C GLY A 60 8.105 5.434 -6.602 1.00 0.00 C ATOM 631 O GLY A 60 7.093 4.770 -6.334 1.00 0.00 O ATOM 0 H GLY A 60 6.318 6.761 -5.958 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.903 6.752 -8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.819 7.422 -6.937 1.00 0.00 H new ATOM 635 N ASN A 61 9.302 5.014 -6.372 1.00 0.00 N ATOM 636 CA ASN A 61 9.546 3.752 -5.708 1.00 0.00 C ATOM 637 C ASN A 61 10.439 3.998 -4.549 1.00 0.00 C ATOM 638 O ASN A 61 11.227 4.951 -4.566 1.00 0.00 O ATOM 639 CB ASN A 61 10.186 2.704 -6.643 1.00 0.00 C ATOM 640 CG ASN A 61 9.209 2.070 -7.617 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.973 2.587 -8.706 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.681 0.917 -7.260 1.00 0.00 N ATOM 0 H ASN A 61 10.146 5.524 -6.633 1.00 0.00 H new ATOM 0 HA ASN A 61 8.587 3.346 -5.387 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.990 3.177 -7.207 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.640 1.920 -6.037 1.00 0.00 H new ATOM 0 HD21 ASN A 61 8.054 0.424 -7.896 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.899 0.517 -6.347 1.00 0.00 H new ATOM 649 N VAL A 62 10.306 3.197 -3.521 1.00 0.00 N ATOM 650 CA VAL A 62 11.183 3.306 -2.392 1.00 0.00 C ATOM 651 C VAL A 62 12.530 2.766 -2.792 1.00 0.00 C ATOM 652 O VAL A 62 12.716 1.563 -2.950 1.00 0.00 O ATOM 653 CB VAL A 62 10.644 2.567 -1.141 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.633 2.643 0.021 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.324 3.166 -0.729 1.00 0.00 C ATOM 0 H VAL A 62 9.599 2.465 -3.447 1.00 0.00 H new ATOM 0 HA VAL A 62 11.257 4.356 -2.109 1.00 0.00 H new ATOM 0 HB VAL A 62 10.508 1.517 -1.399 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.224 2.115 0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.576 2.182 -0.273 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.806 3.687 0.284 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.947 2.645 0.151 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.461 4.222 -0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.608 3.065 -1.545 1.00 0.00 H new ATOM 665 N ILE A 63 13.418 3.657 -3.070 1.00 0.00 N ATOM 666 CA ILE A 63 14.728 3.295 -3.447 1.00 0.00 C ATOM 667 C ILE A 63 15.622 3.461 -2.256 1.00 0.00 C ATOM 668 O ILE A 63 15.726 4.555 -1.687 1.00 0.00 O ATOM 669 CB ILE A 63 15.251 4.152 -4.640 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.295 4.054 -5.847 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.664 3.725 -5.049 1.00 0.00 C ATOM 672 CD1 ILE A 63 14.072 2.644 -6.357 1.00 0.00 C ATOM 0 H ILE A 63 13.248 4.662 -3.040 1.00 0.00 H new ATOM 0 HA ILE A 63 14.724 2.258 -3.783 1.00 0.00 H new ATOM 0 HB ILE A 63 15.289 5.190 -4.309 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.332 4.483 -5.568 1.00 0.00 H new ATOM 0 HG13 ILE A 63 14.692 4.663 -6.660 1.00 0.00 H new ATOM 0 HG21 ILE A 63 17.003 4.340 -5.883 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.342 3.853 -4.205 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.655 2.678 -5.351 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.388 2.668 -7.205 1.00 0.00 H new ATOM 0 HD12 ILE A 63 15.024 2.216 -6.671 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.644 2.033 -5.562 1.00 0.00 H new ATOM 684 N MET A 64 16.202 2.395 -1.839 1.00 0.00 N ATOM 685 CA MET A 64 17.146 2.423 -0.760 1.00 0.00 C ATOM 686 C MET A 64 18.516 2.236 -1.318 1.00 0.00 C ATOM 687 O MET A 64 18.654 2.055 -2.512 1.00 0.00 O ATOM 688 CB MET A 64 16.825 1.398 0.332 1.00 0.00 C ATOM 689 CG MET A 64 15.605 1.776 1.167 1.00 0.00 C ATOM 690 SD MET A 64 15.245 0.626 2.518 1.00 0.00 S ATOM 691 CE MET A 64 16.771 0.680 3.445 1.00 0.00 C ATOM 0 H MET A 64 16.040 1.468 -2.233 1.00 0.00 H new ATOM 0 HA MET A 64 17.085 3.393 -0.267 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.655 0.425 -0.130 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.689 1.293 0.988 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.758 2.772 1.583 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.735 1.834 0.513 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.236 -0.306 3.439 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.448 1.403 2.990 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.562 0.976 4.473 1.00 0.00 H new ATOM 701 N VAL A 65 19.516 2.321 -0.504 1.00 0.00 N ATOM 702 CA VAL A 65 20.873 2.152 -0.969 1.00 0.00 C ATOM 703 C VAL A 65 21.802 1.832 0.200 1.00 0.00 C ATOM 704 O VAL A 65 21.581 2.271 1.327 1.00 0.00 O ATOM 705 CB VAL A 65 21.379 3.406 -1.792 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.546 4.598 -0.946 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.664 3.159 -2.526 1.00 0.00 C ATOM 0 H VAL A 65 19.428 2.507 0.495 1.00 0.00 H new ATOM 0 HA VAL A 65 20.887 1.306 -1.656 1.00 0.00 H new ATOM 0 HB VAL A 65 20.592 3.583 -2.525 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.894 5.431 -1.556 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.591 4.857 -0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.277 4.390 -0.165 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.952 4.060 -3.068 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.446 2.899 -1.813 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.529 2.339 -3.231 1.00 0.00 H new ATOM 717 N CYS A 66 22.763 1.012 -0.074 1.00 0.00 N ATOM 718 CA CYS A 66 23.779 0.622 0.865 1.00 0.00 C ATOM 719 C CYS A 66 24.700 1.798 1.116 1.00 0.00 C ATOM 720 O CYS A 66 25.276 2.344 0.165 1.00 0.00 O ATOM 721 CB CYS A 66 24.577 -0.543 0.270 1.00 0.00 C ATOM 722 SG CYS A 66 25.962 -1.116 1.283 1.00 0.00 S ATOM 0 H CYS A 66 22.872 0.576 -0.990 1.00 0.00 H new ATOM 0 HA CYS A 66 23.325 0.313 1.807 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.899 -1.380 0.101 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.960 -0.241 -0.705 1.00 0.00 H new ATOM 727 N ARG A 67 24.815 2.217 2.360 1.00 0.00 N ATOM 728 CA ARG A 67 25.673 3.315 2.708 1.00 0.00 C ATOM 729 C ARG A 67 26.196 3.138 4.132 1.00 0.00 C ATOM 730 O ARG A 67 25.413 2.987 5.074 1.00 0.00 O ATOM 731 CB ARG A 67 24.928 4.649 2.574 1.00 0.00 C ATOM 732 CG ARG A 67 25.837 5.848 2.693 1.00 0.00 C ATOM 733 CD ARG A 67 25.090 7.154 2.571 1.00 0.00 C ATOM 734 NE ARG A 67 26.018 8.290 2.589 1.00 0.00 N ATOM 735 CZ ARG A 67 25.699 9.548 2.915 1.00 0.00 C ATOM 736 NH1 ARG A 67 24.463 9.858 3.310 1.00 0.00 N ATOM 737 NH2 ARG A 67 26.616 10.496 2.832 1.00 0.00 N ATOM 0 H ARG A 67 24.317 1.804 3.149 1.00 0.00 H new ATOM 0 HA ARG A 67 26.518 3.327 2.020 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.420 4.680 1.610 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.157 4.707 3.343 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.352 5.816 3.653 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.603 5.798 1.919 1.00 0.00 H new ATOM 0 HD2 ARG A 67 24.515 7.164 1.645 1.00 0.00 H new ATOM 0 HD3 ARG A 67 24.377 7.248 3.390 1.00 0.00 H new ATOM 0 HE ARG A 67 26.988 8.106 2.331 1.00 0.00 H new ATOM 0 HH11 ARG A 67 23.748 9.132 3.366 1.00 0.00 H new ATOM 0 HH12 ARG A 67 24.233 10.821 3.556 1.00 0.00 H new ATOM 0 HH21 ARG A 67 27.560 10.267 2.521 1.00 0.00 H new ATOM 0 HH22 ARG A 67 26.380 11.457 3.079 1.00 0.00 H new ATOM 751 N LYS A 68 27.519 3.149 4.277 1.00 0.00 N ATOM 752 CA LYS A 68 28.237 3.008 5.567 1.00 0.00 C ATOM 753 C LYS A 68 27.972 1.684 6.250 1.00 0.00 C ATOM 754 O LYS A 68 28.154 1.544 7.470 1.00 0.00 O ATOM 755 CB LYS A 68 27.913 4.142 6.505 1.00 0.00 C ATOM 756 CG LYS A 68 28.218 5.511 5.931 1.00 0.00 C ATOM 757 CD LYS A 68 29.682 5.657 5.540 1.00 0.00 C ATOM 758 CE LYS A 68 30.635 5.510 6.721 1.00 0.00 C ATOM 759 NZ LYS A 68 30.393 6.531 7.769 1.00 0.00 N ATOM 0 H LYS A 68 28.151 3.259 3.484 1.00 0.00 H new ATOM 0 HA LYS A 68 29.298 3.041 5.319 1.00 0.00 H new ATOM 0 HB2 LYS A 68 26.856 4.095 6.767 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.477 4.011 7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 68 27.591 5.684 5.056 1.00 0.00 H new ATOM 0 HG3 LYS A 68 27.961 6.276 6.664 1.00 0.00 H new ATOM 0 HD2 LYS A 68 29.927 4.907 4.788 1.00 0.00 H new ATOM 0 HD3 LYS A 68 29.833 6.633 5.079 1.00 0.00 H new ATOM 0 HE2 LYS A 68 30.524 4.515 7.153 1.00 0.00 H new ATOM 0 HE3 LYS A 68 31.663 5.591 6.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 31.146 6.479 8.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 30.390 7.477 7.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 29.473 6.354 8.221 1.00 0.00 H new ATOM 773 N GLY A 69 27.572 0.720 5.481 1.00 0.00 N ATOM 774 CA GLY A 69 27.343 -0.583 6.015 1.00 0.00 C ATOM 775 C GLY A 69 25.897 -0.829 6.327 1.00 0.00 C ATOM 776 O GLY A 69 25.509 -1.963 6.639 1.00 0.00 O ATOM 0 H GLY A 69 27.397 0.812 4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 69 27.690 -1.331 5.302 1.00 0.00 H new ATOM 0 HA3 GLY A 69 27.934 -0.710 6.922 1.00 0.00 H new ATOM 780 N GLU A 70 25.086 0.200 6.282 1.00 0.00 N ATOM 781 CA GLU A 70 23.681 0.008 6.509 1.00 0.00 C ATOM 782 C GLU A 70 22.899 0.360 5.264 1.00 0.00 C ATOM 783 O GLU A 70 23.380 1.095 4.400 1.00 0.00 O ATOM 784 CB GLU A 70 23.173 0.824 7.703 1.00 0.00 C ATOM 785 CG GLU A 70 23.320 2.323 7.555 1.00 0.00 C ATOM 786 CD GLU A 70 22.619 3.084 8.648 1.00 0.00 C ATOM 787 OE1 GLU A 70 21.390 3.300 8.552 1.00 0.00 O ATOM 788 OE2 GLU A 70 23.269 3.476 9.628 1.00 0.00 O ATOM 0 H GLU A 70 25.371 1.161 6.094 1.00 0.00 H new ATOM 0 HA GLU A 70 23.529 -1.045 6.746 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.121 0.590 7.864 1.00 0.00 H new ATOM 0 HB3 GLU A 70 23.710 0.507 8.597 1.00 0.00 H new ATOM 0 HG2 GLU A 70 24.379 2.583 7.558 1.00 0.00 H new ATOM 0 HG3 GLU A 70 22.919 2.630 6.589 1.00 0.00 H new ATOM 795 N TRP A 71 21.728 -0.172 5.154 1.00 0.00 N ATOM 796 CA TRP A 71 20.867 0.172 4.066 1.00 0.00 C ATOM 797 C TRP A 71 20.047 1.369 4.459 1.00 0.00 C ATOM 798 O TRP A 71 19.275 1.327 5.427 1.00 0.00 O ATOM 799 CB TRP A 71 19.998 -1.016 3.617 1.00 0.00 C ATOM 800 CG TRP A 71 20.780 -2.104 2.936 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.438 -3.139 3.523 1.00 0.00 C ATOM 802 CD2 TRP A 71 20.978 -2.256 1.523 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.050 -3.912 2.564 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.784 -3.394 1.331 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.554 -1.539 0.408 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.178 -3.828 0.059 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.941 -1.972 -0.843 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.746 -3.102 -1.007 1.00 0.00 C ATOM 0 H TRP A 71 21.340 -0.852 5.808 1.00 0.00 H new ATOM 0 HA TRP A 71 21.471 0.429 3.196 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.490 -1.434 4.486 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.225 -0.655 2.938 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.475 -3.327 4.586 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.614 -4.742 2.746 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.935 -0.661 0.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.799 -4.702 -0.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.614 -1.425 -1.715 1.00 0.00 H new ATOM 0 HH2 TRP A 71 22.032 -3.406 -2.003 1.00 0.00 H new ATOM 819 N VAL A 72 20.239 2.433 3.741 1.00 0.00 N ATOM 820 CA VAL A 72 19.589 3.690 4.001 1.00 0.00 C ATOM 821 C VAL A 72 18.667 3.992 2.850 1.00 0.00 C ATOM 822 O VAL A 72 18.671 3.269 1.870 1.00 0.00 O ATOM 823 CB VAL A 72 20.612 4.855 4.162 1.00 0.00 C ATOM 824 CG1 VAL A 72 21.620 4.552 5.244 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.320 5.179 2.853 1.00 0.00 C ATOM 0 H VAL A 72 20.867 2.456 2.937 1.00 0.00 H new ATOM 0 HA VAL A 72 19.038 3.607 4.938 1.00 0.00 H new ATOM 0 HB VAL A 72 20.041 5.736 4.457 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.320 5.383 5.332 1.00 0.00 H new ATOM 0 HG12 VAL A 72 21.103 4.410 6.193 1.00 0.00 H new ATOM 0 HG13 VAL A 72 22.166 3.644 4.989 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.023 5.996 3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 72 21.860 4.299 2.504 1.00 0.00 H new ATOM 0 HG23 VAL A 72 20.584 5.474 2.105 1.00 0.00 H new ATOM 835 N ALA A 73 17.900 5.030 2.946 1.00 0.00 N ATOM 836 CA ALA A 73 17.010 5.383 1.886 1.00 0.00 C ATOM 837 C ALA A 73 17.675 6.364 0.940 1.00 0.00 C ATOM 838 O ALA A 73 18.204 7.381 1.367 1.00 0.00 O ATOM 839 CB ALA A 73 15.715 5.958 2.437 1.00 0.00 C ATOM 0 H ALA A 73 17.872 5.653 3.754 1.00 0.00 H new ATOM 0 HA ALA A 73 16.766 4.479 1.328 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.053 6.220 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.229 5.217 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 73 15.934 6.850 3.024 1.00 0.00 H new ATOM 845 N LEU A 74 17.688 6.023 -0.337 1.00 0.00 N ATOM 846 CA LEU A 74 18.178 6.905 -1.380 1.00 0.00 C ATOM 847 C LEU A 74 17.145 7.981 -1.486 1.00 0.00 C ATOM 848 O LEU A 74 17.447 9.167 -1.486 1.00 0.00 O ATOM 849 CB LEU A 74 18.237 6.126 -2.709 1.00 0.00 C ATOM 850 CG LEU A 74 18.935 6.764 -3.945 1.00 0.00 C ATOM 851 CD1 LEU A 74 18.351 8.096 -4.405 1.00 0.00 C ATOM 852 CD2 LEU A 74 20.442 6.818 -3.792 1.00 0.00 C ATOM 0 H LEU A 74 17.357 5.121 -0.680 1.00 0.00 H new ATOM 0 HA LEU A 74 19.171 7.300 -1.165 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.733 5.177 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.211 5.895 -2.997 1.00 0.00 H new ATOM 0 HG LEU A 74 18.711 6.078 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.906 8.457 -5.271 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.304 7.960 -4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.425 8.824 -3.597 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.882 7.271 -4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.698 7.414 -2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.832 5.807 -3.670 1.00 0.00 H new ATOM 864 N ASN A 75 15.911 7.543 -1.562 1.00 0.00 N ATOM 865 CA ASN A 75 14.795 8.433 -1.622 1.00 0.00 C ATOM 866 C ASN A 75 14.001 8.358 -0.322 1.00 0.00 C ATOM 867 O ASN A 75 13.085 7.548 -0.212 1.00 0.00 O ATOM 868 CB ASN A 75 13.856 8.110 -2.805 1.00 0.00 C ATOM 869 CG ASN A 75 14.375 8.482 -4.187 1.00 0.00 C ATOM 870 OD1 ASN A 75 15.051 9.593 -4.302 1.00 0.00 O flip ATOM 871 ND2 ASN A 75 14.088 7.791 -5.169 1.00 0.00 N flip ATOM 0 H ASN A 75 15.660 6.555 -1.584 1.00 0.00 H new ATOM 0 HA ASN A 75 15.191 9.438 -1.768 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.644 7.041 -2.794 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.909 8.625 -2.643 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.559 6.928 -5.048 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.380 8.084 -6.101 1.00 0.00 H new ATOM 878 N PRO A 76 14.349 9.165 0.703 1.00 0.00 N ATOM 879 CA PRO A 76 13.633 9.157 1.990 1.00 0.00 C ATOM 880 C PRO A 76 12.220 9.738 1.858 1.00 0.00 C ATOM 881 O PRO A 76 11.343 9.506 2.698 1.00 0.00 O ATOM 882 CB PRO A 76 14.503 10.037 2.895 1.00 0.00 C ATOM 883 CG PRO A 76 15.267 10.912 1.961 1.00 0.00 C ATOM 884 CD PRO A 76 15.476 10.121 0.711 1.00 0.00 C ATOM 0 HA PRO A 76 13.494 8.148 2.379 1.00 0.00 H new ATOM 0 HB2 PRO A 76 13.892 10.627 3.578 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.173 9.433 3.507 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.717 11.829 1.752 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.221 11.205 2.398 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.465 10.759 -0.172 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.437 9.606 0.720 1.00 0.00 H new ATOM 892 N LEU A 77 12.000 10.481 0.786 1.00 0.00 N ATOM 893 CA LEU A 77 10.702 11.059 0.512 1.00 0.00 C ATOM 894 C LEU A 77 9.782 10.037 -0.114 1.00 0.00 C ATOM 895 O LEU A 77 8.564 10.226 -0.177 1.00 0.00 O ATOM 896 CB LEU A 77 10.801 12.315 -0.371 1.00 0.00 C ATOM 897 CG LEU A 77 11.382 13.584 0.281 1.00 0.00 C ATOM 898 CD1 LEU A 77 10.642 13.919 1.558 1.00 0.00 C ATOM 899 CD2 LEU A 77 12.871 13.465 0.543 1.00 0.00 C ATOM 0 H LEU A 77 12.712 10.697 0.088 1.00 0.00 H new ATOM 0 HA LEU A 77 10.280 11.369 1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.412 12.071 -1.240 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.802 12.550 -0.739 1.00 0.00 H new ATOM 0 HG LEU A 77 11.243 14.399 -0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.069 14.819 2.001 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.589 14.090 1.334 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.734 13.090 2.260 1.00 0.00 H new ATOM 0 HD21 LEU A 77 13.234 14.384 1.003 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.057 12.626 1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.394 13.300 -0.399 1.00 0.00 H new ATOM 911 N ARG A 78 10.345 8.952 -0.564 1.00 0.00 N ATOM 912 CA ARG A 78 9.552 7.914 -1.137 1.00 0.00 C ATOM 913 C ARG A 78 9.247 6.882 -0.120 1.00 0.00 C ATOM 914 O ARG A 78 10.133 6.325 0.518 1.00 0.00 O ATOM 915 CB ARG A 78 10.171 7.286 -2.368 1.00 0.00 C ATOM 916 CG ARG A 78 10.317 8.228 -3.535 1.00 0.00 C ATOM 917 CD ARG A 78 8.998 8.869 -3.929 1.00 0.00 C ATOM 918 NE ARG A 78 9.174 9.803 -5.042 1.00 0.00 N ATOM 919 CZ ARG A 78 8.491 10.952 -5.195 1.00 0.00 C ATOM 920 NH1 ARG A 78 7.572 11.323 -4.298 1.00 0.00 N ATOM 921 NH2 ARG A 78 8.741 11.732 -6.231 1.00 0.00 N ATOM 0 H ARG A 78 11.348 8.768 -0.543 1.00 0.00 H new ATOM 0 HA ARG A 78 8.627 8.382 -1.473 1.00 0.00 H new ATOM 0 HB2 ARG A 78 11.154 6.894 -2.107 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.560 6.437 -2.675 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.036 9.008 -3.282 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.723 7.685 -4.388 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.284 8.095 -4.210 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.576 9.395 -3.073 1.00 0.00 H new ATOM 0 HE ARG A 78 9.865 9.565 -5.754 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.383 10.733 -3.488 1.00 0.00 H new ATOM 0 HH12 ARG A 78 7.060 12.196 -4.424 1.00 0.00 H new ATOM 0 HH21 ARG A 78 9.450 11.463 -6.913 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.225 12.604 -6.349 1.00 0.00 H new ATOM 935 N LYS A 79 8.003 6.668 0.046 1.00 0.00 N ATOM 936 CA LYS A 79 7.477 5.712 0.961 1.00 0.00 C ATOM 937 C LYS A 79 6.228 5.189 0.344 1.00 0.00 C ATOM 938 O LYS A 79 5.595 5.897 -0.461 1.00 0.00 O ATOM 939 CB LYS A 79 7.217 6.369 2.323 1.00 0.00 C ATOM 940 CG LYS A 79 6.270 7.551 2.281 1.00 0.00 C ATOM 941 CD LYS A 79 6.348 8.424 3.544 1.00 0.00 C ATOM 942 CE LYS A 79 7.620 9.313 3.613 1.00 0.00 C ATOM 943 NZ LYS A 79 8.895 8.584 3.886 1.00 0.00 N ATOM 0 H LYS A 79 7.282 7.172 -0.471 1.00 0.00 H new ATOM 0 HA LYS A 79 8.175 4.895 1.146 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.812 5.619 3.002 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.169 6.697 2.741 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.498 8.162 1.408 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.249 7.188 2.158 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.466 9.063 3.588 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.318 7.779 4.423 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.721 9.847 2.668 1.00 0.00 H new ATOM 0 HE3 LYS A 79 7.477 10.064 4.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 9.435 9.090 4.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.681 7.622 4.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 9.459 8.532 3.014 1.00 0.00 H new ATOM 957 N CYS A 80 5.887 3.995 0.651 1.00 0.00 N ATOM 958 CA CYS A 80 4.752 3.386 0.053 1.00 0.00 C ATOM 959 C CYS A 80 3.502 3.701 0.829 1.00 0.00 C ATOM 960 O CYS A 80 3.320 3.284 1.979 1.00 0.00 O ATOM 961 CB CYS A 80 4.976 1.899 -0.158 1.00 0.00 C ATOM 962 SG CYS A 80 6.402 1.554 -1.254 1.00 0.00 S ATOM 0 H CYS A 80 6.383 3.409 1.323 1.00 0.00 H new ATOM 0 HA CYS A 80 4.608 3.811 -0.940 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.139 1.419 0.807 1.00 0.00 H new ATOM 0 HB3 CYS A 80 4.077 1.456 -0.587 1.00 0.00 H new ATOM 967 N GLN A 81 2.670 4.460 0.190 1.00 0.00 N ATOM 968 CA GLN A 81 1.453 4.974 0.754 1.00 0.00 C ATOM 969 C GLN A 81 0.290 4.259 0.127 1.00 0.00 C ATOM 970 O GLN A 81 0.475 3.497 -0.815 1.00 0.00 O ATOM 971 CB GLN A 81 1.380 6.470 0.475 1.00 0.00 C ATOM 972 CG GLN A 81 2.442 7.263 1.213 1.00 0.00 C ATOM 973 CD GLN A 81 2.593 8.677 0.705 1.00 0.00 C ATOM 974 OE1 GLN A 81 2.411 8.955 -0.488 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.884 9.587 1.593 1.00 0.00 N ATOM 0 H GLN A 81 2.821 4.752 -0.775 1.00 0.00 H new ATOM 0 HA GLN A 81 1.426 4.813 1.832 1.00 0.00 H new ATOM 0 HB2 GLN A 81 1.487 6.640 -0.596 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.395 6.840 0.760 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.193 7.290 2.274 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.398 6.748 1.123 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.027 9.321 2.567 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.968 10.564 1.313 1.00 0.00 H new ATOM 984 N LYS A 82 -0.885 4.484 0.612 1.00 0.00 N ATOM 985 CA LYS A 82 -2.033 3.811 0.071 1.00 0.00 C ATOM 986 C LYS A 82 -2.533 4.483 -1.181 1.00 0.00 C ATOM 987 O LYS A 82 -2.223 5.649 -1.460 1.00 0.00 O ATOM 988 CB LYS A 82 -3.159 3.721 1.078 1.00 0.00 C ATOM 989 CG LYS A 82 -2.866 2.843 2.267 1.00 0.00 C ATOM 990 CD LYS A 82 -4.087 2.735 3.124 1.00 0.00 C ATOM 991 CE LYS A 82 -3.889 1.844 4.326 1.00 0.00 C ATOM 992 NZ LYS A 82 -5.168 1.666 5.043 1.00 0.00 N ATOM 0 H LYS A 82 -1.082 5.126 1.380 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.706 2.801 -0.178 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.393 4.725 1.433 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.050 3.345 0.575 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.555 1.853 1.933 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.040 3.259 2.844 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.377 3.730 3.461 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.911 2.349 2.525 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.502 0.875 4.010 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.147 2.281 4.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.057 0.935 5.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.443 2.564 5.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.905 1.374 4.370 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.262 3.738 -1.954 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.905 4.274 -3.110 1.00 0.00 C ATOM 1008 C ARG A 83 -5.310 4.662 -2.706 1.00 0.00 C ATOM 1009 O ARG A 83 -5.888 4.017 -1.822 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.927 3.248 -4.258 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.696 1.967 -3.955 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.557 0.962 -5.080 1.00 0.00 C ATOM 1013 NE ARG A 83 -3.144 0.632 -5.334 1.00 0.00 N ATOM 1014 CZ ARG A 83 -2.693 -0.114 -6.346 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -3.538 -0.639 -7.217 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -1.390 -0.348 -6.463 1.00 0.00 N ATOM 0 H ARG A 83 -3.427 2.743 -1.800 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.360 5.143 -3.477 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.365 3.718 -5.139 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.900 2.987 -4.513 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.328 1.530 -3.027 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.750 2.201 -3.801 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -5.105 0.054 -4.828 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.007 1.365 -5.987 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.453 1.004 -4.683 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.540 -0.475 -7.118 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.188 -1.208 -7.988 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.739 0.042 -5.781 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -1.041 -0.917 -7.234 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.850 5.736 -3.261 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.218 6.129 -2.988 1.00 0.00 C ATOM 1032 C PRO A 84 -8.176 5.170 -3.708 1.00 0.00 C ATOM 1033 O PRO A 84 -7.764 4.434 -4.613 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.312 7.539 -3.576 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.294 7.549 -4.664 1.00 0.00 C ATOM 1036 CD PRO A 84 -5.181 6.658 -4.190 1.00 0.00 C ATOM 0 HA PRO A 84 -7.480 6.103 -1.930 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.310 7.744 -3.963 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -7.099 8.299 -2.824 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.717 7.182 -5.599 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.933 8.560 -4.852 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.714 6.125 -5.018 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.395 7.227 -3.694 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.419 5.160 -3.328 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.340 4.185 -3.909 1.00 0.00 C ATOM 1046 C CYS A 85 -11.461 4.817 -4.726 1.00 0.00 C ATOM 1047 O CYS A 85 -12.331 4.112 -5.263 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.907 3.355 -2.801 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.630 2.726 -1.693 1.00 0.00 S ATOM 0 H CYS A 85 -9.826 5.791 -2.638 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.776 3.571 -4.611 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.618 3.952 -2.230 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.462 2.518 -3.225 1.00 0.00 H new ATOM 1054 N GLY A 86 -11.449 6.120 -4.824 1.00 0.00 N ATOM 1055 CA GLY A 86 -12.471 6.809 -5.555 1.00 0.00 C ATOM 1056 C GLY A 86 -13.776 6.841 -4.797 1.00 0.00 C ATOM 1057 O GLY A 86 -13.842 6.450 -3.625 1.00 0.00 O ATOM 0 H GLY A 86 -10.741 6.723 -4.405 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.146 7.828 -5.762 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -12.622 6.321 -6.518 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.796 7.276 -5.453 1.00 0.00 N ATOM 1062 CA HIS A 87 -16.111 7.392 -4.848 1.00 0.00 C ATOM 1063 C HIS A 87 -16.888 6.070 -5.004 1.00 0.00 C ATOM 1064 O HIS A 87 -17.175 5.645 -6.118 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.884 8.579 -5.474 1.00 0.00 C ATOM 1066 CG HIS A 87 -18.241 8.842 -4.868 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -18.441 9.676 -3.793 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -19.462 8.372 -5.198 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -19.722 9.699 -3.485 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -20.362 8.916 -4.322 1.00 0.00 N ATOM 0 H HIS A 87 -14.758 7.567 -6.430 1.00 0.00 H new ATOM 0 HA HIS A 87 -15.998 7.590 -3.782 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -16.278 9.480 -5.378 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -17.008 8.391 -6.540 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -19.688 7.691 -6.005 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.169 10.265 -2.681 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -21.367 8.741 -4.320 1.00 0.00 H new ATOM 1079 N PRO A 88 -17.236 5.416 -3.889 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.956 4.155 -3.902 1.00 0.00 C ATOM 1081 C PRO A 88 -19.472 4.327 -3.945 1.00 0.00 C ATOM 1082 O PRO A 88 -20.121 4.655 -2.933 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.522 3.503 -2.591 1.00 0.00 C ATOM 1084 CG PRO A 88 -17.269 4.644 -1.657 1.00 0.00 C ATOM 1085 CD PRO A 88 -16.942 5.851 -2.511 1.00 0.00 C ATOM 0 HA PRO A 88 -17.730 3.567 -4.792 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.296 2.841 -2.204 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.625 2.899 -2.728 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.145 4.836 -1.037 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.445 4.414 -0.982 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.547 6.713 -2.229 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.898 6.144 -2.401 1.00 0.00 H new ATOM 1093 N GLY A 89 -20.028 4.124 -5.103 1.00 0.00 N ATOM 1094 CA GLY A 89 -21.445 4.151 -5.254 1.00 0.00 C ATOM 1095 C GLY A 89 -21.998 5.508 -5.552 1.00 0.00 C ATOM 1096 O GLY A 89 -21.783 6.455 -4.811 1.00 0.00 O ATOM 0 H GLY A 89 -19.512 3.936 -5.962 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -21.728 3.470 -6.057 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -21.905 3.775 -4.340 1.00 0.00 H new ATOM 1100 N ASP A 90 -22.741 5.598 -6.620 1.00 0.00 N ATOM 1101 CA ASP A 90 -23.398 6.845 -7.022 1.00 0.00 C ATOM 1102 C ASP A 90 -24.791 6.908 -6.381 1.00 0.00 C ATOM 1103 O ASP A 90 -25.654 7.671 -6.791 1.00 0.00 O ATOM 1104 CB ASP A 90 -23.530 6.910 -8.554 1.00 0.00 C ATOM 1105 CG ASP A 90 -24.530 5.911 -9.104 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -24.250 4.689 -9.087 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -25.613 6.328 -9.567 1.00 0.00 O ATOM 0 H ASP A 90 -22.919 4.815 -7.249 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.797 7.691 -6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -23.832 7.916 -8.845 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -22.555 6.726 -9.006 1.00 0.00 H new ATOM 1112 N THR A 91 -24.963 6.112 -5.351 1.00 0.00 N ATOM 1113 CA THR A 91 -26.206 5.972 -4.638 1.00 0.00 C ATOM 1114 C THR A 91 -26.671 7.310 -4.003 1.00 0.00 C ATOM 1115 O THR A 91 -25.862 8.073 -3.453 1.00 0.00 O ATOM 1116 CB THR A 91 -26.074 4.891 -3.529 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.310 4.745 -2.812 1.00 0.00 O ATOM 1118 CG2 THR A 91 -24.942 5.231 -2.556 1.00 0.00 C ATOM 0 H THR A 91 -24.216 5.527 -4.977 1.00 0.00 H new ATOM 0 HA THR A 91 -26.958 5.666 -5.365 1.00 0.00 H new ATOM 0 HB THR A 91 -25.835 3.946 -4.017 1.00 0.00 H new ATOM 0 HG1 THR A 91 -27.349 3.855 -2.405 1.00 0.00 H new ATOM 0 HG21 THR A 91 -24.874 4.457 -1.792 1.00 0.00 H new ATOM 0 HG22 THR A 91 -23.999 5.287 -3.100 1.00 0.00 H new ATOM 0 HG23 THR A 91 -25.145 6.191 -2.082 1.00 0.00 H new ATOM 1126 N PRO A 92 -27.951 7.656 -4.147 1.00 0.00 N ATOM 1127 CA PRO A 92 -28.524 8.812 -3.481 1.00 0.00 C ATOM 1128 C PRO A 92 -29.223 8.439 -2.153 1.00 0.00 C ATOM 1129 O PRO A 92 -29.691 9.312 -1.415 1.00 0.00 O ATOM 1130 CB PRO A 92 -29.541 9.303 -4.500 1.00 0.00 C ATOM 1131 CG PRO A 92 -30.007 8.067 -5.214 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.920 7.023 -5.066 1.00 0.00 C ATOM 0 HA PRO A 92 -27.773 9.551 -3.202 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -30.372 9.814 -4.013 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -29.092 10.014 -5.194 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.944 7.708 -4.789 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -30.195 8.279 -6.266 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -29.312 6.092 -4.656 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.463 6.781 -6.026 1.00 0.00 H new ATOM 1140 N PHE A 93 -29.294 7.155 -1.852 1.00 0.00 N ATOM 1141 CA PHE A 93 -29.975 6.699 -0.639 1.00 0.00 C ATOM 1142 C PHE A 93 -28.998 6.052 0.327 1.00 0.00 C ATOM 1143 O PHE A 93 -29.143 6.160 1.548 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.081 5.692 -0.980 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.096 6.195 -1.963 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -33.073 7.094 -1.576 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -32.063 5.775 -3.280 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -33.999 7.562 -2.485 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -32.981 6.238 -4.192 1.00 0.00 C ATOM 1150 CZ PHE A 93 -33.951 7.133 -3.796 1.00 0.00 C ATOM 0 H PHE A 93 -28.894 6.409 -2.421 1.00 0.00 H new ATOM 0 HA PHE A 93 -30.416 7.577 -0.167 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -30.622 4.788 -1.381 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -31.593 5.408 -0.061 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -33.111 7.433 -0.551 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.305 5.073 -3.596 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -34.759 8.262 -2.172 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -32.942 5.901 -5.217 1.00 0.00 H new ATOM 0 HZ PHE A 93 -34.673 7.499 -4.511 1.00 0.00 H new ATOM 1160 N GLY A 94 -28.007 5.395 -0.216 1.00 0.00 N ATOM 1161 CA GLY A 94 -27.074 4.689 0.592 1.00 0.00 C ATOM 1162 C GLY A 94 -25.982 5.560 1.137 1.00 0.00 C ATOM 1163 O GLY A 94 -25.447 6.428 0.451 1.00 0.00 O ATOM 0 H GLY A 94 -27.833 5.340 -1.220 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -27.604 4.221 1.422 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -26.629 3.886 0.004 1.00 0.00 H new ATOM 1167 N THR A 95 -25.670 5.330 2.354 1.00 0.00 N ATOM 1168 CA THR A 95 -24.613 5.997 3.036 1.00 0.00 C ATOM 1169 C THR A 95 -23.604 4.955 3.483 1.00 0.00 C ATOM 1170 O THR A 95 -23.954 3.768 3.608 1.00 0.00 O ATOM 1171 CB THR A 95 -25.169 6.811 4.221 1.00 0.00 C ATOM 1172 OG1 THR A 95 -26.334 6.139 4.772 1.00 0.00 O ATOM 1173 CG2 THR A 95 -25.543 8.224 3.782 1.00 0.00 C ATOM 0 H THR A 95 -26.159 4.646 2.932 1.00 0.00 H new ATOM 0 HA THR A 95 -24.117 6.707 2.374 1.00 0.00 H new ATOM 0 HB THR A 95 -24.395 6.884 4.985 1.00 0.00 H new ATOM 0 HG1 THR A 95 -26.684 6.657 5.526 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.933 8.779 4.635 1.00 0.00 H new ATOM 0 HG22 THR A 95 -24.659 8.730 3.393 1.00 0.00 H new ATOM 0 HG23 THR A 95 -26.304 8.174 3.004 1.00 0.00 H new ATOM 1181 N PHE A 96 -22.385 5.346 3.690 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.367 4.392 4.031 1.00 0.00 C ATOM 1183 C PHE A 96 -20.597 4.795 5.262 1.00 0.00 C ATOM 1184 O PHE A 96 -20.605 5.963 5.656 1.00 0.00 O ATOM 1185 CB PHE A 96 -20.403 4.155 2.845 1.00 0.00 C ATOM 1186 CG PHE A 96 -19.713 5.397 2.334 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -18.600 5.904 2.984 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -20.191 6.060 1.214 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -17.976 7.041 2.530 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -19.570 7.202 0.755 1.00 0.00 C ATOM 1191 CZ PHE A 96 -18.463 7.694 1.415 1.00 0.00 C ATOM 0 H PHE A 96 -22.068 6.314 3.630 1.00 0.00 H new ATOM 0 HA PHE A 96 -21.878 3.456 4.256 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -19.645 3.434 3.150 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -20.962 3.703 2.025 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.218 5.399 3.859 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -21.058 5.678 0.696 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.106 7.423 3.044 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -19.949 7.710 -0.119 1.00 0.00 H new ATOM 0 HZ PHE A 96 -17.977 8.590 1.059 1.00 0.00 H new ATOM 1201 N THR A 97 -19.980 3.829 5.879 1.00 0.00 N ATOM 1202 CA THR A 97 -19.075 4.063 6.972 1.00 0.00 C ATOM 1203 C THR A 97 -17.692 3.770 6.440 1.00 0.00 C ATOM 1204 O THR A 97 -17.578 3.209 5.350 1.00 0.00 O ATOM 1205 CB THR A 97 -19.371 3.060 8.081 1.00 0.00 C ATOM 1206 OG1 THR A 97 -19.222 1.801 7.540 1.00 0.00 O ATOM 1207 CG2 THR A 97 -20.773 3.217 8.641 1.00 0.00 C ATOM 0 H THR A 97 -20.091 2.845 5.636 1.00 0.00 H new ATOM 0 HA THR A 97 -19.167 5.079 7.357 1.00 0.00 H new ATOM 0 HB THR A 97 -18.684 3.228 8.911 1.00 0.00 H new ATOM 0 HG1 THR A 97 -18.269 1.583 7.476 1.00 0.00 H new ATOM 0 HG21 THR A 97 -20.935 2.480 9.428 1.00 0.00 H new ATOM 0 HG22 THR A 97 -20.890 4.219 9.053 1.00 0.00 H new ATOM 0 HG23 THR A 97 -21.502 3.064 7.845 1.00 0.00 H new ATOM 1215 N LEU A 98 -16.663 4.126 7.162 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.335 3.791 6.748 1.00 0.00 C ATOM 1217 C LEU A 98 -14.547 3.289 7.911 1.00 0.00 C ATOM 1218 O LEU A 98 -14.397 3.968 8.920 1.00 0.00 O ATOM 1219 CB LEU A 98 -14.618 4.962 6.124 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.192 5.513 4.827 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.384 6.701 4.418 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.147 4.469 3.717 1.00 0.00 C ATOM 0 H LEU A 98 -16.723 4.647 8.037 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.422 3.012 5.991 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -14.592 5.771 6.854 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -13.585 4.667 5.939 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.233 5.790 4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.782 7.109 3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.433 7.460 5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.347 6.401 4.268 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.564 4.892 2.803 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.114 4.170 3.540 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.731 3.598 4.013 1.00 0.00 H new ATOM 1234 N THR A 99 -14.036 2.139 7.768 1.00 0.00 N ATOM 1235 CA THR A 99 -13.261 1.526 8.791 1.00 0.00 C ATOM 1236 C THR A 99 -11.988 0.975 8.167 1.00 0.00 C ATOM 1237 O THR A 99 -12.006 0.529 7.022 1.00 0.00 O ATOM 1238 CB THR A 99 -14.080 0.431 9.549 1.00 0.00 C ATOM 1239 OG1 THR A 99 -13.342 -0.111 10.623 1.00 0.00 O ATOM 1240 CG2 THR A 99 -14.509 -0.689 8.648 1.00 0.00 C ATOM 0 H THR A 99 -14.138 1.574 6.925 1.00 0.00 H new ATOM 0 HA THR A 99 -12.990 2.265 9.545 1.00 0.00 H new ATOM 0 HB THR A 99 -14.969 0.934 9.928 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.880 -0.791 11.079 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.074 -1.423 9.223 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.136 -0.293 7.849 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.629 -1.166 8.216 1.00 0.00 H new ATOM 1248 N GLY A 100 -10.889 1.090 8.868 1.00 0.00 N ATOM 1249 CA GLY A 100 -9.624 0.639 8.336 1.00 0.00 C ATOM 1250 C GLY A 100 -8.963 1.713 7.492 1.00 0.00 C ATOM 1251 O GLY A 100 -7.998 1.447 6.770 1.00 0.00 O ATOM 0 H GLY A 100 -10.842 1.490 9.805 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.962 0.360 9.156 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.780 -0.255 7.733 1.00 0.00 H new ATOM 1255 N GLY A 101 -9.461 2.932 7.608 1.00 0.00 N ATOM 1256 CA GLY A 101 -8.924 4.018 6.822 1.00 0.00 C ATOM 1257 C GLY A 101 -9.516 5.368 7.182 1.00 0.00 C ATOM 1258 O GLY A 101 -8.784 6.308 7.430 1.00 0.00 O ATOM 0 H GLY A 101 -10.226 3.188 8.232 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.843 4.055 6.957 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.107 3.818 5.766 1.00 0.00 H new ATOM 1262 N ASN A 102 -10.859 5.449 7.192 1.00 0.00 N ATOM 1263 CA ASN A 102 -11.634 6.713 7.500 1.00 0.00 C ATOM 1264 C ASN A 102 -11.704 7.662 6.326 1.00 0.00 C ATOM 1265 O ASN A 102 -12.373 8.698 6.398 1.00 0.00 O ATOM 1266 CB ASN A 102 -11.179 7.483 8.768 1.00 0.00 C ATOM 1267 CG ASN A 102 -11.640 6.890 10.089 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -11.758 5.599 10.162 1.00 0.00 O flip ATOM 1269 ND2 ASN A 102 -11.881 7.622 11.054 1.00 0.00 N flip ATOM 0 H ASN A 102 -11.459 4.650 6.989 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.632 6.332 7.715 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -10.090 7.533 8.771 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -11.545 8.508 8.701 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -11.779 8.633 10.965 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -12.182 7.216 11.940 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.037 7.300 5.262 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.020 8.029 4.007 1.00 0.00 C ATOM 1278 C VAL A 103 -10.952 6.986 2.916 1.00 0.00 C ATOM 1279 O VAL A 103 -10.832 5.793 3.231 1.00 0.00 O ATOM 1280 CB VAL A 103 -9.793 8.995 3.870 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.861 10.146 4.862 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.494 8.233 4.042 1.00 0.00 C ATOM 0 H VAL A 103 -10.465 6.456 5.238 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.909 8.657 3.947 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.828 9.421 2.867 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.991 10.790 4.732 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.769 10.723 4.688 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.871 9.751 5.878 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.653 8.920 3.944 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.471 7.771 5.029 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.422 7.460 3.277 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.025 7.388 1.671 1.00 0.00 N ATOM 1293 CA PHE A 104 -10.935 6.434 0.580 1.00 0.00 C ATOM 1294 C PHE A 104 -9.492 6.039 0.348 1.00 0.00 C ATOM 1295 O PHE A 104 -8.751 6.740 -0.353 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.524 6.981 -0.725 1.00 0.00 C ATOM 1297 CG PHE A 104 -12.939 7.457 -0.628 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.890 6.738 0.077 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.315 8.636 -1.243 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.184 7.192 0.164 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.607 9.089 -1.161 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.543 8.372 -0.459 1.00 0.00 C ATOM 0 H PHE A 104 -11.145 8.359 1.384 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.521 5.563 0.873 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -10.901 7.807 -1.069 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.470 6.202 -1.485 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.612 5.814 0.562 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.583 9.207 -1.795 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.919 6.628 0.718 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -14.888 10.011 -1.649 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.560 8.730 -0.393 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.092 4.962 0.949 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.757 4.459 0.816 1.00 0.00 C ATOM 1314 C GLU A 105 -7.783 2.934 0.903 1.00 0.00 C ATOM 1315 O GLU A 105 -8.692 2.374 1.508 1.00 0.00 O ATOM 1316 CB GLU A 105 -6.866 5.042 1.912 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.329 4.681 3.339 1.00 0.00 C ATOM 1318 CD GLU A 105 -6.370 5.099 4.435 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -6.019 6.289 4.525 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -5.943 4.223 5.225 1.00 0.00 O ATOM 0 H GLU A 105 -9.690 4.399 1.554 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.349 4.755 -0.151 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.846 4.685 1.768 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.841 6.127 1.810 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.297 5.148 3.523 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.479 3.603 3.397 1.00 0.00 H new ATOM 1327 N TYR A 106 -6.832 2.284 0.247 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.697 0.817 0.256 1.00 0.00 C ATOM 1329 C TYR A 106 -6.900 0.206 1.650 1.00 0.00 C ATOM 1330 O TYR A 106 -6.309 0.650 2.642 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.327 0.407 -0.329 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.936 -1.036 -0.069 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.512 -2.081 -0.775 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.997 -1.346 0.908 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.158 -3.390 -0.514 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.645 -2.648 1.172 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.223 -3.665 0.462 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.871 -4.971 0.736 1.00 0.00 O ATOM 0 H TYR A 106 -6.122 2.755 -0.314 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.493 0.418 -0.372 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.340 0.578 -1.405 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.559 1.059 0.088 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.246 -1.869 -1.538 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.535 -0.548 1.471 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.612 -4.196 -1.072 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.915 -2.868 1.937 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.199 -4.986 1.450 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.750 -0.783 1.716 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.005 -1.458 2.948 1.00 0.00 C ATOM 1350 C GLY A 107 -9.177 -0.896 3.716 1.00 0.00 C ATOM 1351 O GLY A 107 -9.613 -1.495 4.704 1.00 0.00 O ATOM 0 H GLY A 107 -8.279 -1.138 0.920 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.188 -2.513 2.743 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.113 -1.405 3.573 1.00 0.00 H new ATOM 1355 N VAL A 108 -9.697 0.246 3.292 1.00 0.00 N ATOM 1356 CA VAL A 108 -10.825 0.821 3.980 1.00 0.00 C ATOM 1357 C VAL A 108 -12.089 0.048 3.610 1.00 0.00 C ATOM 1358 O VAL A 108 -12.266 -0.383 2.460 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.009 2.360 3.710 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -11.559 2.662 2.327 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -11.861 3.011 4.778 1.00 0.00 C ATOM 0 H VAL A 108 -9.359 0.778 2.490 1.00 0.00 H new ATOM 0 HA VAL A 108 -10.631 0.733 5.049 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.009 2.792 3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.662 3.740 2.204 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.876 2.274 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -12.534 2.189 2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -11.968 4.074 4.561 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -12.845 2.543 4.794 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -11.384 2.886 5.750 1.00 0.00 H new ATOM 1371 N LYS A 109 -12.897 -0.190 4.582 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.131 -0.872 4.402 1.00 0.00 C ATOM 1373 C LYS A 109 -15.247 0.141 4.479 1.00 0.00 C ATOM 1374 O LYS A 109 -15.383 0.842 5.488 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.301 -1.891 5.510 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.491 -2.823 5.359 1.00 0.00 C ATOM 1377 CD LYS A 109 -15.587 -3.798 6.536 1.00 0.00 C ATOM 1378 CE LYS A 109 -14.430 -4.794 6.537 1.00 0.00 C ATOM 1379 NZ LYS A 109 -14.406 -5.642 7.740 1.00 0.00 N ATOM 0 H LYS A 109 -12.715 0.090 5.546 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.148 -1.380 3.438 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.394 -2.493 5.569 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.394 -1.361 6.458 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.408 -2.238 5.293 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.402 -3.382 4.427 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.588 -3.240 7.472 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -16.533 -4.338 6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -14.502 -5.428 5.653 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.488 -4.250 6.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -13.601 -6.298 7.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -14.309 -5.043 8.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -15.291 -6.185 7.800 1.00 0.00 H new ATOM 1393 N ALA A 110 -15.998 0.237 3.429 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.134 1.106 3.361 1.00 0.00 C ATOM 1395 C ALA A 110 -18.374 0.291 3.602 1.00 0.00 C ATOM 1396 O ALA A 110 -18.831 -0.418 2.688 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.227 1.770 1.988 1.00 0.00 C ATOM 0 H ALA A 110 -15.837 -0.297 2.575 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.033 1.886 4.115 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.097 2.426 1.959 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.326 2.355 1.805 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.324 1.004 1.219 1.00 0.00 H new ATOM 1403 N VAL A 111 -18.904 0.324 4.809 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.104 -0.436 5.070 1.00 0.00 C ATOM 1405 C VAL A 111 -21.271 0.357 4.517 1.00 0.00 C ATOM 1406 O VAL A 111 -21.311 1.565 4.652 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.315 -0.834 6.579 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -19.047 -1.135 7.383 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -21.422 -0.092 7.333 1.00 0.00 C ATOM 0 H VAL A 111 -18.535 0.852 5.600 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.015 -1.401 4.570 1.00 0.00 H new ATOM 0 HB VAL A 111 -20.754 -1.826 6.470 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -19.318 -1.396 8.406 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -18.515 -1.968 6.924 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -18.404 -0.255 7.392 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -21.468 -0.454 8.360 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -21.208 0.977 7.334 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.379 -0.270 6.842 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.163 -0.300 3.860 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.253 0.346 3.182 1.00 0.00 C ATOM 1421 C TYR A 112 -24.500 0.191 3.992 1.00 0.00 C ATOM 1422 O TYR A 112 -24.814 -0.890 4.474 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.405 -0.267 1.779 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.417 0.392 0.859 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -25.745 0.011 0.874 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.032 1.367 -0.047 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -26.661 0.580 0.026 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -24.952 1.940 -0.905 1.00 0.00 C ATOM 1429 CZ TYR A 112 -26.271 1.539 -0.858 1.00 0.00 C ATOM 1430 OH TYR A 112 -27.207 2.103 -1.712 1.00 0.00 O ATOM 0 H TYR A 112 -22.163 -1.316 3.772 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.058 1.412 3.068 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.432 -0.243 1.289 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -23.679 -1.316 1.893 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.069 -0.751 1.568 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.000 1.683 -0.083 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -27.694 0.266 0.060 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -24.640 2.698 -1.608 1.00 0.00 H new ATOM 0 HH TYR A 112 -28.037 2.276 -1.220 1.00 0.00 H new ATOM 1440 N THR A 113 -25.159 1.279 4.223 1.00 0.00 N ATOM 1441 CA THR A 113 -26.381 1.266 4.943 1.00 0.00 C ATOM 1442 C THR A 113 -27.261 2.376 4.397 1.00 0.00 C ATOM 1443 O THR A 113 -26.767 3.405 3.938 1.00 0.00 O ATOM 1444 CB THR A 113 -26.136 1.529 6.437 1.00 0.00 C ATOM 1445 OG1 THR A 113 -24.890 0.932 6.845 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.230 0.892 7.245 1.00 0.00 C ATOM 0 H THR A 113 -24.860 2.204 3.914 1.00 0.00 H new ATOM 0 HA THR A 113 -26.853 0.290 4.831 1.00 0.00 H new ATOM 0 HB THR A 113 -26.111 2.607 6.598 1.00 0.00 H new ATOM 0 HG1 THR A 113 -24.741 1.106 7.798 1.00 0.00 H new ATOM 0 HG21 THR A 113 -27.056 1.079 8.305 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.191 1.317 6.955 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.238 -0.183 7.063 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.526 2.179 4.449 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.466 3.177 3.983 1.00 0.00 C ATOM 1456 C CYS A 114 -30.302 3.641 5.146 1.00 0.00 C ATOM 1457 O CYS A 114 -30.372 4.826 5.449 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.352 2.619 2.860 1.00 0.00 C ATOM 1459 SG CYS A 114 -29.433 2.111 1.364 1.00 0.00 S ATOM 0 H CYS A 114 -28.957 1.329 4.812 1.00 0.00 H new ATOM 0 HA CYS A 114 -28.917 4.023 3.570 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -30.906 1.761 3.242 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.087 3.375 2.582 1.00 0.00 H new ATOM 1464 N ASN A 115 -30.890 2.696 5.834 1.00 0.00 N ATOM 1465 CA ASN A 115 -31.720 2.970 6.978 1.00 0.00 C ATOM 1466 C ASN A 115 -31.475 1.861 7.958 1.00 0.00 C ATOM 1467 O ASN A 115 -30.616 1.011 7.709 1.00 0.00 O ATOM 1468 CB ASN A 115 -33.212 2.987 6.593 1.00 0.00 C ATOM 1469 CG ASN A 115 -33.587 4.029 5.550 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -33.538 3.763 4.350 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -33.977 5.195 5.986 1.00 0.00 N ATOM 0 H ASN A 115 -30.805 1.704 5.613 1.00 0.00 H new ATOM 0 HA ASN A 115 -31.477 3.948 7.394 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -33.488 2.001 6.218 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -33.803 3.163 7.492 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -34.254 5.920 5.324 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -34.005 5.381 6.988 1.00 0.00 H new ATOM 1478 N GLU A 116 -32.202 1.838 9.034 1.00 0.00 N ATOM 1479 CA GLU A 116 -32.062 0.788 10.007 1.00 0.00 C ATOM 1480 C GLU A 116 -32.948 -0.384 9.635 1.00 0.00 C ATOM 1481 O GLU A 116 -32.514 -1.540 9.662 1.00 0.00 O ATOM 1482 CB GLU A 116 -32.382 1.298 11.399 1.00 0.00 C ATOM 1483 CG GLU A 116 -32.153 0.268 12.474 1.00 0.00 C ATOM 1484 CD GLU A 116 -30.715 -0.181 12.550 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -29.838 0.653 12.837 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -30.438 -1.381 12.347 1.00 0.00 O ATOM 0 H GLU A 116 -32.905 2.540 9.265 1.00 0.00 H new ATOM 0 HA GLU A 116 -31.026 0.448 10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -31.769 2.175 11.608 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -33.422 1.622 11.430 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -32.452 0.681 13.437 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -32.790 -0.596 12.286 1.00 0.00 H new ATOM 1493 N GLY A 117 -34.165 -0.079 9.268 1.00 0.00 N ATOM 1494 CA GLY A 117 -35.097 -1.103 8.857 1.00 0.00 C ATOM 1495 C GLY A 117 -34.745 -1.652 7.500 1.00 0.00 C ATOM 1496 O GLY A 117 -34.947 -2.832 7.225 1.00 0.00 O ATOM 0 H GLY A 117 -34.537 0.870 9.244 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -35.099 -1.911 9.589 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -36.106 -0.691 8.834 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.198 -0.801 6.657 1.00 0.00 N ATOM 1501 CA TYR A 118 -33.806 -1.213 5.327 1.00 0.00 C ATOM 1502 C TYR A 118 -32.422 -1.793 5.334 1.00 0.00 C ATOM 1503 O TYR A 118 -31.441 -1.120 5.688 1.00 0.00 O ATOM 1504 CB TYR A 118 -33.859 -0.076 4.310 1.00 0.00 C ATOM 1505 CG TYR A 118 -35.241 0.436 3.973 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -35.863 1.396 4.754 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -35.907 -0.023 2.848 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -37.103 1.884 4.430 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -37.156 0.458 2.519 1.00 0.00 C ATOM 1510 CZ TYR A 118 -37.746 1.415 3.312 1.00 0.00 C ATOM 1511 OH TYR A 118 -38.986 1.911 2.983 1.00 0.00 O ATOM 0 H TYR A 118 -34.015 0.180 6.870 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.531 -1.969 5.024 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -33.266 0.756 4.691 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -33.382 -0.413 3.390 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -35.362 1.768 5.635 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -35.441 -0.768 2.220 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -37.571 2.633 5.051 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -37.668 0.086 1.644 1.00 0.00 H new ATOM 0 HH TYR A 118 -39.305 1.477 2.164 1.00 0.00 H new ATOM 1521 N GLN A 119 -32.348 -3.017 4.947 1.00 0.00 N ATOM 1522 CA GLN A 119 -31.148 -3.722 4.795 1.00 0.00 C ATOM 1523 C GLN A 119 -30.985 -3.913 3.312 1.00 0.00 C ATOM 1524 O GLN A 119 -31.640 -3.210 2.528 1.00 0.00 O ATOM 1525 CB GLN A 119 -31.204 -5.057 5.523 1.00 0.00 C ATOM 1526 CG GLN A 119 -31.442 -4.942 7.016 1.00 0.00 C ATOM 1527 CD GLN A 119 -31.312 -6.266 7.742 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -31.593 -7.355 7.067 1.00 0.00 O flip ATOM 1529 NE2 GLN A 119 -30.937 -6.302 8.916 1.00 0.00 N flip ATOM 0 H GLN A 119 -33.172 -3.573 4.719 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.303 -3.183 5.224 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -31.997 -5.663 5.086 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -30.267 -5.589 5.356 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -30.731 -4.232 7.438 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -32.439 -4.536 7.189 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -30.727 -5.435 9.411 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -30.837 -7.198 9.392 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.202 -4.843 2.900 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.872 -4.906 1.518 1.00 0.00 C ATOM 1540 C LEU A 120 -29.742 -6.309 0.976 1.00 0.00 C ATOM 1541 O LEU A 120 -29.491 -7.267 1.711 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.612 -4.076 1.305 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.558 -4.258 2.385 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -26.809 -5.586 2.235 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -26.614 -3.081 2.437 1.00 0.00 C ATOM 0 H LEU A 120 -29.781 -5.563 3.488 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.700 -4.492 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.177 -4.337 0.340 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.888 -3.023 1.256 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.078 -4.298 3.342 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.065 -5.676 3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -27.516 -6.413 2.306 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.312 -5.616 1.265 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -25.873 -3.243 3.220 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -26.110 -2.976 1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -27.177 -2.173 2.653 1.00 0.00 H new ATOM 1557 N LEU A 121 -29.948 -6.412 -0.298 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.797 -7.631 -1.015 1.00 0.00 C ATOM 1559 C LEU A 121 -28.354 -7.816 -1.350 1.00 0.00 C ATOM 1560 O LEU A 121 -27.659 -6.858 -1.742 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.689 -7.682 -2.268 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.188 -7.946 -2.037 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.428 -9.294 -1.379 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.808 -6.855 -1.228 1.00 0.00 C ATOM 0 H LEU A 121 -30.234 -5.626 -0.882 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.128 -8.456 -0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.588 -6.734 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.304 -8.459 -2.929 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.664 -7.964 -3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.498 -9.442 -1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -32.036 -10.086 -2.017 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -31.923 -9.323 -0.414 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.867 -7.068 -1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.312 -6.793 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.698 -5.906 -1.753 1.00 0.00 H new ATOM 1576 N GLY A 122 -27.917 -9.014 -1.193 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.528 -9.335 -1.312 1.00 0.00 C ATOM 1578 C GLY A 122 -26.023 -9.777 0.031 1.00 0.00 C ATOM 1579 O GLY A 122 -26.631 -9.455 1.064 1.00 0.00 O ATOM 0 H GLY A 122 -28.514 -9.812 -0.976 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.384 -10.125 -2.049 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -25.968 -8.468 -1.660 1.00 0.00 H new ATOM 1583 N GLU A 123 -24.939 -10.495 0.052 1.00 0.00 N ATOM 1584 CA GLU A 123 -24.452 -11.055 1.297 1.00 0.00 C ATOM 1585 C GLU A 123 -23.465 -10.130 1.951 1.00 0.00 C ATOM 1586 O GLU A 123 -23.167 -10.264 3.141 1.00 0.00 O ATOM 1587 CB GLU A 123 -23.790 -12.429 1.102 1.00 0.00 C ATOM 1588 CG GLU A 123 -24.676 -13.523 0.517 1.00 0.00 C ATOM 1589 CD GLU A 123 -25.025 -13.306 -0.929 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -24.106 -13.275 -1.773 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -26.227 -13.188 -1.248 1.00 0.00 O ATOM 0 H GLU A 123 -24.372 -10.711 -0.768 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.325 -11.181 1.937 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -22.925 -12.304 0.451 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -23.416 -12.770 2.067 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -24.170 -14.483 0.620 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -25.596 -13.584 1.099 1.00 0.00 H new ATOM 1598 N ILE A 124 -22.950 -9.214 1.191 1.00 0.00 N ATOM 1599 CA ILE A 124 -21.963 -8.312 1.688 1.00 0.00 C ATOM 1600 C ILE A 124 -22.551 -6.910 1.750 1.00 0.00 C ATOM 1601 O ILE A 124 -22.811 -6.292 0.725 1.00 0.00 O ATOM 1602 CB ILE A 124 -20.699 -8.332 0.779 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.182 -9.776 0.578 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.598 -7.470 1.364 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -19.756 -10.475 1.857 1.00 0.00 C ATOM 0 H ILE A 124 -23.202 -9.072 0.213 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.664 -8.622 2.689 1.00 0.00 H new ATOM 0 HB ILE A 124 -20.986 -7.926 -0.191 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -20.964 -10.365 0.100 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.335 -9.753 -0.108 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -18.726 -7.501 0.711 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -19.949 -6.442 1.453 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.326 -7.847 2.350 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -19.408 -11.481 1.623 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -18.950 -9.912 2.328 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -20.604 -10.534 2.539 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.785 -6.426 2.957 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.345 -5.087 3.180 1.00 0.00 C ATOM 1619 C ASN A 125 -22.240 -4.048 3.206 1.00 0.00 C ATOM 1620 O ASN A 125 -22.418 -2.956 3.714 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.113 -5.009 4.525 1.00 0.00 C ATOM 1622 CG ASN A 125 -23.228 -5.063 5.767 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.195 -5.743 5.804 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -23.602 -4.305 6.774 1.00 0.00 N ATOM 0 H ASN A 125 -22.595 -6.943 3.816 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.034 -4.889 2.359 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.689 -4.084 4.546 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.828 -5.831 4.568 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -23.034 -4.265 7.620 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -24.460 -3.757 6.709 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.138 -4.355 2.614 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.001 -3.490 2.682 1.00 0.00 C ATOM 1633 C TYR A 126 -19.167 -3.651 1.450 1.00 0.00 C ATOM 1634 O TYR A 126 -19.468 -4.465 0.592 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.156 -3.747 3.972 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.394 -5.081 4.034 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.113 -5.203 3.487 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -18.942 -6.195 4.656 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -16.403 -6.386 3.551 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -18.241 -7.392 4.725 1.00 0.00 C ATOM 1641 CZ TYR A 126 -16.974 -7.484 4.172 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.273 -8.675 4.247 1.00 0.00 O ATOM 0 H TYR A 126 -20.995 -5.206 2.071 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.356 -2.461 2.736 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.435 -2.936 4.076 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -19.822 -3.693 4.833 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -16.666 -4.348 3.001 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -19.928 -6.130 5.092 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -15.414 -6.454 3.122 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -18.683 -8.250 5.209 1.00 0.00 H new ATOM 0 HH TYR A 126 -16.815 -9.344 4.715 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.150 -2.861 1.366 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.221 -2.869 0.277 1.00 0.00 C ATOM 1654 C ARG A 127 -15.868 -2.622 0.854 1.00 0.00 C ATOM 1655 O ARG A 127 -15.699 -1.687 1.619 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.553 -1.724 -0.660 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.877 -1.855 -1.350 1.00 0.00 C ATOM 1658 CD ARG A 127 -19.318 -0.533 -1.890 1.00 0.00 C ATOM 1659 NE ARG A 127 -19.630 0.428 -0.815 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.203 1.613 -1.027 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -20.552 1.960 -2.258 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -20.432 2.446 -0.009 1.00 0.00 N ATOM 0 H ARG A 127 -17.931 -2.165 2.078 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.261 -3.815 -0.264 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.542 -0.792 -0.094 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -16.770 -1.648 -1.414 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.801 -2.579 -2.161 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.622 -2.236 -0.651 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.535 -0.122 -2.527 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.198 -0.673 -2.517 1.00 0.00 H new ATOM 0 HE ARG A 127 -19.394 0.172 0.144 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.382 1.322 -3.035 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -20.991 2.865 -2.428 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -20.168 2.177 0.939 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -20.871 3.351 -0.179 1.00 0.00 H new ATOM 1676 N GLU A 128 -14.937 -3.441 0.553 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.598 -3.227 1.009 1.00 0.00 C ATOM 1678 C GLU A 128 -12.744 -2.787 -0.125 1.00 0.00 C ATOM 1679 O GLU A 128 -12.884 -3.280 -1.231 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.021 -4.461 1.649 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.349 -4.602 3.094 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.552 -5.686 3.735 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -12.841 -6.865 3.505 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -11.619 -5.370 4.503 1.00 0.00 O ATOM 0 H GLU A 128 -15.068 -4.279 -0.013 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.624 -2.447 1.770 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.386 -5.339 1.116 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -11.937 -4.446 1.533 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.157 -3.658 3.605 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.412 -4.816 3.207 1.00 0.00 H new ATOM 1691 N CYS A 129 -11.899 -1.848 0.112 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.035 -1.391 -0.921 1.00 0.00 C ATOM 1693 C CYS A 129 -9.846 -2.322 -1.057 1.00 0.00 C ATOM 1694 O CYS A 129 -8.890 -2.257 -0.283 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.595 0.043 -0.690 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.606 0.732 -2.049 1.00 0.00 S ATOM 0 H CYS A 129 -11.786 -1.380 1.011 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.590 -1.402 -1.859 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.478 0.665 -0.543 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.014 0.091 0.231 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.954 -3.221 -2.004 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.916 -4.177 -2.314 1.00 0.00 C ATOM 1703 C ASP A 130 -7.851 -3.481 -3.152 1.00 0.00 C ATOM 1704 O ASP A 130 -8.015 -2.321 -3.529 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.534 -5.397 -3.076 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.534 -6.462 -3.515 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.210 -7.346 -2.732 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -8.031 -6.389 -4.656 1.00 0.00 O ATOM 0 H ASP A 130 -10.782 -3.312 -2.593 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.456 -4.554 -1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.281 -5.865 -2.435 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -10.057 -5.027 -3.958 1.00 0.00 H new ATOM 1713 N THR A 131 -6.797 -4.193 -3.436 1.00 0.00 N ATOM 1714 CA THR A 131 -5.664 -3.745 -4.195 1.00 0.00 C ATOM 1715 C THR A 131 -6.076 -3.075 -5.515 1.00 0.00 C ATOM 1716 O THR A 131 -5.528 -2.054 -5.898 1.00 0.00 O ATOM 1717 CB THR A 131 -4.752 -4.960 -4.503 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.472 -5.940 -5.286 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.307 -5.636 -3.224 1.00 0.00 C ATOM 0 H THR A 131 -6.700 -5.160 -3.125 1.00 0.00 H new ATOM 0 HA THR A 131 -5.135 -3.001 -3.599 1.00 0.00 H new ATOM 0 HB THR A 131 -3.887 -4.588 -5.052 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.290 -6.199 -4.813 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.668 -6.486 -3.465 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.751 -4.926 -2.612 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.181 -5.984 -2.673 1.00 0.00 H new ATOM 1727 N ASP A 132 -7.053 -3.650 -6.184 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.476 -3.140 -7.470 1.00 0.00 C ATOM 1729 C ASP A 132 -8.614 -2.147 -7.325 1.00 0.00 C ATOM 1730 O ASP A 132 -8.767 -1.233 -8.138 1.00 0.00 O ATOM 1731 CB ASP A 132 -7.897 -4.277 -8.383 1.00 0.00 C ATOM 1732 CG ASP A 132 -8.142 -3.814 -9.793 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -7.157 -3.686 -10.552 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -9.308 -3.583 -10.170 1.00 0.00 O ATOM 0 H ASP A 132 -7.568 -4.469 -5.859 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.625 -2.622 -7.913 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.124 -5.045 -8.384 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -8.804 -4.738 -7.991 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.376 -2.295 -6.279 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.520 -1.449 -6.067 1.00 0.00 C ATOM 1741 C GLY A 133 -11.471 -2.081 -5.095 1.00 0.00 C ATOM 1742 O GLY A 133 -11.143 -3.109 -4.510 1.00 0.00 O ATOM 0 H GLY A 133 -9.226 -2.997 -5.555 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -10.197 -0.479 -5.689 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.027 -1.269 -7.015 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.652 -1.519 -4.957 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.636 -2.003 -3.988 1.00 0.00 C ATOM 1748 C TRP A 134 -14.118 -3.407 -4.328 1.00 0.00 C ATOM 1749 O TRP A 134 -14.250 -3.766 -5.517 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.858 -1.077 -3.913 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.570 0.343 -3.535 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.403 1.386 -4.385 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.439 0.880 -2.214 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.171 2.538 -3.684 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.189 2.256 -2.348 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.507 0.334 -0.936 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.009 3.092 -1.254 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.329 1.163 0.149 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.084 2.530 -0.018 1.00 0.00 C ATOM 0 H TRP A 134 -12.965 -0.718 -5.505 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.129 -2.017 -3.023 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.356 -1.082 -4.883 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.562 -1.491 -3.191 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.447 1.317 -5.462 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -14.011 3.458 -4.093 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.696 -0.720 -0.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.817 4.147 -1.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.379 0.751 1.146 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -13.951 3.153 0.854 1.00 0.00 H new ATOM 1770 N THR A 135 -14.308 -4.197 -3.311 1.00 0.00 N ATOM 1771 CA THR A 135 -14.902 -5.482 -3.437 1.00 0.00 C ATOM 1772 C THR A 135 -16.405 -5.284 -3.389 1.00 0.00 C ATOM 1773 O THR A 135 -16.894 -4.522 -2.539 1.00 0.00 O ATOM 1774 CB THR A 135 -14.438 -6.427 -2.291 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.692 -5.827 -1.002 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.955 -6.721 -2.407 1.00 0.00 C ATOM 0 H THR A 135 -14.047 -3.955 -2.355 1.00 0.00 H new ATOM 0 HA THR A 135 -14.601 -5.950 -4.374 1.00 0.00 H new ATOM 0 HB THR A 135 -15.002 -7.355 -2.380 1.00 0.00 H new ATOM 0 HG1 THR A 135 -14.546 -6.492 -0.297 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.651 -7.383 -1.596 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.753 -7.202 -3.364 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.393 -5.789 -2.344 1.00 0.00 H new ATOM 1784 N ASN A 136 -17.123 -5.920 -4.311 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.588 -5.780 -4.445 1.00 0.00 C ATOM 1786 C ASN A 136 -18.928 -4.427 -5.049 1.00 0.00 C ATOM 1787 O ASN A 136 -18.047 -3.569 -5.226 1.00 0.00 O ATOM 1788 CB ASN A 136 -19.346 -6.009 -3.102 1.00 0.00 C ATOM 1789 CG ASN A 136 -19.177 -7.413 -2.549 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -19.950 -8.328 -2.863 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -18.182 -7.591 -1.717 1.00 0.00 N ATOM 0 H ASN A 136 -16.711 -6.554 -4.996 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.929 -6.567 -5.118 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.989 -5.290 -2.364 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -20.407 -5.811 -3.253 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -18.022 -8.509 -1.302 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -17.567 -6.812 -1.483 1.00 0.00 H new ATOM 1798 N ASP A 137 -20.165 -4.220 -5.392 1.00 0.00 N ATOM 1799 CA ASP A 137 -20.533 -2.970 -6.002 1.00 0.00 C ATOM 1800 C ASP A 137 -21.422 -2.131 -5.092 1.00 0.00 C ATOM 1801 O ASP A 137 -20.936 -1.541 -4.149 1.00 0.00 O ATOM 1802 CB ASP A 137 -21.059 -3.128 -7.462 1.00 0.00 C ATOM 1803 CG ASP A 137 -22.340 -3.916 -7.592 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -22.303 -5.161 -7.597 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -23.413 -3.294 -7.651 1.00 0.00 O ATOM 0 H ASP A 137 -20.927 -4.886 -5.264 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.617 -2.392 -6.119 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -21.215 -2.136 -7.886 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -20.288 -3.613 -8.060 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.689 -2.087 -5.335 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.594 -1.366 -4.506 1.00 0.00 C ATOM 1812 C ILE A 138 -24.711 -2.315 -4.095 1.00 0.00 C ATOM 1813 O ILE A 138 -25.552 -2.674 -4.924 1.00 0.00 O ATOM 1814 CB ILE A 138 -24.169 -0.146 -5.276 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -23.036 0.800 -5.697 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -25.203 0.618 -4.432 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -23.434 1.696 -6.817 1.00 0.00 C ATOM 0 H ILE A 138 -23.130 -2.557 -6.125 1.00 0.00 H new ATOM 0 HA ILE A 138 -23.081 -0.989 -3.621 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.673 -0.524 -6.166 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -22.733 1.404 -4.842 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -22.168 0.213 -5.996 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -25.584 1.465 -5.002 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -26.027 -0.048 -4.176 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -24.731 0.979 -3.518 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -22.598 2.346 -7.078 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.710 1.095 -7.683 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -24.285 2.305 -6.511 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.672 -2.829 -2.844 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.729 -3.696 -2.329 1.00 0.00 C ATOM 1831 C PRO A 139 -27.077 -2.956 -2.346 1.00 0.00 C ATOM 1832 O PRO A 139 -27.156 -1.776 -2.010 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.267 -4.048 -0.903 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.239 -3.028 -0.559 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.603 -2.609 -1.850 1.00 0.00 C ATOM 0 HA PRO A 139 -25.885 -4.594 -2.926 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.100 -4.018 -0.201 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.851 -5.055 -0.862 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.693 -2.174 -0.056 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.496 -3.441 0.123 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.288 -1.566 -1.823 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.717 -3.204 -2.074 1.00 0.00 H new ATOM 1843 N ILE A 140 -28.111 -3.649 -2.744 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.402 -3.022 -3.013 1.00 0.00 C ATOM 1845 C ILE A 140 -30.260 -2.958 -1.749 1.00 0.00 C ATOM 1846 O ILE A 140 -30.672 -3.993 -1.244 1.00 0.00 O ATOM 1847 CB ILE A 140 -30.214 -3.804 -4.109 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.437 -4.004 -5.436 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.545 -3.120 -4.397 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.406 -5.127 -5.421 1.00 0.00 C ATOM 0 H ILE A 140 -28.095 -4.658 -2.894 1.00 0.00 H new ATOM 0 HA ILE A 140 -29.182 -2.016 -3.370 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.389 -4.794 -3.688 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -30.154 -4.202 -6.232 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.931 -3.071 -5.687 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -32.086 -3.682 -5.159 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -32.139 -3.081 -3.484 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -31.363 -2.107 -4.755 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -27.918 -5.186 -6.394 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.660 -4.926 -4.652 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.902 -6.074 -5.206 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.526 -1.765 -1.253 1.00 0.00 N ATOM 1863 CA CYS A 141 -31.376 -1.599 -0.076 1.00 0.00 C ATOM 1864 C CYS A 141 -32.835 -1.860 -0.405 1.00 0.00 C ATOM 1865 O CYS A 141 -33.455 -1.111 -1.171 1.00 0.00 O ATOM 1866 CB CYS A 141 -31.221 -0.210 0.560 1.00 0.00 C ATOM 1867 SG CYS A 141 -29.605 0.088 1.349 1.00 0.00 S ATOM 0 H CYS A 141 -30.169 -0.893 -1.642 1.00 0.00 H new ATOM 0 HA CYS A 141 -31.043 -2.340 0.651 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -31.380 0.547 -0.208 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -32.005 -0.077 1.306 1.00 0.00 H new ATOM 1872 N GLU A 142 -33.351 -2.936 0.152 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.728 -3.372 0.010 1.00 0.00 C ATOM 1874 C GLU A 142 -35.117 -4.161 1.255 1.00 0.00 C ATOM 1875 O GLU A 142 -35.623 -3.563 2.212 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.942 -4.239 -1.256 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.980 -3.497 -2.577 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.512 -4.347 -3.717 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.601 -4.969 -3.564 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -34.900 -4.373 -4.800 1.00 0.00 O ATOM 1881 OXT GLU A 142 -34.887 -5.393 1.307 1.00 0.00 O ATOM 0 H GLU A 142 -32.799 -3.559 0.742 1.00 0.00 H new ATOM 0 HA GLU A 142 -35.359 -2.490 -0.101 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -34.144 -4.980 -1.302 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -35.878 -4.785 -1.143 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -35.603 -2.609 -2.471 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -33.975 -3.154 -2.824 1.00 0.00 H new TER 1888 GLU A 142