USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 821 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 148 TYR OH : rot -157:sc= -1.15! USER MOD Set 1.2: A 200 THR OG1 : rot -106:sc= 0.377 USER MOD Set 2.1: A 176 HIS : no HE2:sc= 1.03 K(o=0.99,f=-6!) USER MOD Set 2.2: A 180 ASN : amide:sc= -0.0434 K(o=0.99,f=-0.53!) USER MOD Set 3.1: A 133 MET CE :methyl 140:sc= -4.11 (180deg=-7.41!) USER MOD Set 3.2: A 212 MET CE :methyl -116:sc= -7.85! (180deg=-8.77!) USER MOD Set 4.1: A 128 MET CE :methyl -160:sc= -3.81! (180deg=-4.58!) USER MOD Set 4.2: A 131 SER OG : rot 180:sc= -0.239 USER MOD Set 4.3: A 216 GLN : amide:sc= 0.0376 K(o=-2.9,f=-7.6!) USER MOD Set 4.4: A 219 GLN : amide:sc= 1.15 K(o=-2.9,f=-6.4) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0.00967 USER MOD Single : A 139 HIS :FLIP no HD1:sc= 0.0757 F(o=-4.9!,f=0.076) USER MOD Single : A 142 ASN : amide:sc= 0.731 K(o=0.73,f=-3.9!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot -140:sc= 0.376 USER MOD Single : A 152 ASN : amide:sc= -9.49! C(o=-9.5!,f=-13!) USER MOD Single : A 153 MET CE :methyl 165:sc= -11.7! (180deg=-13!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -98:sc= -4.02! USER MOD Single : A 158 ASN : amide:sc= -0.239 K(o=-0.24,f=-2.2!) USER MOD Single : A 159 GLN : amide:sc= -1.63! C(o=-1.6!,f=-2.7!) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot -71:sc= -1.27 USER MOD Single : A 167 GLN : amide:sc= -3.95! C(o=-4!,f=-4.7!) USER MOD Single : A 168 TYR OH : rot 153:sc= 0.139 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 ASN :FLIP amide:sc= -1.2 F(o=-3.2!,f=-1.2) USER MOD Single : A 171 GLN : amide:sc= -0.928! X(o=-0.93!,f=-0.49) USER MOD Single : A 172 ASN : amide:sc= -0.12 K(o=-0.12,f=-2.6!) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 182 THR OG1 : rot 78:sc= -3.41! USER MOD Single : A 184 LYS NZ :NH3+ 160:sc= -0.111 (180deg=-0.476) USER MOD Single : A 185 GLN :FLIP amide:sc= -1.38 F(o=-2.6!,f=-1.4) USER MOD Single : A 186 HIS : no HE2:sc= -2.51! C(o=-2.5!,f=-9.3!) USER MOD Single : A 187 THR OG1 : rot -127:sc= 1.1 USER MOD Single : A 189 THR OG1 : rot 6:sc= 0.65 USER MOD Single : A 190 THR OG1 : rot 103:sc= 0.997 USER MOD Single : A 191 THR OG1 : rot 24:sc= -3.07! USER MOD Single : A 192 THR OG1 : rot 180:sc= -1.06 USER MOD Single : A 193 LYS NZ :NH3+ -123:sc= -0.302 (180deg=-2.08!) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc=-0.000216 USER MOD Single : A 203 LYS NZ :NH3+ 177:sc= 0.234 (180deg=0.23) USER MOD Single : A 205 MET CE :methyl 157:sc= -3.62! (180deg=-5.68!) USER MOD Single : A 211 GLN : amide:sc= -0.0892 K(o=-0.089,f=-1.9) USER MOD Single : A 215 THR OG1 : rot 54:sc= 1.27 USER MOD Single : A 217 TYR OH : rot -36:sc= -0.776 USER MOD Single : A 218 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 221 SER OG : rot 32:sc= 1.24 USER MOD Single : A 222 GLN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -0.262 K(o=-0.26,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 124 -13.412 6.596 -2.235 1.00 1.95 N ATOM 2 CA LEU A 124 -12.218 6.644 -3.056 1.00 1.36 C ATOM 3 C LEU A 124 -12.575 6.537 -4.535 1.00 1.43 C ATOM 4 O LEU A 124 -11.757 6.106 -5.351 1.00 2.13 O ATOM 5 CB LEU A 124 -11.189 5.559 -2.639 1.00 1.23 C ATOM 6 CG LEU A 124 -11.644 4.076 -2.557 1.00 1.15 C ATOM 7 CD1 LEU A 124 -12.755 3.860 -1.541 1.00 1.32 C ATOM 8 CD2 LEU A 124 -12.049 3.528 -3.914 1.00 1.75 C ATOM 0 HA LEU A 124 -11.742 7.611 -2.893 1.00 1.36 H new ATOM 0 HB2 LEU A 124 -10.357 5.609 -3.341 1.00 1.23 H new ATOM 0 HB3 LEU A 124 -10.797 5.837 -1.660 1.00 1.23 H new ATOM 0 HG LEU A 124 -10.773 3.518 -2.213 1.00 1.15 H new ATOM 0 HD11 LEU A 124 -13.034 2.806 -1.525 1.00 1.32 H new ATOM 0 HD12 LEU A 124 -12.407 4.158 -0.552 1.00 1.32 H new ATOM 0 HD13 LEU A 124 -13.622 4.461 -1.816 1.00 1.32 H new ATOM 0 HD21 LEU A 124 -12.360 2.489 -3.809 1.00 1.75 H new ATOM 0 HD22 LEU A 124 -12.877 4.116 -4.311 1.00 1.75 H new ATOM 0 HD23 LEU A 124 -11.202 3.586 -4.597 1.00 1.75 H new ATOM 20 N GLY A 125 -13.800 6.936 -4.869 1.00 1.19 N ATOM 21 CA GLY A 125 -14.213 7.009 -6.260 1.00 1.32 C ATOM 22 C GLY A 125 -13.489 8.133 -6.968 1.00 1.24 C ATOM 23 O GLY A 125 -14.068 9.174 -7.275 1.00 1.68 O ATOM 0 H GLY A 125 -14.517 7.211 -4.197 1.00 1.19 H new ATOM 0 HA2 GLY A 125 -14.003 6.062 -6.758 1.00 1.32 H new ATOM 0 HA3 GLY A 125 -15.290 7.168 -6.318 1.00 1.32 H new ATOM 27 N GLY A 126 -12.216 7.910 -7.203 1.00 1.13 N ATOM 28 CA GLY A 126 -11.339 8.938 -7.680 1.00 1.14 C ATOM 29 C GLY A 126 -10.001 8.836 -6.992 1.00 1.08 C ATOM 30 O GLY A 126 -9.252 7.887 -7.247 1.00 1.83 O ATOM 0 H GLY A 126 -11.765 7.006 -7.066 1.00 1.13 H new ATOM 0 HA2 GLY A 126 -11.210 8.846 -8.758 1.00 1.14 H new ATOM 0 HA3 GLY A 126 -11.779 9.918 -7.494 1.00 1.14 H new ATOM 34 N TYR A 127 -9.717 9.777 -6.088 1.00 0.61 N ATOM 35 CA TYR A 127 -8.417 9.849 -5.422 1.00 0.44 C ATOM 36 C TYR A 127 -7.297 9.910 -6.444 1.00 0.45 C ATOM 37 O TYR A 127 -7.535 9.977 -7.651 1.00 0.71 O ATOM 38 CB TYR A 127 -8.230 8.691 -4.408 1.00 0.37 C ATOM 39 CG TYR A 127 -8.738 9.048 -3.027 1.00 0.46 C ATOM 40 CD1 TYR A 127 -9.321 10.289 -2.780 1.00 1.26 C ATOM 41 CD2 TYR A 127 -8.640 8.154 -1.971 1.00 0.86 C ATOM 42 CE1 TYR A 127 -9.781 10.623 -1.530 1.00 1.38 C ATOM 43 CE2 TYR A 127 -9.101 8.486 -0.712 1.00 0.92 C ATOM 44 CZ TYR A 127 -9.669 9.724 -0.501 1.00 0.78 C ATOM 45 OH TYR A 127 -10.133 10.067 0.740 1.00 0.96 O ATOM 0 H TYR A 127 -10.374 10.502 -5.800 1.00 0.61 H new ATOM 0 HA TYR A 127 -8.380 10.771 -4.842 1.00 0.44 H new ATOM 0 HB2 TYR A 127 -8.756 7.807 -4.769 1.00 0.37 H new ATOM 0 HB3 TYR A 127 -7.173 8.431 -4.348 1.00 0.37 H new ATOM 0 HD1 TYR A 127 -9.413 11.001 -3.586 1.00 1.26 H new ATOM 0 HD2 TYR A 127 -8.196 7.183 -2.136 1.00 0.86 H new ATOM 0 HE1 TYR A 127 -10.229 11.590 -1.358 1.00 1.38 H new ATOM 0 HE2 TYR A 127 -9.017 7.780 0.101 1.00 0.92 H new ATOM 0 HH TYR A 127 -9.983 9.325 1.362 1.00 0.96 H new ATOM 55 N MET A 128 -6.085 9.933 -5.971 1.00 0.38 N ATOM 56 CA MET A 128 -4.957 9.984 -6.838 1.00 0.41 C ATOM 57 C MET A 128 -4.180 8.740 -6.539 1.00 0.42 C ATOM 58 O MET A 128 -3.628 8.572 -5.459 1.00 0.43 O ATOM 59 CB MET A 128 -4.197 11.325 -6.642 1.00 0.46 C ATOM 60 CG MET A 128 -3.083 11.360 -5.608 1.00 0.45 C ATOM 61 SD MET A 128 -1.584 10.522 -6.142 1.00 0.52 S ATOM 62 CE MET A 128 -1.033 9.916 -4.559 1.00 0.46 C ATOM 0 H MET A 128 -5.857 9.917 -4.977 1.00 0.38 H new ATOM 0 HA MET A 128 -5.202 9.988 -7.900 1.00 0.41 H new ATOM 0 HB2 MET A 128 -3.772 11.613 -7.603 1.00 0.46 H new ATOM 0 HB3 MET A 128 -4.927 12.089 -6.375 1.00 0.46 H new ATOM 0 HG2 MET A 128 -2.846 12.398 -5.375 1.00 0.45 H new ATOM 0 HG3 MET A 128 -3.439 10.900 -4.686 1.00 0.45 H new ATOM 0 HE1 MET A 128 0.031 9.684 -4.609 1.00 0.46 H new ATOM 0 HE2 MET A 128 -1.203 10.678 -3.798 1.00 0.46 H new ATOM 0 HE3 MET A 128 -1.589 9.015 -4.301 1.00 0.46 H new ATOM 72 N LEU A 129 -4.274 7.785 -7.437 1.00 0.57 N ATOM 73 CA LEU A 129 -3.717 6.502 -7.144 1.00 0.66 C ATOM 74 C LEU A 129 -2.251 6.680 -6.847 1.00 0.56 C ATOM 75 O LEU A 129 -1.476 7.087 -7.713 1.00 0.56 O ATOM 76 CB LEU A 129 -3.944 5.495 -8.255 1.00 0.92 C ATOM 77 CG LEU A 129 -3.567 4.085 -7.839 1.00 0.37 C ATOM 78 CD1 LEU A 129 -4.682 3.102 -8.144 1.00 1.12 C ATOM 79 CD2 LEU A 129 -2.269 3.673 -8.512 1.00 1.15 C ATOM 0 H LEU A 129 -4.720 7.875 -8.350 1.00 0.57 H new ATOM 0 HA LEU A 129 -4.227 6.088 -6.274 1.00 0.66 H new ATOM 0 HB2 LEU A 129 -4.992 5.516 -8.553 1.00 0.92 H new ATOM 0 HB3 LEU A 129 -3.359 5.783 -9.128 1.00 0.92 H new ATOM 0 HG LEU A 129 -3.416 4.073 -6.760 1.00 0.37 H new ATOM 0 HD11 LEU A 129 -4.380 2.102 -7.834 1.00 1.12 H new ATOM 0 HD12 LEU A 129 -5.582 3.393 -7.603 1.00 1.12 H new ATOM 0 HD13 LEU A 129 -4.886 3.104 -9.215 1.00 1.12 H new ATOM 0 HD21 LEU A 129 -2.007 2.660 -8.207 1.00 1.15 H new ATOM 0 HD22 LEU A 129 -2.394 3.705 -9.594 1.00 1.15 H new ATOM 0 HD23 LEU A 129 -1.473 4.358 -8.218 1.00 1.15 H new ATOM 91 N GLY A 130 -1.916 6.424 -5.594 1.00 0.57 N ATOM 92 CA GLY A 130 -0.616 6.736 -5.070 1.00 0.55 C ATOM 93 C GLY A 130 0.454 5.854 -5.647 1.00 0.53 C ATOM 94 O GLY A 130 0.982 4.982 -4.959 1.00 0.58 O ATOM 0 H GLY A 130 -2.546 5.993 -4.917 1.00 0.57 H new ATOM 0 HA2 GLY A 130 -0.380 7.778 -5.284 1.00 0.55 H new ATOM 0 HA3 GLY A 130 -0.628 6.628 -3.985 1.00 0.55 H new ATOM 98 N SER A 131 0.711 6.072 -6.936 1.00 0.56 N ATOM 99 CA SER A 131 1.772 5.397 -7.680 1.00 0.62 C ATOM 100 C SER A 131 1.580 3.888 -7.744 1.00 0.63 C ATOM 101 O SER A 131 1.711 3.186 -6.739 1.00 1.04 O ATOM 102 CB SER A 131 3.146 5.710 -7.086 1.00 0.71 C ATOM 103 OG SER A 131 3.544 7.033 -7.391 1.00 1.30 O ATOM 0 H SER A 131 0.179 6.734 -7.501 1.00 0.56 H new ATOM 0 HA SER A 131 1.717 5.783 -8.698 1.00 0.62 H new ATOM 0 HB2 SER A 131 3.117 5.576 -6.005 1.00 0.71 H new ATOM 0 HB3 SER A 131 3.882 5.007 -7.475 1.00 0.71 H new ATOM 0 HG SER A 131 4.425 7.208 -6.998 1.00 1.30 H new ATOM 109 N ALA A 132 1.276 3.386 -8.932 1.00 0.64 N ATOM 110 CA ALA A 132 1.314 1.953 -9.161 1.00 0.58 C ATOM 111 C ALA A 132 2.765 1.494 -9.209 1.00 0.53 C ATOM 112 O ALA A 132 3.307 1.180 -10.271 1.00 0.65 O ATOM 113 CB ALA A 132 0.579 1.564 -10.434 1.00 0.71 C ATOM 0 H ALA A 132 1.004 3.943 -9.742 1.00 0.64 H new ATOM 0 HA ALA A 132 0.801 1.455 -8.338 1.00 0.58 H new ATOM 0 HB1 ALA A 132 0.631 0.484 -10.569 1.00 0.71 H new ATOM 0 HB2 ALA A 132 -0.464 1.871 -10.360 1.00 0.71 H new ATOM 0 HB3 ALA A 132 1.043 2.059 -11.287 1.00 0.71 H new ATOM 119 N MET A 133 3.398 1.531 -8.047 1.00 0.46 N ATOM 120 CA MET A 133 4.789 1.133 -7.887 1.00 0.49 C ATOM 121 C MET A 133 5.007 -0.308 -8.307 1.00 0.61 C ATOM 122 O MET A 133 4.066 -1.072 -8.486 1.00 1.65 O ATOM 123 CB MET A 133 5.249 1.327 -6.428 1.00 0.48 C ATOM 124 CG MET A 133 4.252 0.878 -5.389 1.00 0.41 C ATOM 125 SD MET A 133 4.810 -0.511 -4.390 1.00 0.73 S ATOM 126 CE MET A 133 3.654 -0.397 -3.027 1.00 0.40 C ATOM 0 H MET A 133 2.958 1.841 -7.181 1.00 0.46 H new ATOM 0 HA MET A 133 5.386 1.773 -8.537 1.00 0.49 H new ATOM 0 HB2 MET A 133 6.180 0.780 -6.279 1.00 0.48 H new ATOM 0 HB3 MET A 133 5.470 2.382 -6.268 1.00 0.48 H new ATOM 0 HG2 MET A 133 4.025 1.717 -4.731 1.00 0.41 H new ATOM 0 HG3 MET A 133 3.322 0.603 -5.887 1.00 0.41 H new ATOM 0 HE1 MET A 133 3.339 -1.398 -2.733 1.00 0.40 H new ATOM 0 HE2 MET A 133 4.135 0.095 -2.182 1.00 0.40 H new ATOM 0 HE3 MET A 133 2.783 0.182 -3.336 1.00 0.40 H new ATOM 136 N SER A 134 6.258 -0.670 -8.467 1.00 0.72 N ATOM 137 CA SER A 134 6.617 -2.037 -8.782 1.00 0.60 C ATOM 138 C SER A 134 7.223 -2.697 -7.557 1.00 0.52 C ATOM 139 O SER A 134 8.094 -3.565 -7.662 1.00 0.74 O ATOM 140 CB SER A 134 7.598 -2.049 -9.952 1.00 0.71 C ATOM 141 OG SER A 134 8.585 -1.042 -9.793 1.00 1.49 O ATOM 0 H SER A 134 7.051 -0.034 -8.384 1.00 0.72 H new ATOM 0 HA SER A 134 5.728 -2.598 -9.071 1.00 0.60 H new ATOM 0 HB2 SER A 134 8.077 -3.026 -10.021 1.00 0.71 H new ATOM 0 HB3 SER A 134 7.059 -1.892 -10.886 1.00 0.71 H new ATOM 0 HG SER A 134 9.204 -1.068 -10.552 1.00 1.49 H new ATOM 147 N ARG A 135 6.702 -2.281 -6.401 1.00 0.47 N ATOM 148 CA ARG A 135 7.203 -2.678 -5.093 1.00 0.43 C ATOM 149 C ARG A 135 8.478 -1.922 -4.734 1.00 0.47 C ATOM 150 O ARG A 135 9.398 -1.823 -5.540 1.00 0.59 O ATOM 151 CB ARG A 135 7.432 -4.180 -4.986 1.00 0.55 C ATOM 152 CG ARG A 135 6.218 -4.909 -4.463 1.00 0.49 C ATOM 153 CD ARG A 135 5.909 -4.527 -3.038 1.00 1.38 C ATOM 154 NE ARG A 135 4.732 -5.255 -2.549 1.00 2.40 N ATOM 155 CZ ARG A 135 3.475 -4.841 -2.722 1.00 3.22 C ATOM 156 NH1 ARG A 135 3.225 -3.703 -3.349 1.00 3.47 N ATOM 157 NH2 ARG A 135 2.463 -5.560 -2.266 1.00 4.16 N ATOM 0 H ARG A 135 5.905 -1.647 -6.352 1.00 0.47 H new ATOM 0 HA ARG A 135 6.426 -2.414 -4.376 1.00 0.43 H new ATOM 0 HB2 ARG A 135 7.696 -4.576 -5.967 1.00 0.55 H new ATOM 0 HB3 ARG A 135 8.279 -4.370 -4.327 1.00 0.55 H new ATOM 0 HG2 ARG A 135 5.358 -4.684 -5.095 1.00 0.49 H new ATOM 0 HG3 ARG A 135 6.385 -5.984 -4.523 1.00 0.49 H new ATOM 0 HD2 ARG A 135 6.768 -4.746 -2.403 1.00 1.38 H new ATOM 0 HD3 ARG A 135 5.731 -3.454 -2.974 1.00 1.38 H new ATOM 0 HE ARG A 135 4.884 -6.130 -2.047 1.00 2.40 H new ATOM 0 HH11 ARG A 135 3.995 -3.136 -3.704 1.00 3.47 H new ATOM 0 HH12 ARG A 135 2.262 -3.393 -3.478 1.00 3.47 H new ATOM 0 HH21 ARG A 135 2.640 -6.438 -1.778 1.00 4.16 H new ATOM 0 HH22 ARG A 135 1.505 -5.237 -2.402 1.00 4.16 H new ATOM 171 N PRO A 136 8.538 -1.356 -3.517 1.00 0.43 N ATOM 172 CA PRO A 136 9.761 -0.752 -2.975 1.00 0.49 C ATOM 173 C PRO A 136 10.733 -1.827 -2.511 1.00 0.46 C ATOM 174 O PRO A 136 11.715 -1.552 -1.821 1.00 0.58 O ATOM 175 CB PRO A 136 9.263 0.076 -1.780 1.00 0.52 C ATOM 176 CG PRO A 136 7.773 0.067 -1.886 1.00 0.47 C ATOM 177 CD PRO A 136 7.422 -1.209 -2.582 1.00 0.40 C ATOM 0 HA PRO A 136 10.297 -0.154 -3.712 1.00 0.49 H new ATOM 0 HB2 PRO A 136 9.593 -0.358 -0.836 1.00 0.52 H new ATOM 0 HB3 PRO A 136 9.654 1.093 -1.816 1.00 0.52 H new ATOM 0 HG2 PRO A 136 7.311 0.115 -0.900 1.00 0.47 H new ATOM 0 HG3 PRO A 136 7.416 0.930 -2.448 1.00 0.47 H new ATOM 0 HD2 PRO A 136 7.356 -2.048 -1.889 1.00 0.40 H new ATOM 0 HD3 PRO A 136 6.463 -1.144 -3.096 1.00 0.40 H new ATOM 185 N LEU A 137 10.425 -3.053 -2.920 1.00 0.42 N ATOM 186 CA LEU A 137 11.170 -4.245 -2.553 1.00 0.48 C ATOM 187 C LEU A 137 11.183 -4.434 -1.047 1.00 0.45 C ATOM 188 O LEU A 137 12.095 -4.008 -0.346 1.00 0.62 O ATOM 189 CB LEU A 137 12.599 -4.254 -3.091 1.00 0.70 C ATOM 190 CG LEU A 137 12.764 -4.293 -4.620 1.00 0.77 C ATOM 191 CD1 LEU A 137 11.876 -5.366 -5.233 1.00 1.32 C ATOM 192 CD2 LEU A 137 12.485 -2.936 -5.249 1.00 1.33 C ATOM 0 H LEU A 137 9.631 -3.247 -3.530 1.00 0.42 H new ATOM 0 HA LEU A 137 10.648 -5.080 -3.021 1.00 0.48 H new ATOM 0 HB2 LEU A 137 13.108 -3.366 -2.717 1.00 0.70 H new ATOM 0 HB3 LEU A 137 13.115 -5.118 -2.671 1.00 0.70 H new ATOM 0 HG LEU A 137 13.803 -4.545 -4.831 1.00 0.77 H new ATOM 0 HD11 LEU A 137 12.010 -5.375 -6.315 1.00 1.32 H new ATOM 0 HD12 LEU A 137 12.148 -6.340 -4.826 1.00 1.32 H new ATOM 0 HD13 LEU A 137 10.833 -5.153 -4.998 1.00 1.32 H new ATOM 0 HD21 LEU A 137 12.612 -3.003 -6.330 1.00 1.33 H new ATOM 0 HD22 LEU A 137 11.463 -2.633 -5.021 1.00 1.33 H new ATOM 0 HD23 LEU A 137 13.180 -2.199 -4.847 1.00 1.33 H new ATOM 204 N ILE A 138 10.133 -5.055 -0.564 1.00 0.38 N ATOM 205 CA ILE A 138 9.978 -5.350 0.840 1.00 0.39 C ATOM 206 C ILE A 138 10.604 -6.706 1.180 1.00 0.50 C ATOM 207 O ILE A 138 10.842 -7.002 2.344 1.00 1.19 O ATOM 208 CB ILE A 138 8.484 -5.328 1.153 1.00 0.38 C ATOM 209 CG1 ILE A 138 7.925 -3.926 0.915 1.00 0.25 C ATOM 210 CG2 ILE A 138 8.168 -5.807 2.552 1.00 0.57 C ATOM 211 CD1 ILE A 138 8.573 -2.850 1.761 1.00 0.31 C ATOM 0 H ILE A 138 9.354 -5.373 -1.141 1.00 0.38 H new ATOM 0 HA ILE A 138 10.494 -4.607 1.449 1.00 0.39 H new ATOM 0 HB ILE A 138 8.000 -6.031 0.476 1.00 0.38 H new ATOM 0 HG12 ILE A 138 8.050 -3.670 -0.137 1.00 0.25 H new ATOM 0 HG13 ILE A 138 6.854 -3.935 1.116 1.00 0.25 H new ATOM 0 HG21 ILE A 138 7.091 -5.768 2.715 1.00 0.57 H new ATOM 0 HG22 ILE A 138 8.517 -6.833 2.673 1.00 0.57 H new ATOM 0 HG23 ILE A 138 8.668 -5.166 3.278 1.00 0.57 H new ATOM 0 HD11 ILE A 138 8.120 -1.885 1.532 1.00 0.31 H new ATOM 0 HD12 ILE A 138 8.425 -3.079 2.816 1.00 0.31 H new ATOM 0 HD13 ILE A 138 9.640 -2.810 1.544 1.00 0.31 H new ATOM 223 N HIS A 139 10.889 -7.488 0.121 1.00 0.65 N ATOM 224 CA HIS A 139 11.632 -8.778 0.174 1.00 0.75 C ATOM 225 C HIS A 139 11.425 -9.624 1.437 1.00 0.84 C ATOM 226 O HIS A 139 10.692 -10.609 1.402 1.00 1.80 O ATOM 227 CB HIS A 139 13.147 -8.583 -0.079 1.00 0.84 C ATOM 228 CG HIS A 139 13.710 -7.297 0.441 1.00 0.72 C ATOM 229 ND1 HIS A 139 13.658 -6.754 1.671 1.00 1.02 N flip ATOM 230 CD2 HIS A 139 14.335 -6.372 -0.357 1.00 1.15 C flip ATOM 231 CE1 HIS A 139 14.217 -5.507 1.604 1.00 1.08 C flip ATOM 232 NE2 HIS A 139 14.628 -5.308 0.363 1.00 1.33 N flip ATOM 0 H HIS A 139 10.604 -7.239 -0.826 1.00 0.65 H new ATOM 0 HA HIS A 139 11.184 -9.351 -0.638 1.00 0.75 H new ATOM 0 HB2 HIS A 139 13.687 -9.411 0.379 1.00 0.84 H new ATOM 0 HB3 HIS A 139 13.332 -8.637 -1.152 1.00 0.84 H new ATOM 0 HD2 HIS A 139 14.552 -6.496 -1.408 1.00 1.15 H new ATOM 0 HE1 HIS A 139 14.307 -4.807 2.422 1.00 1.08 H new ATOM 0 HE2 HIS A 139 15.095 -4.469 0.020 1.00 1.33 H new ATOM 241 N PHE A 140 12.085 -9.229 2.530 1.00 0.66 N ATOM 242 CA PHE A 140 12.279 -10.053 3.730 1.00 0.54 C ATOM 243 C PHE A 140 13.410 -11.047 3.484 1.00 0.63 C ATOM 244 O PHE A 140 14.214 -11.327 4.375 1.00 0.76 O ATOM 245 CB PHE A 140 11.012 -10.808 4.166 1.00 0.53 C ATOM 246 CG PHE A 140 9.806 -9.939 4.385 1.00 0.40 C ATOM 247 CD1 PHE A 140 9.807 -8.944 5.349 1.00 0.72 C ATOM 248 CD2 PHE A 140 8.669 -10.123 3.618 1.00 0.71 C ATOM 249 CE1 PHE A 140 8.692 -8.150 5.541 1.00 0.74 C ATOM 250 CE2 PHE A 140 7.556 -9.334 3.804 1.00 0.67 C ATOM 251 CZ PHE A 140 7.565 -8.349 4.767 1.00 0.35 C ATOM 0 H PHE A 140 12.510 -8.305 2.608 1.00 0.66 H new ATOM 0 HA PHE A 140 12.530 -9.372 4.544 1.00 0.54 H new ATOM 0 HB2 PHE A 140 10.772 -11.555 3.409 1.00 0.53 H new ATOM 0 HB3 PHE A 140 11.227 -11.347 5.089 1.00 0.53 H new ATOM 0 HD1 PHE A 140 10.687 -8.787 5.956 1.00 0.72 H new ATOM 0 HD2 PHE A 140 8.654 -10.896 2.864 1.00 0.71 H new ATOM 0 HE1 PHE A 140 8.702 -7.376 6.294 1.00 0.74 H new ATOM 0 HE2 PHE A 140 6.677 -9.487 3.196 1.00 0.67 H new ATOM 0 HZ PHE A 140 6.691 -7.732 4.917 1.00 0.35 H new ATOM 261 N GLY A 141 13.476 -11.564 2.260 1.00 0.66 N ATOM 262 CA GLY A 141 14.483 -12.546 1.918 1.00 0.77 C ATOM 263 C GLY A 141 14.070 -13.918 2.381 1.00 0.74 C ATOM 264 O GLY A 141 14.878 -14.845 2.435 1.00 0.86 O ATOM 0 H GLY A 141 12.845 -11.317 1.497 1.00 0.66 H new ATOM 0 HA2 GLY A 141 14.639 -12.553 0.839 1.00 0.77 H new ATOM 0 HA3 GLY A 141 15.434 -12.273 2.376 1.00 0.77 H new ATOM 268 N ASN A 142 12.796 -14.032 2.721 1.00 0.63 N ATOM 269 CA ASN A 142 12.246 -15.276 3.243 1.00 0.63 C ATOM 270 C ASN A 142 11.808 -16.181 2.103 1.00 0.63 C ATOM 271 O ASN A 142 12.138 -15.935 0.944 1.00 0.65 O ATOM 272 CB ASN A 142 11.062 -14.996 4.186 1.00 0.61 C ATOM 273 CG ASN A 142 11.473 -14.201 5.421 1.00 0.81 C ATOM 274 OD1 ASN A 142 12.454 -13.461 5.402 1.00 1.68 O ATOM 275 ND2 ASN A 142 10.736 -14.348 6.507 1.00 1.02 N ATOM 0 H ASN A 142 12.118 -13.273 2.645 1.00 0.63 H new ATOM 0 HA ASN A 142 13.026 -15.781 3.812 1.00 0.63 H new ATOM 0 HB2 ASN A 142 10.292 -14.447 3.644 1.00 0.61 H new ATOM 0 HB3 ASN A 142 10.619 -15.942 4.498 1.00 0.61 H new ATOM 0 HD21 ASN A 142 10.976 -13.840 7.359 1.00 1.02 H new ATOM 0 HD22 ASN A 142 9.927 -14.969 6.494 1.00 1.02 H new ATOM 282 N ASP A 143 11.107 -17.249 2.433 1.00 0.66 N ATOM 283 CA ASP A 143 10.592 -18.152 1.416 1.00 0.67 C ATOM 284 C ASP A 143 9.130 -17.879 1.116 1.00 0.61 C ATOM 285 O ASP A 143 8.798 -17.383 0.049 1.00 0.57 O ATOM 286 CB ASP A 143 10.780 -19.611 1.830 1.00 0.79 C ATOM 287 CG ASP A 143 12.197 -20.093 1.601 1.00 1.34 C ATOM 288 OD1 ASP A 143 12.533 -20.444 0.452 1.00 1.77 O ATOM 289 OD2 ASP A 143 12.980 -20.129 2.572 1.00 2.11 O ATOM 0 H ASP A 143 10.881 -17.514 3.392 1.00 0.66 H new ATOM 0 HA ASP A 143 11.165 -17.971 0.506 1.00 0.67 H new ATOM 0 HB2 ASP A 143 10.526 -19.723 2.884 1.00 0.79 H new ATOM 0 HB3 ASP A 143 10.089 -20.239 1.267 1.00 0.79 H new ATOM 294 N TYR A 144 8.259 -18.160 2.081 1.00 0.64 N ATOM 295 CA TYR A 144 6.821 -18.065 1.850 1.00 0.62 C ATOM 296 C TYR A 144 6.267 -16.698 2.248 1.00 0.55 C ATOM 297 O TYR A 144 5.168 -16.344 1.859 1.00 0.53 O ATOM 298 CB TYR A 144 6.076 -19.172 2.603 1.00 0.76 C ATOM 299 CG TYR A 144 4.585 -19.137 2.376 1.00 0.80 C ATOM 300 CD1 TYR A 144 4.040 -19.469 1.143 1.00 1.17 C ATOM 301 CD2 TYR A 144 3.722 -18.799 3.405 1.00 0.98 C ATOM 302 CE1 TYR A 144 2.677 -19.463 0.946 1.00 1.28 C ATOM 303 CE2 TYR A 144 2.359 -18.786 3.216 1.00 1.09 C ATOM 304 CZ TYR A 144 1.851 -19.021 1.935 1.00 1.08 C ATOM 305 OH TYR A 144 0.484 -19.122 1.785 1.00 1.26 O ATOM 0 H TYR A 144 8.520 -18.453 3.022 1.00 0.64 H new ATOM 0 HA TYR A 144 6.661 -18.191 0.779 1.00 0.62 H new ATOM 0 HB2 TYR A 144 6.463 -20.141 2.290 1.00 0.76 H new ATOM 0 HB3 TYR A 144 6.278 -19.078 3.670 1.00 0.76 H new ATOM 0 HD1 TYR A 144 4.694 -19.736 0.326 1.00 1.17 H new ATOM 0 HD2 TYR A 144 4.126 -18.541 4.373 1.00 0.98 H new ATOM 0 HE1 TYR A 144 2.264 -19.808 0.010 1.00 1.28 H new ATOM 0 HE2 TYR A 144 1.692 -18.597 4.044 1.00 1.09 H new ATOM 0 HH TYR A 144 0.040 -18.762 2.581 1.00 1.26 H new ATOM 315 N GLU A 145 7.015 -15.931 3.019 1.00 0.58 N ATOM 316 CA GLU A 145 6.595 -14.571 3.369 1.00 0.54 C ATOM 317 C GLU A 145 7.145 -13.604 2.347 1.00 0.51 C ATOM 318 O GLU A 145 6.493 -12.630 1.995 1.00 0.50 O ATOM 319 CB GLU A 145 7.099 -14.204 4.750 1.00 0.61 C ATOM 320 CG GLU A 145 6.877 -15.303 5.770 1.00 0.76 C ATOM 321 CD GLU A 145 7.408 -14.938 7.133 1.00 1.31 C ATOM 322 OE1 GLU A 145 6.734 -14.164 7.840 1.00 1.71 O ATOM 323 OE2 GLU A 145 8.504 -15.408 7.491 1.00 1.74 O ATOM 0 H GLU A 145 7.910 -16.216 3.416 1.00 0.58 H new ATOM 0 HA GLU A 145 5.506 -14.521 3.373 1.00 0.54 H new ATOM 0 HB2 GLU A 145 8.164 -13.977 4.694 1.00 0.61 H new ATOM 0 HB3 GLU A 145 6.596 -13.297 5.086 1.00 0.61 H new ATOM 0 HG2 GLU A 145 5.811 -15.516 5.844 1.00 0.76 H new ATOM 0 HG3 GLU A 145 7.362 -16.217 5.427 1.00 0.76 H new ATOM 330 N ASP A 146 8.356 -13.887 1.878 1.00 0.54 N ATOM 331 CA ASP A 146 8.886 -13.213 0.703 1.00 0.54 C ATOM 332 C ASP A 146 7.913 -13.473 -0.427 1.00 0.48 C ATOM 333 O ASP A 146 7.560 -12.593 -1.202 1.00 0.51 O ATOM 334 CB ASP A 146 10.265 -13.773 0.350 1.00 0.57 C ATOM 335 CG ASP A 146 10.979 -13.011 -0.752 1.00 0.87 C ATOM 336 OD1 ASP A 146 10.529 -13.077 -1.919 1.00 1.38 O ATOM 337 OD2 ASP A 146 11.966 -12.311 -0.457 1.00 1.30 O ATOM 0 H ASP A 146 8.984 -14.575 2.293 1.00 0.54 H new ATOM 0 HA ASP A 146 8.999 -12.144 0.884 1.00 0.54 H new ATOM 0 HB2 ASP A 146 10.888 -13.766 1.244 1.00 0.57 H new ATOM 0 HB3 ASP A 146 10.156 -14.814 0.046 1.00 0.57 H new ATOM 342 N ARG A 147 7.469 -14.718 -0.459 1.00 0.44 N ATOM 343 CA ARG A 147 6.422 -15.177 -1.344 1.00 0.45 C ATOM 344 C ARG A 147 5.115 -14.446 -1.106 1.00 0.38 C ATOM 345 O ARG A 147 4.589 -13.809 -2.002 1.00 0.35 O ATOM 346 CB ARG A 147 6.187 -16.650 -1.086 1.00 0.59 C ATOM 347 CG ARG A 147 5.034 -17.235 -1.852 1.00 0.80 C ATOM 348 CD ARG A 147 5.383 -17.319 -3.300 1.00 0.67 C ATOM 349 NE ARG A 147 6.563 -18.159 -3.518 1.00 1.38 N ATOM 350 CZ ARG A 147 6.594 -19.258 -4.274 1.00 1.78 C ATOM 351 NH1 ARG A 147 5.515 -19.652 -4.939 1.00 1.90 N ATOM 352 NH2 ARG A 147 7.720 -19.957 -4.372 1.00 2.55 N ATOM 0 H ARG A 147 7.838 -15.452 0.146 1.00 0.44 H new ATOM 0 HA ARG A 147 6.742 -14.988 -2.369 1.00 0.45 H new ATOM 0 HB2 ARG A 147 7.093 -17.200 -1.339 1.00 0.59 H new ATOM 0 HB3 ARG A 147 6.012 -16.797 -0.020 1.00 0.59 H new ATOM 0 HG2 ARG A 147 4.795 -18.227 -1.468 1.00 0.80 H new ATOM 0 HG3 ARG A 147 4.145 -16.618 -1.717 1.00 0.80 H new ATOM 0 HD2 ARG A 147 4.538 -17.725 -3.856 1.00 0.67 H new ATOM 0 HD3 ARG A 147 5.570 -16.318 -3.689 1.00 0.67 H new ATOM 0 HE ARG A 147 7.429 -17.882 -3.056 1.00 1.38 H new ATOM 0 HH11 ARG A 147 4.651 -19.113 -4.875 1.00 1.90 H new ATOM 0 HH12 ARG A 147 5.549 -20.494 -5.514 1.00 1.90 H new ATOM 0 HH21 ARG A 147 8.555 -19.653 -3.871 1.00 2.55 H new ATOM 0 HH22 ARG A 147 7.750 -20.798 -4.948 1.00 2.55 H new ATOM 366 N TYR A 148 4.571 -14.566 0.094 1.00 0.39 N ATOM 367 CA TYR A 148 3.255 -14.039 0.347 1.00 0.38 C ATOM 368 C TYR A 148 3.235 -12.525 0.177 1.00 0.32 C ATOM 369 O TYR A 148 2.263 -11.981 -0.316 1.00 0.44 O ATOM 370 CB TYR A 148 2.637 -14.570 1.668 1.00 0.53 C ATOM 371 CG TYR A 148 3.220 -14.170 3.010 1.00 0.90 C ATOM 372 CD1 TYR A 148 3.679 -12.870 3.202 1.00 1.93 C ATOM 373 CD2 TYR A 148 3.406 -15.073 4.034 1.00 1.13 C ATOM 374 CE1 TYR A 148 4.282 -12.492 4.383 1.00 2.86 C ATOM 375 CE2 TYR A 148 4.021 -14.705 5.210 1.00 1.93 C ATOM 376 CZ TYR A 148 4.115 -13.455 5.541 1.00 2.73 C ATOM 377 OH TYR A 148 5.076 -13.072 6.558 1.00 3.74 O ATOM 0 H TYR A 148 5.018 -15.018 0.892 1.00 0.39 H new ATOM 0 HA TYR A 148 2.577 -14.424 -0.414 1.00 0.38 H new ATOM 0 HB2 TYR A 148 1.588 -14.275 1.673 1.00 0.53 H new ATOM 0 HB3 TYR A 148 2.661 -15.659 1.619 1.00 0.53 H new ATOM 0 HD1 TYR A 148 3.561 -12.144 2.411 1.00 1.93 H new ATOM 0 HD2 TYR A 148 3.063 -16.090 3.912 1.00 1.13 H new ATOM 0 HE1 TYR A 148 4.837 -11.570 4.477 1.00 2.86 H new ATOM 0 HE2 TYR A 148 4.428 -15.464 5.862 1.00 1.93 H new ATOM 0 HH TYR A 148 5.265 -13.841 7.136 1.00 3.74 H new ATOM 387 N TYR A 149 4.311 -11.856 0.560 1.00 0.27 N ATOM 388 CA TYR A 149 4.598 -10.515 0.077 1.00 0.25 C ATOM 389 C TYR A 149 4.647 -10.412 -1.467 1.00 0.25 C ATOM 390 O TYR A 149 4.043 -9.512 -2.042 1.00 0.29 O ATOM 391 CB TYR A 149 5.917 -10.041 0.678 1.00 0.35 C ATOM 392 CG TYR A 149 6.665 -9.066 -0.187 1.00 0.31 C ATOM 393 CD1 TYR A 149 6.170 -7.790 -0.408 1.00 0.85 C ATOM 394 CD2 TYR A 149 7.863 -9.418 -0.776 1.00 1.17 C ATOM 395 CE1 TYR A 149 6.853 -6.890 -1.193 1.00 0.80 C ATOM 396 CE2 TYR A 149 8.550 -8.524 -1.562 1.00 1.32 C ATOM 397 CZ TYR A 149 8.041 -7.280 -1.790 1.00 0.63 C ATOM 398 OH TYR A 149 8.733 -6.372 -2.554 1.00 0.81 O ATOM 0 H TYR A 149 5.006 -12.224 1.210 1.00 0.27 H new ATOM 0 HA TYR A 149 3.776 -9.874 0.396 1.00 0.25 H new ATOM 0 HB2 TYR A 149 5.719 -9.577 1.644 1.00 0.35 H new ATOM 0 HB3 TYR A 149 6.552 -10.907 0.865 1.00 0.35 H new ATOM 0 HD1 TYR A 149 5.233 -7.498 0.043 1.00 0.85 H new ATOM 0 HD2 TYR A 149 8.265 -10.408 -0.617 1.00 1.17 H new ATOM 0 HE1 TYR A 149 6.468 -5.892 -1.342 1.00 0.80 H new ATOM 0 HE2 TYR A 149 9.495 -8.808 -2.000 1.00 1.32 H new ATOM 0 HH TYR A 149 9.095 -6.820 -3.347 1.00 0.81 H new ATOM 408 N ARG A 150 5.366 -11.303 -2.135 1.00 0.27 N ATOM 409 CA ARG A 150 5.578 -11.181 -3.588 1.00 0.30 C ATOM 410 C ARG A 150 4.276 -11.370 -4.371 1.00 0.33 C ATOM 411 O ARG A 150 4.131 -10.897 -5.491 1.00 0.40 O ATOM 412 CB ARG A 150 6.629 -12.172 -4.096 1.00 0.32 C ATOM 413 CG ARG A 150 6.076 -13.543 -4.426 1.00 0.78 C ATOM 414 CD ARG A 150 6.983 -14.279 -5.388 1.00 0.83 C ATOM 415 NE ARG A 150 7.002 -13.628 -6.698 1.00 0.94 N ATOM 416 CZ ARG A 150 8.072 -13.564 -7.486 1.00 1.23 C ATOM 417 NH1 ARG A 150 9.235 -14.045 -7.070 1.00 1.61 N ATOM 418 NH2 ARG A 150 7.981 -13.010 -8.687 1.00 1.36 N ATOM 0 H ARG A 150 5.813 -12.114 -1.708 1.00 0.27 H new ATOM 0 HA ARG A 150 5.943 -10.168 -3.758 1.00 0.30 H new ATOM 0 HB2 ARG A 150 7.102 -11.759 -4.987 1.00 0.32 H new ATOM 0 HB3 ARG A 150 7.408 -12.278 -3.341 1.00 0.32 H new ATOM 0 HG2 ARG A 150 5.964 -14.124 -3.510 1.00 0.78 H new ATOM 0 HG3 ARG A 150 5.082 -13.442 -4.863 1.00 0.78 H new ATOM 0 HD2 ARG A 150 7.994 -14.316 -4.983 1.00 0.83 H new ATOM 0 HD3 ARG A 150 6.644 -15.309 -5.496 1.00 0.83 H new ATOM 0 HE ARG A 150 6.139 -13.195 -7.028 1.00 0.94 H new ATOM 0 HH11 ARG A 150 9.311 -14.465 -6.144 1.00 1.61 H new ATOM 0 HH12 ARG A 150 10.054 -13.995 -7.676 1.00 1.61 H new ATOM 0 HH21 ARG A 150 7.090 -12.632 -9.008 1.00 1.36 H new ATOM 0 HH22 ARG A 150 8.802 -12.962 -9.290 1.00 1.36 H new ATOM 432 N GLU A 151 3.342 -12.055 -3.763 1.00 0.36 N ATOM 433 CA GLU A 151 2.067 -12.341 -4.380 1.00 0.45 C ATOM 434 C GLU A 151 1.079 -11.339 -3.839 1.00 0.49 C ATOM 435 O GLU A 151 0.034 -11.075 -4.423 1.00 0.59 O ATOM 436 CB GLU A 151 1.630 -13.769 -4.087 1.00 0.57 C ATOM 437 CG GLU A 151 1.678 -14.107 -2.622 1.00 0.82 C ATOM 438 CD GLU A 151 0.722 -15.215 -2.243 1.00 1.60 C ATOM 439 OE1 GLU A 151 -0.458 -15.139 -2.632 1.00 2.11 O ATOM 440 OE2 GLU A 151 1.147 -16.163 -1.551 1.00 2.16 O ATOM 0 H GLU A 151 3.442 -12.433 -2.821 1.00 0.36 H new ATOM 0 HA GLU A 151 2.134 -12.257 -5.465 1.00 0.45 H new ATOM 0 HB2 GLU A 151 0.615 -13.916 -4.455 1.00 0.57 H new ATOM 0 HB3 GLU A 151 2.271 -14.459 -4.635 1.00 0.57 H new ATOM 0 HG2 GLU A 151 2.693 -14.402 -2.355 1.00 0.82 H new ATOM 0 HG3 GLU A 151 1.442 -13.216 -2.041 1.00 0.82 H new ATOM 447 N ASN A 152 1.461 -10.771 -2.696 1.00 0.45 N ATOM 448 CA ASN A 152 0.770 -9.643 -2.094 1.00 0.50 C ATOM 449 C ASN A 152 0.912 -8.433 -2.983 1.00 0.55 C ATOM 450 O ASN A 152 0.420 -7.363 -2.705 1.00 0.88 O ATOM 451 CB ASN A 152 1.292 -9.392 -0.666 1.00 0.46 C ATOM 452 CG ASN A 152 1.734 -7.969 -0.363 1.00 0.51 C ATOM 453 OD1 ASN A 152 0.925 -7.107 -0.085 1.00 0.85 O ATOM 454 ND2 ASN A 152 3.028 -7.722 -0.393 1.00 0.67 N ATOM 0 H ASN A 152 2.269 -11.088 -2.160 1.00 0.45 H new ATOM 0 HA ASN A 152 -0.293 -9.864 -2.004 1.00 0.50 H new ATOM 0 HB2 ASN A 152 0.509 -9.667 0.040 1.00 0.46 H new ATOM 0 HB3 ASN A 152 2.134 -10.060 -0.485 1.00 0.46 H new ATOM 0 HD21 ASN A 152 3.374 -6.786 -0.179 1.00 0.67 H new ATOM 0 HD22 ASN A 152 3.684 -8.466 -0.630 1.00 0.67 H new ATOM 461 N MET A 153 1.639 -8.595 -4.044 1.00 0.43 N ATOM 462 CA MET A 153 1.731 -7.556 -5.019 1.00 0.46 C ATOM 463 C MET A 153 0.794 -7.819 -6.203 1.00 0.51 C ATOM 464 O MET A 153 0.662 -6.992 -7.105 1.00 0.63 O ATOM 465 CB MET A 153 3.182 -7.417 -5.389 1.00 0.42 C ATOM 466 CG MET A 153 3.566 -7.751 -6.815 1.00 0.92 C ATOM 467 SD MET A 153 5.354 -7.831 -6.944 1.00 1.27 S ATOM 468 CE MET A 153 5.684 -8.382 -5.269 1.00 1.39 C ATOM 0 H MET A 153 2.176 -9.436 -4.256 1.00 0.43 H new ATOM 0 HA MET A 153 1.389 -6.601 -4.621 1.00 0.46 H new ATOM 0 HB2 MET A 153 3.485 -6.389 -5.189 1.00 0.42 H new ATOM 0 HB3 MET A 153 3.763 -8.056 -4.724 1.00 0.42 H new ATOM 0 HG2 MET A 153 3.126 -8.704 -7.109 1.00 0.92 H new ATOM 0 HG3 MET A 153 3.174 -6.995 -7.496 1.00 0.92 H new ATOM 0 HE1 MET A 153 6.707 -8.752 -5.202 1.00 1.39 H new ATOM 0 HE2 MET A 153 5.554 -7.548 -4.579 1.00 1.39 H new ATOM 0 HE3 MET A 153 4.992 -9.182 -5.006 1.00 1.39 H new ATOM 478 N TYR A 154 0.137 -8.977 -6.174 1.00 0.49 N ATOM 479 CA TYR A 154 -0.875 -9.326 -7.167 1.00 0.55 C ATOM 480 C TYR A 154 -2.256 -9.383 -6.511 1.00 0.47 C ATOM 481 O TYR A 154 -3.237 -8.857 -7.040 1.00 0.59 O ATOM 482 CB TYR A 154 -0.558 -10.679 -7.813 1.00 0.66 C ATOM 483 CG TYR A 154 0.734 -10.700 -8.597 1.00 1.18 C ATOM 484 CD1 TYR A 154 1.954 -10.879 -7.957 1.00 2.12 C ATOM 485 CD2 TYR A 154 0.735 -10.535 -9.976 1.00 1.57 C ATOM 486 CE1 TYR A 154 3.138 -10.890 -8.668 1.00 3.05 C ATOM 487 CE2 TYR A 154 1.914 -10.549 -10.693 1.00 2.39 C ATOM 488 CZ TYR A 154 3.106 -10.751 -10.044 1.00 3.08 C ATOM 489 OH TYR A 154 4.288 -10.734 -10.749 1.00 4.05 O ATOM 0 H TYR A 154 0.290 -9.695 -5.466 1.00 0.49 H new ATOM 0 HA TYR A 154 -0.872 -8.559 -7.941 1.00 0.55 H new ATOM 0 HB2 TYR A 154 -0.510 -11.439 -7.034 1.00 0.66 H new ATOM 0 HB3 TYR A 154 -1.378 -10.954 -8.477 1.00 0.66 H new ATOM 0 HD1 TYR A 154 1.977 -11.012 -6.885 1.00 2.12 H new ATOM 0 HD2 TYR A 154 -0.201 -10.394 -10.495 1.00 1.57 H new ATOM 0 HE1 TYR A 154 4.081 -11.006 -8.154 1.00 3.05 H new ATOM 0 HE2 TYR A 154 1.899 -10.401 -11.763 1.00 2.39 H new ATOM 0 HH TYR A 154 4.097 -10.631 -11.705 1.00 4.05 H new ATOM 499 N ARG A 155 -2.322 -10.042 -5.357 1.00 0.37 N ATOM 500 CA ARG A 155 -3.551 -10.130 -4.579 1.00 0.36 C ATOM 501 C ARG A 155 -3.766 -8.820 -3.863 1.00 0.31 C ATOM 502 O ARG A 155 -4.856 -8.256 -3.857 1.00 0.41 O ATOM 503 CB ARG A 155 -3.450 -11.275 -3.576 1.00 0.43 C ATOM 504 CG ARG A 155 -2.371 -11.079 -2.530 1.00 0.63 C ATOM 505 CD ARG A 155 -1.751 -12.409 -2.155 1.00 0.58 C ATOM 506 NE ARG A 155 -0.790 -12.301 -1.073 1.00 0.78 N ATOM 507 CZ ARG A 155 -0.937 -12.919 0.096 1.00 1.20 C ATOM 508 NH1 ARG A 155 -2.018 -13.649 0.343 1.00 1.05 N ATOM 509 NH2 ARG A 155 -0.002 -12.817 1.015 1.00 1.89 N ATOM 0 H ARG A 155 -1.529 -10.527 -4.938 1.00 0.37 H new ATOM 0 HA ARG A 155 -4.396 -10.327 -5.238 1.00 0.36 H new ATOM 0 HB2 ARG A 155 -4.411 -11.393 -3.075 1.00 0.43 H new ATOM 0 HB3 ARG A 155 -3.256 -12.202 -4.115 1.00 0.43 H new ATOM 0 HG2 ARG A 155 -1.602 -10.407 -2.913 1.00 0.63 H new ATOM 0 HG3 ARG A 155 -2.796 -10.606 -1.645 1.00 0.63 H new ATOM 0 HD2 ARG A 155 -2.540 -13.103 -1.865 1.00 0.58 H new ATOM 0 HD3 ARG A 155 -1.259 -12.834 -3.030 1.00 0.58 H new ATOM 0 HE ARG A 155 0.038 -11.723 -1.216 1.00 0.78 H new ATOM 0 HH11 ARG A 155 -2.745 -13.740 -0.367 1.00 1.05 H new ATOM 0 HH12 ARG A 155 -2.121 -14.119 1.242 1.00 1.05 H new ATOM 0 HH21 ARG A 155 0.835 -12.264 0.831 1.00 1.89 H new ATOM 0 HH22 ARG A 155 -0.114 -13.291 1.911 1.00 1.89 H new ATOM 523 N TYR A 156 -2.696 -8.328 -3.289 1.00 0.27 N ATOM 524 CA TYR A 156 -2.682 -7.017 -2.726 1.00 0.28 C ATOM 525 C TYR A 156 -1.977 -6.202 -3.743 1.00 0.39 C ATOM 526 O TYR A 156 -1.327 -6.771 -4.611 1.00 0.78 O ATOM 527 CB TYR A 156 -1.952 -7.014 -1.404 1.00 0.35 C ATOM 528 CG TYR A 156 -2.510 -8.020 -0.446 1.00 0.95 C ATOM 529 CD1 TYR A 156 -3.863 -8.063 -0.166 1.00 1.51 C ATOM 530 CD2 TYR A 156 -1.683 -8.932 0.174 1.00 1.36 C ATOM 531 CE1 TYR A 156 -4.370 -8.994 0.709 1.00 2.14 C ATOM 532 CE2 TYR A 156 -2.179 -9.862 1.043 1.00 1.99 C ATOM 533 CZ TYR A 156 -3.520 -9.886 1.310 1.00 2.31 C ATOM 534 OH TYR A 156 -4.011 -10.806 2.176 1.00 2.98 O ATOM 0 H TYR A 156 -1.814 -8.832 -3.203 1.00 0.27 H new ATOM 0 HA TYR A 156 -3.679 -6.632 -2.510 1.00 0.28 H new ATOM 0 HB2 TYR A 156 -0.896 -7.224 -1.574 1.00 0.35 H new ATOM 0 HB3 TYR A 156 -2.012 -6.020 -0.960 1.00 0.35 H new ATOM 0 HD1 TYR A 156 -4.529 -7.357 -0.640 1.00 1.51 H new ATOM 0 HD2 TYR A 156 -0.623 -8.911 -0.031 1.00 1.36 H new ATOM 0 HE1 TYR A 156 -5.429 -9.023 0.921 1.00 2.14 H new ATOM 0 HE2 TYR A 156 -1.517 -10.573 1.516 1.00 1.99 H new ATOM 0 HH TYR A 156 -3.885 -10.490 3.095 1.00 2.98 H new ATOM 544 N PRO A 157 -2.093 -4.910 -3.752 1.00 0.28 N ATOM 545 CA PRO A 157 -1.512 -4.198 -4.837 1.00 0.29 C ATOM 546 C PRO A 157 -0.154 -3.597 -4.526 1.00 0.34 C ATOM 547 O PRO A 157 0.413 -3.773 -3.443 1.00 0.66 O ATOM 548 CB PRO A 157 -2.533 -3.096 -5.034 1.00 0.31 C ATOM 549 CG PRO A 157 -2.871 -2.724 -3.624 1.00 0.32 C ATOM 550 CD PRO A 157 -2.844 -4.028 -2.836 1.00 0.33 C ATOM 0 HA PRO A 157 -1.319 -4.838 -5.698 1.00 0.29 H new ATOM 0 HB2 PRO A 157 -2.121 -2.254 -5.590 1.00 0.31 H new ATOM 0 HB3 PRO A 157 -3.407 -3.444 -5.584 1.00 0.31 H new ATOM 0 HG2 PRO A 157 -2.151 -2.010 -3.224 1.00 0.32 H new ATOM 0 HG3 PRO A 157 -3.852 -2.253 -3.568 1.00 0.32 H new ATOM 0 HD2 PRO A 157 -2.345 -3.915 -1.874 1.00 0.33 H new ATOM 0 HD3 PRO A 157 -3.846 -4.405 -2.633 1.00 0.33 H new ATOM 558 N ASN A 158 0.350 -2.881 -5.499 1.00 0.32 N ATOM 559 CA ASN A 158 1.513 -2.052 -5.334 1.00 0.31 C ATOM 560 C ASN A 158 1.123 -0.617 -5.610 1.00 0.33 C ATOM 561 O ASN A 158 1.695 0.053 -6.458 1.00 0.42 O ATOM 562 CB ASN A 158 2.658 -2.518 -6.235 1.00 0.40 C ATOM 563 CG ASN A 158 2.195 -3.104 -7.564 1.00 0.74 C ATOM 564 OD1 ASN A 158 1.192 -2.677 -8.137 1.00 1.47 O ATOM 565 ND2 ASN A 158 2.924 -4.092 -8.063 1.00 1.42 N ATOM 0 H ASN A 158 -0.043 -2.858 -6.440 1.00 0.32 H new ATOM 0 HA ASN A 158 1.880 -2.130 -4.311 1.00 0.31 H new ATOM 0 HB2 ASN A 158 3.320 -1.675 -6.431 1.00 0.40 H new ATOM 0 HB3 ASN A 158 3.245 -3.267 -5.703 1.00 0.40 H new ATOM 0 HD21 ASN A 158 2.660 -4.524 -8.949 1.00 1.42 H new ATOM 0 HD22 ASN A 158 3.749 -4.421 -7.561 1.00 1.42 H new ATOM 572 N GLN A 159 0.102 -0.176 -4.894 1.00 0.30 N ATOM 573 CA GLN A 159 -0.419 1.169 -5.026 1.00 0.31 C ATOM 574 C GLN A 159 -1.344 1.469 -3.861 1.00 0.28 C ATOM 575 O GLN A 159 -1.746 0.554 -3.144 1.00 0.29 O ATOM 576 CB GLN A 159 -1.171 1.314 -6.342 1.00 0.38 C ATOM 577 CG GLN A 159 -2.330 0.341 -6.481 1.00 0.44 C ATOM 578 CD GLN A 159 -2.291 -0.436 -7.781 1.00 0.92 C ATOM 579 OE1 GLN A 159 -1.715 -1.521 -7.851 1.00 1.63 O ATOM 580 NE2 GLN A 159 -2.895 0.113 -8.823 1.00 1.50 N ATOM 0 H GLN A 159 -0.388 -0.745 -4.204 1.00 0.30 H new ATOM 0 HA GLN A 159 0.410 1.877 -5.020 1.00 0.31 H new ATOM 0 HB2 GLN A 159 -1.549 2.333 -6.427 1.00 0.38 H new ATOM 0 HB3 GLN A 159 -0.477 1.162 -7.168 1.00 0.38 H new ATOM 0 HG2 GLN A 159 -2.314 -0.358 -5.645 1.00 0.44 H new ATOM 0 HG3 GLN A 159 -3.269 0.891 -6.419 1.00 0.44 H new ATOM 0 HE21 GLN A 159 -3.362 1.014 -8.725 1.00 1.50 H new ATOM 0 HE22 GLN A 159 -2.893 -0.365 -9.724 1.00 1.50 H new ATOM 589 N VAL A 160 -1.679 2.736 -3.669 1.00 0.30 N ATOM 590 CA VAL A 160 -2.600 3.120 -2.623 1.00 0.28 C ATOM 591 C VAL A 160 -3.557 4.183 -3.113 1.00 0.31 C ATOM 592 O VAL A 160 -3.358 4.767 -4.172 1.00 0.53 O ATOM 593 CB VAL A 160 -1.892 3.602 -1.350 1.00 0.28 C ATOM 594 CG1 VAL A 160 -1.474 2.417 -0.492 1.00 0.30 C ATOM 595 CG2 VAL A 160 -0.688 4.461 -1.696 1.00 0.29 C ATOM 0 H VAL A 160 -1.324 3.512 -4.227 1.00 0.30 H new ATOM 0 HA VAL A 160 -3.157 2.220 -2.362 1.00 0.28 H new ATOM 0 HB VAL A 160 -2.592 4.212 -0.779 1.00 0.28 H new ATOM 0 HG11 VAL A 160 -0.973 2.777 0.407 1.00 0.30 H new ATOM 0 HG12 VAL A 160 -2.356 1.843 -0.210 1.00 0.30 H new ATOM 0 HG13 VAL A 160 -0.792 1.781 -1.057 1.00 0.30 H new ATOM 0 HG21 VAL A 160 -0.201 4.792 -0.778 1.00 0.29 H new ATOM 0 HG22 VAL A 160 0.016 3.878 -2.290 1.00 0.29 H new ATOM 0 HG23 VAL A 160 -1.013 5.330 -2.268 1.00 0.29 H new ATOM 605 N TYR A 161 -4.607 4.409 -2.359 1.00 0.32 N ATOM 606 CA TYR A 161 -5.652 5.321 -2.772 1.00 0.36 C ATOM 607 C TYR A 161 -5.717 6.534 -1.876 1.00 0.34 C ATOM 608 O TYR A 161 -6.121 6.437 -0.721 1.00 0.42 O ATOM 609 CB TYR A 161 -6.986 4.607 -2.726 1.00 0.49 C ATOM 610 CG TYR A 161 -7.168 3.565 -3.800 1.00 0.44 C ATOM 611 CD1 TYR A 161 -7.412 3.922 -5.121 1.00 0.65 C ATOM 612 CD2 TYR A 161 -7.092 2.214 -3.487 1.00 0.38 C ATOM 613 CE1 TYR A 161 -7.574 2.957 -6.096 1.00 0.74 C ATOM 614 CE2 TYR A 161 -7.252 1.247 -4.454 1.00 0.49 C ATOM 615 CZ TYR A 161 -7.492 1.623 -5.758 1.00 0.63 C ATOM 616 OH TYR A 161 -7.661 0.662 -6.725 1.00 0.82 O ATOM 0 H TYR A 161 -4.762 3.972 -1.451 1.00 0.32 H new ATOM 0 HA TYR A 161 -5.427 5.653 -3.785 1.00 0.36 H new ATOM 0 HB2 TYR A 161 -7.097 4.131 -1.752 1.00 0.49 H new ATOM 0 HB3 TYR A 161 -7.783 5.345 -2.813 1.00 0.49 H new ATOM 0 HD1 TYR A 161 -7.476 4.966 -5.388 1.00 0.65 H new ATOM 0 HD2 TYR A 161 -6.904 1.916 -2.466 1.00 0.38 H new ATOM 0 HE1 TYR A 161 -7.764 3.246 -7.119 1.00 0.74 H new ATOM 0 HE2 TYR A 161 -7.190 0.201 -4.192 1.00 0.49 H new ATOM 0 HH TYR A 161 -7.572 -0.227 -6.322 1.00 0.82 H new ATOM 626 N TYR A 162 -5.310 7.670 -2.408 1.00 0.31 N ATOM 627 CA TYR A 162 -5.467 8.923 -1.708 1.00 0.27 C ATOM 628 C TYR A 162 -5.244 10.081 -2.645 1.00 0.31 C ATOM 629 O TYR A 162 -4.793 9.903 -3.741 1.00 0.55 O ATOM 630 CB TYR A 162 -4.555 9.021 -0.489 1.00 0.39 C ATOM 631 CG TYR A 162 -3.073 9.005 -0.776 1.00 0.46 C ATOM 632 CD1 TYR A 162 -2.397 7.819 -1.005 1.00 0.77 C ATOM 633 CD2 TYR A 162 -2.341 10.180 -0.757 1.00 0.89 C ATOM 634 CE1 TYR A 162 -1.035 7.813 -1.209 1.00 1.16 C ATOM 635 CE2 TYR A 162 -0.983 10.178 -0.944 1.00 1.29 C ATOM 636 CZ TYR A 162 -0.338 8.995 -1.170 1.00 1.35 C ATOM 637 OH TYR A 162 1.010 8.992 -1.328 1.00 1.82 O ATOM 0 H TYR A 162 -4.868 7.748 -3.324 1.00 0.31 H new ATOM 0 HA TYR A 162 -6.492 8.965 -1.339 1.00 0.27 H new ATOM 0 HB2 TYR A 162 -4.793 9.940 0.046 1.00 0.39 H new ATOM 0 HB3 TYR A 162 -4.785 8.193 0.181 1.00 0.39 H new ATOM 0 HD1 TYR A 162 -2.944 6.888 -1.024 1.00 0.77 H new ATOM 0 HD2 TYR A 162 -2.851 11.118 -0.591 1.00 0.89 H new ATOM 0 HE1 TYR A 162 -0.518 6.884 -1.399 1.00 1.16 H new ATOM 0 HE2 TYR A 162 -0.428 11.104 -0.913 1.00 1.29 H new ATOM 0 HH TYR A 162 1.431 8.600 -0.535 1.00 1.82 H new ATOM 647 N ARG A 163 -5.566 11.255 -2.193 1.00 0.26 N ATOM 648 CA ARG A 163 -5.436 12.465 -2.988 1.00 0.32 C ATOM 649 C ARG A 163 -4.136 13.141 -2.587 1.00 0.36 C ATOM 650 O ARG A 163 -3.502 12.693 -1.638 1.00 0.41 O ATOM 651 CB ARG A 163 -6.634 13.388 -2.762 1.00 0.41 C ATOM 652 CG ARG A 163 -6.771 13.874 -1.333 1.00 0.75 C ATOM 653 CD ARG A 163 -7.877 14.906 -1.219 1.00 1.28 C ATOM 654 NE ARG A 163 -8.243 15.179 0.170 1.00 1.93 N ATOM 655 CZ ARG A 163 -9.354 15.821 0.531 1.00 2.58 C ATOM 656 NH1 ARG A 163 -10.170 16.313 -0.393 1.00 2.91 N ATOM 657 NH2 ARG A 163 -9.638 15.994 1.813 1.00 3.26 N ATOM 0 H ARG A 163 -5.931 11.415 -1.254 1.00 0.26 H new ATOM 0 HA ARG A 163 -5.417 12.225 -4.051 1.00 0.32 H new ATOM 0 HB2 ARG A 163 -6.546 14.251 -3.422 1.00 0.41 H new ATOM 0 HB3 ARG A 163 -7.545 12.861 -3.046 1.00 0.41 H new ATOM 0 HG2 ARG A 163 -6.985 13.031 -0.676 1.00 0.75 H new ATOM 0 HG3 ARG A 163 -5.828 14.307 -0.999 1.00 0.75 H new ATOM 0 HD2 ARG A 163 -7.557 15.832 -1.696 1.00 1.28 H new ATOM 0 HD3 ARG A 163 -8.755 14.555 -1.761 1.00 1.28 H new ATOM 0 HE ARG A 163 -7.612 14.860 0.905 1.00 1.93 H new ATOM 0 HH11 ARG A 163 -9.948 16.200 -1.382 1.00 2.91 H new ATOM 0 HH12 ARG A 163 -11.020 16.804 -0.114 1.00 2.91 H new ATOM 0 HH21 ARG A 163 -9.006 15.635 2.528 1.00 3.26 H new ATOM 0 HH22 ARG A 163 -10.489 16.486 2.085 1.00 3.26 H new ATOM 671 N PRO A 164 -3.696 14.220 -3.250 1.00 0.45 N ATOM 672 CA PRO A 164 -2.331 14.685 -3.074 1.00 0.51 C ATOM 673 C PRO A 164 -2.203 15.554 -1.854 1.00 0.51 C ATOM 674 O PRO A 164 -2.935 16.525 -1.647 1.00 0.57 O ATOM 675 CB PRO A 164 -2.077 15.544 -4.312 1.00 0.65 C ATOM 676 CG PRO A 164 -3.248 15.307 -5.210 1.00 0.80 C ATOM 677 CD PRO A 164 -4.388 14.980 -4.291 1.00 0.53 C ATOM 0 HA PRO A 164 -1.635 13.855 -2.953 1.00 0.51 H new ATOM 0 HB2 PRO A 164 -1.992 16.598 -4.048 1.00 0.65 H new ATOM 0 HB3 PRO A 164 -1.144 15.262 -4.801 1.00 0.65 H new ATOM 0 HG2 PRO A 164 -3.468 16.189 -5.812 1.00 0.80 H new ATOM 0 HG3 PRO A 164 -3.054 14.489 -5.903 1.00 0.80 H new ATOM 0 HD2 PRO A 164 -4.870 15.875 -3.897 1.00 0.53 H new ATOM 0 HD3 PRO A 164 -5.161 14.393 -4.786 1.00 0.53 H new ATOM 685 N VAL A 165 -1.259 15.145 -1.039 1.00 0.52 N ATOM 686 CA VAL A 165 -1.194 15.564 0.328 1.00 0.50 C ATOM 687 C VAL A 165 0.168 16.093 0.679 1.00 0.49 C ATOM 688 O VAL A 165 1.188 15.620 0.176 1.00 0.47 O ATOM 689 CB VAL A 165 -1.550 14.393 1.244 1.00 0.50 C ATOM 690 CG1 VAL A 165 -3.028 14.102 1.138 1.00 1.31 C ATOM 691 CG2 VAL A 165 -0.725 13.170 0.884 1.00 1.15 C ATOM 0 H VAL A 165 -0.512 14.507 -1.315 1.00 0.52 H new ATOM 0 HA VAL A 165 -1.912 16.372 0.468 1.00 0.50 H new ATOM 0 HB VAL A 165 -1.319 14.657 2.276 1.00 0.50 H new ATOM 0 HG11 VAL A 165 -3.282 13.267 1.791 1.00 1.31 H new ATOM 0 HG12 VAL A 165 -3.595 14.983 1.438 1.00 1.31 H new ATOM 0 HG13 VAL A 165 -3.275 13.845 0.108 1.00 1.31 H new ATOM 0 HG21 VAL A 165 -0.990 12.345 1.545 1.00 1.15 H new ATOM 0 HG22 VAL A 165 -0.926 12.886 -0.149 1.00 1.15 H new ATOM 0 HG23 VAL A 165 0.335 13.400 0.997 1.00 1.15 H new ATOM 701 N ASP A 166 0.152 17.057 1.568 1.00 0.62 N ATOM 702 CA ASP A 166 1.329 17.810 1.935 1.00 0.67 C ATOM 703 C ASP A 166 0.907 18.903 2.905 1.00 0.90 C ATOM 704 O ASP A 166 1.660 19.307 3.791 1.00 1.48 O ATOM 705 CB ASP A 166 1.986 18.387 0.671 1.00 0.62 C ATOM 706 CG ASP A 166 2.852 19.601 0.951 1.00 0.70 C ATOM 707 OD1 ASP A 166 4.012 19.431 1.380 1.00 0.90 O ATOM 708 OD2 ASP A 166 2.376 20.737 0.741 1.00 1.07 O ATOM 0 H ASP A 166 -0.691 17.345 2.065 1.00 0.62 H new ATOM 0 HA ASP A 166 2.068 17.174 2.422 1.00 0.67 H new ATOM 0 HB2 ASP A 166 2.595 17.615 0.200 1.00 0.62 H new ATOM 0 HB3 ASP A 166 1.209 18.660 -0.043 1.00 0.62 H new ATOM 713 N GLN A 167 -0.338 19.335 2.745 1.00 0.75 N ATOM 714 CA GLN A 167 -0.950 20.313 3.635 1.00 0.96 C ATOM 715 C GLN A 167 -1.334 19.697 4.984 1.00 0.87 C ATOM 716 O GLN A 167 -1.653 20.417 5.930 1.00 1.10 O ATOM 717 CB GLN A 167 -2.194 20.923 2.978 1.00 1.34 C ATOM 718 CG GLN A 167 -3.259 19.906 2.562 1.00 1.50 C ATOM 719 CD GLN A 167 -2.912 19.157 1.283 1.00 2.16 C ATOM 720 OE1 GLN A 167 -2.172 19.655 0.443 1.00 2.71 O ATOM 721 NE2 GLN A 167 -3.466 17.968 1.118 1.00 2.72 N ATOM 0 H GLN A 167 -0.951 19.017 1.995 1.00 0.75 H new ATOM 0 HA GLN A 167 -0.210 21.092 3.818 1.00 0.96 H new ATOM 0 HB2 GLN A 167 -2.642 21.636 3.671 1.00 1.34 H new ATOM 0 HB3 GLN A 167 -1.884 21.486 2.097 1.00 1.34 H new ATOM 0 HG2 GLN A 167 -3.399 19.187 3.369 1.00 1.50 H new ATOM 0 HG3 GLN A 167 -4.210 20.421 2.426 1.00 1.50 H new ATOM 0 HE21 GLN A 167 -4.077 17.586 1.840 1.00 2.72 H new ATOM 0 HE22 GLN A 167 -3.282 17.433 0.269 1.00 2.72 H new ATOM 730 N TYR A 168 -1.311 18.373 5.071 1.00 0.82 N ATOM 731 CA TYR A 168 -1.669 17.685 6.305 1.00 0.92 C ATOM 732 C TYR A 168 -0.427 17.470 7.163 1.00 0.95 C ATOM 733 O TYR A 168 0.655 17.215 6.639 1.00 1.61 O ATOM 734 CB TYR A 168 -2.324 16.334 6.009 1.00 1.02 C ATOM 735 CG TYR A 168 -3.650 16.415 5.285 1.00 1.24 C ATOM 736 CD1 TYR A 168 -4.710 17.114 5.841 1.00 1.62 C ATOM 737 CD2 TYR A 168 -3.838 15.815 4.044 1.00 2.02 C ATOM 738 CE1 TYR A 168 -5.921 17.217 5.186 1.00 2.11 C ATOM 739 CE2 TYR A 168 -5.051 15.911 3.383 1.00 2.63 C ATOM 740 CZ TYR A 168 -6.088 16.513 3.950 1.00 2.50 C ATOM 741 OH TYR A 168 -7.292 16.727 3.306 1.00 3.21 O ATOM 0 H TYR A 168 -1.049 17.755 4.303 1.00 0.82 H new ATOM 0 HA TYR A 168 -2.383 18.308 6.844 1.00 0.92 H new ATOM 0 HB2 TYR A 168 -1.636 15.736 5.411 1.00 1.02 H new ATOM 0 HB3 TYR A 168 -2.472 15.804 6.950 1.00 1.02 H new ATOM 0 HD1 TYR A 168 -4.586 17.587 6.804 1.00 1.62 H new ATOM 0 HD2 TYR A 168 -3.026 15.266 3.590 1.00 2.02 H new ATOM 0 HE1 TYR A 168 -6.723 17.814 5.596 1.00 2.11 H new ATOM 0 HE2 TYR A 168 -5.154 15.491 2.394 1.00 2.63 H new ATOM 0 HH TYR A 168 -7.175 16.596 2.342 1.00 3.21 H new ATOM 751 N SER A 169 -0.577 17.574 8.473 1.00 1.17 N ATOM 752 CA SER A 169 0.555 17.414 9.373 1.00 1.17 C ATOM 753 C SER A 169 0.669 15.977 9.889 1.00 1.05 C ATOM 754 O SER A 169 1.731 15.557 10.344 1.00 1.12 O ATOM 755 CB SER A 169 0.428 18.389 10.538 1.00 1.40 C ATOM 756 OG SER A 169 0.247 19.716 10.070 1.00 1.94 O ATOM 0 H SER A 169 -1.465 17.767 8.936 1.00 1.17 H new ATOM 0 HA SER A 169 1.465 17.633 8.815 1.00 1.17 H new ATOM 0 HB2 SER A 169 -0.415 18.103 11.167 1.00 1.40 H new ATOM 0 HB3 SER A 169 1.322 18.337 11.160 1.00 1.40 H new ATOM 0 HG SER A 169 0.166 20.324 10.834 1.00 1.94 H new ATOM 762 N ASN A 170 -0.425 15.228 9.823 1.00 0.98 N ATOM 763 CA ASN A 170 -0.411 13.822 10.224 1.00 0.89 C ATOM 764 C ASN A 170 0.089 12.952 9.097 1.00 0.68 C ATOM 765 O ASN A 170 -0.459 12.934 7.994 1.00 0.75 O ATOM 766 CB ASN A 170 -1.799 13.364 10.695 1.00 1.08 C ATOM 767 CG ASN A 170 -2.915 13.746 9.732 1.00 1.74 C ATOM 768 OD1 ASN A 170 -3.304 12.821 8.868 1.00 2.20 O flip ATOM 769 ND2 ASN A 170 -3.439 14.859 9.779 1.00 2.25 N flip ATOM 0 H ASN A 170 -1.330 15.566 9.497 1.00 0.98 H new ATOM 0 HA ASN A 170 0.274 13.720 11.065 1.00 0.89 H new ATOM 0 HB2 ASN A 170 -1.793 12.282 10.823 1.00 1.08 H new ATOM 0 HB3 ASN A 170 -2.006 13.800 11.672 1.00 1.08 H new ATOM 0 HD21 ASN A 170 -3.114 15.548 10.458 1.00 2.25 H new ATOM 0 HD22 ASN A 170 -4.198 15.093 9.139 1.00 2.25 H new ATOM 776 N GLN A 171 1.143 12.228 9.401 1.00 0.63 N ATOM 777 CA GLN A 171 1.880 11.506 8.404 1.00 0.56 C ATOM 778 C GLN A 171 1.452 10.042 8.303 1.00 0.47 C ATOM 779 O GLN A 171 0.862 9.641 7.298 1.00 0.60 O ATOM 780 CB GLN A 171 3.355 11.617 8.742 1.00 0.86 C ATOM 781 CG GLN A 171 4.223 10.737 7.896 1.00 0.71 C ATOM 782 CD GLN A 171 4.099 11.043 6.420 1.00 1.11 C ATOM 783 OE1 GLN A 171 4.943 11.724 5.837 1.00 1.63 O ATOM 784 NE2 GLN A 171 2.994 10.614 5.827 1.00 1.41 N ATOM 0 H GLN A 171 1.508 12.127 10.348 1.00 0.63 H new ATOM 0 HA GLN A 171 1.675 11.944 7.427 1.00 0.56 H new ATOM 0 HB2 GLN A 171 3.672 12.653 8.621 1.00 0.86 H new ATOM 0 HB3 GLN A 171 3.501 11.360 9.791 1.00 0.86 H new ATOM 0 HG2 GLN A 171 5.262 10.856 8.202 1.00 0.71 H new ATOM 0 HG3 GLN A 171 3.957 9.695 8.071 1.00 0.71 H new ATOM 0 HE21 GLN A 171 2.321 10.052 6.348 1.00 1.41 H new ATOM 0 HE22 GLN A 171 2.817 10.846 4.850 1.00 1.41 H new ATOM 793 N ASN A 172 1.727 9.253 9.335 1.00 0.47 N ATOM 794 CA ASN A 172 1.418 7.823 9.298 1.00 0.49 C ATOM 795 C ASN A 172 -0.078 7.651 9.214 1.00 0.42 C ATOM 796 O ASN A 172 -0.589 6.729 8.589 1.00 0.52 O ATOM 797 CB ASN A 172 1.924 7.114 10.554 1.00 0.65 C ATOM 798 CG ASN A 172 3.401 7.316 10.804 1.00 1.19 C ATOM 799 OD1 ASN A 172 4.202 7.436 9.876 1.00 1.88 O ATOM 800 ND2 ASN A 172 3.762 7.378 12.072 1.00 1.56 N ATOM 0 H ASN A 172 2.159 9.572 10.202 1.00 0.47 H new ATOM 0 HA ASN A 172 1.911 7.385 8.430 1.00 0.49 H new ATOM 0 HB2 ASN A 172 1.364 7.476 11.417 1.00 0.65 H new ATOM 0 HB3 ASN A 172 1.721 6.047 10.467 1.00 0.65 H new ATOM 0 HD21 ASN A 172 4.740 7.531 12.317 1.00 1.56 H new ATOM 0 HD22 ASN A 172 3.063 7.273 12.807 1.00 1.56 H new ATOM 807 N SER A 173 -0.749 8.586 9.850 1.00 0.41 N ATOM 808 CA SER A 173 -2.190 8.647 9.911 1.00 0.46 C ATOM 809 C SER A 173 -2.825 8.572 8.536 1.00 0.37 C ATOM 810 O SER A 173 -3.520 7.613 8.215 1.00 0.36 O ATOM 811 CB SER A 173 -2.559 9.965 10.559 1.00 0.60 C ATOM 812 OG SER A 173 -3.731 9.856 11.345 1.00 0.74 O ATOM 0 H SER A 173 -0.292 9.346 10.353 1.00 0.41 H new ATOM 0 HA SER A 173 -2.558 7.794 10.482 1.00 0.46 H new ATOM 0 HB2 SER A 173 -1.733 10.306 11.183 1.00 0.60 H new ATOM 0 HB3 SER A 173 -2.708 10.720 9.787 1.00 0.60 H new ATOM 0 HG SER A 173 -3.937 10.725 11.748 1.00 0.74 H new ATOM 818 N PHE A 174 -2.568 9.588 7.729 1.00 0.33 N ATOM 819 CA PHE A 174 -3.191 9.692 6.426 1.00 0.32 C ATOM 820 C PHE A 174 -2.667 8.607 5.502 1.00 0.24 C ATOM 821 O PHE A 174 -3.392 8.095 4.653 1.00 0.30 O ATOM 822 CB PHE A 174 -2.944 11.076 5.831 1.00 0.40 C ATOM 823 CG PHE A 174 -3.417 11.188 4.419 1.00 0.61 C ATOM 824 CD1 PHE A 174 -4.715 11.573 4.127 1.00 1.12 C ATOM 825 CD2 PHE A 174 -2.563 10.880 3.382 1.00 0.99 C ATOM 826 CE1 PHE A 174 -5.149 11.646 2.819 1.00 1.41 C ATOM 827 CE2 PHE A 174 -2.986 10.953 2.085 1.00 1.29 C ATOM 828 CZ PHE A 174 -4.277 11.335 1.794 1.00 1.33 C ATOM 0 H PHE A 174 -1.931 10.352 7.956 1.00 0.33 H new ATOM 0 HA PHE A 174 -4.266 9.554 6.539 1.00 0.32 H new ATOM 0 HB2 PHE A 174 -3.450 11.825 6.440 1.00 0.40 H new ATOM 0 HB3 PHE A 174 -1.878 11.300 5.872 1.00 0.40 H new ATOM 0 HD1 PHE A 174 -5.394 11.818 4.930 1.00 1.12 H new ATOM 0 HD2 PHE A 174 -1.549 10.578 3.597 1.00 0.99 H new ATOM 0 HE1 PHE A 174 -6.163 11.944 2.598 1.00 1.41 H new ATOM 0 HE2 PHE A 174 -2.304 10.710 1.283 1.00 1.29 H new ATOM 0 HZ PHE A 174 -4.607 11.391 0.767 1.00 1.33 H new ATOM 838 N VAL A 175 -1.410 8.252 5.685 1.00 0.20 N ATOM 839 CA VAL A 175 -0.788 7.246 4.851 1.00 0.20 C ATOM 840 C VAL A 175 -1.386 5.864 5.109 1.00 0.22 C ATOM 841 O VAL A 175 -2.055 5.310 4.252 1.00 0.25 O ATOM 842 CB VAL A 175 0.728 7.230 5.081 1.00 0.28 C ATOM 843 CG1 VAL A 175 1.312 5.883 4.741 1.00 0.33 C ATOM 844 CG2 VAL A 175 1.388 8.312 4.252 1.00 0.41 C ATOM 0 H VAL A 175 -0.802 8.645 6.403 1.00 0.20 H new ATOM 0 HA VAL A 175 -0.983 7.502 3.810 1.00 0.20 H new ATOM 0 HB VAL A 175 0.917 7.423 6.137 1.00 0.28 H new ATOM 0 HG11 VAL A 175 2.388 5.899 4.913 1.00 0.33 H new ATOM 0 HG12 VAL A 175 0.855 5.119 5.370 1.00 0.33 H new ATOM 0 HG13 VAL A 175 1.115 5.655 3.693 1.00 0.33 H new ATOM 0 HG21 VAL A 175 2.465 8.294 4.421 1.00 0.41 H new ATOM 0 HG22 VAL A 175 1.184 8.137 3.196 1.00 0.41 H new ATOM 0 HG23 VAL A 175 0.991 9.285 4.542 1.00 0.41 H new ATOM 854 N HIS A 176 -1.131 5.304 6.279 1.00 0.26 N ATOM 855 CA HIS A 176 -1.875 4.116 6.726 1.00 0.33 C ATOM 856 C HIS A 176 -3.396 4.210 6.423 1.00 0.30 C ATOM 857 O HIS A 176 -4.049 3.187 6.243 1.00 0.32 O ATOM 858 CB HIS A 176 -1.653 3.869 8.219 1.00 0.46 C ATOM 859 CG HIS A 176 -1.987 2.469 8.647 1.00 0.73 C ATOM 860 ND1 HIS A 176 -1.041 1.475 8.767 1.00 0.97 N ATOM 861 CD2 HIS A 176 -3.170 1.896 8.971 1.00 1.40 C ATOM 862 CE1 HIS A 176 -1.628 0.353 9.142 1.00 1.32 C ATOM 863 NE2 HIS A 176 -2.921 0.580 9.273 1.00 1.69 N ATOM 0 H HIS A 176 -0.427 5.639 6.936 1.00 0.26 H new ATOM 0 HA HIS A 176 -1.484 3.273 6.156 1.00 0.33 H new ATOM 0 HB2 HIS A 176 -0.611 4.077 8.463 1.00 0.46 H new ATOM 0 HB3 HIS A 176 -2.261 4.571 8.790 1.00 0.46 H new ATOM 0 HD1 HIS A 176 -0.042 1.588 8.593 1.00 0.97 H new ATOM 0 HD2 HIS A 176 -4.133 2.385 8.989 1.00 1.40 H new ATOM 0 HE1 HIS A 176 -1.133 -0.592 9.313 1.00 1.32 H new ATOM 872 N ASP A 177 -3.964 5.421 6.371 1.00 0.30 N ATOM 873 CA ASP A 177 -5.382 5.595 5.992 1.00 0.33 C ATOM 874 C ASP A 177 -5.618 5.312 4.517 1.00 0.28 C ATOM 875 O ASP A 177 -6.596 4.665 4.174 1.00 0.29 O ATOM 876 CB ASP A 177 -5.866 7.002 6.337 1.00 0.41 C ATOM 877 CG ASP A 177 -7.323 7.226 5.986 1.00 0.60 C ATOM 878 OD1 ASP A 177 -8.199 6.636 6.654 1.00 0.81 O ATOM 879 OD2 ASP A 177 -7.603 8.017 5.064 1.00 0.84 O ATOM 0 H ASP A 177 -3.474 6.290 6.583 1.00 0.30 H new ATOM 0 HA ASP A 177 -5.956 4.868 6.567 1.00 0.33 H new ATOM 0 HB2 ASP A 177 -5.723 7.179 7.403 1.00 0.41 H new ATOM 0 HB3 ASP A 177 -5.253 7.732 5.808 1.00 0.41 H new ATOM 884 N CYS A 178 -4.715 5.758 3.657 1.00 0.26 N ATOM 885 CA CYS A 178 -4.826 5.522 2.228 1.00 0.27 C ATOM 886 C CYS A 178 -4.851 4.022 1.963 1.00 0.24 C ATOM 887 O CYS A 178 -5.461 3.546 1.009 1.00 0.29 O ATOM 888 CB CYS A 178 -3.638 6.119 1.495 1.00 0.34 C ATOM 889 SG CYS A 178 -2.180 5.052 1.485 1.00 0.79 S ATOM 0 H CYS A 178 -3.889 6.291 3.929 1.00 0.26 H new ATOM 0 HA CYS A 178 -5.744 5.989 1.872 1.00 0.27 H new ATOM 0 HB2 CYS A 178 -3.927 6.333 0.466 1.00 0.34 H new ATOM 0 HB3 CYS A 178 -3.378 7.071 1.958 1.00 0.34 H new ATOM 894 N VAL A 179 -4.143 3.281 2.805 1.00 0.23 N ATOM 895 CA VAL A 179 -4.156 1.844 2.738 1.00 0.22 C ATOM 896 C VAL A 179 -5.420 1.299 3.375 1.00 0.22 C ATOM 897 O VAL A 179 -5.938 0.283 2.951 1.00 0.22 O ATOM 898 CB VAL A 179 -2.914 1.236 3.399 1.00 0.21 C ATOM 899 CG1 VAL A 179 -1.774 2.228 3.391 1.00 0.21 C ATOM 900 CG2 VAL A 179 -3.202 0.730 4.795 1.00 0.24 C ATOM 0 H VAL A 179 -3.552 3.664 3.543 1.00 0.23 H new ATOM 0 HA VAL A 179 -4.140 1.559 1.686 1.00 0.22 H new ATOM 0 HB VAL A 179 -2.616 0.368 2.811 1.00 0.21 H new ATOM 0 HG11 VAL A 179 -0.899 1.781 3.864 1.00 0.21 H new ATOM 0 HG12 VAL A 179 -1.533 2.497 2.363 1.00 0.21 H new ATOM 0 HG13 VAL A 179 -2.066 3.123 3.941 1.00 0.21 H new ATOM 0 HG21 VAL A 179 -2.293 0.308 5.224 1.00 0.24 H new ATOM 0 HG22 VAL A 179 -3.547 1.556 5.417 1.00 0.24 H new ATOM 0 HG23 VAL A 179 -3.973 -0.039 4.751 1.00 0.24 H new ATOM 910 N ASN A 180 -5.952 1.996 4.368 1.00 0.25 N ATOM 911 CA ASN A 180 -7.256 1.635 4.910 1.00 0.27 C ATOM 912 C ASN A 180 -8.318 1.859 3.843 1.00 0.27 C ATOM 913 O ASN A 180 -9.500 1.628 4.065 1.00 0.30 O ATOM 914 CB ASN A 180 -7.587 2.423 6.180 1.00 0.31 C ATOM 915 CG ASN A 180 -6.788 1.945 7.379 1.00 0.77 C ATOM 916 OD1 ASN A 180 -6.352 0.795 7.432 1.00 1.41 O ATOM 917 ND2 ASN A 180 -6.617 2.812 8.364 1.00 1.30 N ATOM 0 H ASN A 180 -5.511 2.802 4.810 1.00 0.25 H new ATOM 0 HA ASN A 180 -7.234 0.582 5.192 1.00 0.27 H new ATOM 0 HB2 ASN A 180 -7.387 3.481 6.011 1.00 0.31 H new ATOM 0 HB3 ASN A 180 -8.652 2.331 6.395 1.00 0.31 H new ATOM 0 HD21 ASN A 180 -6.109 2.536 9.204 1.00 1.30 H new ATOM 0 HD22 ASN A 180 -6.993 3.757 8.283 1.00 1.30 H new ATOM 924 N ILE A 181 -7.873 2.402 2.720 1.00 0.25 N ATOM 925 CA ILE A 181 -8.642 2.429 1.488 1.00 0.29 C ATOM 926 C ILE A 181 -8.205 1.291 0.548 1.00 0.27 C ATOM 927 O ILE A 181 -9.025 0.628 -0.075 1.00 0.36 O ATOM 928 CB ILE A 181 -8.439 3.763 0.757 1.00 0.35 C ATOM 929 CG1 ILE A 181 -8.050 4.876 1.706 1.00 0.49 C ATOM 930 CG2 ILE A 181 -9.701 4.172 0.083 1.00 0.40 C ATOM 931 CD1 ILE A 181 -9.171 5.308 2.631 1.00 1.14 C ATOM 0 H ILE A 181 -6.956 2.841 2.639 1.00 0.25 H new ATOM 0 HA ILE A 181 -9.692 2.305 1.753 1.00 0.29 H new ATOM 0 HB ILE A 181 -7.637 3.607 0.036 1.00 0.35 H new ATOM 0 HG12 ILE A 181 -7.201 4.549 2.306 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -7.718 5.737 1.126 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -9.547 5.120 -0.433 1.00 0.40 H new ATOM 0 HG22 ILE A 181 -9.992 3.409 -0.639 1.00 0.40 H new ATOM 0 HG23 ILE A 181 -10.490 4.288 0.826 1.00 0.40 H new ATOM 0 HD11 ILE A 181 -8.818 6.108 3.281 1.00 1.14 H new ATOM 0 HD12 ILE A 181 -10.013 5.666 2.039 1.00 1.14 H new ATOM 0 HD13 ILE A 181 -9.489 4.460 3.238 1.00 1.14 H new ATOM 943 N THR A 182 -6.898 1.064 0.490 1.00 0.20 N ATOM 944 CA THR A 182 -6.274 0.171 -0.491 1.00 0.20 C ATOM 945 C THR A 182 -6.449 -1.272 -0.125 1.00 0.24 C ATOM 946 O THR A 182 -6.854 -2.113 -0.935 1.00 0.26 O ATOM 947 CB THR A 182 -4.765 0.444 -0.595 1.00 0.20 C ATOM 948 OG1 THR A 182 -4.566 1.710 -1.177 1.00 0.22 O ATOM 949 CG2 THR A 182 -4.072 -0.608 -1.438 1.00 0.26 C ATOM 0 H THR A 182 -6.231 1.497 1.128 1.00 0.20 H new ATOM 0 HA THR A 182 -6.768 0.369 -1.442 1.00 0.20 H new ATOM 0 HB THR A 182 -4.339 0.413 0.408 1.00 0.20 H new ATOM 0 HG1 THR A 182 -4.724 2.407 -0.506 1.00 0.22 H new ATOM 0 HG21 THR A 182 -3.006 -0.387 -1.492 1.00 0.26 H new ATOM 0 HG22 THR A 182 -4.216 -1.589 -0.986 1.00 0.26 H new ATOM 0 HG23 THR A 182 -4.495 -0.606 -2.443 1.00 0.26 H new ATOM 957 N VAL A 183 -6.137 -1.532 1.110 1.00 0.28 N ATOM 958 CA VAL A 183 -6.188 -2.848 1.667 1.00 0.36 C ATOM 959 C VAL A 183 -7.630 -3.270 1.806 1.00 0.44 C ATOM 960 O VAL A 183 -7.949 -4.322 2.332 1.00 0.74 O ATOM 961 CB VAL A 183 -5.440 -2.897 3.006 1.00 0.34 C ATOM 962 CG1 VAL A 183 -4.226 -2.027 2.921 1.00 0.26 C ATOM 963 CG2 VAL A 183 -6.315 -2.516 4.192 1.00 0.40 C ATOM 0 H VAL A 183 -5.833 -0.818 1.772 1.00 0.28 H new ATOM 0 HA VAL A 183 -5.688 -3.552 1.002 1.00 0.36 H new ATOM 0 HB VAL A 183 -5.140 -3.929 3.186 1.00 0.34 H new ATOM 0 HG11 VAL A 183 -3.690 -2.057 3.869 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -3.575 -2.387 2.124 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -4.527 -1.002 2.707 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -5.728 -2.570 5.109 1.00 0.40 H new ATOM 0 HG22 VAL A 183 -6.687 -1.500 4.058 1.00 0.40 H new ATOM 0 HG23 VAL A 183 -7.157 -3.205 4.259 1.00 0.40 H new ATOM 973 N LYS A 184 -8.505 -2.387 1.390 1.00 0.32 N ATOM 974 CA LYS A 184 -9.906 -2.684 1.358 1.00 0.34 C ATOM 975 C LYS A 184 -10.234 -3.295 0.019 1.00 0.35 C ATOM 976 O LYS A 184 -10.470 -4.491 -0.104 1.00 0.37 O ATOM 977 CB LYS A 184 -10.705 -1.402 1.588 1.00 0.38 C ATOM 978 CG LYS A 184 -10.429 -0.783 2.944 1.00 0.43 C ATOM 979 CD LYS A 184 -9.666 -1.731 3.831 1.00 0.76 C ATOM 980 CE LYS A 184 -9.693 -1.347 5.297 1.00 0.60 C ATOM 981 NZ LYS A 184 -11.076 -1.330 5.846 1.00 1.00 N ATOM 0 H LYS A 184 -8.263 -1.450 1.067 1.00 0.32 H new ATOM 0 HA LYS A 184 -10.168 -3.390 2.146 1.00 0.34 H new ATOM 0 HB2 LYS A 184 -10.463 -0.681 0.807 1.00 0.38 H new ATOM 0 HB3 LYS A 184 -11.769 -1.620 1.501 1.00 0.38 H new ATOM 0 HG2 LYS A 184 -9.860 0.138 2.817 1.00 0.43 H new ATOM 0 HG3 LYS A 184 -11.371 -0.512 3.422 1.00 0.43 H new ATOM 0 HD2 LYS A 184 -10.081 -2.733 3.719 1.00 0.76 H new ATOM 0 HD3 LYS A 184 -8.630 -1.775 3.495 1.00 0.76 H new ATOM 0 HE2 LYS A 184 -9.086 -2.051 5.867 1.00 0.60 H new ATOM 0 HE3 LYS A 184 -9.242 -0.363 5.422 1.00 0.60 H new ATOM 0 HZ1 LYS A 184 -11.039 -1.401 6.883 1.00 1.00 H new ATOM 0 HZ2 LYS A 184 -11.546 -0.442 5.577 1.00 1.00 H new ATOM 0 HZ3 LYS A 184 -11.612 -2.135 5.463 1.00 1.00 H new ATOM 995 N GLN A 185 -10.114 -2.463 -0.981 1.00 0.38 N ATOM 996 CA GLN A 185 -10.321 -2.825 -2.367 1.00 0.49 C ATOM 997 C GLN A 185 -9.745 -4.194 -2.697 1.00 0.51 C ATOM 998 O GLN A 185 -10.393 -5.023 -3.329 1.00 0.64 O ATOM 999 CB GLN A 185 -9.620 -1.767 -3.194 1.00 0.60 C ATOM 1000 CG GLN A 185 -9.925 -0.378 -2.685 1.00 0.78 C ATOM 1001 CD GLN A 185 -11.345 0.039 -2.994 1.00 1.38 C ATOM 1002 OE1 GLN A 185 -11.572 0.502 -4.210 1.00 1.83 O flip ATOM 1003 NE2 GLN A 185 -12.240 -0.108 -2.168 1.00 2.13 N flip ATOM 0 H GLN A 185 -9.862 -1.483 -0.855 1.00 0.38 H new ATOM 0 HA GLN A 185 -11.389 -2.878 -2.578 1.00 0.49 H new ATOM 0 HB2 GLN A 185 -8.544 -1.937 -3.169 1.00 0.60 H new ATOM 0 HB3 GLN A 185 -9.932 -1.851 -4.235 1.00 0.60 H new ATOM 0 HG2 GLN A 185 -9.763 -0.343 -1.608 1.00 0.78 H new ATOM 0 HG3 GLN A 185 -9.232 0.333 -3.135 1.00 0.78 H new ATOM 0 HE21 GLN A 185 -12.022 -0.469 -1.239 1.00 2.13 H new ATOM 0 HE22 GLN A 185 -13.202 0.131 -2.410 1.00 2.13 H new ATOM 1012 N HIS A 186 -8.542 -4.432 -2.208 1.00 0.45 N ATOM 1013 CA HIS A 186 -7.751 -5.569 -2.631 1.00 0.54 C ATOM 1014 C HIS A 186 -7.865 -6.792 -1.740 1.00 0.69 C ATOM 1015 O HIS A 186 -7.278 -7.825 -2.043 1.00 1.31 O ATOM 1016 CB HIS A 186 -6.304 -5.148 -2.774 1.00 0.49 C ATOM 1017 CG HIS A 186 -5.946 -4.851 -4.192 1.00 0.53 C ATOM 1018 ND1 HIS A 186 -5.332 -5.765 -5.017 1.00 0.68 N ATOM 1019 CD2 HIS A 186 -6.155 -3.745 -4.943 1.00 0.54 C ATOM 1020 CE1 HIS A 186 -5.182 -5.235 -6.217 1.00 0.72 C ATOM 1021 NE2 HIS A 186 -5.671 -4.012 -6.198 1.00 0.66 N ATOM 0 H HIS A 186 -8.088 -3.844 -1.509 1.00 0.45 H new ATOM 0 HA HIS A 186 -8.160 -5.884 -3.591 1.00 0.54 H new ATOM 0 HB2 HIS A 186 -6.121 -4.265 -2.161 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -5.657 -5.939 -2.395 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -5.039 -6.703 -4.745 1.00 0.68 H new ATOM 0 HD2 HIS A 186 -6.616 -2.825 -4.616 1.00 0.54 H new ATOM 0 HE1 HIS A 186 -4.734 -5.722 -7.070 1.00 0.72 H new ATOM 1030 N THR A 187 -8.611 -6.703 -0.667 1.00 0.38 N ATOM 1031 CA THR A 187 -8.671 -7.806 0.274 1.00 0.45 C ATOM 1032 C THR A 187 -10.106 -8.207 0.574 1.00 0.54 C ATOM 1033 O THR A 187 -10.371 -9.298 1.074 1.00 0.83 O ATOM 1034 CB THR A 187 -7.958 -7.450 1.588 1.00 0.57 C ATOM 1035 OG1 THR A 187 -8.827 -6.706 2.445 1.00 1.63 O ATOM 1036 CG2 THR A 187 -6.718 -6.637 1.310 1.00 0.88 C ATOM 0 H THR A 187 -9.180 -5.893 -0.421 1.00 0.38 H new ATOM 0 HA THR A 187 -8.163 -8.649 -0.194 1.00 0.45 H new ATOM 0 HB THR A 187 -7.677 -8.380 2.082 1.00 0.57 H new ATOM 0 HG1 THR A 187 -8.381 -5.879 2.725 1.00 1.63 H new ATOM 0 HG21 THR A 187 -6.224 -6.393 2.251 1.00 0.88 H new ATOM 0 HG22 THR A 187 -6.038 -7.213 0.682 1.00 0.88 H new ATOM 0 HG23 THR A 187 -6.994 -5.717 0.796 1.00 0.88 H new ATOM 1044 N VAL A 188 -11.034 -7.342 0.212 1.00 0.41 N ATOM 1045 CA VAL A 188 -12.404 -7.485 0.659 1.00 0.46 C ATOM 1046 C VAL A 188 -13.282 -8.019 -0.461 1.00 0.45 C ATOM 1047 O VAL A 188 -14.479 -8.257 -0.293 1.00 0.57 O ATOM 1048 CB VAL A 188 -12.945 -6.145 1.195 1.00 0.51 C ATOM 1049 CG1 VAL A 188 -11.911 -5.510 2.114 1.00 0.53 C ATOM 1050 CG2 VAL A 188 -13.320 -5.200 0.057 1.00 0.49 C ATOM 0 H VAL A 188 -10.864 -6.535 -0.389 1.00 0.41 H new ATOM 0 HA VAL A 188 -12.424 -8.207 1.475 1.00 0.46 H new ATOM 0 HB VAL A 188 -13.855 -6.339 1.763 1.00 0.51 H new ATOM 0 HG11 VAL A 188 -12.294 -4.562 2.493 1.00 0.53 H new ATOM 0 HG12 VAL A 188 -11.707 -6.179 2.950 1.00 0.53 H new ATOM 0 HG13 VAL A 188 -10.990 -5.333 1.558 1.00 0.53 H new ATOM 0 HG21 VAL A 188 -13.698 -4.265 0.470 1.00 0.49 H new ATOM 0 HG22 VAL A 188 -12.440 -4.998 -0.553 1.00 0.49 H new ATOM 0 HG23 VAL A 188 -14.091 -5.662 -0.560 1.00 0.49 H new ATOM 1060 N THR A 189 -12.657 -8.187 -1.605 1.00 0.38 N ATOM 1061 CA THR A 189 -13.266 -8.813 -2.764 1.00 0.41 C ATOM 1062 C THR A 189 -12.157 -9.374 -3.623 1.00 0.34 C ATOM 1063 O THR A 189 -12.212 -10.505 -4.102 1.00 0.35 O ATOM 1064 CB THR A 189 -14.104 -7.812 -3.588 1.00 0.50 C ATOM 1065 OG1 THR A 189 -15.221 -7.345 -2.818 1.00 0.64 O ATOM 1066 CG2 THR A 189 -14.591 -8.447 -4.885 1.00 0.51 C ATOM 0 H THR A 189 -11.694 -7.888 -1.762 1.00 0.38 H new ATOM 0 HA THR A 189 -13.943 -9.598 -2.427 1.00 0.41 H new ATOM 0 HB THR A 189 -13.467 -6.964 -3.840 1.00 0.50 H new ATOM 0 HG1 THR A 189 -15.157 -7.694 -1.904 1.00 0.64 H new ATOM 0 HG21 THR A 189 -15.179 -7.721 -5.447 1.00 0.51 H new ATOM 0 HG22 THR A 189 -13.734 -8.760 -5.481 1.00 0.51 H new ATOM 0 HG23 THR A 189 -15.209 -9.315 -4.655 1.00 0.51 H new ATOM 1074 N THR A 190 -11.134 -8.555 -3.775 1.00 0.32 N ATOM 1075 CA THR A 190 -9.934 -8.928 -4.478 1.00 0.34 C ATOM 1076 C THR A 190 -9.203 -10.079 -3.782 1.00 0.34 C ATOM 1077 O THR A 190 -8.485 -10.843 -4.422 1.00 0.42 O ATOM 1078 CB THR A 190 -9.018 -7.707 -4.588 1.00 0.39 C ATOM 1079 OG1 THR A 190 -9.631 -6.710 -5.410 1.00 0.54 O ATOM 1080 CG2 THR A 190 -7.661 -8.071 -5.152 1.00 0.55 C ATOM 0 H THR A 190 -11.118 -7.603 -3.408 1.00 0.32 H new ATOM 0 HA THR A 190 -10.211 -9.276 -5.473 1.00 0.34 H new ATOM 0 HB THR A 190 -8.868 -7.315 -3.582 1.00 0.39 H new ATOM 0 HG1 THR A 190 -9.997 -5.999 -4.844 1.00 0.54 H new ATOM 0 HG21 THR A 190 -7.041 -7.177 -5.214 1.00 0.55 H new ATOM 0 HG22 THR A 190 -7.180 -8.801 -4.501 1.00 0.55 H new ATOM 0 HG23 THR A 190 -7.783 -8.497 -6.148 1.00 0.55 H new ATOM 1088 N THR A 191 -9.382 -10.221 -2.473 1.00 0.34 N ATOM 1089 CA THR A 191 -8.768 -11.342 -1.785 1.00 0.47 C ATOM 1090 C THR A 191 -9.783 -12.449 -1.560 1.00 0.35 C ATOM 1091 O THR A 191 -9.483 -13.629 -1.729 1.00 0.34 O ATOM 1092 CB THR A 191 -8.127 -10.979 -0.440 1.00 0.83 C ATOM 1093 OG1 THR A 191 -7.101 -9.999 -0.629 1.00 1.66 O ATOM 1094 CG2 THR A 191 -7.510 -12.206 0.208 1.00 1.23 C ATOM 0 H THR A 191 -9.930 -9.593 -1.885 1.00 0.34 H new ATOM 0 HA THR A 191 -7.965 -11.676 -2.442 1.00 0.47 H new ATOM 0 HB THR A 191 -8.909 -10.580 0.206 1.00 0.83 H new ATOM 0 HG1 THR A 191 -7.272 -9.502 -1.456 1.00 1.66 H new ATOM 0 HG21 THR A 191 -7.061 -11.927 1.161 1.00 1.23 H new ATOM 0 HG22 THR A 191 -8.283 -12.956 0.377 1.00 1.23 H new ATOM 0 HG23 THR A 191 -6.743 -12.617 -0.448 1.00 1.23 H new ATOM 1102 N THR A 192 -11.003 -12.066 -1.220 1.00 0.46 N ATOM 1103 CA THR A 192 -12.056 -13.027 -0.937 1.00 0.60 C ATOM 1104 C THR A 192 -12.576 -13.677 -2.216 1.00 0.59 C ATOM 1105 O THR A 192 -13.732 -14.085 -2.293 1.00 0.73 O ATOM 1106 CB THR A 192 -13.219 -12.355 -0.196 1.00 0.76 C ATOM 1107 OG1 THR A 192 -13.627 -11.182 -0.906 1.00 0.69 O ATOM 1108 CG2 THR A 192 -12.813 -11.980 1.219 1.00 0.90 C ATOM 0 H THR A 192 -11.289 -11.091 -1.133 1.00 0.46 H new ATOM 0 HA THR A 192 -11.625 -13.802 -0.304 1.00 0.60 H new ATOM 0 HB THR A 192 -14.049 -13.060 -0.142 1.00 0.76 H new ATOM 0 HG1 THR A 192 -14.371 -10.755 -0.432 1.00 0.69 H new ATOM 0 HG21 THR A 192 -13.654 -11.505 1.725 1.00 0.90 H new ATOM 0 HG22 THR A 192 -12.522 -12.878 1.764 1.00 0.90 H new ATOM 0 HG23 THR A 192 -11.972 -11.288 1.185 1.00 0.90 H new ATOM 1116 N LYS A 193 -11.708 -13.793 -3.213 1.00 0.51 N ATOM 1117 CA LYS A 193 -12.059 -14.476 -4.439 1.00 0.58 C ATOM 1118 C LYS A 193 -11.579 -15.911 -4.377 1.00 0.69 C ATOM 1119 O LYS A 193 -11.548 -16.628 -5.377 1.00 0.82 O ATOM 1120 CB LYS A 193 -11.511 -13.743 -5.675 1.00 0.53 C ATOM 1121 CG LYS A 193 -10.107 -13.170 -5.521 1.00 0.45 C ATOM 1122 CD LYS A 193 -9.027 -14.234 -5.539 1.00 0.53 C ATOM 1123 CE LYS A 193 -7.648 -13.593 -5.540 1.00 0.57 C ATOM 1124 NZ LYS A 193 -6.551 -14.598 -5.600 1.00 1.12 N ATOM 0 H LYS A 193 -10.758 -13.421 -3.191 1.00 0.51 H new ATOM 0 HA LYS A 193 -13.144 -14.477 -4.539 1.00 0.58 H new ATOM 0 HB2 LYS A 193 -11.514 -14.434 -6.518 1.00 0.53 H new ATOM 0 HB3 LYS A 193 -12.192 -12.930 -5.927 1.00 0.53 H new ATOM 0 HG2 LYS A 193 -9.921 -12.458 -6.325 1.00 0.45 H new ATOM 0 HG3 LYS A 193 -10.048 -12.616 -4.584 1.00 0.45 H new ATOM 0 HD2 LYS A 193 -9.132 -14.882 -4.669 1.00 0.53 H new ATOM 0 HD3 LYS A 193 -9.143 -14.863 -6.422 1.00 0.53 H new ATOM 0 HE2 LYS A 193 -7.565 -12.919 -6.392 1.00 0.57 H new ATOM 0 HE3 LYS A 193 -7.532 -12.987 -4.641 1.00 0.57 H new ATOM 0 HZ1 LYS A 193 -5.919 -14.471 -4.784 1.00 1.12 H new ATOM 0 HZ2 LYS A 193 -6.956 -15.556 -5.579 1.00 1.12 H new ATOM 0 HZ3 LYS A 193 -6.011 -14.470 -6.479 1.00 1.12 H new ATOM 1138 N GLY A 194 -11.219 -16.318 -3.173 1.00 0.70 N ATOM 1139 CA GLY A 194 -10.764 -17.668 -2.950 1.00 0.81 C ATOM 1140 C GLY A 194 -9.311 -17.683 -2.567 1.00 0.75 C ATOM 1141 O GLY A 194 -8.618 -18.687 -2.715 1.00 0.86 O ATOM 0 H GLY A 194 -11.235 -15.730 -2.340 1.00 0.70 H new ATOM 0 HA2 GLY A 194 -11.358 -18.131 -2.162 1.00 0.81 H new ATOM 0 HA3 GLY A 194 -10.913 -18.261 -3.852 1.00 0.81 H new ATOM 1145 N GLU A 195 -8.859 -16.551 -2.067 1.00 0.63 N ATOM 1146 CA GLU A 195 -7.486 -16.378 -1.659 1.00 0.60 C ATOM 1147 C GLU A 195 -7.417 -16.434 -0.142 1.00 0.59 C ATOM 1148 O GLU A 195 -8.381 -16.075 0.534 1.00 0.63 O ATOM 1149 CB GLU A 195 -6.971 -15.032 -2.184 1.00 0.64 C ATOM 1150 CG GLU A 195 -5.494 -14.804 -1.955 1.00 0.72 C ATOM 1151 CD GLU A 195 -4.645 -15.800 -2.712 1.00 0.84 C ATOM 1152 OE1 GLU A 195 -4.367 -15.557 -3.903 1.00 1.40 O ATOM 1153 OE2 GLU A 195 -4.277 -16.840 -2.132 1.00 1.29 O ATOM 0 H GLU A 195 -9.439 -15.723 -1.933 1.00 0.63 H new ATOM 0 HA GLU A 195 -6.859 -17.170 -2.069 1.00 0.60 H new ATOM 0 HB2 GLU A 195 -7.176 -14.969 -3.253 1.00 0.64 H new ATOM 0 HB3 GLU A 195 -7.530 -14.229 -1.704 1.00 0.64 H new ATOM 0 HG2 GLU A 195 -5.231 -13.793 -2.265 1.00 0.72 H new ATOM 0 HG3 GLU A 195 -5.276 -14.877 -0.889 1.00 0.72 H new ATOM 1160 N ASN A 196 -6.296 -16.879 0.393 1.00 0.64 N ATOM 1161 CA ASN A 196 -6.157 -17.006 1.834 1.00 0.69 C ATOM 1162 C ASN A 196 -5.350 -15.852 2.369 1.00 0.63 C ATOM 1163 O ASN A 196 -4.186 -15.669 2.010 1.00 0.80 O ATOM 1164 CB ASN A 196 -5.478 -18.322 2.225 1.00 0.91 C ATOM 1165 CG ASN A 196 -6.282 -19.546 1.823 1.00 1.07 C ATOM 1166 OD1 ASN A 196 -6.136 -20.066 0.716 1.00 1.13 O ATOM 1167 ND2 ASN A 196 -7.130 -20.027 2.721 1.00 1.99 N ATOM 0 H ASN A 196 -5.473 -17.157 -0.142 1.00 0.64 H new ATOM 0 HA ASN A 196 -7.158 -16.999 2.266 1.00 0.69 H new ATOM 0 HB2 ASN A 196 -4.495 -18.370 1.757 1.00 0.91 H new ATOM 0 HB3 ASN A 196 -5.319 -18.336 3.303 1.00 0.91 H new ATOM 0 HD21 ASN A 196 -7.687 -20.854 2.505 1.00 1.99 H new ATOM 0 HD22 ASN A 196 -7.225 -19.571 3.628 1.00 1.99 H new ATOM 1174 N PHE A 197 -5.984 -15.056 3.207 1.00 0.54 N ATOM 1175 CA PHE A 197 -5.307 -13.950 3.830 1.00 0.53 C ATOM 1176 C PHE A 197 -5.471 -14.016 5.332 1.00 0.56 C ATOM 1177 O PHE A 197 -6.580 -13.939 5.870 1.00 0.68 O ATOM 1178 CB PHE A 197 -5.777 -12.603 3.274 1.00 0.52 C ATOM 1179 CG PHE A 197 -7.128 -12.134 3.712 1.00 1.12 C ATOM 1180 CD1 PHE A 197 -8.242 -12.868 3.362 1.00 1.63 C ATOM 1181 CD2 PHE A 197 -7.288 -10.982 4.462 1.00 1.49 C ATOM 1182 CE1 PHE A 197 -9.504 -12.465 3.752 1.00 2.36 C ATOM 1183 CE2 PHE A 197 -8.547 -10.571 4.855 1.00 2.19 C ATOM 1184 CZ PHE A 197 -9.609 -11.219 4.549 1.00 2.61 C ATOM 0 H PHE A 197 -6.965 -15.159 3.468 1.00 0.54 H new ATOM 0 HA PHE A 197 -4.246 -14.031 3.594 1.00 0.53 H new ATOM 0 HB2 PHE A 197 -5.046 -11.845 3.554 1.00 0.52 H new ATOM 0 HB3 PHE A 197 -5.773 -12.663 2.186 1.00 0.52 H new ATOM 0 HD1 PHE A 197 -8.126 -13.768 2.776 1.00 1.63 H new ATOM 0 HD2 PHE A 197 -6.422 -10.400 4.742 1.00 1.49 H new ATOM 0 HE1 PHE A 197 -10.381 -13.036 3.486 1.00 2.36 H new ATOM 0 HE2 PHE A 197 -8.640 -9.669 5.442 1.00 2.19 H new ATOM 0 HZ PHE A 197 -10.576 -10.860 4.870 1.00 2.61 H new ATOM 1194 N THR A 198 -4.368 -14.217 6.004 1.00 0.55 N ATOM 1195 CA THR A 198 -4.349 -14.201 7.434 1.00 0.60 C ATOM 1196 C THR A 198 -3.606 -12.957 7.893 1.00 0.52 C ATOM 1197 O THR A 198 -3.064 -12.248 7.067 1.00 0.43 O ATOM 1198 CB THR A 198 -3.740 -15.493 8.028 1.00 0.74 C ATOM 1199 OG1 THR A 198 -4.011 -15.563 9.436 1.00 1.12 O ATOM 1200 CG2 THR A 198 -2.238 -15.563 7.795 1.00 0.78 C ATOM 0 H THR A 198 -3.462 -14.396 5.572 1.00 0.55 H new ATOM 0 HA THR A 198 -5.374 -14.168 7.804 1.00 0.60 H new ATOM 0 HB THR A 198 -4.203 -16.340 7.521 1.00 0.74 H new ATOM 0 HG1 THR A 198 -3.623 -16.385 9.803 1.00 1.12 H new ATOM 0 HG21 THR A 198 -1.845 -16.484 8.226 1.00 0.78 H new ATOM 0 HG22 THR A 198 -2.035 -15.548 6.724 1.00 0.78 H new ATOM 0 HG23 THR A 198 -1.756 -14.707 8.268 1.00 0.78 H new ATOM 1208 N GLU A 199 -3.667 -12.659 9.180 1.00 0.59 N ATOM 1209 CA GLU A 199 -3.036 -11.472 9.779 1.00 0.63 C ATOM 1210 C GLU A 199 -1.652 -11.151 9.200 1.00 0.55 C ATOM 1211 O GLU A 199 -1.271 -9.980 9.096 1.00 0.53 O ATOM 1212 CB GLU A 199 -2.927 -11.637 11.293 1.00 0.82 C ATOM 1213 CG GLU A 199 -3.650 -10.551 12.070 1.00 1.14 C ATOM 1214 CD GLU A 199 -5.160 -10.688 12.005 1.00 2.11 C ATOM 1215 OE1 GLU A 199 -5.701 -10.823 10.887 1.00 2.91 O ATOM 1216 OE2 GLU A 199 -5.815 -10.664 13.069 1.00 2.55 O ATOM 0 H GLU A 199 -4.162 -13.238 9.858 1.00 0.59 H new ATOM 0 HA GLU A 199 -3.685 -10.632 9.532 1.00 0.63 H new ATOM 0 HB2 GLU A 199 -3.334 -12.608 11.576 1.00 0.82 H new ATOM 0 HB3 GLU A 199 -1.875 -11.637 11.576 1.00 0.82 H new ATOM 0 HG2 GLU A 199 -3.331 -10.583 13.112 1.00 1.14 H new ATOM 0 HG3 GLU A 199 -3.361 -9.576 11.678 1.00 1.14 H new ATOM 1223 N THR A 200 -0.908 -12.168 8.817 1.00 0.56 N ATOM 1224 CA THR A 200 0.400 -11.953 8.238 1.00 0.57 C ATOM 1225 C THR A 200 0.298 -11.454 6.780 1.00 0.44 C ATOM 1226 O THR A 200 1.199 -10.777 6.272 1.00 0.44 O ATOM 1227 CB THR A 200 1.238 -13.236 8.294 1.00 0.73 C ATOM 1228 OG1 THR A 200 2.605 -12.908 8.555 1.00 0.92 O ATOM 1229 CG2 THR A 200 1.130 -13.995 6.984 1.00 0.99 C ATOM 0 H THR A 200 -1.185 -13.146 8.896 1.00 0.56 H new ATOM 0 HA THR A 200 0.894 -11.182 8.829 1.00 0.57 H new ATOM 0 HB THR A 200 0.859 -13.869 9.096 1.00 0.73 H new ATOM 0 HG1 THR A 200 3.130 -13.020 7.735 1.00 0.92 H new ATOM 0 HG21 THR A 200 1.730 -14.903 7.039 1.00 0.99 H new ATOM 0 HG22 THR A 200 0.088 -14.259 6.801 1.00 0.99 H new ATOM 0 HG23 THR A 200 1.494 -13.369 6.170 1.00 0.99 H new ATOM 1237 N ASP A 201 -0.802 -11.787 6.113 1.00 0.41 N ATOM 1238 CA ASP A 201 -1.025 -11.361 4.738 1.00 0.36 C ATOM 1239 C ASP A 201 -1.433 -9.912 4.716 1.00 0.31 C ATOM 1240 O ASP A 201 -1.162 -9.157 3.772 1.00 0.34 O ATOM 1241 CB ASP A 201 -2.067 -12.222 4.031 1.00 0.45 C ATOM 1242 CG ASP A 201 -1.663 -13.682 3.971 1.00 0.92 C ATOM 1243 OD1 ASP A 201 -2.004 -14.440 4.898 1.00 1.27 O ATOM 1244 OD2 ASP A 201 -1.006 -14.079 2.992 1.00 1.49 O ATOM 0 H ASP A 201 -1.555 -12.353 6.505 1.00 0.41 H new ATOM 0 HA ASP A 201 -0.089 -11.484 4.194 1.00 0.36 H new ATOM 0 HB2 ASP A 201 -3.021 -12.133 4.550 1.00 0.45 H new ATOM 0 HB3 ASP A 201 -2.218 -11.847 3.019 1.00 0.45 H new ATOM 1249 N ILE A 202 -2.051 -9.523 5.790 1.00 0.30 N ATOM 1250 CA ILE A 202 -2.437 -8.155 5.982 1.00 0.32 C ATOM 1251 C ILE A 202 -1.201 -7.302 6.092 1.00 0.31 C ATOM 1252 O ILE A 202 -1.026 -6.351 5.344 1.00 0.34 O ATOM 1253 CB ILE A 202 -3.251 -7.997 7.258 1.00 0.41 C ATOM 1254 CG1 ILE A 202 -3.798 -9.346 7.646 1.00 0.48 C ATOM 1255 CG2 ILE A 202 -4.364 -6.996 7.051 1.00 0.54 C ATOM 1256 CD1 ILE A 202 -4.961 -9.829 6.793 1.00 0.53 C ATOM 0 H ILE A 202 -2.303 -10.144 6.559 1.00 0.30 H new ATOM 0 HA ILE A 202 -3.044 -7.845 5.131 1.00 0.32 H new ATOM 0 HB ILE A 202 -2.619 -7.620 8.062 1.00 0.41 H new ATOM 0 HG12 ILE A 202 -2.994 -10.079 7.588 1.00 0.48 H new ATOM 0 HG13 ILE A 202 -4.120 -9.307 8.687 1.00 0.48 H new ATOM 0 HG21 ILE A 202 -4.937 -6.894 7.972 1.00 0.54 H new ATOM 0 HG22 ILE A 202 -3.939 -6.030 6.779 1.00 0.54 H new ATOM 0 HG23 ILE A 202 -5.020 -7.341 6.252 1.00 0.54 H new ATOM 0 HD11 ILE A 202 -5.289 -10.807 7.145 1.00 0.53 H new ATOM 0 HD12 ILE A 202 -5.786 -9.121 6.868 1.00 0.53 H new ATOM 0 HD13 ILE A 202 -4.643 -9.905 5.753 1.00 0.53 H new ATOM 1268 N LYS A 203 -0.310 -7.705 6.987 1.00 0.32 N ATOM 1269 CA LYS A 203 0.840 -6.898 7.316 1.00 0.35 C ATOM 1270 C LYS A 203 1.700 -6.646 6.113 1.00 0.30 C ATOM 1271 O LYS A 203 1.976 -5.506 5.837 1.00 0.31 O ATOM 1272 CB LYS A 203 1.652 -7.491 8.457 1.00 0.44 C ATOM 1273 CG LYS A 203 1.835 -8.981 8.391 1.00 0.49 C ATOM 1274 CD LYS A 203 3.293 -9.387 8.531 1.00 0.61 C ATOM 1275 CE LYS A 203 4.133 -8.917 7.352 1.00 0.77 C ATOM 1276 NZ LYS A 203 5.571 -9.256 7.544 1.00 1.14 N ATOM 0 H LYS A 203 -0.368 -8.588 7.495 1.00 0.32 H new ATOM 0 HA LYS A 203 0.458 -5.937 7.660 1.00 0.35 H new ATOM 0 HB2 LYS A 203 2.634 -7.018 8.469 1.00 0.44 H new ATOM 0 HB3 LYS A 203 1.165 -7.240 9.400 1.00 0.44 H new ATOM 0 HG2 LYS A 203 1.251 -9.452 9.181 1.00 0.49 H new ATOM 0 HG3 LYS A 203 1.446 -9.352 7.443 1.00 0.49 H new ATOM 0 HD2 LYS A 203 3.698 -8.971 9.453 1.00 0.61 H new ATOM 0 HD3 LYS A 203 3.361 -10.472 8.614 1.00 0.61 H new ATOM 0 HE2 LYS A 203 3.767 -9.379 6.435 1.00 0.77 H new ATOM 0 HE3 LYS A 203 4.024 -7.839 7.231 1.00 0.77 H new ATOM 0 HZ1 LYS A 203 6.111 -8.969 6.703 1.00 1.14 H new ATOM 0 HZ2 LYS A 203 5.938 -8.754 8.378 1.00 1.14 H new ATOM 0 HZ3 LYS A 203 5.670 -10.282 7.686 1.00 1.14 H new ATOM 1290 N ILE A 204 2.097 -7.675 5.373 1.00 0.29 N ATOM 1291 CA ILE A 204 2.860 -7.451 4.163 1.00 0.28 C ATOM 1292 C ILE A 204 2.198 -6.409 3.295 1.00 0.24 C ATOM 1293 O ILE A 204 2.833 -5.456 2.895 1.00 0.27 O ATOM 1294 CB ILE A 204 2.971 -8.732 3.371 1.00 0.28 C ATOM 1295 CG1 ILE A 204 1.667 -9.449 3.560 1.00 0.26 C ATOM 1296 CG2 ILE A 204 4.163 -9.538 3.829 1.00 0.38 C ATOM 1297 CD1 ILE A 204 1.440 -10.637 2.688 1.00 0.28 C ATOM 0 H ILE A 204 1.905 -8.653 5.589 1.00 0.29 H new ATOM 0 HA ILE A 204 3.851 -7.104 4.456 1.00 0.28 H new ATOM 0 HB ILE A 204 3.142 -8.550 2.310 1.00 0.28 H new ATOM 0 HG12 ILE A 204 1.599 -9.768 4.600 1.00 0.26 H new ATOM 0 HG13 ILE A 204 0.857 -8.739 3.391 1.00 0.26 H new ATOM 0 HG21 ILE A 204 4.226 -10.457 3.247 1.00 0.38 H new ATOM 0 HG22 ILE A 204 5.073 -8.955 3.687 1.00 0.38 H new ATOM 0 HG23 ILE A 204 4.052 -9.784 4.885 1.00 0.38 H new ATOM 0 HD11 ILE A 204 0.467 -11.073 2.913 1.00 0.28 H new ATOM 0 HD12 ILE A 204 1.467 -10.331 1.642 1.00 0.28 H new ATOM 0 HD13 ILE A 204 2.220 -11.376 2.870 1.00 0.28 H new ATOM 1309 N MET A 205 0.914 -6.561 3.029 1.00 0.21 N ATOM 1310 CA MET A 205 0.254 -5.611 2.162 1.00 0.23 C ATOM 1311 C MET A 205 0.194 -4.235 2.786 1.00 0.22 C ATOM 1312 O MET A 205 0.697 -3.276 2.207 1.00 0.22 O ATOM 1313 CB MET A 205 -1.141 -6.067 1.794 1.00 0.29 C ATOM 1314 CG MET A 205 -2.115 -4.933 1.575 1.00 0.29 C ATOM 1315 SD MET A 205 -3.806 -5.482 1.785 1.00 0.41 S ATOM 1316 CE MET A 205 -3.625 -6.470 3.275 1.00 0.35 C ATOM 0 H MET A 205 0.324 -7.311 3.390 1.00 0.21 H new ATOM 0 HA MET A 205 0.851 -5.554 1.252 1.00 0.23 H new ATOM 0 HB2 MET A 205 -1.089 -6.669 0.887 1.00 0.29 H new ATOM 0 HB3 MET A 205 -1.522 -6.714 2.584 1.00 0.29 H new ATOM 0 HG2 MET A 205 -1.902 -4.127 2.277 1.00 0.29 H new ATOM 0 HG3 MET A 205 -1.984 -4.526 0.572 1.00 0.29 H new ATOM 0 HE1 MET A 205 -4.589 -6.550 3.778 1.00 0.35 H new ATOM 0 HE2 MET A 205 -3.270 -7.466 3.010 1.00 0.35 H new ATOM 0 HE3 MET A 205 -2.907 -5.994 3.942 1.00 0.35 H new ATOM 1326 N GLU A 206 -0.425 -4.146 3.961 1.00 0.23 N ATOM 1327 CA GLU A 206 -0.589 -2.873 4.636 1.00 0.25 C ATOM 1328 C GLU A 206 0.752 -2.210 4.763 1.00 0.24 C ATOM 1329 O GLU A 206 0.917 -1.063 4.407 1.00 0.26 O ATOM 1330 CB GLU A 206 -1.162 -3.051 6.037 1.00 0.29 C ATOM 1331 CG GLU A 206 -2.380 -3.944 6.119 1.00 0.37 C ATOM 1332 CD GLU A 206 -2.876 -4.059 7.544 1.00 0.57 C ATOM 1333 OE1 GLU A 206 -2.240 -4.771 8.348 1.00 1.25 O ATOM 1334 OE2 GLU A 206 -3.924 -3.451 7.860 1.00 1.00 O ATOM 0 H GLU A 206 -0.819 -4.943 4.460 1.00 0.23 H new ATOM 0 HA GLU A 206 -1.278 -2.268 4.047 1.00 0.25 H new ATOM 0 HB2 GLU A 206 -0.385 -3.461 6.682 1.00 0.29 H new ATOM 0 HB3 GLU A 206 -1.422 -2.070 6.435 1.00 0.29 H new ATOM 0 HG2 GLU A 206 -3.172 -3.543 5.486 1.00 0.37 H new ATOM 0 HG3 GLU A 206 -2.135 -4.934 5.735 1.00 0.37 H new ATOM 1341 N ARG A 207 1.714 -2.979 5.221 1.00 0.24 N ATOM 1342 CA ARG A 207 3.042 -2.476 5.480 1.00 0.25 C ATOM 1343 C ARG A 207 3.677 -1.941 4.201 1.00 0.26 C ATOM 1344 O ARG A 207 4.388 -0.944 4.240 1.00 0.35 O ATOM 1345 CB ARG A 207 3.908 -3.581 6.086 1.00 0.25 C ATOM 1346 CG ARG A 207 4.618 -4.411 5.047 1.00 0.25 C ATOM 1347 CD ARG A 207 5.422 -5.509 5.680 1.00 0.32 C ATOM 1348 NE ARG A 207 6.721 -5.033 6.160 1.00 0.47 N ATOM 1349 CZ ARG A 207 7.080 -4.954 7.442 1.00 0.69 C ATOM 1350 NH1 ARG A 207 6.220 -5.257 8.403 1.00 0.87 N ATOM 1351 NH2 ARG A 207 8.303 -4.543 7.752 1.00 0.89 N ATOM 0 H ARG A 207 1.596 -3.972 5.424 1.00 0.24 H new ATOM 0 HA ARG A 207 2.970 -1.653 6.191 1.00 0.25 H new ATOM 0 HB2 ARG A 207 4.646 -3.133 6.751 1.00 0.25 H new ATOM 0 HB3 ARG A 207 3.282 -4.232 6.697 1.00 0.25 H new ATOM 0 HG2 ARG A 207 3.888 -4.841 4.362 1.00 0.25 H new ATOM 0 HG3 ARG A 207 5.274 -3.773 4.455 1.00 0.25 H new ATOM 0 HD2 ARG A 207 4.862 -5.934 6.513 1.00 0.32 H new ATOM 0 HD3 ARG A 207 5.574 -6.310 4.956 1.00 0.32 H new ATOM 0 HE ARG A 207 7.403 -4.740 5.461 1.00 0.47 H new ATOM 0 HH11 ARG A 207 5.274 -5.554 8.165 1.00 0.87 H new ATOM 0 HH12 ARG A 207 6.504 -5.193 9.381 1.00 0.87 H new ATOM 0 HH21 ARG A 207 8.959 -4.291 7.013 1.00 0.89 H new ATOM 0 HH22 ARG A 207 8.587 -4.479 8.730 1.00 0.89 H new ATOM 1365 N VAL A 208 3.406 -2.583 3.060 1.00 0.23 N ATOM 1366 CA VAL A 208 4.009 -2.161 1.820 1.00 0.23 C ATOM 1367 C VAL A 208 3.272 -0.970 1.270 1.00 0.25 C ATOM 1368 O VAL A 208 3.876 0.053 0.949 1.00 0.34 O ATOM 1369 CB VAL A 208 4.029 -3.261 0.732 1.00 0.22 C ATOM 1370 CG1 VAL A 208 4.665 -2.703 -0.520 1.00 0.28 C ATOM 1371 CG2 VAL A 208 4.780 -4.494 1.192 1.00 0.22 C ATOM 0 H VAL A 208 2.780 -3.385 2.983 1.00 0.23 H new ATOM 0 HA VAL A 208 5.043 -1.916 2.061 1.00 0.23 H new ATOM 0 HB VAL A 208 3.002 -3.564 0.529 1.00 0.22 H new ATOM 0 HG11 VAL A 208 4.683 -3.472 -1.292 1.00 0.28 H new ATOM 0 HG12 VAL A 208 4.087 -1.849 -0.872 1.00 0.28 H new ATOM 0 HG13 VAL A 208 5.684 -2.386 -0.300 1.00 0.28 H new ATOM 0 HG21 VAL A 208 4.771 -5.242 0.400 1.00 0.22 H new ATOM 0 HG22 VAL A 208 5.810 -4.226 1.426 1.00 0.22 H new ATOM 0 HG23 VAL A 208 4.300 -4.902 2.082 1.00 0.22 H new ATOM 1381 N VAL A 209 1.964 -1.107 1.172 1.00 0.22 N ATOM 1382 CA VAL A 209 1.148 -0.048 0.639 1.00 0.25 C ATOM 1383 C VAL A 209 1.297 1.199 1.505 1.00 0.27 C ATOM 1384 O VAL A 209 1.393 2.302 0.992 1.00 0.32 O ATOM 1385 CB VAL A 209 -0.338 -0.449 0.526 1.00 0.31 C ATOM 1386 CG1 VAL A 209 -0.530 -1.673 -0.336 1.00 1.11 C ATOM 1387 CG2 VAL A 209 -0.968 -0.650 1.873 1.00 1.19 C ATOM 0 H VAL A 209 1.450 -1.941 1.455 1.00 0.22 H new ATOM 0 HA VAL A 209 1.497 0.160 -0.372 1.00 0.25 H new ATOM 0 HB VAL A 209 -0.844 0.385 0.039 1.00 0.31 H new ATOM 0 HG11 VAL A 209 -1.591 -1.919 -0.388 1.00 1.11 H new ATOM 0 HG12 VAL A 209 -0.155 -1.474 -1.340 1.00 1.11 H new ATOM 0 HG13 VAL A 209 0.016 -2.512 0.096 1.00 1.11 H new ATOM 0 HG21 VAL A 209 -2.014 -0.931 1.747 1.00 1.19 H new ATOM 0 HG22 VAL A 209 -0.441 -1.441 2.407 1.00 1.19 H new ATOM 0 HG23 VAL A 209 -0.907 0.276 2.445 1.00 1.19 H new ATOM 1397 N GLU A 210 1.355 0.994 2.816 1.00 0.26 N ATOM 1398 CA GLU A 210 1.514 2.079 3.779 1.00 0.29 C ATOM 1399 C GLU A 210 2.874 2.756 3.672 1.00 0.29 C ATOM 1400 O GLU A 210 2.948 3.970 3.582 1.00 0.33 O ATOM 1401 CB GLU A 210 1.264 1.568 5.211 1.00 0.31 C ATOM 1402 CG GLU A 210 2.501 1.390 6.086 1.00 0.32 C ATOM 1403 CD GLU A 210 2.155 1.077 7.528 1.00 0.70 C ATOM 1404 OE1 GLU A 210 1.456 1.888 8.169 1.00 1.12 O ATOM 1405 OE2 GLU A 210 2.567 0.006 8.024 1.00 1.19 O ATOM 0 H GLU A 210 1.293 0.069 3.242 1.00 0.26 H new ATOM 0 HA GLU A 210 0.767 2.836 3.540 1.00 0.29 H new ATOM 0 HB2 GLU A 210 0.588 2.262 5.710 1.00 0.31 H new ATOM 0 HB3 GLU A 210 0.748 0.610 5.148 1.00 0.31 H new ATOM 0 HG2 GLU A 210 3.115 0.586 5.681 1.00 0.32 H new ATOM 0 HG3 GLU A 210 3.101 2.299 6.049 1.00 0.32 H new ATOM 1412 N GLN A 211 3.960 2.005 3.620 1.00 0.27 N ATOM 1413 CA GLN A 211 5.251 2.642 3.748 1.00 0.31 C ATOM 1414 C GLN A 211 5.580 3.305 2.427 1.00 0.31 C ATOM 1415 O GLN A 211 6.412 4.204 2.333 1.00 0.34 O ATOM 1416 CB GLN A 211 6.335 1.631 4.165 1.00 0.34 C ATOM 1417 CG GLN A 211 6.622 0.542 3.135 1.00 0.39 C ATOM 1418 CD GLN A 211 7.824 0.848 2.257 1.00 0.97 C ATOM 1419 OE1 GLN A 211 7.700 1.459 1.196 1.00 1.55 O ATOM 1420 NE2 GLN A 211 8.996 0.412 2.693 1.00 1.56 N ATOM 0 H GLN A 211 3.974 0.993 3.495 1.00 0.27 H new ATOM 0 HA GLN A 211 5.219 3.395 4.536 1.00 0.31 H new ATOM 0 HB2 GLN A 211 7.259 2.173 4.368 1.00 0.34 H new ATOM 0 HB3 GLN A 211 6.031 1.158 5.099 1.00 0.34 H new ATOM 0 HG2 GLN A 211 6.790 -0.403 3.652 1.00 0.39 H new ATOM 0 HG3 GLN A 211 5.744 0.408 2.503 1.00 0.39 H new ATOM 0 HE21 GLN A 211 9.056 -0.091 3.578 1.00 1.56 H new ATOM 0 HE22 GLN A 211 9.839 0.579 2.143 1.00 1.56 H new ATOM 1429 N MET A 212 4.867 2.857 1.414 1.00 0.30 N ATOM 1430 CA MET A 212 4.994 3.387 0.085 1.00 0.31 C ATOM 1431 C MET A 212 4.001 4.511 -0.120 1.00 0.30 C ATOM 1432 O MET A 212 4.237 5.429 -0.889 1.00 0.33 O ATOM 1433 CB MET A 212 4.768 2.269 -0.903 1.00 0.34 C ATOM 1434 CG MET A 212 5.502 2.460 -2.205 1.00 1.17 C ATOM 1435 SD MET A 212 4.700 3.647 -3.297 1.00 1.65 S ATOM 1436 CE MET A 212 3.035 2.991 -3.265 1.00 0.37 C ATOM 0 H MET A 212 4.179 2.108 1.498 1.00 0.30 H new ATOM 0 HA MET A 212 5.993 3.797 -0.066 1.00 0.31 H new ATOM 0 HB2 MET A 212 5.082 1.328 -0.452 1.00 0.34 H new ATOM 0 HB3 MET A 212 3.700 2.184 -1.106 1.00 0.34 H new ATOM 0 HG2 MET A 212 6.518 2.795 -1.997 1.00 1.17 H new ATOM 0 HG3 MET A 212 5.581 1.500 -2.716 1.00 1.17 H new ATOM 0 HE1 MET A 212 2.759 2.650 -4.263 1.00 0.37 H new ATOM 0 HE2 MET A 212 2.987 2.153 -2.569 1.00 0.37 H new ATOM 0 HE3 MET A 212 2.343 3.770 -2.943 1.00 0.37 H new ATOM 1446 N CYS A 213 2.886 4.425 0.577 1.00 0.28 N ATOM 1447 CA CYS A 213 1.950 5.528 0.671 1.00 0.27 C ATOM 1448 C CYS A 213 2.660 6.696 1.321 1.00 0.25 C ATOM 1449 O CYS A 213 2.488 7.850 0.950 1.00 0.25 O ATOM 1450 CB CYS A 213 0.764 5.114 1.522 1.00 0.36 C ATOM 1451 SG CYS A 213 -0.600 6.302 1.568 1.00 0.42 S ATOM 0 H CYS A 213 2.603 3.592 1.093 1.00 0.28 H new ATOM 0 HA CYS A 213 1.593 5.809 -0.320 1.00 0.27 H new ATOM 0 HB2 CYS A 213 0.384 4.163 1.150 1.00 0.36 H new ATOM 0 HB3 CYS A 213 1.110 4.942 2.541 1.00 0.36 H new ATOM 1456 N ILE A 214 3.467 6.351 2.308 1.00 0.25 N ATOM 1457 CA ILE A 214 4.347 7.282 2.973 1.00 0.27 C ATOM 1458 C ILE A 214 5.415 7.787 2.002 1.00 0.27 C ATOM 1459 O ILE A 214 5.714 8.981 1.957 1.00 0.29 O ATOM 1460 CB ILE A 214 4.996 6.587 4.190 1.00 0.30 C ATOM 1461 CG1 ILE A 214 4.297 6.983 5.489 1.00 0.33 C ATOM 1462 CG2 ILE A 214 6.464 6.898 4.268 1.00 0.31 C ATOM 1463 CD1 ILE A 214 4.784 6.221 6.702 1.00 0.36 C ATOM 0 H ILE A 214 3.527 5.400 2.672 1.00 0.25 H new ATOM 0 HA ILE A 214 3.774 8.142 3.319 1.00 0.27 H new ATOM 0 HB ILE A 214 4.880 5.512 4.056 1.00 0.30 H new ATOM 0 HG12 ILE A 214 4.444 8.050 5.659 1.00 0.33 H new ATOM 0 HG13 ILE A 214 3.225 6.822 5.377 1.00 0.33 H new ATOM 0 HG21 ILE A 214 6.897 6.396 5.134 1.00 0.31 H new ATOM 0 HG22 ILE A 214 6.959 6.549 3.362 1.00 0.31 H new ATOM 0 HG23 ILE A 214 6.603 7.975 4.365 1.00 0.31 H new ATOM 0 HD11 ILE A 214 4.241 6.558 7.585 1.00 0.36 H new ATOM 0 HD12 ILE A 214 4.612 5.155 6.555 1.00 0.36 H new ATOM 0 HD13 ILE A 214 5.850 6.401 6.841 1.00 0.36 H new ATOM 1475 N THR A 215 5.971 6.868 1.220 1.00 0.28 N ATOM 1476 CA THR A 215 6.945 7.214 0.203 1.00 0.30 C ATOM 1477 C THR A 215 6.320 8.159 -0.811 1.00 0.30 C ATOM 1478 O THR A 215 6.906 9.171 -1.191 1.00 0.34 O ATOM 1479 CB THR A 215 7.463 5.957 -0.520 1.00 0.34 C ATOM 1480 OG1 THR A 215 8.100 5.075 0.416 1.00 0.37 O ATOM 1481 CG2 THR A 215 8.437 6.331 -1.625 1.00 0.39 C ATOM 0 H THR A 215 5.759 5.872 1.276 1.00 0.28 H new ATOM 0 HA THR A 215 7.787 7.703 0.694 1.00 0.30 H new ATOM 0 HB THR A 215 6.611 5.447 -0.969 1.00 0.34 H new ATOM 0 HG1 THR A 215 7.489 4.890 1.159 1.00 0.37 H new ATOM 0 HG21 THR A 215 8.789 5.427 -2.121 1.00 0.39 H new ATOM 0 HG22 THR A 215 7.935 6.971 -2.351 1.00 0.39 H new ATOM 0 HG23 THR A 215 9.286 6.864 -1.197 1.00 0.39 H new ATOM 1489 N GLN A 216 5.115 7.831 -1.238 1.00 0.30 N ATOM 1490 CA GLN A 216 4.386 8.693 -2.135 1.00 0.32 C ATOM 1491 C GLN A 216 3.869 9.937 -1.403 1.00 0.30 C ATOM 1492 O GLN A 216 3.512 10.911 -2.035 1.00 0.45 O ATOM 1493 CB GLN A 216 3.245 7.918 -2.817 1.00 0.44 C ATOM 1494 CG GLN A 216 2.428 8.742 -3.810 1.00 1.08 C ATOM 1495 CD GLN A 216 3.172 9.051 -5.089 1.00 1.76 C ATOM 1496 OE1 GLN A 216 4.395 9.094 -5.115 1.00 2.17 O ATOM 1497 NE2 GLN A 216 2.435 9.292 -6.161 1.00 2.60 N ATOM 0 H GLN A 216 4.626 6.975 -0.976 1.00 0.30 H new ATOM 0 HA GLN A 216 5.066 9.037 -2.914 1.00 0.32 H new ATOM 0 HB2 GLN A 216 3.667 7.058 -3.337 1.00 0.44 H new ATOM 0 HB3 GLN A 216 2.576 7.529 -2.049 1.00 0.44 H new ATOM 0 HG2 GLN A 216 1.513 8.202 -4.052 1.00 1.08 H new ATOM 0 HG3 GLN A 216 2.130 9.678 -3.336 1.00 1.08 H new ATOM 0 HE21 GLN A 216 1.418 9.247 -6.101 1.00 2.60 H new ATOM 0 HE22 GLN A 216 2.884 9.523 -7.047 1.00 2.60 H new ATOM 1506 N TYR A 217 3.848 9.919 -0.067 1.00 0.27 N ATOM 1507 CA TYR A 217 3.460 11.109 0.697 1.00 0.29 C ATOM 1508 C TYR A 217 4.572 12.142 0.629 1.00 0.30 C ATOM 1509 O TYR A 217 4.326 13.299 0.309 1.00 0.31 O ATOM 1510 CB TYR A 217 3.148 10.781 2.169 1.00 0.37 C ATOM 1511 CG TYR A 217 2.404 11.882 2.904 1.00 0.56 C ATOM 1512 CD1 TYR A 217 2.983 13.133 3.073 1.00 0.80 C ATOM 1513 CD2 TYR A 217 1.127 11.679 3.420 1.00 1.06 C ATOM 1514 CE1 TYR A 217 2.318 14.145 3.737 1.00 0.95 C ATOM 1515 CE2 TYR A 217 0.457 12.686 4.086 1.00 1.26 C ATOM 1516 CZ TYR A 217 1.023 13.884 4.257 1.00 1.04 C ATOM 1517 OH TYR A 217 0.396 14.922 4.907 1.00 1.26 O ATOM 0 H TYR A 217 4.091 9.107 0.501 1.00 0.27 H new ATOM 0 HA TYR A 217 2.548 11.505 0.249 1.00 0.29 H new ATOM 0 HB2 TYR A 217 2.555 9.867 2.209 1.00 0.37 H new ATOM 0 HB3 TYR A 217 4.083 10.578 2.691 1.00 0.37 H new ATOM 0 HD1 TYR A 217 3.971 13.318 2.678 1.00 0.80 H new ATOM 0 HD2 TYR A 217 0.652 10.717 3.297 1.00 1.06 H new ATOM 0 HE1 TYR A 217 2.774 15.116 3.858 1.00 0.95 H new ATOM 0 HE2 TYR A 217 -0.535 12.503 4.473 1.00 1.26 H new ATOM 0 HH TYR A 217 1.058 15.441 5.409 1.00 1.26 H new ATOM 1527 N GLN A 218 5.798 11.722 0.928 1.00 0.33 N ATOM 1528 CA GLN A 218 6.940 12.627 0.859 1.00 0.42 C ATOM 1529 C GLN A 218 7.139 13.090 -0.583 1.00 0.46 C ATOM 1530 O GLN A 218 7.578 14.213 -0.840 1.00 0.58 O ATOM 1531 CB GLN A 218 8.210 11.945 1.385 1.00 0.47 C ATOM 1532 CG GLN A 218 8.689 10.806 0.509 1.00 0.63 C ATOM 1533 CD GLN A 218 9.974 10.177 0.998 1.00 1.23 C ATOM 1534 OE1 GLN A 218 9.956 9.231 1.785 1.00 1.83 O ATOM 1535 NE2 GLN A 218 11.097 10.693 0.532 1.00 1.97 N ATOM 0 H GLN A 218 6.025 10.771 1.218 1.00 0.33 H new ATOM 0 HA GLN A 218 6.741 13.494 1.489 1.00 0.42 H new ATOM 0 HB2 GLN A 218 9.004 12.687 1.469 1.00 0.47 H new ATOM 0 HB3 GLN A 218 8.020 11.566 2.389 1.00 0.47 H new ATOM 0 HG2 GLN A 218 7.913 10.042 0.462 1.00 0.63 H new ATOM 0 HG3 GLN A 218 8.836 11.174 -0.506 1.00 0.63 H new ATOM 0 HE21 GLN A 218 11.066 11.477 -0.119 1.00 1.97 H new ATOM 0 HE22 GLN A 218 11.995 10.307 0.823 1.00 1.97 H new ATOM 1544 N GLN A 219 6.789 12.219 -1.520 1.00 0.42 N ATOM 1545 CA GLN A 219 6.846 12.550 -2.932 1.00 0.53 C ATOM 1546 C GLN A 219 5.715 13.506 -3.300 1.00 0.51 C ATOM 1547 O GLN A 219 5.941 14.518 -3.961 1.00 0.58 O ATOM 1548 CB GLN A 219 6.779 11.272 -3.765 1.00 0.60 C ATOM 1549 CG GLN A 219 6.697 11.517 -5.260 1.00 0.78 C ATOM 1550 CD GLN A 219 7.380 10.425 -6.062 1.00 0.98 C ATOM 1551 OE1 GLN A 219 8.570 10.510 -6.363 1.00 1.58 O ATOM 1552 NE2 GLN A 219 6.647 9.382 -6.396 1.00 1.70 N ATOM 0 H GLN A 219 6.461 11.273 -1.323 1.00 0.42 H new ATOM 0 HA GLN A 219 7.790 13.052 -3.145 1.00 0.53 H new ATOM 0 HB2 GLN A 219 7.660 10.666 -3.554 1.00 0.60 H new ATOM 0 HB3 GLN A 219 5.910 10.692 -3.453 1.00 0.60 H new ATOM 0 HG2 GLN A 219 5.651 11.583 -5.558 1.00 0.78 H new ATOM 0 HG3 GLN A 219 7.156 12.477 -5.494 1.00 0.78 H new ATOM 0 HE21 GLN A 219 5.663 9.344 -6.130 1.00 1.70 H new ATOM 0 HE22 GLN A 219 7.064 8.613 -6.920 1.00 1.70 H new ATOM 1561 N GLU A 220 4.508 13.186 -2.847 1.00 0.45 N ATOM 1562 CA GLU A 220 3.339 14.037 -3.054 1.00 0.46 C ATOM 1563 C GLU A 220 3.592 15.406 -2.450 1.00 0.46 C ATOM 1564 O GLU A 220 3.229 16.427 -3.020 1.00 0.49 O ATOM 1565 CB GLU A 220 2.107 13.404 -2.395 1.00 0.45 C ATOM 1566 CG GLU A 220 0.862 13.399 -3.264 1.00 0.75 C ATOM 1567 CD GLU A 220 1.154 13.141 -4.729 1.00 1.21 C ATOM 1568 OE1 GLU A 220 1.459 11.980 -5.085 1.00 1.74 O ATOM 1569 OE2 GLU A 220 1.088 14.090 -5.533 1.00 1.62 O ATOM 0 H GLU A 220 4.311 12.331 -2.327 1.00 0.45 H new ATOM 0 HA GLU A 220 3.158 14.140 -4.124 1.00 0.46 H new ATOM 0 HB2 GLU A 220 2.346 12.377 -2.118 1.00 0.45 H new ATOM 0 HB3 GLU A 220 1.888 13.940 -1.472 1.00 0.45 H new ATOM 0 HG2 GLU A 220 0.175 12.636 -2.898 1.00 0.75 H new ATOM 0 HG3 GLU A 220 0.355 14.359 -3.165 1.00 0.75 H new ATOM 1576 N SER A 221 4.243 15.400 -1.299 1.00 0.46 N ATOM 1577 CA SER A 221 4.593 16.613 -0.586 1.00 0.51 C ATOM 1578 C SER A 221 5.403 17.556 -1.481 1.00 0.56 C ATOM 1579 O SER A 221 5.121 18.750 -1.567 1.00 0.63 O ATOM 1580 CB SER A 221 5.400 16.241 0.664 1.00 0.52 C ATOM 1581 OG SER A 221 5.606 17.356 1.516 1.00 0.74 O ATOM 0 H SER A 221 4.545 14.546 -0.831 1.00 0.46 H new ATOM 0 HA SER A 221 3.681 17.133 -0.293 1.00 0.51 H new ATOM 0 HB2 SER A 221 4.877 15.457 1.213 1.00 0.52 H new ATOM 0 HB3 SER A 221 6.364 15.831 0.364 1.00 0.52 H new ATOM 0 HG SER A 221 4.841 17.965 1.449 1.00 0.74 H new ATOM 1587 N GLN A 222 6.395 17.007 -2.169 1.00 0.57 N ATOM 1588 CA GLN A 222 7.276 17.810 -3.008 1.00 0.68 C ATOM 1589 C GLN A 222 6.698 18.003 -4.385 1.00 0.69 C ATOM 1590 O GLN A 222 7.000 18.977 -5.065 1.00 0.79 O ATOM 1591 CB GLN A 222 8.637 17.163 -3.114 1.00 0.77 C ATOM 1592 CG GLN A 222 9.306 17.049 -1.772 1.00 1.19 C ATOM 1593 CD GLN A 222 10.791 16.759 -1.870 1.00 1.31 C ATOM 1594 OE1 GLN A 222 11.192 16.073 -2.930 1.00 1.81 O flip ATOM 1595 NE2 GLN A 222 11.572 17.151 -1.005 1.00 1.52 N flip ATOM 0 H GLN A 222 6.610 16.010 -2.163 1.00 0.57 H new ATOM 0 HA GLN A 222 7.376 18.788 -2.538 1.00 0.68 H new ATOM 0 HB2 GLN A 222 8.535 16.171 -3.555 1.00 0.77 H new ATOM 0 HB3 GLN A 222 9.266 17.747 -3.786 1.00 0.77 H new ATOM 0 HG2 GLN A 222 9.159 17.977 -1.219 1.00 1.19 H new ATOM 0 HG3 GLN A 222 8.824 16.257 -1.199 1.00 1.19 H new ATOM 0 HE21 GLN A 222 11.223 17.677 -0.203 1.00 1.52 H new ATOM 0 HE22 GLN A 222 12.569 16.951 -1.089 1.00 1.52 H new ATOM 1604 N ALA A 223 5.875 17.078 -4.804 1.00 0.64 N ATOM 1605 CA ALA A 223 5.167 17.246 -6.043 1.00 0.71 C ATOM 1606 C ALA A 223 4.157 18.367 -5.885 1.00 0.71 C ATOM 1607 O ALA A 223 3.926 19.148 -6.804 1.00 0.82 O ATOM 1608 CB ALA A 223 4.502 15.957 -6.449 1.00 0.72 C ATOM 0 H ALA A 223 5.680 16.208 -4.309 1.00 0.64 H new ATOM 0 HA ALA A 223 5.866 17.512 -6.836 1.00 0.71 H new ATOM 0 HB1 ALA A 223 3.970 16.102 -7.389 1.00 0.72 H new ATOM 0 HB2 ALA A 223 5.258 15.182 -6.575 1.00 0.72 H new ATOM 0 HB3 ALA A 223 3.796 15.653 -5.676 1.00 0.72 H new ATOM 1614 N ALA A 224 3.581 18.452 -4.692 1.00 0.65 N ATOM 1615 CA ALA A 224 2.699 19.548 -4.334 1.00 0.72 C ATOM 1616 C ALA A 224 3.502 20.805 -4.095 1.00 0.82 C ATOM 1617 O ALA A 224 3.017 21.905 -4.310 1.00 0.93 O ATOM 1618 CB ALA A 224 1.874 19.192 -3.110 1.00 0.75 C ATOM 0 H ALA A 224 3.713 17.764 -3.950 1.00 0.65 H new ATOM 0 HA ALA A 224 2.012 19.729 -5.161 1.00 0.72 H new ATOM 0 HB1 ALA A 224 1.219 20.026 -2.857 1.00 0.75 H new ATOM 0 HB2 ALA A 224 1.271 18.309 -3.322 1.00 0.75 H new ATOM 0 HB3 ALA A 224 2.538 18.985 -2.271 1.00 0.75 H new ATOM 1624 N TYR A 225 4.732 20.626 -3.655 1.00 0.88 N ATOM 1625 CA TYR A 225 5.695 21.711 -3.616 1.00 1.02 C ATOM 1626 C TYR A 225 5.837 22.316 -5.013 1.00 1.13 C ATOM 1627 O TYR A 225 6.009 23.524 -5.169 1.00 1.30 O ATOM 1628 CB TYR A 225 7.031 21.175 -3.098 1.00 1.02 C ATOM 1629 CG TYR A 225 8.250 21.915 -3.592 1.00 1.29 C ATOM 1630 CD1 TYR A 225 8.859 21.578 -4.788 1.00 2.15 C ATOM 1631 CD2 TYR A 225 8.781 22.963 -2.854 1.00 1.62 C ATOM 1632 CE1 TYR A 225 9.968 22.267 -5.240 1.00 2.88 C ATOM 1633 CE2 TYR A 225 9.890 23.656 -3.295 1.00 2.22 C ATOM 1634 CZ TYR A 225 10.507 23.247 -4.509 1.00 2.75 C ATOM 1635 OH TYR A 225 11.582 23.992 -4.941 1.00 3.57 O ATOM 0 H TYR A 225 5.091 19.733 -3.317 1.00 0.88 H new ATOM 0 HA TYR A 225 5.356 22.498 -2.942 1.00 1.02 H new ATOM 0 HB2 TYR A 225 7.021 21.209 -2.009 1.00 1.02 H new ATOM 0 HB3 TYR A 225 7.120 20.127 -3.384 1.00 1.02 H new ATOM 0 HD1 TYR A 225 8.462 20.764 -5.377 1.00 2.15 H new ATOM 0 HD2 TYR A 225 8.319 23.241 -1.918 1.00 1.62 H new ATOM 0 HE1 TYR A 225 10.404 22.011 -6.194 1.00 2.88 H new ATOM 0 HE2 TYR A 225 10.280 24.490 -2.731 1.00 2.22 H new ATOM 0 HH TYR A 225 11.817 24.654 -4.258 1.00 3.57 H new ATOM 1645 N GLN A 226 5.745 21.457 -6.024 1.00 1.09 N ATOM 1646 CA GLN A 226 5.810 21.888 -7.413 1.00 1.27 C ATOM 1647 C GLN A 226 4.472 22.475 -7.859 1.00 1.36 C ATOM 1648 O GLN A 226 4.430 23.469 -8.585 1.00 1.55 O ATOM 1649 CB GLN A 226 6.202 20.722 -8.318 1.00 1.32 C ATOM 1650 CG GLN A 226 7.519 20.071 -7.929 1.00 1.60 C ATOM 1651 CD GLN A 226 7.885 18.909 -8.828 1.00 2.19 C ATOM 1652 OE1 GLN A 226 7.502 17.767 -8.574 1.00 2.87 O ATOM 1653 NE2 GLN A 226 8.638 19.190 -9.876 1.00 2.60 N ATOM 0 H GLN A 226 5.624 20.451 -5.903 1.00 1.09 H new ATOM 0 HA GLN A 226 6.572 22.663 -7.493 1.00 1.27 H new ATOM 0 HB2 GLN A 226 5.413 19.971 -8.292 1.00 1.32 H new ATOM 0 HB3 GLN A 226 6.271 21.077 -9.346 1.00 1.32 H new ATOM 0 HG2 GLN A 226 8.313 20.817 -7.965 1.00 1.60 H new ATOM 0 HG3 GLN A 226 7.456 19.722 -6.898 1.00 1.60 H new ATOM 0 HE21 GLN A 226 8.933 20.151 -10.049 1.00 2.60 H new ATOM 0 HE22 GLN A 226 8.924 18.446 -10.512 1.00 2.60 H new ATOM 1662 N ARG A 227 3.384 21.853 -7.413 1.00 1.25 N ATOM 1663 CA ARG A 227 2.032 22.304 -7.749 1.00 1.35 C ATOM 1664 C ARG A 227 1.717 23.634 -7.080 1.00 1.38 C ATOM 1665 O ARG A 227 0.845 24.379 -7.528 1.00 1.46 O ATOM 1666 CB ARG A 227 0.994 21.284 -7.284 1.00 1.32 C ATOM 1667 CG ARG A 227 1.224 19.879 -7.802 1.00 1.00 C ATOM 1668 CD ARG A 227 0.405 18.872 -7.014 1.00 1.08 C ATOM 1669 NE ARG A 227 -1.028 18.961 -7.303 1.00 1.97 N ATOM 1670 CZ ARG A 227 -1.783 17.926 -7.673 1.00 2.50 C ATOM 1671 NH1 ARG A 227 -1.245 16.719 -7.822 1.00 2.39 N ATOM 1672 NH2 ARG A 227 -3.081 18.102 -7.883 1.00 3.59 N ATOM 0 H ARG A 227 3.411 21.028 -6.813 1.00 1.25 H new ATOM 0 HA ARG A 227 1.991 22.417 -8.832 1.00 1.35 H new ATOM 0 HB2 ARG A 227 0.988 21.260 -6.194 1.00 1.32 H new ATOM 0 HB3 ARG A 227 0.006 21.618 -7.601 1.00 1.32 H new ATOM 0 HG2 ARG A 227 0.955 19.827 -8.857 1.00 1.00 H new ATOM 0 HG3 ARG A 227 2.283 19.629 -7.730 1.00 1.00 H new ATOM 0 HD2 ARG A 227 0.756 17.866 -7.242 1.00 1.08 H new ATOM 0 HD3 ARG A 227 0.567 19.032 -5.948 1.00 1.08 H new ATOM 0 HE ARG A 227 -1.477 19.873 -7.216 1.00 1.97 H new ATOM 0 HH11 ARG A 227 -0.249 16.580 -7.653 1.00 2.39 H new ATOM 0 HH12 ARG A 227 -1.829 15.932 -8.105 1.00 2.39 H new ATOM 0 HH21 ARG A 227 -3.497 19.025 -7.761 1.00 3.59 H new ATOM 0 HH22 ARG A 227 -3.663 17.314 -8.166 1.00 3.59 H new ATOM 1686 N ALA A 228 2.413 23.899 -5.987 1.00 1.34 N ATOM 1687 CA ALA A 228 2.160 25.075 -5.181 1.00 1.43 C ATOM 1688 C ALA A 228 2.557 26.342 -5.927 1.00 1.64 C ATOM 1689 CB ALA A 228 2.902 24.975 -3.856 1.00 1.40 C ATOM 0 H ALA A 228 3.166 23.306 -5.637 1.00 1.34 H new ATOM 0 HA ALA A 228 1.091 25.128 -4.977 1.00 1.43 H new ATOM 0 HB1 ALA A 228 2.703 25.865 -3.260 1.00 1.40 H new ATOM 0 HB2 ALA A 228 2.562 24.092 -3.314 1.00 1.40 H new ATOM 0 HB3 ALA A 228 3.973 24.896 -4.044 1.00 1.40 H new TER 1695 ALA A 228