USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 805 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 163 TYR OH : rot -43:sc= 1.24 USER MOD Set 1.2: A 217 GLN : amide:sc= 1.02 K(o=2.3,f=-2!) USER MOD Set 2.1: A 172 GLN : amide:sc= 0.63 X(o=1.2,f=1) USER MOD Set 2.2: A 215 THR OG1 : rot 180:sc= 0.555 USER MOD Set 3.1: A 149 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 199 THR OG1 : rot -79:sc= 2.25 USER MOD Set 3.3: A 201 THR OG1 : rot 79:sc= 1.41 USER MOD Set 4.1: A 162 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 186 GLN : amide:sc= -1.04 K(o=-1,f=-0.076) USER MOD Single : A 128 TYR OH : rot 25:sc= 1.24 USER MOD Single : A 129 MET CE :methyl 174:sc= -0.873 (180deg=-1.04) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 134 MET CE :methyl -138:sc= -0.257 (180deg=-2.37!) USER MOD Single : A 135 SER OG : rot -57:sc= 0.0402 USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 MET CE :methyl -150:sc= -1.48 (180deg=-4.95!) USER MOD Single : A 140 HIS : no HD1:sc= -0.539 X(o=-0.54,f=-0.13) USER MOD Single : A 143 ASN : amide:sc= -0.866 K(o=-0.87,f=-0.099) USER MOD Single : A 150 TYR OH : rot -1:sc= 0.514 USER MOD Single : A 153 ASN : amide:sc= 0.591 K(o=0.59,f=-0.054) USER MOD Single : A 154 MET CE :methyl -166:sc=-0.000727 (180deg=-0.227) USER MOD Single : A 155 ASN : amide:sc=-0.00583 X(o=-0.0058,f=0) USER MOD Single : A 157 TYR OH : rot -165:sc= 1.51 USER MOD Single : A 159 ASN : amide:sc= -0.195 X(o=-0.2,f=-0.0078) USER MOD Single : A 160 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.54) USER MOD Single : A 168 GLN : amide:sc= 0.694 K(o=0.69,f=-0.31) USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 170 ASN : amide:sc= 0.845 K(o=0.84,f=-0.00023) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= -0.268 X(o=-0.27,f=-0.17) USER MOD Single : A 174 ASN : amide:sc=-0.00937 X(o=-0.0094,f=0) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 181 ASN : amide:sc= -0.0637 X(o=-0.064,f=0) USER MOD Single : A 183 THR OG1 : rot -125:sc= 0.864 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 HIS : no HD1:sc= -0.396 X(o=-0.4,f=-0.4) USER MOD Single : A 188 THR OG1 : rot -51:sc= 1.13 USER MOD Single : A 190 THR OG1 : rot 71:sc= 1.04 USER MOD Single : A 191 THR OG1 : rot -128:sc= 1 USER MOD Single : A 192 THR OG1 : rot 104:sc= 1.14 USER MOD Single : A 193 THR OG1 : rot -26:sc= 0.79 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 204 LYS NZ :NH3+ 179:sc= 1.23 (180deg=1.17) USER MOD Single : A 206 MET CE :methyl -165:sc= -1.47 (180deg=-1.84) USER MOD Single : A 212 GLN : amide:sc= 0.493 K(o=0.49,f=-0.19) USER MOD Single : A 213 MET CE :methyl -157:sc= -1.35 (180deg=-1.99) USER MOD Single : A 216 THR OG1 : rot 104:sc= 1.2 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.52) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN : amide:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 125 10.733 -13.213 -4.624 1.00 0.00 N ATOM 2 CA LEU A 125 10.013 -11.954 -4.796 1.00 0.00 C ATOM 3 C LEU A 125 10.119 -11.438 -6.232 1.00 0.00 C ATOM 4 O LEU A 125 9.162 -10.898 -6.784 1.00 0.00 O ATOM 5 CB LEU A 125 10.636 -10.917 -3.853 1.00 0.00 C ATOM 6 CG LEU A 125 10.583 -11.262 -2.354 1.00 0.00 C ATOM 7 CD1 LEU A 125 10.812 -9.976 -1.573 1.00 0.00 C ATOM 8 CD2 LEU A 125 9.250 -11.866 -1.926 1.00 0.00 C ATOM 0 HA LEU A 125 8.959 -12.119 -4.572 1.00 0.00 H new ATOM 0 HB2 LEU A 125 11.678 -10.774 -4.138 1.00 0.00 H new ATOM 0 HB3 LEU A 125 10.130 -9.964 -4.006 1.00 0.00 H new ATOM 0 HG LEU A 125 11.350 -12.011 -2.154 1.00 0.00 H new ATOM 0 HD11 LEU A 125 10.780 -10.189 -0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.787 -9.562 -1.832 1.00 0.00 H new ATOM 0 HD13 LEU A 125 10.034 -9.255 -1.823 1.00 0.00 H new ATOM 0 HD21 LEU A 125 9.277 -12.087 -0.859 1.00 0.00 H new ATOM 0 HD22 LEU A 125 8.447 -11.157 -2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 125 9.072 -12.786 -2.483 1.00 0.00 H new ATOM 20 N GLY A 126 11.321 -11.583 -6.791 1.00 0.00 N ATOM 21 CA GLY A 126 11.716 -11.214 -8.156 1.00 0.00 C ATOM 22 C GLY A 126 12.510 -9.906 -8.227 1.00 0.00 C ATOM 23 O GLY A 126 13.252 -9.674 -9.181 1.00 0.00 O ATOM 0 H GLY A 126 12.098 -11.988 -6.269 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.316 -12.018 -8.583 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.822 -11.122 -8.773 1.00 0.00 H new ATOM 27 N GLY A 127 12.381 -9.067 -7.197 1.00 0.00 N ATOM 28 CA GLY A 127 13.126 -7.830 -6.999 1.00 0.00 C ATOM 29 C GLY A 127 12.224 -6.759 -6.403 1.00 0.00 C ATOM 30 O GLY A 127 11.826 -5.841 -7.117 1.00 0.00 O ATOM 0 H GLY A 127 11.719 -9.245 -6.442 1.00 0.00 H new ATOM 0 HA2 GLY A 127 13.974 -8.010 -6.338 1.00 0.00 H new ATOM 0 HA3 GLY A 127 13.531 -7.485 -7.950 1.00 0.00 H new ATOM 34 N TYR A 128 11.886 -6.887 -5.115 1.00 0.00 N ATOM 35 CA TYR A 128 11.161 -5.903 -4.323 1.00 0.00 C ATOM 36 C TYR A 128 11.604 -5.997 -2.856 1.00 0.00 C ATOM 37 O TYR A 128 12.121 -7.028 -2.433 1.00 0.00 O ATOM 38 CB TYR A 128 9.667 -6.207 -4.405 1.00 0.00 C ATOM 39 CG TYR A 128 9.084 -6.285 -5.804 1.00 0.00 C ATOM 40 CD1 TYR A 128 8.585 -5.130 -6.427 1.00 0.00 C ATOM 41 CD2 TYR A 128 9.032 -7.520 -6.480 1.00 0.00 C ATOM 42 CE1 TYR A 128 7.991 -5.219 -7.695 1.00 0.00 C ATOM 43 CE2 TYR A 128 8.444 -7.609 -7.761 1.00 0.00 C ATOM 44 CZ TYR A 128 7.907 -6.450 -8.370 1.00 0.00 C ATOM 45 OH TYR A 128 7.358 -6.497 -9.622 1.00 0.00 O ATOM 0 H TYR A 128 12.124 -7.720 -4.577 1.00 0.00 H new ATOM 0 HA TYR A 128 11.366 -4.903 -4.705 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.480 -7.155 -3.901 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.128 -5.439 -3.850 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.658 -4.174 -5.931 1.00 0.00 H new ATOM 0 HD2 TYR A 128 9.444 -8.404 -6.016 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.592 -4.329 -8.160 1.00 0.00 H new ATOM 0 HE2 TYR A 128 8.404 -8.558 -8.274 1.00 0.00 H new ATOM 0 HH TYR A 128 7.451 -5.622 -10.053 1.00 0.00 H new ATOM 55 N MET A 129 11.349 -4.946 -2.072 1.00 0.00 N ATOM 56 CA MET A 129 11.750 -4.820 -0.668 1.00 0.00 C ATOM 57 C MET A 129 10.668 -4.092 0.135 1.00 0.00 C ATOM 58 O MET A 129 10.310 -2.958 -0.194 1.00 0.00 O ATOM 59 CB MET A 129 13.092 -4.073 -0.563 1.00 0.00 C ATOM 60 CG MET A 129 14.286 -5.023 -0.483 1.00 0.00 C ATOM 61 SD MET A 129 14.800 -5.559 1.176 1.00 0.00 S ATOM 62 CE MET A 129 13.307 -6.347 1.839 1.00 0.00 C ATOM 0 H MET A 129 10.839 -4.130 -2.410 1.00 0.00 H new ATOM 0 HA MET A 129 11.874 -5.819 -0.250 1.00 0.00 H new ATOM 0 HB2 MET A 129 13.209 -3.420 -1.428 1.00 0.00 H new ATOM 0 HB3 MET A 129 13.080 -3.434 0.320 1.00 0.00 H new ATOM 0 HG2 MET A 129 14.053 -5.912 -1.070 1.00 0.00 H new ATOM 0 HG3 MET A 129 15.137 -4.539 -0.962 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.534 -6.805 2.802 1.00 0.00 H new ATOM 0 HE2 MET A 129 12.527 -5.597 1.969 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.962 -7.114 1.145 1.00 0.00 H new ATOM 72 N LEU A 130 10.140 -4.752 1.171 1.00 0.00 N ATOM 73 CA LEU A 130 9.101 -4.241 2.053 1.00 0.00 C ATOM 74 C LEU A 130 9.532 -2.981 2.796 1.00 0.00 C ATOM 75 O LEU A 130 10.362 -3.027 3.710 1.00 0.00 O ATOM 76 CB LEU A 130 8.647 -5.365 2.985 1.00 0.00 C ATOM 77 CG LEU A 130 7.427 -5.020 3.842 1.00 0.00 C ATOM 78 CD1 LEU A 130 6.235 -4.555 3.005 1.00 0.00 C ATOM 79 CD2 LEU A 130 7.022 -6.250 4.658 1.00 0.00 C ATOM 0 H LEU A 130 10.441 -5.694 1.423 1.00 0.00 H new ATOM 0 HA LEU A 130 8.247 -3.924 1.454 1.00 0.00 H new ATOM 0 HB2 LEU A 130 8.418 -6.247 2.387 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.474 -5.632 3.643 1.00 0.00 H new ATOM 0 HG LEU A 130 7.708 -4.195 4.496 1.00 0.00 H new ATOM 0 HD11 LEU A 130 5.397 -4.323 3.662 1.00 0.00 H new ATOM 0 HD12 LEU A 130 6.512 -3.664 2.442 1.00 0.00 H new ATOM 0 HD13 LEU A 130 5.945 -5.346 2.313 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.153 -6.010 5.271 1.00 0.00 H new ATOM 0 HD22 LEU A 130 6.775 -7.069 3.983 1.00 0.00 H new ATOM 0 HD23 LEU A 130 7.849 -6.548 5.302 1.00 0.00 H new ATOM 91 N GLY A 131 8.941 -1.859 2.388 1.00 0.00 N ATOM 92 CA GLY A 131 9.001 -0.591 3.071 1.00 0.00 C ATOM 93 C GLY A 131 8.294 -0.661 4.418 1.00 0.00 C ATOM 94 O GLY A 131 7.473 -1.539 4.685 1.00 0.00 O ATOM 0 H GLY A 131 8.386 -1.819 1.533 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.042 -0.302 3.217 1.00 0.00 H new ATOM 0 HA3 GLY A 131 8.540 0.180 2.454 1.00 0.00 H new ATOM 98 N SER A 132 8.610 0.312 5.254 1.00 0.00 N ATOM 99 CA SER A 132 8.161 0.488 6.610 1.00 0.00 C ATOM 100 C SER A 132 6.660 0.669 6.671 1.00 0.00 C ATOM 101 O SER A 132 6.020 1.387 5.891 1.00 0.00 O ATOM 102 CB SER A 132 8.875 1.675 7.262 1.00 0.00 C ATOM 103 OG SER A 132 8.841 2.832 6.440 1.00 0.00 O ATOM 0 H SER A 132 9.242 1.060 4.970 1.00 0.00 H new ATOM 0 HA SER A 132 8.411 -0.415 7.167 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.407 1.898 8.221 1.00 0.00 H new ATOM 0 HB3 SER A 132 9.911 1.407 7.468 1.00 0.00 H new ATOM 0 HG SER A 132 9.305 3.568 6.891 1.00 0.00 H new ATOM 109 N ALA A 133 6.137 0.004 7.680 1.00 0.00 N ATOM 110 CA ALA A 133 4.753 0.036 8.096 1.00 0.00 C ATOM 111 C ALA A 133 4.294 1.453 8.413 1.00 0.00 C ATOM 112 O ALA A 133 5.044 2.285 8.939 1.00 0.00 O ATOM 113 CB ALA A 133 4.642 -0.888 9.305 1.00 0.00 C ATOM 0 H ALA A 133 6.702 -0.610 8.266 1.00 0.00 H new ATOM 0 HA ALA A 133 4.097 -0.304 7.295 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.612 -0.900 9.660 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.939 -1.897 9.020 1.00 0.00 H new ATOM 0 HB3 ALA A 133 5.296 -0.528 10.099 1.00 0.00 H new ATOM 119 N MET A 134 3.037 1.710 8.076 1.00 0.00 N ATOM 120 CA MET A 134 2.394 3.005 8.246 1.00 0.00 C ATOM 121 C MET A 134 1.273 2.936 9.270 1.00 0.00 C ATOM 122 O MET A 134 0.479 1.993 9.298 1.00 0.00 O ATOM 123 CB MET A 134 1.879 3.490 6.896 1.00 0.00 C ATOM 124 CG MET A 134 1.021 2.467 6.150 1.00 0.00 C ATOM 125 SD MET A 134 1.845 1.592 4.796 1.00 0.00 S ATOM 126 CE MET A 134 0.360 0.883 4.045 1.00 0.00 C ATOM 0 H MET A 134 2.422 1.006 7.667 1.00 0.00 H new ATOM 0 HA MET A 134 3.126 3.718 8.626 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.294 4.397 7.047 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.730 3.760 6.270 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.660 1.731 6.868 1.00 0.00 H new ATOM 0 HG3 MET A 134 0.145 2.978 5.749 1.00 0.00 H new ATOM 0 HE1 MET A 134 0.555 -0.150 3.757 1.00 0.00 H new ATOM 0 HE2 MET A 134 -0.460 0.911 4.763 1.00 0.00 H new ATOM 0 HE3 MET A 134 0.088 1.460 3.161 1.00 0.00 H new ATOM 136 N SER A 135 1.202 3.960 10.116 1.00 0.00 N ATOM 137 CA SER A 135 0.330 3.945 11.286 1.00 0.00 C ATOM 138 C SER A 135 -1.136 4.282 10.948 1.00 0.00 C ATOM 139 O SER A 135 -1.800 5.040 11.664 1.00 0.00 O ATOM 140 CB SER A 135 0.919 4.836 12.376 1.00 0.00 C ATOM 141 OG SER A 135 0.343 4.491 13.629 1.00 0.00 O ATOM 0 H SER A 135 1.743 4.818 10.011 1.00 0.00 H new ATOM 0 HA SER A 135 0.289 2.926 11.671 1.00 0.00 H new ATOM 0 HB2 SER A 135 2.002 4.715 12.415 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.724 5.884 12.150 1.00 0.00 H new ATOM 0 HG SER A 135 -0.632 4.577 13.576 1.00 0.00 H new ATOM 147 N ARG A 136 -1.628 3.710 9.839 1.00 0.00 N ATOM 148 CA ARG A 136 -2.936 3.860 9.194 1.00 0.00 C ATOM 149 C ARG A 136 -3.331 5.354 9.077 1.00 0.00 C ATOM 150 O ARG A 136 -4.002 5.881 9.970 1.00 0.00 O ATOM 151 CB ARG A 136 -3.970 2.922 9.846 1.00 0.00 C ATOM 152 CG ARG A 136 -3.579 1.436 9.838 1.00 0.00 C ATOM 153 CD ARG A 136 -2.728 1.034 11.051 1.00 0.00 C ATOM 154 NE ARG A 136 -2.485 -0.408 11.042 1.00 0.00 N ATOM 155 CZ ARG A 136 -1.512 -1.059 11.668 1.00 0.00 C ATOM 156 NH1 ARG A 136 -0.659 -0.478 12.474 1.00 0.00 N ATOM 157 NH2 ARG A 136 -1.364 -2.345 11.504 1.00 0.00 N ATOM 0 H ARG A 136 -1.049 3.055 9.314 1.00 0.00 H new ATOM 0 HA ARG A 136 -2.892 3.527 8.157 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.128 3.237 10.877 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.922 3.037 9.328 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -4.483 0.828 9.818 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -3.027 1.216 8.924 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -1.779 1.570 11.032 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -3.237 1.319 11.972 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.133 -0.975 10.496 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -0.723 0.525 12.647 1.00 0.00 H new ATOM 0 HH12 ARG A 136 0.069 -1.029 12.929 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -1.998 -2.857 10.891 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -0.614 -2.838 11.989 1.00 0.00 H new ATOM 171 N PRO A 137 -2.894 6.061 8.005 1.00 0.00 N ATOM 172 CA PRO A 137 -2.935 7.526 7.803 1.00 0.00 C ATOM 173 C PRO A 137 -4.164 8.407 8.112 1.00 0.00 C ATOM 174 O PRO A 137 -4.064 9.634 7.991 1.00 0.00 O ATOM 175 CB PRO A 137 -2.596 7.701 6.341 1.00 0.00 C ATOM 176 CG PRO A 137 -1.537 6.642 6.092 1.00 0.00 C ATOM 177 CD PRO A 137 -2.100 5.482 6.909 1.00 0.00 C ATOM 0 HA PRO A 137 -2.266 7.899 8.578 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.469 7.552 5.706 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.218 8.702 6.134 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.440 6.395 5.035 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -0.551 6.953 6.439 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -2.719 4.838 6.285 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -1.294 4.864 7.304 1.00 0.00 H new ATOM 185 N MET A 138 -5.308 7.830 8.471 1.00 0.00 N ATOM 186 CA MET A 138 -6.626 8.470 8.658 1.00 0.00 C ATOM 187 C MET A 138 -7.079 9.259 7.417 1.00 0.00 C ATOM 188 O MET A 138 -7.729 10.308 7.481 1.00 0.00 O ATOM 189 CB MET A 138 -6.673 9.259 9.979 1.00 0.00 C ATOM 190 CG MET A 138 -6.355 8.373 11.194 1.00 0.00 C ATOM 191 SD MET A 138 -7.317 6.834 11.350 1.00 0.00 S ATOM 192 CE MET A 138 -8.990 7.506 11.558 1.00 0.00 C ATOM 0 H MET A 138 -5.351 6.828 8.655 1.00 0.00 H new ATOM 0 HA MET A 138 -7.377 7.686 8.757 1.00 0.00 H new ATOM 0 HB2 MET A 138 -5.960 10.082 9.935 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.662 9.701 10.102 1.00 0.00 H new ATOM 0 HG2 MET A 138 -5.297 8.112 11.159 1.00 0.00 H new ATOM 0 HG3 MET A 138 -6.508 8.964 12.097 1.00 0.00 H new ATOM 0 HE1 MET A 138 -9.700 6.686 11.667 1.00 0.00 H new ATOM 0 HE2 MET A 138 -9.022 8.135 12.448 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.254 8.101 10.684 1.00 0.00 H new ATOM 202 N MET A 139 -6.696 8.714 6.266 1.00 0.00 N ATOM 203 CA MET A 139 -6.955 9.191 4.926 1.00 0.00 C ATOM 204 C MET A 139 -8.309 8.686 4.437 1.00 0.00 C ATOM 205 O MET A 139 -8.757 7.585 4.778 1.00 0.00 O ATOM 206 CB MET A 139 -5.833 8.732 3.987 1.00 0.00 C ATOM 207 CG MET A 139 -5.674 7.208 3.907 1.00 0.00 C ATOM 208 SD MET A 139 -4.250 6.705 2.928 1.00 0.00 S ATOM 209 CE MET A 139 -4.806 7.310 1.325 1.00 0.00 C ATOM 0 H MET A 139 -6.149 7.853 6.255 1.00 0.00 H new ATOM 0 HA MET A 139 -6.981 10.281 4.933 1.00 0.00 H new ATOM 0 HB2 MET A 139 -6.028 9.120 2.987 1.00 0.00 H new ATOM 0 HB3 MET A 139 -4.892 9.169 4.321 1.00 0.00 H new ATOM 0 HG2 MET A 139 -5.577 6.804 4.915 1.00 0.00 H new ATOM 0 HG3 MET A 139 -6.577 6.775 3.476 1.00 0.00 H new ATOM 0 HE1 MET A 139 -4.390 6.684 0.536 1.00 0.00 H new ATOM 0 HE2 MET A 139 -5.895 7.275 1.280 1.00 0.00 H new ATOM 0 HE3 MET A 139 -4.470 8.338 1.188 1.00 0.00 H new ATOM 219 N HIS A 140 -8.961 9.505 3.619 1.00 0.00 N ATOM 220 CA HIS A 140 -10.304 9.217 3.142 1.00 0.00 C ATOM 221 C HIS A 140 -10.323 8.880 1.657 1.00 0.00 C ATOM 222 O HIS A 140 -9.325 9.024 0.943 1.00 0.00 O ATOM 223 CB HIS A 140 -11.217 10.367 3.580 1.00 0.00 C ATOM 224 CG HIS A 140 -11.238 11.610 2.729 1.00 0.00 C ATOM 225 ND1 HIS A 140 -12.256 12.544 2.726 1.00 0.00 N ATOM 226 CD2 HIS A 140 -10.307 12.003 1.813 1.00 0.00 C ATOM 227 CE1 HIS A 140 -11.953 13.484 1.811 1.00 0.00 C ATOM 228 NE2 HIS A 140 -10.769 13.174 1.254 1.00 0.00 N ATOM 0 H HIS A 140 -8.574 10.382 3.271 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.699 8.307 3.594 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -12.235 9.983 3.637 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.929 10.657 4.590 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.385 11.494 1.572 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -12.559 14.343 1.565 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -10.291 13.717 0.535 1.00 0.00 H new ATOM 237 N PHE A 141 -11.491 8.474 1.187 1.00 0.00 N ATOM 238 CA PHE A 141 -11.749 8.091 -0.193 1.00 0.00 C ATOM 239 C PHE A 141 -12.659 9.087 -0.894 1.00 0.00 C ATOM 240 O PHE A 141 -12.502 9.335 -2.092 1.00 0.00 O ATOM 241 CB PHE A 141 -12.367 6.694 -0.180 1.00 0.00 C ATOM 242 CG PHE A 141 -11.612 5.742 0.722 1.00 0.00 C ATOM 243 CD1 PHE A 141 -10.323 5.312 0.358 1.00 0.00 C ATOM 244 CD2 PHE A 141 -12.139 5.406 1.982 1.00 0.00 C ATOM 245 CE1 PHE A 141 -9.552 4.561 1.261 1.00 0.00 C ATOM 246 CE2 PHE A 141 -11.359 4.650 2.879 1.00 0.00 C ATOM 247 CZ PHE A 141 -10.063 4.250 2.525 1.00 0.00 C ATOM 0 H PHE A 141 -12.318 8.399 1.779 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.814 8.087 -0.754 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.403 6.760 0.151 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.381 6.296 -1.195 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.926 5.559 -0.616 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -13.133 5.725 2.259 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -8.565 4.224 0.979 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -11.761 4.377 3.844 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.458 3.700 3.230 1.00 0.00 H new ATOM 257 N GLY A 142 -13.563 9.676 -0.114 1.00 0.00 N ATOM 258 CA GLY A 142 -14.693 10.491 -0.536 1.00 0.00 C ATOM 259 C GLY A 142 -16.004 9.701 -0.560 1.00 0.00 C ATOM 260 O GLY A 142 -16.991 10.181 -1.133 1.00 0.00 O ATOM 0 H GLY A 142 -13.519 9.588 0.901 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.796 11.341 0.138 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.496 10.894 -1.529 1.00 0.00 H new ATOM 264 N ASN A 143 -16.020 8.494 0.025 1.00 0.00 N ATOM 265 CA ASN A 143 -17.155 7.578 0.032 1.00 0.00 C ATOM 266 C ASN A 143 -17.200 6.883 1.402 1.00 0.00 C ATOM 267 O ASN A 143 -16.201 6.358 1.880 1.00 0.00 O ATOM 268 CB ASN A 143 -17.064 6.562 -1.127 1.00 0.00 C ATOM 269 CG ASN A 143 -16.256 7.012 -2.337 1.00 0.00 C ATOM 270 OD1 ASN A 143 -16.658 7.858 -3.122 1.00 0.00 O ATOM 271 ND2 ASN A 143 -15.081 6.452 -2.552 1.00 0.00 N ATOM 0 H ASN A 143 -15.211 8.122 0.522 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.081 8.131 -0.124 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.627 5.640 -0.744 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.075 6.323 -1.457 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -14.525 6.727 -3.362 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -14.728 5.744 -1.908 1.00 0.00 H new ATOM 278 N ASP A 144 -18.373 6.888 2.028 1.00 0.00 N ATOM 279 CA ASP A 144 -18.634 6.513 3.418 1.00 0.00 C ATOM 280 C ASP A 144 -18.470 5.022 3.696 1.00 0.00 C ATOM 281 O ASP A 144 -17.890 4.636 4.709 1.00 0.00 O ATOM 282 CB ASP A 144 -20.066 6.933 3.782 1.00 0.00 C ATOM 283 CG ASP A 144 -20.103 8.362 4.303 1.00 0.00 C ATOM 284 OD1 ASP A 144 -19.511 8.609 5.381 1.00 0.00 O ATOM 285 OD2 ASP A 144 -20.759 9.239 3.677 1.00 0.00 O ATOM 0 H ASP A 144 -19.226 7.173 1.547 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.891 7.027 4.028 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.708 6.846 2.905 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.465 6.257 4.538 1.00 0.00 H new ATOM 290 N TRP A 145 -18.991 4.194 2.789 1.00 0.00 N ATOM 291 CA TRP A 145 -18.977 2.735 2.884 1.00 0.00 C ATOM 292 C TRP A 145 -17.563 2.184 2.682 1.00 0.00 C ATOM 293 O TRP A 145 -17.228 1.126 3.209 1.00 0.00 O ATOM 294 CB TRP A 145 -19.982 2.164 1.878 1.00 0.00 C ATOM 295 CG TRP A 145 -19.585 2.180 0.431 1.00 0.00 C ATOM 296 CD1 TRP A 145 -19.416 3.277 -0.346 1.00 0.00 C ATOM 297 CD2 TRP A 145 -19.363 1.032 -0.446 1.00 0.00 C ATOM 298 NE1 TRP A 145 -19.070 2.886 -1.625 1.00 0.00 N ATOM 299 CE2 TRP A 145 -19.043 1.514 -1.749 1.00 0.00 C ATOM 300 CE3 TRP A 145 -19.434 -0.370 -0.280 1.00 0.00 C ATOM 301 CZ2 TRP A 145 -18.801 0.658 -2.833 1.00 0.00 C ATOM 302 CZ3 TRP A 145 -19.211 -1.240 -1.367 1.00 0.00 C ATOM 303 CH2 TRP A 145 -18.892 -0.730 -2.638 1.00 0.00 C ATOM 0 H TRP A 145 -19.448 4.532 1.942 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.280 2.424 3.884 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.193 1.132 2.159 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.914 2.719 1.979 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.534 4.299 -0.017 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.860 3.534 -2.385 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -19.662 -0.780 0.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.548 1.060 -3.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -19.286 -2.308 -1.222 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -18.717 -1.405 -3.463 1.00 0.00 H new ATOM 314 N GLU A 146 -16.733 2.960 1.982 1.00 0.00 N ATOM 315 CA GLU A 146 -15.293 2.809 1.860 1.00 0.00 C ATOM 316 C GLU A 146 -14.615 3.319 3.146 1.00 0.00 C ATOM 317 O GLU A 146 -13.852 2.580 3.768 1.00 0.00 O ATOM 318 CB GLU A 146 -14.828 3.550 0.592 1.00 0.00 C ATOM 319 CG GLU A 146 -14.871 2.693 -0.692 1.00 0.00 C ATOM 320 CD GLU A 146 -14.431 3.453 -1.958 1.00 0.00 C ATOM 321 OE1 GLU A 146 -13.415 4.196 -1.936 1.00 0.00 O ATOM 322 OE2 GLU A 146 -15.089 3.333 -3.019 1.00 0.00 O ATOM 0 H GLU A 146 -17.078 3.761 1.453 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.008 1.762 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.454 4.431 0.449 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.809 3.905 0.745 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.228 1.823 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.885 2.321 -0.836 1.00 0.00 H new ATOM 329 N ASP A 147 -14.938 4.538 3.604 1.00 0.00 N ATOM 330 CA ASP A 147 -14.365 5.152 4.810 1.00 0.00 C ATOM 331 C ASP A 147 -14.458 4.242 6.028 1.00 0.00 C ATOM 332 O ASP A 147 -13.482 4.102 6.766 1.00 0.00 O ATOM 333 CB ASP A 147 -15.006 6.520 5.088 1.00 0.00 C ATOM 334 CG ASP A 147 -13.954 7.592 5.358 1.00 0.00 C ATOM 335 OD1 ASP A 147 -13.034 7.736 4.511 1.00 0.00 O ATOM 336 OD2 ASP A 147 -14.023 8.288 6.403 1.00 0.00 O ATOM 0 H ASP A 147 -15.619 5.136 3.136 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.304 5.304 4.614 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.616 6.816 4.235 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.674 6.441 5.946 1.00 0.00 H new ATOM 341 N ARG A 148 -15.616 3.600 6.199 1.00 0.00 N ATOM 342 CA ARG A 148 -15.856 2.598 7.244 1.00 0.00 C ATOM 343 C ARG A 148 -15.186 1.245 6.980 1.00 0.00 C ATOM 344 O ARG A 148 -14.731 0.627 7.940 1.00 0.00 O ATOM 345 CB ARG A 148 -17.358 2.483 7.535 1.00 0.00 C ATOM 346 CG ARG A 148 -18.183 1.988 6.346 1.00 0.00 C ATOM 347 CD ARG A 148 -18.417 0.478 6.343 1.00 0.00 C ATOM 348 NE ARG A 148 -19.279 0.054 5.236 1.00 0.00 N ATOM 349 CZ ARG A 148 -20.601 0.092 5.193 1.00 0.00 C ATOM 350 NH1 ARG A 148 -21.326 0.705 6.101 1.00 0.00 N ATOM 351 NH2 ARG A 148 -21.214 -0.508 4.207 1.00 0.00 N ATOM 0 H ARG A 148 -16.429 3.764 5.605 1.00 0.00 H new ATOM 0 HA ARG A 148 -15.364 2.956 8.148 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -17.505 1.803 8.375 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -17.734 3.458 7.845 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.148 2.496 6.349 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -17.677 2.270 5.422 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.459 -0.036 6.273 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -18.870 0.180 7.289 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.808 -0.310 4.408 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -20.872 1.179 6.882 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -22.343 0.707 6.025 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.674 -0.993 3.490 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -22.232 -0.491 4.154 1.00 0.00 H new ATOM 365 N TYR A 149 -15.056 0.790 5.724 1.00 0.00 N ATOM 366 CA TYR A 149 -14.422 -0.488 5.393 1.00 0.00 C ATOM 367 C TYR A 149 -12.979 -0.548 5.897 1.00 0.00 C ATOM 368 O TYR A 149 -12.556 -1.568 6.451 1.00 0.00 O ATOM 369 CB TYR A 149 -14.446 -0.684 3.871 1.00 0.00 C ATOM 370 CG TYR A 149 -14.907 -2.056 3.444 1.00 0.00 C ATOM 371 CD1 TYR A 149 -14.102 -3.174 3.712 1.00 0.00 C ATOM 372 CD2 TYR A 149 -16.155 -2.212 2.815 1.00 0.00 C ATOM 373 CE1 TYR A 149 -14.571 -4.462 3.404 1.00 0.00 C ATOM 374 CE2 TYR A 149 -16.602 -3.499 2.454 1.00 0.00 C ATOM 375 CZ TYR A 149 -15.814 -4.629 2.761 1.00 0.00 C ATOM 376 OH TYR A 149 -16.307 -5.878 2.522 1.00 0.00 O ATOM 0 H TYR A 149 -15.390 1.303 4.909 1.00 0.00 H new ATOM 0 HA TYR A 149 -14.980 -1.284 5.885 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -15.102 0.065 3.427 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -13.446 -0.507 3.475 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -13.125 -3.045 4.154 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -16.769 -1.348 2.609 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -13.977 -5.327 3.661 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -17.546 -3.620 1.943 1.00 0.00 H new ATOM 0 HH TYR A 149 -17.175 -5.807 2.072 1.00 0.00 H new ATOM 386 N TYR A 150 -12.269 0.577 5.732 1.00 0.00 N ATOM 387 CA TYR A 150 -10.967 0.875 6.320 1.00 0.00 C ATOM 388 C TYR A 150 -11.015 0.607 7.828 1.00 0.00 C ATOM 389 O TYR A 150 -10.355 -0.321 8.293 1.00 0.00 O ATOM 390 CB TYR A 150 -10.600 2.317 5.920 1.00 0.00 C ATOM 391 CG TYR A 150 -9.399 2.979 6.574 1.00 0.00 C ATOM 392 CD1 TYR A 150 -9.531 3.551 7.855 1.00 0.00 C ATOM 393 CD2 TYR A 150 -8.203 3.166 5.850 1.00 0.00 C ATOM 394 CE1 TYR A 150 -8.466 4.254 8.439 1.00 0.00 C ATOM 395 CE2 TYR A 150 -7.146 3.908 6.411 1.00 0.00 C ATOM 396 CZ TYR A 150 -7.271 4.429 7.717 1.00 0.00 C ATOM 397 OH TYR A 150 -6.243 5.108 8.281 1.00 0.00 O ATOM 0 H TYR A 150 -12.612 1.342 5.151 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.172 0.229 5.947 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.436 2.328 4.842 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.469 2.945 6.116 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.462 3.447 8.393 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -8.098 2.739 4.863 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.563 4.658 9.436 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -6.243 4.078 5.844 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.505 5.417 9.173 1.00 0.00 H new ATOM 407 N ARG A 151 -11.856 1.327 8.590 1.00 0.00 N ATOM 408 CA ARG A 151 -11.929 1.203 10.066 1.00 0.00 C ATOM 409 C ARG A 151 -12.191 -0.223 10.539 1.00 0.00 C ATOM 410 O ARG A 151 -11.748 -0.615 11.625 1.00 0.00 O ATOM 411 CB ARG A 151 -13.030 2.093 10.669 1.00 0.00 C ATOM 412 CG ARG A 151 -13.062 3.467 10.022 1.00 0.00 C ATOM 413 CD ARG A 151 -14.063 4.413 10.661 1.00 0.00 C ATOM 414 NE ARG A 151 -14.084 5.668 9.901 1.00 0.00 N ATOM 415 CZ ARG A 151 -15.059 6.550 9.785 1.00 0.00 C ATOM 416 NH1 ARG A 151 -16.138 6.534 10.522 1.00 0.00 N ATOM 417 NH2 ARG A 151 -14.960 7.489 8.882 1.00 0.00 N ATOM 0 H ARG A 151 -12.506 2.012 8.206 1.00 0.00 H new ATOM 0 HA ARG A 151 -10.946 1.523 10.410 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -13.998 1.609 10.543 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -12.865 2.200 11.741 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.068 3.910 10.079 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.302 3.357 8.964 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.055 3.962 10.670 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.790 4.605 11.699 1.00 0.00 H new ATOM 0 HE ARG A 151 -13.228 5.889 9.393 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -16.259 5.813 11.233 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.859 7.243 10.387 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -14.138 7.533 8.280 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -15.705 8.178 8.779 1.00 0.00 H new ATOM 431 N GLU A 152 -12.940 -0.979 9.741 1.00 0.00 N ATOM 432 CA GLU A 152 -13.444 -2.299 10.086 1.00 0.00 C ATOM 433 C GLU A 152 -12.602 -3.439 9.518 1.00 0.00 C ATOM 434 O GLU A 152 -12.898 -4.591 9.831 1.00 0.00 O ATOM 435 CB GLU A 152 -14.922 -2.414 9.681 1.00 0.00 C ATOM 436 CG GLU A 152 -15.767 -1.404 10.472 1.00 0.00 C ATOM 437 CD GLU A 152 -17.189 -1.886 10.737 1.00 0.00 C ATOM 438 OE1 GLU A 152 -18.055 -1.763 9.837 1.00 0.00 O ATOM 439 OE2 GLU A 152 -17.482 -2.324 11.889 1.00 0.00 O ATOM 0 H GLU A 152 -13.220 -0.678 8.808 1.00 0.00 H new ATOM 0 HA GLU A 152 -13.365 -2.406 11.168 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -15.029 -2.231 8.612 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -15.281 -3.426 9.869 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -15.277 -1.197 11.424 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -15.806 -0.464 9.922 1.00 0.00 H new ATOM 446 N ASN A 153 -11.544 -3.161 8.741 1.00 0.00 N ATOM 447 CA ASN A 153 -10.603 -4.204 8.334 1.00 0.00 C ATOM 448 C ASN A 153 -9.122 -3.840 8.470 1.00 0.00 C ATOM 449 O ASN A 153 -8.285 -4.727 8.348 1.00 0.00 O ATOM 450 CB ASN A 153 -10.903 -4.685 6.912 1.00 0.00 C ATOM 451 CG ASN A 153 -12.307 -5.240 6.758 1.00 0.00 C ATOM 452 OD1 ASN A 153 -12.525 -6.455 6.771 1.00 0.00 O ATOM 453 ND2 ASN A 153 -13.277 -4.364 6.590 1.00 0.00 N ATOM 0 H ASN A 153 -11.324 -2.230 8.387 1.00 0.00 H new ATOM 0 HA ASN A 153 -10.765 -5.012 9.047 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -10.768 -3.856 6.218 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -10.182 -5.454 6.635 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.238 -4.684 6.466 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -13.067 -3.366 6.584 1.00 0.00 H new ATOM 460 N MET A 154 -8.755 -2.583 8.721 1.00 0.00 N ATOM 461 CA MET A 154 -7.379 -2.107 8.664 1.00 0.00 C ATOM 462 C MET A 154 -6.399 -2.834 9.590 1.00 0.00 C ATOM 463 O MET A 154 -5.206 -2.871 9.295 1.00 0.00 O ATOM 464 CB MET A 154 -7.329 -0.593 8.895 1.00 0.00 C ATOM 465 CG MET A 154 -7.820 -0.220 10.293 1.00 0.00 C ATOM 466 SD MET A 154 -7.919 1.568 10.575 1.00 0.00 S ATOM 467 CE MET A 154 -8.717 1.608 12.202 1.00 0.00 C ATOM 0 H MET A 154 -9.423 -1.855 8.975 1.00 0.00 H new ATOM 0 HA MET A 154 -7.034 -2.344 7.657 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.307 -0.238 8.761 1.00 0.00 H new ATOM 0 HB3 MET A 154 -7.942 -0.090 8.147 1.00 0.00 H new ATOM 0 HG2 MET A 154 -8.805 -0.659 10.452 1.00 0.00 H new ATOM 0 HG3 MET A 154 -7.151 -0.660 11.033 1.00 0.00 H new ATOM 0 HE1 MET A 154 -9.073 2.617 12.408 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.560 0.917 12.211 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.999 1.314 12.967 1.00 0.00 H new ATOM 477 N ASN A 155 -6.874 -3.459 10.674 1.00 0.00 N ATOM 478 CA ASN A 155 -6.041 -4.320 11.506 1.00 0.00 C ATOM 479 C ASN A 155 -5.611 -5.588 10.731 1.00 0.00 C ATOM 480 O ASN A 155 -4.424 -5.946 10.739 1.00 0.00 O ATOM 481 CB ASN A 155 -6.788 -4.601 12.818 1.00 0.00 C ATOM 482 CG ASN A 155 -6.319 -5.861 13.520 1.00 0.00 C ATOM 483 OD1 ASN A 155 -5.192 -5.949 14.006 1.00 0.00 O ATOM 484 ND2 ASN A 155 -7.178 -6.859 13.542 1.00 0.00 N ATOM 0 H ASN A 155 -7.840 -3.380 10.993 1.00 0.00 H new ATOM 0 HA ASN A 155 -5.105 -3.825 11.766 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -6.661 -3.751 13.489 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -7.854 -4.686 12.609 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -6.918 -7.746 13.973 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -8.103 -6.745 13.128 1.00 0.00 H new ATOM 491 N ARG A 156 -6.551 -6.209 9.995 1.00 0.00 N ATOM 492 CA ARG A 156 -6.285 -7.277 9.036 1.00 0.00 C ATOM 493 C ARG A 156 -5.517 -6.796 7.801 1.00 0.00 C ATOM 494 O ARG A 156 -4.659 -7.544 7.317 1.00 0.00 O ATOM 495 CB ARG A 156 -7.596 -7.923 8.532 1.00 0.00 C ATOM 496 CG ARG A 156 -8.235 -8.895 9.512 1.00 0.00 C ATOM 497 CD ARG A 156 -9.167 -8.210 10.509 1.00 0.00 C ATOM 498 NE ARG A 156 -10.481 -8.877 10.518 1.00 0.00 N ATOM 499 CZ ARG A 156 -11.620 -8.386 10.981 1.00 0.00 C ATOM 500 NH1 ARG A 156 -11.728 -7.171 11.444 1.00 0.00 N ATOM 501 NH2 ARG A 156 -12.713 -9.096 10.986 1.00 0.00 N ATOM 0 H ARG A 156 -7.540 -5.969 10.059 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.677 -7.998 9.582 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -8.312 -7.133 8.304 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -7.393 -8.448 7.599 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -8.796 -9.647 8.956 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -7.451 -9.420 10.058 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -8.729 -8.240 11.507 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -9.286 -7.159 10.244 1.00 0.00 H new ATOM 0 HE ARG A 156 -10.517 -9.818 10.125 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -10.914 -6.557 11.459 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -12.627 -6.835 11.791 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -12.702 -10.051 10.628 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.579 -8.697 11.348 1.00 0.00 H new ATOM 515 N TYR A 157 -5.818 -5.594 7.286 1.00 0.00 N ATOM 516 CA TYR A 157 -5.383 -5.150 5.954 1.00 0.00 C ATOM 517 C TYR A 157 -3.848 -5.027 5.804 1.00 0.00 C ATOM 518 O TYR A 157 -3.142 -4.945 6.816 1.00 0.00 O ATOM 519 CB TYR A 157 -6.261 -3.939 5.523 1.00 0.00 C ATOM 520 CG TYR A 157 -5.831 -2.480 5.635 1.00 0.00 C ATOM 521 CD1 TYR A 157 -4.726 -2.040 6.390 1.00 0.00 C ATOM 522 CD2 TYR A 157 -6.714 -1.519 5.094 1.00 0.00 C ATOM 523 CE1 TYR A 157 -4.497 -0.665 6.583 1.00 0.00 C ATOM 524 CE2 TYR A 157 -6.521 -0.143 5.319 1.00 0.00 C ATOM 525 CZ TYR A 157 -5.403 0.285 6.071 1.00 0.00 C ATOM 526 OH TYR A 157 -5.231 1.598 6.376 1.00 0.00 O ATOM 0 H TYR A 157 -6.373 -4.899 7.785 1.00 0.00 H new ATOM 0 HA TYR A 157 -5.568 -5.926 5.211 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.507 -4.102 4.474 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.191 -4.024 6.085 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -4.050 -2.763 6.823 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.552 -1.846 4.497 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -3.623 -0.336 7.126 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -7.220 0.578 4.921 1.00 0.00 H new ATOM 0 HH TYR A 157 -6.047 2.094 6.157 1.00 0.00 H new ATOM 536 N PRO A 158 -3.285 -5.028 4.578 1.00 0.00 N ATOM 537 CA PRO A 158 -1.880 -4.703 4.357 1.00 0.00 C ATOM 538 C PRO A 158 -1.589 -3.288 4.825 1.00 0.00 C ATOM 539 O PRO A 158 -2.306 -2.337 4.526 1.00 0.00 O ATOM 540 CB PRO A 158 -1.609 -4.867 2.867 1.00 0.00 C ATOM 541 CG PRO A 158 -2.982 -4.768 2.249 1.00 0.00 C ATOM 542 CD PRO A 158 -3.912 -5.352 3.312 1.00 0.00 C ATOM 0 HA PRO A 158 -1.227 -5.364 4.927 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -0.943 -4.090 2.492 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -1.138 -5.825 2.647 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -3.241 -3.735 2.017 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.041 -5.329 1.316 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.910 -4.919 3.244 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.023 -6.430 3.191 1.00 0.00 H new ATOM 550 N ASN A 159 -0.498 -3.177 5.569 1.00 0.00 N ATOM 551 CA ASN A 159 -0.121 -1.992 6.309 1.00 0.00 C ATOM 552 C ASN A 159 1.343 -1.603 6.065 1.00 0.00 C ATOM 553 O ASN A 159 1.866 -0.749 6.782 1.00 0.00 O ATOM 554 CB ASN A 159 -0.480 -2.210 7.780 1.00 0.00 C ATOM 555 CG ASN A 159 0.419 -3.221 8.448 1.00 0.00 C ATOM 556 OD1 ASN A 159 0.166 -4.425 8.493 1.00 0.00 O ATOM 557 ND2 ASN A 159 1.539 -2.732 8.911 1.00 0.00 N ATOM 0 H ASN A 159 0.170 -3.940 5.675 1.00 0.00 H new ATOM 0 HA ASN A 159 -0.682 -1.127 5.953 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.413 -1.261 8.312 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.515 -2.544 7.853 1.00 0.00 H new ATOM 0 HD21 ASN A 159 2.234 -3.353 9.325 1.00 0.00 H new ATOM 0 HD22 ASN A 159 1.718 -1.729 8.858 1.00 0.00 H new ATOM 564 N GLN A 160 2.002 -2.257 5.093 1.00 0.00 N ATOM 565 CA GLN A 160 3.272 -1.860 4.518 1.00 0.00 C ATOM 566 C GLN A 160 3.404 -2.310 3.054 1.00 0.00 C ATOM 567 O GLN A 160 2.731 -3.244 2.606 1.00 0.00 O ATOM 568 CB GLN A 160 4.491 -2.300 5.323 1.00 0.00 C ATOM 569 CG GLN A 160 4.311 -3.253 6.510 1.00 0.00 C ATOM 570 CD GLN A 160 5.624 -3.670 7.173 1.00 0.00 C ATOM 571 OE1 GLN A 160 5.612 -4.364 8.186 1.00 0.00 O ATOM 572 NE2 GLN A 160 6.776 -3.265 6.677 1.00 0.00 N ATOM 0 H GLN A 160 1.636 -3.114 4.677 1.00 0.00 H new ATOM 0 HA GLN A 160 3.261 -0.771 4.554 1.00 0.00 H new ATOM 0 HB2 GLN A 160 5.187 -2.771 4.629 1.00 0.00 H new ATOM 0 HB3 GLN A 160 4.976 -1.399 5.699 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.675 -2.774 7.255 1.00 0.00 H new ATOM 0 HG3 GLN A 160 3.787 -4.146 6.170 1.00 0.00 H new ATOM 0 HE21 GLN A 160 6.795 -2.688 5.836 1.00 0.00 H new ATOM 0 HE22 GLN A 160 7.649 -3.528 7.134 1.00 0.00 H new ATOM 581 N VAL A 161 4.319 -1.655 2.331 1.00 0.00 N ATOM 582 CA VAL A 161 4.383 -1.686 0.870 1.00 0.00 C ATOM 583 C VAL A 161 5.741 -2.219 0.357 1.00 0.00 C ATOM 584 O VAL A 161 6.790 -1.679 0.694 1.00 0.00 O ATOM 585 CB VAL A 161 3.950 -0.295 0.327 1.00 0.00 C ATOM 586 CG1 VAL A 161 3.083 0.519 1.306 1.00 0.00 C ATOM 587 CG2 VAL A 161 5.099 0.630 -0.041 1.00 0.00 C ATOM 0 H VAL A 161 5.047 -1.079 2.754 1.00 0.00 H new ATOM 0 HA VAL A 161 3.677 -2.412 0.466 1.00 0.00 H new ATOM 0 HB VAL A 161 3.387 -0.584 -0.560 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.823 1.476 0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.172 -0.035 1.532 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.640 0.693 2.227 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.701 1.575 -0.410 1.00 0.00 H new ATOM 0 HG22 VAL A 161 5.714 0.814 0.840 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.706 0.165 -0.817 1.00 0.00 H new ATOM 597 N TYR A 162 5.754 -3.305 -0.419 1.00 0.00 N ATOM 598 CA TYR A 162 6.946 -3.851 -1.091 1.00 0.00 C ATOM 599 C TYR A 162 7.302 -2.989 -2.302 1.00 0.00 C ATOM 600 O TYR A 162 6.437 -2.738 -3.130 1.00 0.00 O ATOM 601 CB TYR A 162 6.696 -5.286 -1.568 1.00 0.00 C ATOM 602 CG TYR A 162 6.980 -6.401 -0.594 1.00 0.00 C ATOM 603 CD1 TYR A 162 8.277 -6.931 -0.471 1.00 0.00 C ATOM 604 CD2 TYR A 162 5.914 -6.976 0.111 1.00 0.00 C ATOM 605 CE1 TYR A 162 8.509 -8.012 0.398 1.00 0.00 C ATOM 606 CE2 TYR A 162 6.135 -8.053 0.985 1.00 0.00 C ATOM 607 CZ TYR A 162 7.442 -8.572 1.135 1.00 0.00 C ATOM 608 OH TYR A 162 7.679 -9.652 1.926 1.00 0.00 O ATOM 0 H TYR A 162 4.912 -3.849 -0.606 1.00 0.00 H new ATOM 0 HA TYR A 162 7.766 -3.849 -0.373 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.652 -5.363 -1.872 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.301 -5.455 -2.459 1.00 0.00 H new ATOM 0 HD1 TYR A 162 9.091 -6.510 -1.042 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.915 -6.588 -0.019 1.00 0.00 H new ATOM 0 HE1 TYR A 162 9.506 -8.415 0.502 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.313 -8.482 1.539 1.00 0.00 H new ATOM 0 HH TYR A 162 6.848 -9.922 2.369 1.00 0.00 H new ATOM 618 N TYR A 163 8.566 -2.586 -2.463 1.00 0.00 N ATOM 619 CA TYR A 163 9.012 -1.949 -3.708 1.00 0.00 C ATOM 620 C TYR A 163 10.497 -2.148 -3.978 1.00 0.00 C ATOM 621 O TYR A 163 11.310 -2.247 -3.054 1.00 0.00 O ATOM 622 CB TYR A 163 8.703 -0.448 -3.685 1.00 0.00 C ATOM 623 CG TYR A 163 9.336 0.323 -2.546 1.00 0.00 C ATOM 624 CD1 TYR A 163 8.701 0.375 -1.291 1.00 0.00 C ATOM 625 CD2 TYR A 163 10.556 0.993 -2.749 1.00 0.00 C ATOM 626 CE1 TYR A 163 9.269 1.142 -0.255 1.00 0.00 C ATOM 627 CE2 TYR A 163 11.141 1.736 -1.711 1.00 0.00 C ATOM 628 CZ TYR A 163 10.497 1.812 -0.460 1.00 0.00 C ATOM 629 OH TYR A 163 11.076 2.529 0.542 1.00 0.00 O ATOM 0 H TYR A 163 9.293 -2.688 -1.755 1.00 0.00 H new ATOM 0 HA TYR A 163 8.461 -2.436 -4.513 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.034 -0.011 -4.627 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.622 -0.317 -3.635 1.00 0.00 H new ATOM 0 HD1 TYR A 163 7.784 -0.170 -1.123 1.00 0.00 H new ATOM 0 HD2 TYR A 163 11.046 0.936 -3.710 1.00 0.00 H new ATOM 0 HE1 TYR A 163 8.766 1.218 0.697 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.079 2.246 -1.871 1.00 0.00 H new ATOM 0 HH TYR A 163 10.392 3.059 1.003 1.00 0.00 H new ATOM 639 N ARG A 164 10.853 -2.178 -5.263 1.00 0.00 N ATOM 640 CA ARG A 164 12.232 -2.112 -5.732 1.00 0.00 C ATOM 641 C ARG A 164 12.731 -0.675 -5.516 1.00 0.00 C ATOM 642 O ARG A 164 11.980 0.246 -5.831 1.00 0.00 O ATOM 643 CB ARG A 164 12.218 -2.487 -7.213 1.00 0.00 C ATOM 644 CG ARG A 164 13.585 -2.802 -7.816 1.00 0.00 C ATOM 645 CD ARG A 164 14.365 -3.889 -7.057 1.00 0.00 C ATOM 646 NE ARG A 164 15.017 -4.848 -7.960 1.00 0.00 N ATOM 647 CZ ARG A 164 16.103 -5.567 -7.689 1.00 0.00 C ATOM 648 NH1 ARG A 164 16.774 -5.449 -6.570 1.00 0.00 N ATOM 649 NH2 ARG A 164 16.580 -6.454 -8.524 1.00 0.00 N ATOM 0 H ARG A 164 10.174 -2.250 -6.021 1.00 0.00 H new ATOM 0 HA ARG A 164 12.896 -2.791 -5.198 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.571 -3.354 -7.346 1.00 0.00 H new ATOM 0 HB3 ARG A 164 11.771 -1.667 -7.775 1.00 0.00 H new ATOM 0 HG2 ARG A 164 13.451 -3.120 -8.850 1.00 0.00 H new ATOM 0 HG3 ARG A 164 14.181 -1.889 -7.838 1.00 0.00 H new ATOM 0 HD2 ARG A 164 15.119 -3.417 -6.427 1.00 0.00 H new ATOM 0 HD3 ARG A 164 13.685 -4.424 -6.394 1.00 0.00 H new ATOM 0 HE ARG A 164 14.597 -4.974 -8.881 1.00 0.00 H new ATOM 0 HH11 ARG A 164 16.469 -4.783 -5.860 1.00 0.00 H new ATOM 0 HH12 ARG A 164 17.601 -6.023 -6.408 1.00 0.00 H new ATOM 0 HH21 ARG A 164 16.116 -6.613 -9.419 1.00 0.00 H new ATOM 0 HH22 ARG A 164 17.415 -6.986 -8.281 1.00 0.00 H new ATOM 663 N PRO A 165 13.933 -0.445 -4.954 1.00 0.00 N ATOM 664 CA PRO A 165 14.414 0.892 -4.614 1.00 0.00 C ATOM 665 C PRO A 165 14.356 1.878 -5.769 1.00 0.00 C ATOM 666 O PRO A 165 14.438 1.518 -6.940 1.00 0.00 O ATOM 667 CB PRO A 165 15.829 0.723 -4.089 1.00 0.00 C ATOM 668 CG PRO A 165 15.803 -0.689 -3.555 1.00 0.00 C ATOM 669 CD PRO A 165 14.944 -1.413 -4.583 1.00 0.00 C ATOM 0 HA PRO A 165 13.758 1.331 -3.862 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.573 0.847 -4.876 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.064 1.449 -3.310 1.00 0.00 H new ATOM 0 HG2 PRO A 165 16.803 -1.116 -3.489 1.00 0.00 H new ATOM 0 HG3 PRO A 165 15.369 -0.738 -2.556 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.533 -1.722 -5.446 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.496 -2.314 -4.163 1.00 0.00 H new ATOM 677 N VAL A 166 14.244 3.140 -5.383 1.00 0.00 N ATOM 678 CA VAL A 166 13.903 4.279 -6.244 1.00 0.00 C ATOM 679 C VAL A 166 15.026 4.695 -7.204 1.00 0.00 C ATOM 680 O VAL A 166 14.765 5.313 -8.243 1.00 0.00 O ATOM 681 CB VAL A 166 13.392 5.430 -5.348 1.00 0.00 C ATOM 682 CG1 VAL A 166 14.464 6.401 -4.847 1.00 0.00 C ATOM 683 CG2 VAL A 166 12.281 6.213 -6.040 1.00 0.00 C ATOM 0 H VAL A 166 14.395 3.419 -4.414 1.00 0.00 H new ATOM 0 HA VAL A 166 13.106 3.977 -6.924 1.00 0.00 H new ATOM 0 HB VAL A 166 13.012 4.924 -4.461 1.00 0.00 H new ATOM 0 HG11 VAL A 166 13.999 7.169 -4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 166 15.201 5.856 -4.257 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.956 6.870 -5.699 1.00 0.00 H new ATOM 0 HG21 VAL A 166 11.941 7.016 -5.387 1.00 0.00 H new ATOM 0 HG22 VAL A 166 12.660 6.637 -6.970 1.00 0.00 H new ATOM 0 HG23 VAL A 166 11.447 5.546 -6.259 1.00 0.00 H new ATOM 693 N ASP A 167 16.269 4.304 -6.901 1.00 0.00 N ATOM 694 CA ASP A 167 17.472 4.739 -7.625 1.00 0.00 C ATOM 695 C ASP A 167 17.645 4.224 -9.060 1.00 0.00 C ATOM 696 O ASP A 167 18.659 4.560 -9.686 1.00 0.00 O ATOM 697 CB ASP A 167 18.759 4.474 -6.833 1.00 0.00 C ATOM 698 CG ASP A 167 19.370 3.074 -6.926 1.00 0.00 C ATOM 699 OD1 ASP A 167 18.717 2.051 -6.597 1.00 0.00 O ATOM 700 OD2 ASP A 167 20.583 2.986 -7.228 1.00 0.00 O ATOM 0 H ASP A 167 16.472 3.665 -6.132 1.00 0.00 H new ATOM 0 HA ASP A 167 17.295 5.810 -7.723 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.510 5.192 -7.162 1.00 0.00 H new ATOM 0 HB3 ASP A 167 18.557 4.684 -5.783 1.00 0.00 H new ATOM 705 N GLN A 168 16.690 3.446 -9.590 1.00 0.00 N ATOM 706 CA GLN A 168 16.668 3.076 -11.011 1.00 0.00 C ATOM 707 C GLN A 168 15.330 3.353 -11.721 1.00 0.00 C ATOM 708 O GLN A 168 15.031 2.821 -12.793 1.00 0.00 O ATOM 709 CB GLN A 168 17.159 1.658 -11.302 1.00 0.00 C ATOM 710 CG GLN A 168 17.953 0.978 -10.192 1.00 0.00 C ATOM 711 CD GLN A 168 16.989 0.270 -9.247 1.00 0.00 C ATOM 712 OE1 GLN A 168 16.364 -0.736 -9.596 1.00 0.00 O ATOM 713 NE2 GLN A 168 16.837 0.744 -8.033 1.00 0.00 N ATOM 0 H GLN A 168 15.917 3.058 -9.049 1.00 0.00 H new ATOM 0 HA GLN A 168 17.400 3.757 -11.445 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.294 1.037 -11.534 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.779 1.688 -12.198 1.00 0.00 H new ATOM 0 HG2 GLN A 168 18.656 0.262 -10.618 1.00 0.00 H new ATOM 0 HG3 GLN A 168 18.541 1.715 -9.645 1.00 0.00 H new ATOM 0 HE21 GLN A 168 17.352 1.575 -7.742 1.00 0.00 H new ATOM 0 HE22 GLN A 168 16.204 0.282 -7.381 1.00 0.00 H new ATOM 722 N TYR A 169 14.517 4.198 -11.104 1.00 0.00 N ATOM 723 CA TYR A 169 13.235 4.670 -11.599 1.00 0.00 C ATOM 724 C TYR A 169 13.364 6.137 -11.990 1.00 0.00 C ATOM 725 O TYR A 169 14.397 6.781 -11.749 1.00 0.00 O ATOM 726 CB TYR A 169 12.151 4.414 -10.538 1.00 0.00 C ATOM 727 CG TYR A 169 11.951 2.924 -10.355 1.00 0.00 C ATOM 728 CD1 TYR A 169 12.828 2.205 -9.526 1.00 0.00 C ATOM 729 CD2 TYR A 169 11.001 2.239 -11.134 1.00 0.00 C ATOM 730 CE1 TYR A 169 12.820 0.803 -9.535 1.00 0.00 C ATOM 731 CE2 TYR A 169 10.977 0.833 -11.138 1.00 0.00 C ATOM 732 CZ TYR A 169 11.917 0.115 -10.363 1.00 0.00 C ATOM 733 OH TYR A 169 12.013 -1.239 -10.448 1.00 0.00 O ATOM 0 H TYR A 169 14.749 4.594 -10.193 1.00 0.00 H new ATOM 0 HA TYR A 169 12.932 4.125 -12.493 1.00 0.00 H new ATOM 0 HB2 TYR A 169 12.441 4.870 -9.591 1.00 0.00 H new ATOM 0 HB3 TYR A 169 11.214 4.881 -10.842 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.511 2.735 -8.879 1.00 0.00 H new ATOM 0 HD2 TYR A 169 10.290 2.793 -11.729 1.00 0.00 H new ATOM 0 HE1 TYR A 169 13.506 0.253 -8.907 1.00 0.00 H new ATOM 0 HE2 TYR A 169 10.244 0.304 -11.730 1.00 0.00 H new ATOM 0 HH TYR A 169 11.324 -1.578 -11.056 1.00 0.00 H new ATOM 743 N ASN A 170 12.295 6.666 -12.565 1.00 0.00 N ATOM 744 CA ASN A 170 12.135 8.084 -12.857 1.00 0.00 C ATOM 745 C ASN A 170 10.672 8.550 -12.687 1.00 0.00 C ATOM 746 O ASN A 170 10.421 9.765 -12.662 1.00 0.00 O ATOM 747 CB ASN A 170 12.712 8.334 -14.263 1.00 0.00 C ATOM 748 CG ASN A 170 13.288 9.728 -14.460 1.00 0.00 C ATOM 749 OD1 ASN A 170 14.438 9.898 -14.856 1.00 0.00 O ATOM 750 ND2 ASN A 170 12.514 10.763 -14.219 1.00 0.00 N ATOM 0 H ASN A 170 11.492 6.106 -12.850 1.00 0.00 H new ATOM 0 HA ASN A 170 12.686 8.691 -12.139 1.00 0.00 H new ATOM 0 HB2 ASN A 170 13.493 7.599 -14.459 1.00 0.00 H new ATOM 0 HB3 ASN A 170 11.927 8.170 -15.001 1.00 0.00 H new ATOM 0 HD21 ASN A 170 12.868 11.709 -14.361 1.00 0.00 H new ATOM 0 HD22 ASN A 170 11.559 10.620 -13.890 1.00 0.00 H new ATOM 757 N ASN A 171 9.707 7.628 -12.527 1.00 0.00 N ATOM 758 CA ASN A 171 8.298 7.931 -12.377 1.00 0.00 C ATOM 759 C ASN A 171 7.656 7.148 -11.234 1.00 0.00 C ATOM 760 O ASN A 171 7.662 5.913 -11.220 1.00 0.00 O ATOM 761 CB ASN A 171 7.570 7.645 -13.691 1.00 0.00 C ATOM 762 CG ASN A 171 8.049 8.531 -14.821 1.00 0.00 C ATOM 763 OD1 ASN A 171 7.747 9.715 -14.876 1.00 0.00 O ATOM 764 ND2 ASN A 171 8.834 7.992 -15.723 1.00 0.00 N ATOM 0 H ASN A 171 9.905 6.628 -12.500 1.00 0.00 H new ATOM 0 HA ASN A 171 8.210 8.988 -12.128 1.00 0.00 H new ATOM 0 HB2 ASN A 171 7.717 6.600 -13.965 1.00 0.00 H new ATOM 0 HB3 ASN A 171 6.499 7.789 -13.549 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.202 8.562 -16.485 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.076 7.003 -15.663 1.00 0.00 H new ATOM 771 N GLN A 172 7.032 7.893 -10.321 1.00 0.00 N ATOM 772 CA GLN A 172 6.211 7.397 -9.243 1.00 0.00 C ATOM 773 C GLN A 172 5.131 6.450 -9.729 1.00 0.00 C ATOM 774 O GLN A 172 5.145 5.304 -9.318 1.00 0.00 O ATOM 775 CB GLN A 172 5.607 8.610 -8.548 1.00 0.00 C ATOM 776 CG GLN A 172 6.560 9.114 -7.478 1.00 0.00 C ATOM 777 CD GLN A 172 6.237 10.544 -7.115 1.00 0.00 C ATOM 778 OE1 GLN A 172 6.690 11.484 -7.765 1.00 0.00 O ATOM 779 NE2 GLN A 172 5.383 10.763 -6.146 1.00 0.00 N ATOM 0 H GLN A 172 7.096 8.911 -10.324 1.00 0.00 H new ATOM 0 HA GLN A 172 6.821 6.814 -8.553 1.00 0.00 H new ATOM 0 HB2 GLN A 172 5.412 9.398 -9.275 1.00 0.00 H new ATOM 0 HB3 GLN A 172 4.649 8.345 -8.100 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.489 8.483 -6.592 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.587 9.046 -7.836 1.00 0.00 H new ATOM 0 HE21 GLN A 172 5.009 9.980 -5.609 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.092 11.716 -5.929 1.00 0.00 H new ATOM 788 N ASN A 173 4.218 6.877 -10.603 1.00 0.00 N ATOM 789 CA ASN A 173 3.023 6.117 -10.963 1.00 0.00 C ATOM 790 C ASN A 173 3.335 4.663 -11.370 1.00 0.00 C ATOM 791 O ASN A 173 2.628 3.732 -10.974 1.00 0.00 O ATOM 792 CB ASN A 173 2.257 6.887 -12.051 1.00 0.00 C ATOM 793 CG ASN A 173 2.877 6.771 -13.430 1.00 0.00 C ATOM 794 OD1 ASN A 173 2.465 5.954 -14.241 1.00 0.00 O ATOM 795 ND2 ASN A 173 3.898 7.541 -13.709 1.00 0.00 N ATOM 0 H ASN A 173 4.290 7.772 -11.086 1.00 0.00 H new ATOM 0 HA ASN A 173 2.389 6.022 -10.082 1.00 0.00 H new ATOM 0 HB2 ASN A 173 1.232 6.519 -12.091 1.00 0.00 H new ATOM 0 HB3 ASN A 173 2.207 7.940 -11.772 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.362 7.465 -14.614 1.00 0.00 H new ATOM 0 HD22 ASN A 173 4.229 8.218 -13.021 1.00 0.00 H new ATOM 802 N ASN A 174 4.444 4.500 -12.103 1.00 0.00 N ATOM 803 CA ASN A 174 5.000 3.270 -12.625 1.00 0.00 C ATOM 804 C ASN A 174 5.665 2.404 -11.539 1.00 0.00 C ATOM 805 O ASN A 174 5.317 1.230 -11.364 1.00 0.00 O ATOM 806 CB ASN A 174 6.001 3.704 -13.703 1.00 0.00 C ATOM 807 CG ASN A 174 6.855 2.556 -14.183 1.00 0.00 C ATOM 808 OD1 ASN A 174 6.356 1.519 -14.606 1.00 0.00 O ATOM 809 ND2 ASN A 174 8.154 2.725 -14.091 1.00 0.00 N ATOM 0 H ASN A 174 5.016 5.304 -12.362 1.00 0.00 H new ATOM 0 HA ASN A 174 4.216 2.631 -13.031 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.460 4.130 -14.548 1.00 0.00 H new ATOM 0 HB3 ASN A 174 6.642 4.490 -13.305 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.787 1.978 -14.377 1.00 0.00 H new ATOM 0 HD22 ASN A 174 8.530 3.603 -13.734 1.00 0.00 H new ATOM 816 N PHE A 175 6.623 2.984 -10.804 1.00 0.00 N ATOM 817 CA PHE A 175 7.216 2.390 -9.595 1.00 0.00 C ATOM 818 C PHE A 175 6.116 1.904 -8.645 1.00 0.00 C ATOM 819 O PHE A 175 6.162 0.786 -8.134 1.00 0.00 O ATOM 820 CB PHE A 175 8.103 3.460 -8.935 1.00 0.00 C ATOM 821 CG PHE A 175 8.558 3.228 -7.499 1.00 0.00 C ATOM 822 CD1 PHE A 175 7.680 3.495 -6.430 1.00 0.00 C ATOM 823 CD2 PHE A 175 9.900 2.913 -7.214 1.00 0.00 C ATOM 824 CE1 PHE A 175 8.134 3.496 -5.101 1.00 0.00 C ATOM 825 CE2 PHE A 175 10.360 2.922 -5.886 1.00 0.00 C ATOM 826 CZ PHE A 175 9.485 3.235 -4.833 1.00 0.00 C ATOM 0 H PHE A 175 7.016 3.896 -11.036 1.00 0.00 H new ATOM 0 HA PHE A 175 7.822 1.520 -9.848 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.994 3.582 -9.552 1.00 0.00 H new ATOM 0 HB3 PHE A 175 7.563 4.406 -8.965 1.00 0.00 H new ATOM 0 HD1 PHE A 175 6.640 3.702 -6.636 1.00 0.00 H new ATOM 0 HD2 PHE A 175 10.577 2.664 -8.017 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.448 3.696 -4.292 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.393 2.687 -5.674 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.852 3.275 -3.818 1.00 0.00 H new ATOM 836 N VAL A 176 5.105 2.754 -8.440 1.00 0.00 N ATOM 837 CA VAL A 176 3.970 2.542 -7.555 1.00 0.00 C ATOM 838 C VAL A 176 3.029 1.443 -8.048 1.00 0.00 C ATOM 839 O VAL A 176 2.551 0.671 -7.224 1.00 0.00 O ATOM 840 CB VAL A 176 3.246 3.865 -7.260 1.00 0.00 C ATOM 841 CG1 VAL A 176 1.914 3.657 -6.550 1.00 0.00 C ATOM 842 CG2 VAL A 176 4.144 4.744 -6.385 1.00 0.00 C ATOM 0 H VAL A 176 5.060 3.655 -8.916 1.00 0.00 H new ATOM 0 HA VAL A 176 4.363 2.173 -6.608 1.00 0.00 H new ATOM 0 HB VAL A 176 3.038 4.344 -8.217 1.00 0.00 H new ATOM 0 HG11 VAL A 176 1.445 4.624 -6.366 1.00 0.00 H new ATOM 0 HG12 VAL A 176 1.260 3.049 -7.175 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.083 3.149 -5.601 1.00 0.00 H new ATOM 0 HG21 VAL A 176 3.636 5.685 -6.172 1.00 0.00 H new ATOM 0 HG22 VAL A 176 4.359 4.227 -5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 176 5.078 4.947 -6.910 1.00 0.00 H new ATOM 852 N HIS A 177 2.801 1.316 -9.360 1.00 0.00 N ATOM 853 CA HIS A 177 1.997 0.235 -9.955 1.00 0.00 C ATOM 854 C HIS A 177 2.532 -1.137 -9.553 1.00 0.00 C ATOM 855 O HIS A 177 1.789 -2.016 -9.108 1.00 0.00 O ATOM 856 CB HIS A 177 2.033 0.401 -11.474 1.00 0.00 C ATOM 857 CG HIS A 177 1.082 -0.484 -12.240 1.00 0.00 C ATOM 858 ND1 HIS A 177 1.445 -1.519 -13.080 1.00 0.00 N ATOM 859 CD2 HIS A 177 -0.280 -0.382 -12.259 1.00 0.00 C ATOM 860 CE1 HIS A 177 0.318 -2.032 -13.611 1.00 0.00 C ATOM 861 NE2 HIS A 177 -0.742 -1.356 -13.123 1.00 0.00 N ATOM 0 H HIS A 177 3.173 1.968 -10.050 1.00 0.00 H new ATOM 0 HA HIS A 177 0.971 0.298 -9.591 1.00 0.00 H new ATOM 0 HB2 HIS A 177 1.811 1.440 -11.715 1.00 0.00 H new ATOM 0 HB3 HIS A 177 3.047 0.203 -11.821 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -0.880 0.324 -11.705 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.271 -2.851 -14.313 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -1.720 -1.534 -13.353 1.00 0.00 H new ATOM 870 N ASP A 178 3.847 -1.281 -9.691 1.00 0.00 N ATOM 871 CA ASP A 178 4.608 -2.412 -9.165 1.00 0.00 C ATOM 872 C ASP A 178 4.531 -2.504 -7.642 1.00 0.00 C ATOM 873 O ASP A 178 4.230 -3.569 -7.107 1.00 0.00 O ATOM 874 CB ASP A 178 6.073 -2.294 -9.577 1.00 0.00 C ATOM 875 CG ASP A 178 6.360 -3.160 -10.800 1.00 0.00 C ATOM 876 OD1 ASP A 178 6.547 -4.396 -10.657 1.00 0.00 O ATOM 877 OD2 ASP A 178 6.291 -2.613 -11.933 1.00 0.00 O ATOM 0 H ASP A 178 4.426 -0.600 -10.182 1.00 0.00 H new ATOM 0 HA ASP A 178 4.164 -3.315 -9.584 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.311 -1.254 -9.798 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.714 -2.599 -8.750 1.00 0.00 H new ATOM 882 N CYS A 179 4.812 -1.390 -6.961 1.00 0.00 N ATOM 883 CA CYS A 179 4.868 -1.301 -5.511 1.00 0.00 C ATOM 884 C CYS A 179 3.607 -1.897 -4.852 1.00 0.00 C ATOM 885 O CYS A 179 3.658 -2.841 -4.055 1.00 0.00 O ATOM 886 CB CYS A 179 5.041 0.156 -5.114 1.00 0.00 C ATOM 887 SG CYS A 179 5.097 0.463 -3.350 1.00 0.00 S ATOM 0 H CYS A 179 5.012 -0.503 -7.423 1.00 0.00 H new ATOM 0 HA CYS A 179 5.717 -1.886 -5.157 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.961 0.531 -5.562 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.221 0.733 -5.541 1.00 0.00 H new ATOM 892 N VAL A 180 2.441 -1.342 -5.223 1.00 0.00 N ATOM 893 CA VAL A 180 1.161 -1.757 -4.657 1.00 0.00 C ATOM 894 C VAL A 180 0.857 -3.205 -4.998 1.00 0.00 C ATOM 895 O VAL A 180 0.419 -3.955 -4.125 1.00 0.00 O ATOM 896 CB VAL A 180 -0.021 -0.881 -5.106 1.00 0.00 C ATOM 897 CG1 VAL A 180 0.186 0.546 -4.633 1.00 0.00 C ATOM 898 CG2 VAL A 180 -0.392 -0.796 -6.588 1.00 0.00 C ATOM 0 H VAL A 180 2.366 -0.600 -5.918 1.00 0.00 H new ATOM 0 HA VAL A 180 1.270 -1.638 -3.579 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.853 -1.416 -4.648 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.654 1.161 -4.954 1.00 0.00 H new ATOM 0 HG12 VAL A 180 0.253 0.563 -3.545 1.00 0.00 H new ATOM 0 HG13 VAL A 180 1.108 0.940 -5.059 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.248 -0.133 -6.711 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.454 -0.405 -7.153 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.647 -1.790 -6.957 1.00 0.00 H new ATOM 908 N ASN A 181 1.132 -3.593 -6.251 1.00 0.00 N ATOM 909 CA ASN A 181 0.977 -4.947 -6.749 1.00 0.00 C ATOM 910 C ASN A 181 1.651 -5.949 -5.829 1.00 0.00 C ATOM 911 O ASN A 181 0.967 -6.838 -5.342 1.00 0.00 O ATOM 912 CB ASN A 181 1.500 -5.034 -8.181 1.00 0.00 C ATOM 913 CG ASN A 181 1.592 -6.443 -8.729 1.00 0.00 C ATOM 914 OD1 ASN A 181 0.676 -6.952 -9.370 1.00 0.00 O ATOM 915 ND2 ASN A 181 2.729 -7.076 -8.530 1.00 0.00 N ATOM 0 H ASN A 181 1.478 -2.946 -6.959 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.082 -5.203 -6.763 1.00 0.00 H new ATOM 0 HB2 ASN A 181 0.849 -4.447 -8.829 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.488 -4.576 -8.222 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.865 -8.012 -8.912 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.474 -6.630 -7.994 1.00 0.00 H new ATOM 922 N ILE A 182 2.965 -5.843 -5.603 1.00 0.00 N ATOM 923 CA ILE A 182 3.680 -6.901 -4.899 1.00 0.00 C ATOM 924 C ILE A 182 3.283 -6.991 -3.417 1.00 0.00 C ATOM 925 O ILE A 182 3.100 -8.111 -2.931 1.00 0.00 O ATOM 926 CB ILE A 182 5.203 -6.802 -5.143 1.00 0.00 C ATOM 927 CG1 ILE A 182 5.992 -7.889 -4.389 1.00 0.00 C ATOM 928 CG2 ILE A 182 5.755 -5.415 -4.793 1.00 0.00 C ATOM 929 CD1 ILE A 182 5.751 -9.294 -4.946 1.00 0.00 C ATOM 0 H ILE A 182 3.540 -5.052 -5.892 1.00 0.00 H new ATOM 0 HA ILE A 182 3.371 -7.857 -5.322 1.00 0.00 H new ATOM 0 HB ILE A 182 5.341 -6.967 -6.212 1.00 0.00 H new ATOM 0 HG12 ILE A 182 7.056 -7.660 -4.441 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.713 -7.868 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 182 6.829 -5.393 -4.980 1.00 0.00 H new ATOM 0 HG22 ILE A 182 5.263 -4.662 -5.409 1.00 0.00 H new ATOM 0 HG23 ILE A 182 5.566 -5.203 -3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 182 6.333 -10.017 -4.375 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.692 -9.539 -4.869 1.00 0.00 H new ATOM 0 HD13 ILE A 182 6.056 -9.328 -5.992 1.00 0.00 H new ATOM 941 N THR A 183 3.074 -5.862 -2.714 1.00 0.00 N ATOM 942 CA THR A 183 2.482 -5.914 -1.368 1.00 0.00 C ATOM 943 C THR A 183 1.131 -6.589 -1.406 1.00 0.00 C ATOM 944 O THR A 183 0.951 -7.596 -0.728 1.00 0.00 O ATOM 945 CB THR A 183 2.470 -4.551 -0.640 1.00 0.00 C ATOM 946 OG1 THR A 183 3.353 -4.674 0.450 1.00 0.00 O ATOM 947 CG2 THR A 183 1.152 -4.069 -0.032 1.00 0.00 C ATOM 0 H THR A 183 3.301 -4.925 -3.047 1.00 0.00 H new ATOM 0 HA THR A 183 3.137 -6.531 -0.753 1.00 0.00 H new ATOM 0 HB THR A 183 2.721 -3.827 -1.415 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.886 -4.434 1.278 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.303 -3.100 0.443 1.00 0.00 H new ATOM 0 HG22 THR A 183 0.402 -3.975 -0.817 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.810 -4.788 0.712 1.00 0.00 H new ATOM 955 N ILE A 184 0.201 -6.093 -2.224 1.00 0.00 N ATOM 956 CA ILE A 184 -1.143 -6.670 -2.279 1.00 0.00 C ATOM 957 C ILE A 184 -1.058 -8.163 -2.624 1.00 0.00 C ATOM 958 O ILE A 184 -1.567 -8.978 -1.856 1.00 0.00 O ATOM 959 CB ILE A 184 -2.073 -5.853 -3.216 1.00 0.00 C ATOM 960 CG1 ILE A 184 -2.399 -4.488 -2.555 1.00 0.00 C ATOM 961 CG2 ILE A 184 -3.369 -6.623 -3.541 1.00 0.00 C ATOM 962 CD1 ILE A 184 -3.200 -3.514 -3.432 1.00 0.00 C ATOM 0 H ILE A 184 0.351 -5.302 -2.851 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.609 -6.605 -1.296 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.553 -5.685 -4.159 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -2.959 -4.671 -1.638 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -1.463 -4.008 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -3.995 -6.020 -4.199 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.120 -7.561 -4.036 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.909 -6.832 -2.618 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.377 -2.590 -2.881 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.637 -3.294 -4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.155 -3.966 -3.699 1.00 0.00 H new ATOM 974 N LYS A 185 -0.355 -8.560 -3.691 1.00 0.00 N ATOM 975 CA LYS A 185 -0.150 -9.948 -4.096 1.00 0.00 C ATOM 976 C LYS A 185 0.293 -10.826 -2.923 1.00 0.00 C ATOM 977 O LYS A 185 -0.396 -11.788 -2.588 1.00 0.00 O ATOM 978 CB LYS A 185 0.848 -9.957 -5.266 1.00 0.00 C ATOM 979 CG LYS A 185 0.842 -11.277 -6.030 1.00 0.00 C ATOM 980 CD LYS A 185 1.701 -11.182 -7.300 1.00 0.00 C ATOM 981 CE LYS A 185 3.179 -10.966 -6.957 1.00 0.00 C ATOM 982 NZ LYS A 185 4.056 -11.119 -8.139 1.00 0.00 N ATOM 0 H LYS A 185 0.102 -7.896 -4.316 1.00 0.00 H new ATOM 0 HA LYS A 185 -1.091 -10.386 -4.430 1.00 0.00 H new ATOM 0 HB2 LYS A 185 0.607 -9.144 -5.951 1.00 0.00 H new ATOM 0 HB3 LYS A 185 1.851 -9.766 -4.885 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.220 -12.074 -5.390 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.181 -11.542 -6.298 1.00 0.00 H new ATOM 0 HD2 LYS A 185 1.591 -12.095 -7.885 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.346 -10.360 -7.921 1.00 0.00 H new ATOM 0 HE2 LYS A 185 3.310 -9.969 -6.536 1.00 0.00 H new ATOM 0 HE3 LYS A 185 3.480 -11.679 -6.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 5.046 -10.964 -7.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 3.952 -12.078 -8.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 3.788 -10.422 -8.863 1.00 0.00 H new ATOM 996 N GLN A 186 1.387 -10.475 -2.241 1.00 0.00 N ATOM 997 CA GLN A 186 1.913 -11.315 -1.170 1.00 0.00 C ATOM 998 C GLN A 186 1.101 -11.264 0.118 1.00 0.00 C ATOM 999 O GLN A 186 0.952 -12.286 0.794 1.00 0.00 O ATOM 1000 CB GLN A 186 3.331 -10.891 -0.849 1.00 0.00 C ATOM 1001 CG GLN A 186 4.258 -11.269 -2.007 1.00 0.00 C ATOM 1002 CD GLN A 186 5.635 -11.512 -1.445 1.00 0.00 C ATOM 1003 OE1 GLN A 186 6.070 -12.642 -1.234 1.00 0.00 O ATOM 1004 NE2 GLN A 186 6.304 -10.455 -1.046 1.00 0.00 N ATOM 0 H GLN A 186 1.919 -9.622 -2.412 1.00 0.00 H new ATOM 0 HA GLN A 186 1.864 -12.338 -1.542 1.00 0.00 H new ATOM 0 HB2 GLN A 186 3.369 -9.815 -0.677 1.00 0.00 H new ATOM 0 HB3 GLN A 186 3.666 -11.373 0.070 1.00 0.00 H new ATOM 0 HG2 GLN A 186 3.890 -12.162 -2.513 1.00 0.00 H new ATOM 0 HG3 GLN A 186 4.285 -10.471 -2.749 1.00 0.00 H new ATOM 0 HE21 GLN A 186 5.936 -9.521 -1.225 1.00 0.00 H new ATOM 0 HE22 GLN A 186 7.192 -10.568 -0.557 1.00 0.00 H new ATOM 1013 N HIS A 187 0.590 -10.087 0.488 1.00 0.00 N ATOM 1014 CA HIS A 187 -0.098 -9.893 1.752 1.00 0.00 C ATOM 1015 C HIS A 187 -1.412 -10.618 1.678 1.00 0.00 C ATOM 1016 O HIS A 187 -1.770 -11.321 2.607 1.00 0.00 O ATOM 1017 CB HIS A 187 -0.346 -8.410 2.058 1.00 0.00 C ATOM 1018 CG HIS A 187 -0.238 -8.167 3.545 1.00 0.00 C ATOM 1019 ND1 HIS A 187 -1.261 -8.212 4.486 1.00 0.00 N ATOM 1020 CD2 HIS A 187 0.947 -8.022 4.211 1.00 0.00 C ATOM 1021 CE1 HIS A 187 -0.687 -8.102 5.700 1.00 0.00 C ATOM 1022 NE2 HIS A 187 0.646 -7.975 5.557 1.00 0.00 N ATOM 0 H HIS A 187 0.645 -9.246 -0.086 1.00 0.00 H new ATOM 0 HA HIS A 187 0.528 -10.283 2.554 1.00 0.00 H new ATOM 0 HB2 HIS A 187 0.379 -7.794 1.526 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -1.334 -8.117 1.704 1.00 0.00 H new ATOM 0 HD2 HIS A 187 1.930 -7.957 3.769 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -1.215 -8.114 6.642 1.00 0.00 H new ATOM 0 HE2 HIS A 187 1.319 -7.863 6.315 1.00 0.00 H new ATOM 1031 N THR A 188 -2.092 -10.476 0.544 1.00 0.00 N ATOM 1032 CA THR A 188 -3.357 -11.135 0.293 1.00 0.00 C ATOM 1033 C THR A 188 -3.186 -12.643 0.264 1.00 0.00 C ATOM 1034 O THR A 188 -3.859 -13.307 1.042 1.00 0.00 O ATOM 1035 CB THR A 188 -4.038 -10.613 -0.957 1.00 0.00 C ATOM 1036 OG1 THR A 188 -3.271 -10.808 -2.123 1.00 0.00 O ATOM 1037 CG2 THR A 188 -4.404 -9.137 -0.787 1.00 0.00 C ATOM 0 H THR A 188 -1.772 -9.894 -0.230 1.00 0.00 H new ATOM 0 HA THR A 188 -4.022 -10.895 1.123 1.00 0.00 H new ATOM 0 HB THR A 188 -4.950 -11.196 -1.088 1.00 0.00 H new ATOM 0 HG1 THR A 188 -2.367 -10.457 -1.982 1.00 0.00 H new ATOM 0 HG21 THR A 188 -4.892 -8.777 -1.693 1.00 0.00 H new ATOM 0 HG22 THR A 188 -5.082 -9.025 0.059 1.00 0.00 H new ATOM 0 HG23 THR A 188 -3.499 -8.556 -0.607 1.00 0.00 H new ATOM 1045 N VAL A 189 -2.244 -13.194 -0.508 1.00 0.00 N ATOM 1046 CA VAL A 189 -1.883 -14.626 -0.439 1.00 0.00 C ATOM 1047 C VAL A 189 -1.632 -15.085 0.994 1.00 0.00 C ATOM 1048 O VAL A 189 -2.219 -16.070 1.428 1.00 0.00 O ATOM 1049 CB VAL A 189 -0.674 -14.922 -1.334 1.00 0.00 C ATOM 1050 CG1 VAL A 189 0.006 -16.275 -1.067 1.00 0.00 C ATOM 1051 CG2 VAL A 189 -1.066 -14.895 -2.817 1.00 0.00 C ATOM 0 H VAL A 189 -1.708 -12.668 -1.198 1.00 0.00 H new ATOM 0 HA VAL A 189 -2.735 -15.196 -0.810 1.00 0.00 H new ATOM 0 HB VAL A 189 0.036 -14.133 -1.087 1.00 0.00 H new ATOM 0 HG11 VAL A 189 0.850 -16.398 -1.746 1.00 0.00 H new ATOM 0 HG12 VAL A 189 0.361 -16.307 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -0.710 -17.080 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -0.190 -15.108 -3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -1.831 -15.648 -3.005 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -1.456 -13.910 -3.072 1.00 0.00 H new ATOM 1061 N THR A 190 -0.793 -14.350 1.728 1.00 0.00 N ATOM 1062 CA THR A 190 -0.439 -14.666 3.123 1.00 0.00 C ATOM 1063 C THR A 190 -1.699 -14.682 4.002 1.00 0.00 C ATOM 1064 O THR A 190 -2.069 -15.691 4.596 1.00 0.00 O ATOM 1065 CB THR A 190 0.600 -13.667 3.686 1.00 0.00 C ATOM 1066 OG1 THR A 190 1.723 -13.521 2.834 1.00 0.00 O ATOM 1067 CG2 THR A 190 1.134 -14.100 5.050 1.00 0.00 C ATOM 0 H THR A 190 -0.334 -13.511 1.372 1.00 0.00 H new ATOM 0 HA THR A 190 0.015 -15.657 3.136 1.00 0.00 H new ATOM 0 HB THR A 190 0.062 -12.723 3.768 1.00 0.00 H new ATOM 0 HG1 THR A 190 1.461 -13.028 2.029 1.00 0.00 H new ATOM 0 HG21 THR A 190 1.860 -13.369 5.405 1.00 0.00 H new ATOM 0 HG22 THR A 190 0.309 -14.167 5.759 1.00 0.00 H new ATOM 0 HG23 THR A 190 1.615 -15.074 4.960 1.00 0.00 H new ATOM 1075 N THR A 191 -2.375 -13.538 4.077 1.00 0.00 N ATOM 1076 CA THR A 191 -3.509 -13.237 4.937 1.00 0.00 C ATOM 1077 C THR A 191 -4.747 -14.077 4.589 1.00 0.00 C ATOM 1078 O THR A 191 -5.470 -14.495 5.490 1.00 0.00 O ATOM 1079 CB THR A 191 -3.719 -11.710 4.939 1.00 0.00 C ATOM 1080 OG1 THR A 191 -4.020 -11.230 6.234 1.00 0.00 O ATOM 1081 CG2 THR A 191 -4.644 -11.194 3.826 1.00 0.00 C ATOM 0 H THR A 191 -2.123 -12.740 3.494 1.00 0.00 H new ATOM 0 HA THR A 191 -3.304 -13.535 5.965 1.00 0.00 H new ATOM 0 HB THR A 191 -2.761 -11.265 4.670 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.838 -10.692 6.201 1.00 0.00 H new ATOM 0 HG21 THR A 191 -4.736 -10.111 3.902 1.00 0.00 H new ATOM 0 HG22 THR A 191 -4.225 -11.455 2.854 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.629 -11.650 3.931 1.00 0.00 H new ATOM 1089 N THR A 192 -4.923 -14.474 3.317 1.00 0.00 N ATOM 1090 CA THR A 192 -6.029 -15.334 2.847 1.00 0.00 C ATOM 1091 C THR A 192 -5.954 -16.761 3.401 1.00 0.00 C ATOM 1092 O THR A 192 -6.981 -17.438 3.523 1.00 0.00 O ATOM 1093 CB THR A 192 -6.034 -15.439 1.317 1.00 0.00 C ATOM 1094 OG1 THR A 192 -6.147 -14.152 0.758 1.00 0.00 O ATOM 1095 CG2 THR A 192 -7.173 -16.244 0.690 1.00 0.00 C ATOM 0 H THR A 192 -4.287 -14.201 2.568 1.00 0.00 H new ATOM 0 HA THR A 192 -6.938 -14.856 3.211 1.00 0.00 H new ATOM 0 HB THR A 192 -5.100 -15.958 1.100 1.00 0.00 H new ATOM 0 HG1 THR A 192 -5.274 -13.866 0.415 1.00 0.00 H new ATOM 0 HG21 THR A 192 -7.065 -16.244 -0.395 1.00 0.00 H new ATOM 0 HG22 THR A 192 -7.139 -17.270 1.058 1.00 0.00 H new ATOM 0 HG23 THR A 192 -8.128 -15.793 0.959 1.00 0.00 H new ATOM 1103 N THR A 193 -4.735 -17.172 3.785 1.00 0.00 N ATOM 1104 CA THR A 193 -4.521 -18.395 4.571 1.00 0.00 C ATOM 1105 C THR A 193 -4.196 -18.159 6.053 1.00 0.00 C ATOM 1106 O THR A 193 -4.208 -19.139 6.799 1.00 0.00 O ATOM 1107 CB THR A 193 -3.612 -19.417 3.873 1.00 0.00 C ATOM 1108 OG1 THR A 193 -3.570 -20.599 4.639 1.00 0.00 O ATOM 1109 CG2 THR A 193 -2.182 -18.908 3.683 1.00 0.00 C ATOM 0 H THR A 193 -3.876 -16.669 3.561 1.00 0.00 H new ATOM 0 HA THR A 193 -5.500 -18.872 4.607 1.00 0.00 H new ATOM 0 HB THR A 193 -4.034 -19.597 2.884 1.00 0.00 H new ATOM 0 HG1 THR A 193 -3.747 -20.386 5.579 1.00 0.00 H new ATOM 0 HG21 THR A 193 -1.587 -19.673 3.185 1.00 0.00 H new ATOM 0 HG22 THR A 193 -2.195 -18.005 3.073 1.00 0.00 H new ATOM 0 HG23 THR A 193 -1.744 -18.683 4.655 1.00 0.00 H new ATOM 1117 N LYS A 194 -3.990 -16.913 6.522 1.00 0.00 N ATOM 1118 CA LYS A 194 -4.145 -16.601 7.955 1.00 0.00 C ATOM 1119 C LYS A 194 -5.649 -16.644 8.307 1.00 0.00 C ATOM 1120 O LYS A 194 -6.026 -16.739 9.475 1.00 0.00 O ATOM 1121 CB LYS A 194 -3.600 -15.212 8.322 1.00 0.00 C ATOM 1122 CG LYS A 194 -2.103 -15.029 8.036 1.00 0.00 C ATOM 1123 CD LYS A 194 -1.596 -13.677 8.558 1.00 0.00 C ATOM 1124 CE LYS A 194 -1.192 -13.796 10.030 1.00 0.00 C ATOM 1125 NZ LYS A 194 -0.929 -12.479 10.645 1.00 0.00 N ATOM 0 H LYS A 194 -3.721 -16.119 5.941 1.00 0.00 H new ATOM 0 HA LYS A 194 -3.574 -17.340 8.517 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.159 -14.457 7.770 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -3.781 -15.031 9.382 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -1.540 -15.836 8.504 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -1.925 -15.097 6.963 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -0.743 -13.347 7.965 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -2.374 -12.921 8.447 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -1.984 -14.301 10.583 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -0.300 -14.417 10.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -0.659 -12.609 11.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -0.156 -12.006 10.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.787 -11.894 10.592 1.00 0.00 H new ATOM 1139 N GLY A 195 -6.510 -16.550 7.282 1.00 0.00 N ATOM 1140 CA GLY A 195 -7.950 -16.789 7.320 1.00 0.00 C ATOM 1141 C GLY A 195 -8.819 -15.785 6.568 1.00 0.00 C ATOM 1142 O GLY A 195 -10.043 -15.914 6.578 1.00 0.00 O ATOM 0 H GLY A 195 -6.193 -16.288 6.348 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -8.143 -17.782 6.914 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -8.268 -16.804 8.363 1.00 0.00 H new ATOM 1146 N GLU A 196 -8.251 -14.738 5.983 1.00 0.00 N ATOM 1147 CA GLU A 196 -8.996 -13.658 5.335 1.00 0.00 C ATOM 1148 C GLU A 196 -9.478 -13.962 3.922 1.00 0.00 C ATOM 1149 O GLU A 196 -9.223 -15.007 3.332 1.00 0.00 O ATOM 1150 CB GLU A 196 -8.163 -12.378 5.409 1.00 0.00 C ATOM 1151 CG GLU A 196 -8.275 -11.823 6.830 1.00 0.00 C ATOM 1152 CD GLU A 196 -6.943 -11.302 7.346 1.00 0.00 C ATOM 1153 OE1 GLU A 196 -6.279 -10.546 6.594 1.00 0.00 O ATOM 1154 OE2 GLU A 196 -6.564 -11.647 8.496 1.00 0.00 O ATOM 0 H GLU A 196 -7.240 -14.610 5.943 1.00 0.00 H new ATOM 0 HA GLU A 196 -9.928 -13.531 5.886 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -7.122 -12.586 5.162 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -8.522 -11.647 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -9.010 -11.018 6.848 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -8.641 -12.604 7.496 1.00 0.00 H new ATOM 1161 N ASN A 197 -10.259 -13.018 3.428 1.00 0.00 N ATOM 1162 CA ASN A 197 -10.891 -12.973 2.127 1.00 0.00 C ATOM 1163 C ASN A 197 -11.257 -11.520 1.842 1.00 0.00 C ATOM 1164 O ASN A 197 -12.204 -10.970 2.425 1.00 0.00 O ATOM 1165 CB ASN A 197 -12.094 -13.901 2.110 1.00 0.00 C ATOM 1166 CG ASN A 197 -12.904 -13.842 0.826 1.00 0.00 C ATOM 1167 OD1 ASN A 197 -12.406 -14.059 -0.276 1.00 0.00 O ATOM 1168 ND2 ASN A 197 -14.183 -13.569 0.937 1.00 0.00 N ATOM 0 H ASN A 197 -10.486 -12.190 3.979 1.00 0.00 H new ATOM 0 HA ASN A 197 -10.223 -13.322 1.340 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -11.752 -14.924 2.265 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -12.744 -13.652 2.949 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.772 -13.536 0.105 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.588 -13.390 1.856 1.00 0.00 H new ATOM 1175 N PHE A 198 -10.419 -10.861 1.047 1.00 0.00 N ATOM 1176 CA PHE A 198 -10.694 -9.543 0.502 1.00 0.00 C ATOM 1177 C PHE A 198 -11.818 -9.582 -0.538 1.00 0.00 C ATOM 1178 O PHE A 198 -12.119 -10.615 -1.143 1.00 0.00 O ATOM 1179 CB PHE A 198 -9.399 -8.923 -0.059 1.00 0.00 C ATOM 1180 CG PHE A 198 -8.865 -9.419 -1.395 1.00 0.00 C ATOM 1181 CD1 PHE A 198 -9.572 -9.198 -2.595 1.00 0.00 C ATOM 1182 CD2 PHE A 198 -7.565 -9.950 -1.462 1.00 0.00 C ATOM 1183 CE1 PHE A 198 -9.009 -9.516 -3.839 1.00 0.00 C ATOM 1184 CE2 PHE A 198 -6.980 -10.207 -2.717 1.00 0.00 C ATOM 1185 CZ PHE A 198 -7.700 -10.011 -3.904 1.00 0.00 C ATOM 0 H PHE A 198 -9.515 -11.238 0.761 1.00 0.00 H new ATOM 0 HA PHE A 198 -11.051 -8.902 1.308 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -9.559 -7.848 -0.147 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -8.615 -9.069 0.684 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -10.565 -8.776 -2.555 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -7.017 -10.160 -0.555 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.582 -9.380 -4.744 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -5.961 -10.561 -2.766 1.00 0.00 H new ATOM 0 HZ PHE A 198 -7.250 -10.239 -4.859 1.00 0.00 H new ATOM 1195 N THR A 199 -12.346 -8.394 -0.810 1.00 0.00 N ATOM 1196 CA THR A 199 -13.284 -8.049 -1.867 1.00 0.00 C ATOM 1197 C THR A 199 -12.736 -6.869 -2.655 1.00 0.00 C ATOM 1198 O THR A 199 -11.856 -6.158 -2.184 1.00 0.00 O ATOM 1199 CB THR A 199 -14.630 -7.629 -1.263 1.00 0.00 C ATOM 1200 OG1 THR A 199 -14.512 -6.464 -0.454 1.00 0.00 O ATOM 1201 CG2 THR A 199 -15.260 -8.765 -0.472 1.00 0.00 C ATOM 0 H THR A 199 -12.106 -7.578 -0.246 1.00 0.00 H new ATOM 0 HA THR A 199 -13.420 -8.918 -2.511 1.00 0.00 H new ATOM 0 HB THR A 199 -15.287 -7.386 -2.098 1.00 0.00 H new ATOM 0 HG1 THR A 199 -14.148 -6.710 0.422 1.00 0.00 H new ATOM 0 HG21 THR A 199 -16.212 -8.435 -0.057 1.00 0.00 H new ATOM 0 HG22 THR A 199 -15.427 -9.618 -1.130 1.00 0.00 H new ATOM 0 HG23 THR A 199 -14.593 -9.057 0.339 1.00 0.00 H new ATOM 1209 N GLU A 200 -13.338 -6.580 -3.800 1.00 0.00 N ATOM 1210 CA GLU A 200 -13.132 -5.387 -4.613 1.00 0.00 C ATOM 1211 C GLU A 200 -13.213 -4.095 -3.783 1.00 0.00 C ATOM 1212 O GLU A 200 -12.516 -3.124 -4.082 1.00 0.00 O ATOM 1213 CB GLU A 200 -14.088 -5.371 -5.825 1.00 0.00 C ATOM 1214 CG GLU A 200 -15.515 -5.951 -5.696 1.00 0.00 C ATOM 1215 CD GLU A 200 -15.589 -7.471 -5.923 1.00 0.00 C ATOM 1216 OE1 GLU A 200 -14.938 -8.254 -5.186 1.00 0.00 O ATOM 1217 OE2 GLU A 200 -16.306 -7.928 -6.852 1.00 0.00 O ATOM 0 H GLU A 200 -14.026 -7.210 -4.212 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.115 -5.428 -5.003 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.188 -4.334 -6.144 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.593 -5.907 -6.635 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -15.902 -5.722 -4.703 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -16.166 -5.453 -6.415 1.00 0.00 H new ATOM 1224 N THR A 201 -13.982 -4.110 -2.688 1.00 0.00 N ATOM 1225 CA THR A 201 -14.015 -3.070 -1.677 1.00 0.00 C ATOM 1226 C THR A 201 -12.701 -2.957 -0.921 1.00 0.00 C ATOM 1227 O THR A 201 -12.050 -1.920 -0.978 1.00 0.00 O ATOM 1228 CB THR A 201 -15.168 -3.241 -0.665 1.00 0.00 C ATOM 1229 OG1 THR A 201 -15.980 -4.370 -0.926 1.00 0.00 O ATOM 1230 CG2 THR A 201 -16.038 -1.995 -0.697 1.00 0.00 C ATOM 0 H THR A 201 -14.619 -4.880 -2.483 1.00 0.00 H new ATOM 0 HA THR A 201 -14.186 -2.149 -2.234 1.00 0.00 H new ATOM 0 HB THR A 201 -14.714 -3.392 0.314 1.00 0.00 H new ATOM 0 HG1 THR A 201 -15.532 -5.178 -0.599 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.857 -2.104 0.014 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.438 -1.125 -0.429 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.444 -1.861 -1.700 1.00 0.00 H new ATOM 1238 N ASP A 202 -12.305 -4.036 -0.240 1.00 0.00 N ATOM 1239 CA ASP A 202 -11.069 -4.139 0.537 1.00 0.00 C ATOM 1240 C ASP A 202 -9.867 -3.786 -0.335 1.00 0.00 C ATOM 1241 O ASP A 202 -8.972 -3.061 0.082 1.00 0.00 O ATOM 1242 CB ASP A 202 -10.865 -5.580 1.005 1.00 0.00 C ATOM 1243 CG ASP A 202 -11.934 -6.124 1.937 1.00 0.00 C ATOM 1244 OD1 ASP A 202 -12.946 -6.683 1.436 1.00 0.00 O ATOM 1245 OD2 ASP A 202 -11.696 -6.094 3.171 1.00 0.00 O ATOM 0 H ASP A 202 -12.858 -4.893 -0.214 1.00 0.00 H new ATOM 0 HA ASP A 202 -11.150 -3.457 1.384 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -10.811 -6.224 0.127 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -9.901 -5.647 1.509 1.00 0.00 H new ATOM 1250 N ILE A 203 -9.893 -4.280 -1.571 1.00 0.00 N ATOM 1251 CA ILE A 203 -8.943 -3.983 -2.624 1.00 0.00 C ATOM 1252 C ILE A 203 -8.845 -2.497 -2.833 1.00 0.00 C ATOM 1253 O ILE A 203 -7.754 -1.960 -2.686 1.00 0.00 O ATOM 1254 CB ILE A 203 -9.370 -4.718 -3.907 1.00 0.00 C ATOM 1255 CG1 ILE A 203 -9.044 -6.203 -3.755 1.00 0.00 C ATOM 1256 CG2 ILE A 203 -8.790 -4.158 -5.219 1.00 0.00 C ATOM 1257 CD1 ILE A 203 -7.559 -6.476 -3.525 1.00 0.00 C ATOM 0 H ILE A 203 -10.617 -4.931 -1.874 1.00 0.00 H new ATOM 0 HA ILE A 203 -7.950 -4.333 -2.343 1.00 0.00 H new ATOM 0 HB ILE A 203 -10.443 -4.556 -4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -9.614 -6.609 -2.920 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -9.369 -6.733 -4.651 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -9.154 -4.749 -6.059 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -9.103 -3.121 -5.342 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -7.702 -4.207 -5.186 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -7.398 -7.549 -3.426 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -6.984 -6.099 -4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -7.234 -5.974 -2.614 1.00 0.00 H new ATOM 1269 N LYS A 204 -9.965 -1.839 -3.145 1.00 0.00 N ATOM 1270 CA LYS A 204 -9.969 -0.403 -3.387 1.00 0.00 C ATOM 1271 C LYS A 204 -9.424 0.396 -2.200 1.00 0.00 C ATOM 1272 O LYS A 204 -8.630 1.315 -2.421 1.00 0.00 O ATOM 1273 CB LYS A 204 -11.377 0.058 -3.755 1.00 0.00 C ATOM 1274 CG LYS A 204 -11.546 0.032 -5.278 1.00 0.00 C ATOM 1275 CD LYS A 204 -13.017 0.021 -5.687 1.00 0.00 C ATOM 1276 CE LYS A 204 -13.918 0.979 -4.894 1.00 0.00 C ATOM 1277 NZ LYS A 204 -13.513 2.392 -5.023 1.00 0.00 N ATOM 0 H LYS A 204 -10.879 -2.283 -3.235 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.296 -0.209 -4.223 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.117 -0.591 -3.286 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.551 1.065 -3.377 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -11.055 0.902 -5.713 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.050 -0.850 -5.683 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -13.086 0.273 -6.745 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -13.402 -0.992 -5.575 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -14.947 0.869 -5.237 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -13.901 0.697 -3.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -14.167 2.992 -4.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -12.548 2.511 -4.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -13.538 2.670 -6.025 1.00 0.00 H new ATOM 1291 N ILE A 205 -9.791 -0.008 -0.971 1.00 0.00 N ATOM 1292 CA ILE A 205 -9.208 0.506 0.277 1.00 0.00 C ATOM 1293 C ILE A 205 -7.695 0.362 0.242 1.00 0.00 C ATOM 1294 O ILE A 205 -6.988 1.361 0.247 1.00 0.00 O ATOM 1295 CB ILE A 205 -9.771 -0.187 1.538 1.00 0.00 C ATOM 1296 CG1 ILE A 205 -11.284 -0.055 1.673 1.00 0.00 C ATOM 1297 CG2 ILE A 205 -9.102 0.337 2.817 1.00 0.00 C ATOM 1298 CD1 ILE A 205 -11.763 1.369 1.888 1.00 0.00 C ATOM 0 H ILE A 205 -10.513 -0.712 -0.817 1.00 0.00 H new ATOM 0 HA ILE A 205 -9.484 1.558 0.343 1.00 0.00 H new ATOM 0 HB ILE A 205 -9.539 -1.244 1.411 1.00 0.00 H new ATOM 0 HG12 ILE A 205 -11.755 -0.454 0.774 1.00 0.00 H new ATOM 0 HG13 ILE A 205 -11.619 -0.670 2.508 1.00 0.00 H new ATOM 0 HG21 ILE A 205 -9.523 -0.173 3.683 1.00 0.00 H new ATOM 0 HG22 ILE A 205 -8.030 0.148 2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 205 -9.278 1.409 2.906 1.00 0.00 H new ATOM 0 HD11 ILE A 205 -12.850 1.378 1.974 1.00 0.00 H new ATOM 0 HD12 ILE A 205 -11.323 1.767 2.802 1.00 0.00 H new ATOM 0 HD13 ILE A 205 -11.461 1.986 1.042 1.00 0.00 H new ATOM 1310 N MET A 206 -7.203 -0.876 0.198 1.00 0.00 N ATOM 1311 CA MET A 206 -5.789 -1.222 0.201 1.00 0.00 C ATOM 1312 C MET A 206 -5.064 -0.412 -0.851 1.00 0.00 C ATOM 1313 O MET A 206 -4.283 0.454 -0.481 1.00 0.00 O ATOM 1314 CB MET A 206 -5.631 -2.728 -0.055 1.00 0.00 C ATOM 1315 CG MET A 206 -6.104 -3.573 1.126 1.00 0.00 C ATOM 1316 SD MET A 206 -6.576 -5.296 0.754 1.00 0.00 S ATOM 1317 CE MET A 206 -5.406 -5.784 -0.544 1.00 0.00 C ATOM 0 H MET A 206 -7.807 -1.697 0.158 1.00 0.00 H new ATOM 0 HA MET A 206 -5.352 -0.989 1.172 1.00 0.00 H new ATOM 0 HB2 MET A 206 -6.197 -3.004 -0.945 1.00 0.00 H new ATOM 0 HB3 MET A 206 -4.584 -2.951 -0.261 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.311 -3.590 1.873 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.960 -3.075 1.581 1.00 0.00 H new ATOM 0 HE1 MET A 206 -5.758 -6.695 -1.028 1.00 0.00 H new ATOM 0 HE2 MET A 206 -5.329 -4.987 -1.283 1.00 0.00 H new ATOM 0 HE3 MET A 206 -4.426 -5.964 -0.102 1.00 0.00 H new ATOM 1327 N GLU A 207 -5.399 -0.623 -2.123 1.00 0.00 N ATOM 1328 CA GLU A 207 -5.011 0.154 -3.299 1.00 0.00 C ATOM 1329 C GLU A 207 -4.915 1.650 -3.095 1.00 0.00 C ATOM 1330 O GLU A 207 -4.011 2.246 -3.679 1.00 0.00 O ATOM 1331 CB GLU A 207 -6.004 -0.107 -4.429 1.00 0.00 C ATOM 1332 CG GLU A 207 -5.679 -1.445 -5.056 1.00 0.00 C ATOM 1333 CD GLU A 207 -4.591 -1.344 -6.139 1.00 0.00 C ATOM 1334 OE1 GLU A 207 -3.923 -0.287 -6.315 1.00 0.00 O ATOM 1335 OE2 GLU A 207 -4.499 -2.330 -6.913 1.00 0.00 O ATOM 0 H GLU A 207 -5.999 -1.407 -2.378 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.002 -0.185 -3.535 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -7.024 -0.107 -4.044 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.945 0.685 -5.175 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.350 -2.135 -4.279 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.584 -1.866 -5.494 1.00 0.00 H new ATOM 1342 N ARG A 208 -5.791 2.262 -2.297 1.00 0.00 N ATOM 1343 CA ARG A 208 -5.677 3.678 -2.003 1.00 0.00 C ATOM 1344 C ARG A 208 -4.473 3.944 -1.116 1.00 0.00 C ATOM 1345 O ARG A 208 -3.607 4.753 -1.447 1.00 0.00 O ATOM 1346 CB ARG A 208 -6.952 4.159 -1.309 1.00 0.00 C ATOM 1347 CG ARG A 208 -6.924 5.667 -1.066 1.00 0.00 C ATOM 1348 CD ARG A 208 -6.898 6.470 -2.351 1.00 0.00 C ATOM 1349 NE ARG A 208 -8.130 6.304 -3.142 1.00 0.00 N ATOM 1350 CZ ARG A 208 -8.553 7.151 -4.066 1.00 0.00 C ATOM 1351 NH1 ARG A 208 -7.749 8.058 -4.565 1.00 0.00 N ATOM 1352 NH2 ARG A 208 -9.796 7.101 -4.478 1.00 0.00 N ATOM 0 H ARG A 208 -6.580 1.797 -1.848 1.00 0.00 H new ATOM 0 HA ARG A 208 -5.543 4.222 -2.938 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.818 3.904 -1.920 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -7.068 3.639 -0.358 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.799 5.952 -0.483 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -6.047 5.918 -0.469 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.761 7.525 -2.114 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.041 6.164 -2.950 1.00 0.00 H new ATOM 0 HE ARG A 208 -8.698 5.476 -2.964 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -6.784 8.117 -4.241 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -8.089 8.705 -5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -10.436 6.410 -4.086 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -10.124 7.753 -5.190 1.00 0.00 H new ATOM 1366 N VAL A 209 -4.464 3.286 0.042 1.00 0.00 N ATOM 1367 CA VAL A 209 -3.543 3.576 1.132 1.00 0.00 C ATOM 1368 C VAL A 209 -2.159 3.149 0.715 1.00 0.00 C ATOM 1369 O VAL A 209 -1.190 3.873 0.920 1.00 0.00 O ATOM 1370 CB VAL A 209 -3.992 2.847 2.412 1.00 0.00 C ATOM 1371 CG1 VAL A 209 -3.143 3.231 3.627 1.00 0.00 C ATOM 1372 CG2 VAL A 209 -5.470 3.150 2.680 1.00 0.00 C ATOM 0 H VAL A 209 -5.109 2.524 0.250 1.00 0.00 H new ATOM 0 HA VAL A 209 -3.537 4.644 1.349 1.00 0.00 H new ATOM 0 HB VAL A 209 -3.855 1.777 2.253 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -3.498 2.691 4.505 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -2.101 2.972 3.439 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.224 4.304 3.803 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -5.789 2.634 3.586 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.604 4.224 2.808 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.070 2.807 1.837 1.00 0.00 H new ATOM 1382 N VAL A 210 -2.085 1.990 0.065 1.00 0.00 N ATOM 1383 CA VAL A 210 -0.830 1.437 -0.387 1.00 0.00 C ATOM 1384 C VAL A 210 -0.240 2.255 -1.535 1.00 0.00 C ATOM 1385 O VAL A 210 0.949 2.519 -1.480 1.00 0.00 O ATOM 1386 CB VAL A 210 -1.031 -0.054 -0.659 1.00 0.00 C ATOM 1387 CG1 VAL A 210 -1.914 -0.384 -1.848 1.00 0.00 C ATOM 1388 CG2 VAL A 210 0.284 -0.773 -0.882 1.00 0.00 C ATOM 0 H VAL A 210 -2.898 1.415 -0.158 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.062 1.508 0.383 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.533 -0.395 0.247 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -1.992 -1.466 -1.954 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -2.907 0.038 -1.692 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.478 0.039 -2.753 1.00 0.00 H new ATOM 0 HG21 VAL A 210 0.094 -1.829 -1.072 1.00 0.00 H new ATOM 0 HG22 VAL A 210 0.796 -0.337 -1.740 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.910 -0.671 0.005 1.00 0.00 H new ATOM 1398 N GLU A 211 -1.021 2.752 -2.509 1.00 0.00 N ATOM 1399 CA GLU A 211 -0.512 3.629 -3.575 1.00 0.00 C ATOM 1400 C GLU A 211 0.008 4.954 -3.016 1.00 0.00 C ATOM 1401 O GLU A 211 1.113 5.378 -3.359 1.00 0.00 O ATOM 1402 CB GLU A 211 -1.613 3.825 -4.623 1.00 0.00 C ATOM 1403 CG GLU A 211 -1.327 4.862 -5.720 1.00 0.00 C ATOM 1404 CD GLU A 211 -2.547 5.733 -6.035 1.00 0.00 C ATOM 1405 OE1 GLU A 211 -3.341 5.382 -6.952 1.00 0.00 O ATOM 1406 OE2 GLU A 211 -2.687 6.844 -5.450 1.00 0.00 O ATOM 0 H GLU A 211 -2.020 2.557 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 211 0.345 3.158 -4.056 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.806 2.865 -5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -2.529 4.115 -4.108 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.500 5.500 -5.406 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -1.007 4.348 -6.627 1.00 0.00 H new ATOM 1413 N GLN A 212 -0.768 5.589 -2.137 1.00 0.00 N ATOM 1414 CA GLN A 212 -0.346 6.797 -1.440 1.00 0.00 C ATOM 1415 C GLN A 212 0.912 6.564 -0.599 1.00 0.00 C ATOM 1416 O GLN A 212 1.803 7.409 -0.606 1.00 0.00 O ATOM 1417 CB GLN A 212 -1.499 7.347 -0.595 1.00 0.00 C ATOM 1418 CG GLN A 212 -2.640 7.860 -1.488 1.00 0.00 C ATOM 1419 CD GLN A 212 -2.229 9.055 -2.332 1.00 0.00 C ATOM 1420 OE1 GLN A 212 -2.213 10.184 -1.844 1.00 0.00 O ATOM 1421 NE2 GLN A 212 -1.954 8.861 -3.610 1.00 0.00 N ATOM 0 H GLN A 212 -1.707 5.277 -1.890 1.00 0.00 H new ATOM 0 HA GLN A 212 -0.081 7.544 -2.188 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.874 6.567 0.067 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.136 8.156 0.039 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.974 7.055 -2.143 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.489 8.136 -0.863 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.972 7.918 -3.998 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.724 9.654 -4.208 1.00 0.00 H new ATOM 1430 N MET A 213 1.043 5.425 0.084 1.00 0.00 N ATOM 1431 CA MET A 213 2.259 5.075 0.818 1.00 0.00 C ATOM 1432 C MET A 213 3.443 4.759 -0.084 1.00 0.00 C ATOM 1433 O MET A 213 4.539 5.238 0.167 1.00 0.00 O ATOM 1434 CB MET A 213 1.949 3.892 1.716 1.00 0.00 C ATOM 1435 CG MET A 213 1.151 4.396 2.908 1.00 0.00 C ATOM 1436 SD MET A 213 2.020 5.501 4.063 1.00 0.00 S ATOM 1437 CE MET A 213 3.689 4.775 4.113 1.00 0.00 C ATOM 0 H MET A 213 0.309 4.720 0.143 1.00 0.00 H new ATOM 0 HA MET A 213 2.558 5.945 1.403 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.381 3.139 1.170 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.871 3.416 2.050 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.272 4.919 2.532 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.793 3.532 3.468 1.00 0.00 H new ATOM 0 HE1 MET A 213 4.185 5.066 5.039 1.00 0.00 H new ATOM 0 HE2 MET A 213 3.615 3.688 4.067 1.00 0.00 H new ATOM 0 HE3 MET A 213 4.268 5.135 3.263 1.00 0.00 H new ATOM 1447 N CYS A 214 3.221 3.998 -1.147 1.00 0.00 N ATOM 1448 CA CYS A 214 4.169 3.728 -2.227 1.00 0.00 C ATOM 1449 C CYS A 214 4.751 5.015 -2.824 1.00 0.00 C ATOM 1450 O CYS A 214 5.963 5.231 -2.790 1.00 0.00 O ATOM 1451 CB CYS A 214 3.446 2.919 -3.297 1.00 0.00 C ATOM 1452 SG CYS A 214 3.241 1.163 -2.947 1.00 0.00 S ATOM 0 H CYS A 214 2.328 3.526 -1.290 1.00 0.00 H new ATOM 0 HA CYS A 214 5.014 3.168 -1.826 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.460 3.357 -3.453 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.992 3.022 -4.235 1.00 0.00 H new ATOM 1457 N THR A 215 3.895 5.886 -3.368 1.00 0.00 N ATOM 1458 CA THR A 215 4.323 7.190 -3.874 1.00 0.00 C ATOM 1459 C THR A 215 4.977 8.039 -2.786 1.00 0.00 C ATOM 1460 O THR A 215 5.979 8.689 -3.055 1.00 0.00 O ATOM 1461 CB THR A 215 3.148 7.898 -4.564 1.00 0.00 C ATOM 1462 OG1 THR A 215 3.604 8.605 -5.688 1.00 0.00 O ATOM 1463 CG2 THR A 215 2.377 8.853 -3.677 1.00 0.00 C ATOM 0 H THR A 215 2.896 5.708 -3.469 1.00 0.00 H new ATOM 0 HA THR A 215 5.098 7.035 -4.624 1.00 0.00 H new ATOM 0 HB THR A 215 2.459 7.100 -4.842 1.00 0.00 H new ATOM 0 HG1 THR A 215 2.848 9.052 -6.122 1.00 0.00 H new ATOM 0 HG21 THR A 215 1.567 9.306 -4.248 1.00 0.00 H new ATOM 0 HG22 THR A 215 1.962 8.308 -2.829 1.00 0.00 H new ATOM 0 HG23 THR A 215 3.046 9.633 -3.314 1.00 0.00 H new ATOM 1471 N THR A 216 4.464 8.011 -1.549 1.00 0.00 N ATOM 1472 CA THR A 216 5.068 8.746 -0.429 1.00 0.00 C ATOM 1473 C THR A 216 6.462 8.206 -0.117 1.00 0.00 C ATOM 1474 O THR A 216 7.385 8.990 0.077 1.00 0.00 O ATOM 1475 CB THR A 216 4.176 8.723 0.827 1.00 0.00 C ATOM 1476 OG1 THR A 216 2.919 9.308 0.540 1.00 0.00 O ATOM 1477 CG2 THR A 216 4.782 9.472 2.010 1.00 0.00 C ATOM 0 H THR A 216 3.628 7.484 -1.297 1.00 0.00 H new ATOM 0 HA THR A 216 5.161 9.787 -0.738 1.00 0.00 H new ATOM 0 HB THR A 216 4.075 7.674 1.104 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.246 8.603 0.437 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.104 9.417 2.861 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.737 9.019 2.277 1.00 0.00 H new ATOM 0 HG23 THR A 216 4.939 10.516 1.738 1.00 0.00 H new ATOM 1485 N GLN A 217 6.661 6.886 -0.143 1.00 0.00 N ATOM 1486 CA GLN A 217 7.977 6.283 -0.037 1.00 0.00 C ATOM 1487 C GLN A 217 8.880 6.793 -1.160 1.00 0.00 C ATOM 1488 O GLN A 217 9.970 7.245 -0.847 1.00 0.00 O ATOM 1489 CB GLN A 217 7.889 4.745 -0.015 1.00 0.00 C ATOM 1490 CG GLN A 217 7.445 4.158 1.337 1.00 0.00 C ATOM 1491 CD GLN A 217 8.590 4.186 2.339 1.00 0.00 C ATOM 1492 OE1 GLN A 217 9.470 3.324 2.334 1.00 0.00 O ATOM 1493 NE2 GLN A 217 8.651 5.191 3.187 1.00 0.00 N ATOM 0 H GLN A 217 5.905 6.208 -0.239 1.00 0.00 H new ATOM 0 HA GLN A 217 8.423 6.581 0.912 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.190 4.421 -0.786 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.864 4.333 -0.275 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.601 4.727 1.726 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.102 3.133 1.199 1.00 0.00 H new ATOM 0 HE21 GLN A 217 7.920 5.903 3.188 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.429 5.258 3.843 1.00 0.00 H new ATOM 1502 N TYR A 218 8.432 6.860 -2.421 1.00 0.00 N ATOM 1503 CA TYR A 218 9.197 7.518 -3.485 1.00 0.00 C ATOM 1504 C TYR A 218 9.667 8.915 -3.073 1.00 0.00 C ATOM 1505 O TYR A 218 10.834 9.214 -3.269 1.00 0.00 O ATOM 1506 CB TYR A 218 8.385 7.608 -4.786 1.00 0.00 C ATOM 1507 CG TYR A 218 9.190 7.714 -6.076 1.00 0.00 C ATOM 1508 CD1 TYR A 218 10.002 8.834 -6.356 1.00 0.00 C ATOM 1509 CD2 TYR A 218 9.071 6.697 -7.038 1.00 0.00 C ATOM 1510 CE1 TYR A 218 10.749 8.892 -7.551 1.00 0.00 C ATOM 1511 CE2 TYR A 218 9.790 6.758 -8.248 1.00 0.00 C ATOM 1512 CZ TYR A 218 10.658 7.843 -8.495 1.00 0.00 C ATOM 1513 OH TYR A 218 11.432 7.843 -9.614 1.00 0.00 O ATOM 0 H TYR A 218 7.543 6.466 -2.728 1.00 0.00 H new ATOM 0 HA TYR A 218 10.077 6.899 -3.660 1.00 0.00 H new ATOM 0 HB2 TYR A 218 7.746 6.728 -4.852 1.00 0.00 H new ATOM 0 HB3 TYR A 218 7.728 8.475 -4.720 1.00 0.00 H new ATOM 0 HD1 TYR A 218 10.052 9.651 -5.651 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.419 5.857 -6.847 1.00 0.00 H new ATOM 0 HE1 TYR A 218 11.391 9.738 -7.745 1.00 0.00 H new ATOM 0 HE2 TYR A 218 9.677 5.976 -8.985 1.00 0.00 H new ATOM 0 HH TYR A 218 11.236 7.044 -10.147 1.00 0.00 H new ATOM 1523 N GLN A 219 8.817 9.754 -2.463 1.00 0.00 N ATOM 1524 CA GLN A 219 9.202 11.064 -1.938 1.00 0.00 C ATOM 1525 C GLN A 219 10.341 10.920 -0.904 1.00 0.00 C ATOM 1526 O GLN A 219 11.378 11.579 -1.020 1.00 0.00 O ATOM 1527 CB GLN A 219 7.994 11.792 -1.323 1.00 0.00 C ATOM 1528 CG GLN A 219 6.730 11.886 -2.197 1.00 0.00 C ATOM 1529 CD GLN A 219 5.497 12.360 -1.431 1.00 0.00 C ATOM 1530 OE1 GLN A 219 5.567 13.010 -0.395 1.00 0.00 O ATOM 1531 NE2 GLN A 219 4.315 12.011 -1.898 1.00 0.00 N ATOM 0 H GLN A 219 7.831 9.535 -2.321 1.00 0.00 H new ATOM 0 HA GLN A 219 9.566 11.668 -2.769 1.00 0.00 H new ATOM 0 HB2 GLN A 219 7.729 11.288 -0.393 1.00 0.00 H new ATOM 0 HB3 GLN A 219 8.303 12.804 -1.060 1.00 0.00 H new ATOM 0 HG2 GLN A 219 6.920 12.570 -3.025 1.00 0.00 H new ATOM 0 HG3 GLN A 219 6.525 10.908 -2.632 1.00 0.00 H new ATOM 0 HE21 GLN A 219 4.247 11.470 -2.760 1.00 0.00 H new ATOM 0 HE22 GLN A 219 3.469 12.282 -1.398 1.00 0.00 H new ATOM 1540 N LYS A 220 10.173 10.019 0.081 1.00 0.00 N ATOM 1541 CA LYS A 220 11.153 9.763 1.156 1.00 0.00 C ATOM 1542 C LYS A 220 12.485 9.280 0.614 1.00 0.00 C ATOM 1543 O LYS A 220 13.538 9.828 0.952 1.00 0.00 O ATOM 1544 CB LYS A 220 10.655 8.733 2.199 1.00 0.00 C ATOM 1545 CG LYS A 220 9.262 8.904 2.810 1.00 0.00 C ATOM 1546 CD LYS A 220 8.757 10.339 2.782 1.00 0.00 C ATOM 1547 CE LYS A 220 7.926 10.628 4.027 1.00 0.00 C ATOM 1548 NZ LYS A 220 7.623 12.069 4.136 1.00 0.00 N ATOM 0 H LYS A 220 9.338 9.437 0.155 1.00 0.00 H new ATOM 0 HA LYS A 220 11.281 10.728 1.646 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.690 7.749 1.731 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.374 8.722 3.018 1.00 0.00 H new ATOM 0 HG2 LYS A 220 8.558 8.269 2.272 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.282 8.555 3.842 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.600 11.028 2.730 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.156 10.503 1.888 1.00 0.00 H new ATOM 0 HE2 LYS A 220 6.997 10.059 3.989 1.00 0.00 H new ATOM 0 HE3 LYS A 220 8.466 10.298 4.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 7.057 12.241 4.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.511 12.607 4.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.088 12.375 3.299 1.00 0.00 H new ATOM 1562 N GLU A 221 12.440 8.233 -0.196 1.00 0.00 N ATOM 1563 CA GLU A 221 13.583 7.621 -0.828 1.00 0.00 C ATOM 1564 C GLU A 221 14.200 8.547 -1.878 1.00 0.00 C ATOM 1565 O GLU A 221 15.398 8.467 -2.095 1.00 0.00 O ATOM 1566 CB GLU A 221 13.148 6.278 -1.398 1.00 0.00 C ATOM 1567 CG GLU A 221 12.530 5.377 -0.314 1.00 0.00 C ATOM 1568 CD GLU A 221 13.276 5.312 1.039 1.00 0.00 C ATOM 1569 OE1 GLU A 221 14.297 4.571 1.109 1.00 0.00 O ATOM 1570 OE2 GLU A 221 12.875 5.980 2.031 1.00 0.00 O ATOM 0 H GLU A 221 11.563 7.771 -0.437 1.00 0.00 H new ATOM 0 HA GLU A 221 14.374 7.448 -0.098 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.423 6.438 -2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.007 5.776 -1.844 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.512 5.719 -0.126 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.458 4.365 -0.712 1.00 0.00 H new ATOM 1577 N SER A 222 13.430 9.468 -2.475 1.00 0.00 N ATOM 1578 CA SER A 222 13.938 10.461 -3.441 1.00 0.00 C ATOM 1579 C SER A 222 14.820 11.487 -2.744 1.00 0.00 C ATOM 1580 O SER A 222 15.977 11.685 -3.116 1.00 0.00 O ATOM 1581 CB SER A 222 12.780 11.175 -4.145 1.00 0.00 C ATOM 1582 OG SER A 222 13.211 12.278 -4.917 1.00 0.00 O ATOM 0 H SER A 222 12.428 9.548 -2.302 1.00 0.00 H new ATOM 0 HA SER A 222 14.531 9.929 -4.185 1.00 0.00 H new ATOM 0 HB2 SER A 222 12.259 10.467 -4.789 1.00 0.00 H new ATOM 0 HB3 SER A 222 12.061 11.516 -3.400 1.00 0.00 H new ATOM 0 HG SER A 222 12.437 12.699 -5.347 1.00 0.00 H new ATOM 1588 N GLN A 223 14.273 12.085 -1.682 1.00 0.00 N ATOM 1589 CA GLN A 223 14.998 12.934 -0.739 1.00 0.00 C ATOM 1590 C GLN A 223 16.243 12.231 -0.209 1.00 0.00 C ATOM 1591 O GLN A 223 17.323 12.813 -0.214 1.00 0.00 O ATOM 1592 CB GLN A 223 14.065 13.267 0.427 1.00 0.00 C ATOM 1593 CG GLN A 223 12.979 14.280 0.021 1.00 0.00 C ATOM 1594 CD GLN A 223 11.725 14.233 0.895 1.00 0.00 C ATOM 1595 OE1 GLN A 223 11.772 14.078 2.117 1.00 0.00 O ATOM 1596 NE2 GLN A 223 10.558 14.382 0.298 1.00 0.00 N ATOM 0 H GLN A 223 13.285 11.987 -1.450 1.00 0.00 H new ATOM 0 HA GLN A 223 15.317 13.842 -1.251 1.00 0.00 H new ATOM 0 HB2 GLN A 223 13.593 12.353 0.787 1.00 0.00 H new ATOM 0 HB3 GLN A 223 14.648 13.672 1.254 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.400 15.284 0.062 1.00 0.00 H new ATOM 0 HG3 GLN A 223 12.694 14.096 -1.015 1.00 0.00 H new ATOM 0 HE21 GLN A 223 10.515 14.511 -0.713 1.00 0.00 H new ATOM 0 HE22 GLN A 223 9.699 14.369 0.847 1.00 0.00 H new ATOM 1605 N ALA A 224 16.106 10.968 0.207 1.00 0.00 N ATOM 1606 CA ALA A 224 17.203 10.169 0.712 1.00 0.00 C ATOM 1607 C ALA A 224 18.251 9.931 -0.376 1.00 0.00 C ATOM 1608 O ALA A 224 19.443 10.058 -0.127 1.00 0.00 O ATOM 1609 CB ALA A 224 16.681 8.840 1.251 1.00 0.00 C ATOM 0 H ALA A 224 15.213 10.474 0.198 1.00 0.00 H new ATOM 0 HA ALA A 224 17.680 10.715 1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.515 8.248 1.628 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.974 9.028 2.059 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.181 8.294 0.451 1.00 0.00 H new ATOM 1615 N TYR A 225 17.822 9.617 -1.600 1.00 0.00 N ATOM 1616 CA TYR A 225 18.689 9.363 -2.743 1.00 0.00 C ATOM 1617 C TYR A 225 19.484 10.619 -3.111 1.00 0.00 C ATOM 1618 O TYR A 225 20.676 10.523 -3.408 1.00 0.00 O ATOM 1619 CB TYR A 225 17.811 8.858 -3.897 1.00 0.00 C ATOM 1620 CG TYR A 225 18.407 8.984 -5.276 1.00 0.00 C ATOM 1621 CD1 TYR A 225 18.277 10.199 -5.969 1.00 0.00 C ATOM 1622 CD2 TYR A 225 19.052 7.889 -5.869 1.00 0.00 C ATOM 1623 CE1 TYR A 225 18.785 10.322 -7.275 1.00 0.00 C ATOM 1624 CE2 TYR A 225 19.550 8.003 -7.178 1.00 0.00 C ATOM 1625 CZ TYR A 225 19.402 9.210 -7.892 1.00 0.00 C ATOM 1626 OH TYR A 225 19.824 9.270 -9.187 1.00 0.00 O ATOM 0 H TYR A 225 16.831 9.531 -1.826 1.00 0.00 H new ATOM 0 HA TYR A 225 19.431 8.601 -2.506 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.575 7.809 -3.718 1.00 0.00 H new ATOM 0 HB3 TYR A 225 16.868 9.404 -3.878 1.00 0.00 H new ATOM 0 HD1 TYR A 225 17.787 11.039 -5.499 1.00 0.00 H new ATOM 0 HD2 TYR A 225 19.165 6.964 -5.323 1.00 0.00 H new ATOM 0 HE1 TYR A 225 18.704 11.261 -7.803 1.00 0.00 H new ATOM 0 HE2 TYR A 225 20.048 7.163 -7.639 1.00 0.00 H new ATOM 0 HH TYR A 225 20.225 8.412 -9.440 1.00 0.00 H new ATOM 1636 N TYR A 226 18.829 11.783 -3.057 1.00 0.00 N ATOM 1637 CA TYR A 226 19.434 13.098 -3.246 1.00 0.00 C ATOM 1638 C TYR A 226 20.382 13.476 -2.092 1.00 0.00 C ATOM 1639 O TYR A 226 21.446 14.053 -2.328 1.00 0.00 O ATOM 1640 CB TYR A 226 18.317 14.134 -3.422 1.00 0.00 C ATOM 1641 CG TYR A 226 18.848 15.545 -3.552 1.00 0.00 C ATOM 1642 CD1 TYR A 226 19.338 15.999 -4.792 1.00 0.00 C ATOM 1643 CD2 TYR A 226 18.959 16.354 -2.405 1.00 0.00 C ATOM 1644 CE1 TYR A 226 19.977 17.250 -4.881 1.00 0.00 C ATOM 1645 CE2 TYR A 226 19.605 17.599 -2.484 1.00 0.00 C ATOM 1646 CZ TYR A 226 20.131 18.038 -3.718 1.00 0.00 C ATOM 1647 OH TYR A 226 20.871 19.178 -3.756 1.00 0.00 O ATOM 0 H TYR A 226 17.827 11.833 -2.874 1.00 0.00 H new ATOM 0 HA TYR A 226 20.053 13.074 -4.143 1.00 0.00 H new ATOM 0 HB2 TYR A 226 17.733 13.886 -4.308 1.00 0.00 H new ATOM 0 HB3 TYR A 226 17.640 14.082 -2.569 1.00 0.00 H new ATOM 0 HD1 TYR A 226 19.223 15.387 -5.675 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.548 16.018 -1.465 1.00 0.00 H new ATOM 0 HE1 TYR A 226 20.347 17.605 -5.831 1.00 0.00 H new ATOM 0 HE2 TYR A 226 19.699 18.218 -1.604 1.00 0.00 H new ATOM 0 HH TYR A 226 20.871 19.597 -2.870 1.00 0.00 H new ATOM 1657 N ASP A 227 20.020 13.125 -0.853 1.00 0.00 N ATOM 1658 CA ASP A 227 20.862 13.220 0.335 1.00 0.00 C ATOM 1659 C ASP A 227 22.134 12.351 0.234 1.00 0.00 C ATOM 1660 O ASP A 227 23.228 12.836 0.550 1.00 0.00 O ATOM 1661 CB ASP A 227 19.992 12.876 1.556 1.00 0.00 C ATOM 1662 CG ASP A 227 20.778 12.583 2.824 1.00 0.00 C ATOM 1663 OD1 ASP A 227 21.082 13.546 3.576 1.00 0.00 O ATOM 1664 OD2 ASP A 227 21.053 11.396 3.114 1.00 0.00 O ATOM 0 H ASP A 227 19.093 12.752 -0.647 1.00 0.00 H new ATOM 0 HA ASP A 227 21.242 14.236 0.437 1.00 0.00 H new ATOM 0 HB2 ASP A 227 19.312 13.706 1.748 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.377 12.009 1.316 1.00 0.00 H new ATOM 1669 N GLY A 228 22.009 11.104 -0.240 1.00 0.00 N ATOM 1670 CA GLY A 228 23.111 10.157 -0.441 1.00 0.00 C ATOM 1671 C GLY A 228 22.770 8.667 -0.359 1.00 0.00 C ATOM 1672 O GLY A 228 23.664 7.825 -0.479 1.00 0.00 O ATOM 0 H GLY A 228 21.104 10.714 -0.503 1.00 0.00 H new ATOM 0 HA2 GLY A 228 23.550 10.351 -1.420 1.00 0.00 H new ATOM 0 HA3 GLY A 228 23.880 10.370 0.301 1.00 0.00 H new TER 1676 GLY A 228