USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1286 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 154 CYS SG : rot 120:sc= -2.17 USER MOD Set 1.2: A 162 CYS SG : rot -59:sc= -1.97 USER MOD Set 2.1: A 122 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 151 SER OG : rot -7:sc= 0.691 USER MOD Set 2.3: A 156 TYR OH : rot -99:sc= 1.03 USER MOD Set 3.1: A 60 HIS :FLIP no HE2:sc= 0.418 F(o=-1.7,f=-1) USER MOD Set 3.2: A 80 HIS : no HD1:sc= -0.301 K(o=-1,f=-7.5) USER MOD Set 3.3: A 83 THR OG1 : rot 104:sc= 0.843 USER MOD Set 3.4: A 96 HIS : no HE2:sc= -1.99 K(o=-1,f=-6.2!) USER MOD Single : A 5 THR OG1 : rot 29:sc= 0.266 USER MOD Single : A 10 THR OG1 : rot 67:sc= 1.23 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 13 GLN : amide:sc= 0.012 X(o=0.012,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.467 X(o=-0.47,f=-0.33) USER MOD Single : A 19 LYS NZ :NH3+ -161:sc= 1.15 (180deg=0.548) USER MOD Single : A 24 SER OG : rot 180:sc= 0.305 USER MOD Single : A 26 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-3.2!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 34:sc= 0.0121 USER MOD Single : A 43 SER OG : rot 150:sc= 0.0195 USER MOD Single : A 44 TYR OH : rot 70:sc= 0.395 USER MOD Single : A 51 TYR OH : rot 40:sc= 0.222 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 89:sc= 0.0414 USER MOD Single : A 62 THR OG1 : rot 45:sc= 0.262 USER MOD Single : A 65 SER OG : rot 40:sc= 0.172 USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00361 USER MOD Single : A 71 SER OG : rot 62:sc= -0.81 USER MOD Single : A 75 THR OG1 : rot -124:sc=-0.00208 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 105 SER OG : rot -39:sc= 0.502 USER MOD Single : A 107 THR OG1 : rot -66:sc= 0.133 USER MOD Single : A 115 LYS NZ :NH3+ 162:sc= 0.31 (180deg=0.183) USER MOD Single : A 116 THR OG1 : rot -81:sc= 0.372 USER MOD Single : A 117 THR OG1 : rot 83:sc= 0.367 USER MOD Single : A 119 GLN : amide:sc= -0.202 X(o=-0.2,f=0) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot -110:sc= 0.791 USER MOD Single : A 127 TYR OH : rot 30:sc= -0.212 USER MOD Single : A 128 MET CE :methyl -165:sc= 0 (180deg=-0.45) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN :FLIP amide:sc= -0.762 F(o=-1.5,f=-0.76) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 78:sc= 0.691 USER MOD Single : A 159 THR OG1 : rot -21:sc= 0.162 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -2.32 K(o=-2.3,f=-3.8!) USER MOD Single : A 173 THR OG1 : rot -170:sc= 0 USER MOD Single : A 176 THR OG1 : rot 42:sc= 0.137 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.848 2.322 -16.903 1.00 31.13 N ATOM 60 CA THR A 5 -13.519 1.295 -15.890 1.00 55.25 C ATOM 61 C THR A 5 -12.205 0.534 -16.230 1.00 32.11 C ATOM 62 O THR A 5 -11.473 0.099 -15.331 1.00 30.21 O ATOM 63 CB THR A 5 -14.716 0.295 -15.750 1.00 32.12 C ATOM 64 OG1 THR A 5 -15.941 1.041 -15.619 1.00 33.12 O ATOM 65 CG2 THR A 5 -14.571 -0.659 -14.540 1.00 14.04 C ATOM 0 HA THR A 5 -13.353 1.801 -14.939 1.00 55.25 H new ATOM 0 HB THR A 5 -14.725 -0.324 -16.647 1.00 32.12 H new ATOM 0 HG1 THR A 5 -15.851 1.901 -16.080 1.00 33.12 H new ATOM 0 HG21 THR A 5 -15.432 -1.327 -14.498 1.00 14.04 H new ATOM 0 HG22 THR A 5 -13.660 -1.248 -14.648 1.00 14.04 H new ATOM 0 HG23 THR A 5 -14.519 -0.076 -13.621 1.00 14.04 H new ATOM 73 N GLU A 6 -11.891 0.416 -17.535 1.00 23.45 N ATOM 74 CA GLU A 6 -10.688 -0.306 -18.020 1.00 4.25 C ATOM 75 C GLU A 6 -9.420 0.548 -17.877 1.00 31.43 C ATOM 76 O GLU A 6 -8.327 0.070 -18.167 1.00 43.01 O ATOM 77 CB GLU A 6 -10.877 -0.746 -19.498 1.00 60.24 C ATOM 78 CG GLU A 6 -11.051 0.417 -20.488 1.00 1.31 C ATOM 79 CD GLU A 6 -11.404 -0.034 -21.913 1.00 54.05 C ATOM 80 OE1 GLU A 6 -12.515 -0.577 -22.113 1.00 53.35 O ATOM 81 OE2 GLU A 6 -10.579 0.144 -22.839 1.00 50.24 O ATOM 0 H GLU A 6 -12.458 0.815 -18.283 1.00 23.45 H new ATOM 0 HA GLU A 6 -10.564 -1.193 -17.399 1.00 4.25 H new ATOM 0 HB2 GLU A 6 -10.014 -1.339 -19.801 1.00 60.24 H new ATOM 0 HB3 GLU A 6 -11.750 -1.396 -19.562 1.00 60.24 H new ATOM 0 HG2 GLU A 6 -11.834 1.080 -20.122 1.00 1.31 H new ATOM 0 HG3 GLU A 6 -10.129 0.998 -20.518 1.00 1.31 H new ATOM 88 N ASP A 7 -9.583 1.812 -17.430 1.00 33.41 N ATOM 89 CA ASP A 7 -8.454 2.709 -17.100 1.00 12.45 C ATOM 90 C ASP A 7 -7.761 2.222 -15.811 1.00 63.14 C ATOM 91 O ASP A 7 -6.548 2.371 -15.650 1.00 72.40 O ATOM 92 CB ASP A 7 -8.941 4.168 -16.961 1.00 0.01 C ATOM 93 CG ASP A 7 -7.798 5.177 -16.739 1.00 43.24 C ATOM 94 OD1 ASP A 7 -6.932 5.304 -17.634 1.00 75.41 O ATOM 95 OD2 ASP A 7 -7.756 5.842 -15.678 1.00 52.14 O ATOM 0 H ASP A 7 -10.499 2.239 -17.288 1.00 33.41 H new ATOM 0 HA ASP A 7 -7.727 2.683 -17.912 1.00 12.45 H new ATOM 0 HB2 ASP A 7 -9.492 4.446 -17.859 1.00 0.01 H new ATOM 0 HB3 ASP A 7 -9.639 4.232 -16.126 1.00 0.01 H new ATOM 100 N TRP A 8 -8.563 1.655 -14.892 1.00 11.34 N ATOM 101 CA TRP A 8 -8.052 0.869 -13.750 1.00 33.21 C ATOM 102 C TRP A 8 -7.198 -0.310 -14.244 1.00 63.20 C ATOM 103 O TRP A 8 -6.136 -0.578 -13.688 1.00 23.55 O ATOM 104 CB TRP A 8 -9.220 0.365 -12.861 1.00 24.11 C ATOM 105 CG TRP A 8 -8.843 -0.711 -11.846 1.00 73.33 C ATOM 106 CD1 TRP A 8 -7.979 -0.597 -10.784 1.00 32.34 C ATOM 107 CD2 TRP A 8 -9.323 -2.066 -11.817 1.00 45.44 C ATOM 108 NE1 TRP A 8 -7.922 -1.779 -10.095 1.00 31.23 N ATOM 109 CE2 TRP A 8 -8.733 -2.695 -10.707 1.00 62.40 C ATOM 110 CE3 TRP A 8 -10.202 -2.801 -12.623 1.00 42.14 C ATOM 111 CZ2 TRP A 8 -8.995 -4.024 -10.378 1.00 62.14 C ATOM 112 CZ3 TRP A 8 -10.463 -4.119 -12.298 1.00 23.45 C ATOM 113 CH2 TRP A 8 -9.863 -4.719 -11.181 1.00 11.35 C ATOM 0 H TRP A 8 -9.580 1.727 -14.918 1.00 11.34 H new ATOM 0 HA TRP A 8 -7.421 1.519 -13.144 1.00 33.21 H new ATOM 0 HB2 TRP A 8 -9.642 1.216 -12.326 1.00 24.11 H new ATOM 0 HB3 TRP A 8 -10.005 -0.026 -13.507 1.00 24.11 H new ATOM 0 HD1 TRP A 8 -7.425 0.295 -10.530 1.00 32.34 H new ATOM 0 HE1 TRP A 8 -7.364 -1.949 -9.259 1.00 31.23 H new ATOM 0 HE3 TRP A 8 -10.668 -2.345 -13.484 1.00 42.14 H new ATOM 0 HZ2 TRP A 8 -8.531 -4.490 -9.521 1.00 62.14 H new ATOM 0 HZ3 TRP A 8 -11.139 -4.695 -12.913 1.00 23.45 H new ATOM 0 HH2 TRP A 8 -10.089 -5.749 -10.949 1.00 11.35 H new ATOM 124 N GLU A 9 -7.677 -1.009 -15.281 1.00 65.20 N ATOM 125 CA GLU A 9 -6.961 -2.160 -15.866 1.00 12.34 C ATOM 126 C GLU A 9 -5.669 -1.687 -16.590 1.00 3.01 C ATOM 127 O GLU A 9 -4.662 -2.407 -16.621 1.00 32.35 O ATOM 128 CB GLU A 9 -7.931 -2.937 -16.804 1.00 62.45 C ATOM 129 CG GLU A 9 -7.441 -4.319 -17.315 1.00 44.12 C ATOM 130 CD GLU A 9 -6.555 -4.250 -18.571 1.00 31.21 C ATOM 131 OE1 GLU A 9 -7.055 -3.815 -19.631 1.00 42.31 O ATOM 132 OE2 GLU A 9 -5.374 -4.653 -18.524 1.00 43.54 O ATOM 0 H GLU A 9 -8.564 -0.798 -15.738 1.00 65.20 H new ATOM 0 HA GLU A 9 -6.637 -2.843 -15.081 1.00 12.34 H new ATOM 0 HB2 GLU A 9 -8.873 -3.083 -16.275 1.00 62.45 H new ATOM 0 HB3 GLU A 9 -8.145 -2.309 -17.669 1.00 62.45 H new ATOM 0 HG2 GLU A 9 -6.884 -4.812 -16.518 1.00 44.12 H new ATOM 0 HG3 GLU A 9 -8.309 -4.943 -17.530 1.00 44.12 H new ATOM 139 N THR A 10 -5.706 -0.450 -17.125 1.00 72.22 N ATOM 140 CA THR A 10 -4.570 0.180 -17.828 1.00 20.13 C ATOM 141 C THR A 10 -3.419 0.509 -16.841 1.00 71.22 C ATOM 142 O THR A 10 -2.249 0.202 -17.113 1.00 5.04 O ATOM 143 CB THR A 10 -5.041 1.482 -18.563 1.00 72.11 C ATOM 144 OG1 THR A 10 -6.159 1.183 -19.405 1.00 3.34 O ATOM 145 CG2 THR A 10 -3.936 2.132 -19.421 1.00 62.23 C ATOM 0 H THR A 10 -6.533 0.145 -17.081 1.00 72.22 H new ATOM 0 HA THR A 10 -4.194 -0.528 -18.567 1.00 20.13 H new ATOM 0 HB THR A 10 -5.313 2.195 -17.784 1.00 72.11 H new ATOM 0 HG1 THR A 10 -6.930 0.940 -18.851 1.00 3.34 H new ATOM 0 HG21 THR A 10 -4.328 3.028 -19.902 1.00 62.23 H new ATOM 0 HG22 THR A 10 -3.093 2.401 -18.785 1.00 62.23 H new ATOM 0 HG23 THR A 10 -3.605 1.427 -20.183 1.00 62.23 H new ATOM 153 N GLN A 11 -3.755 1.154 -15.702 1.00 55.32 N ATOM 154 CA GLN A 11 -2.774 1.418 -14.622 1.00 63.43 C ATOM 155 C GLN A 11 -2.355 0.119 -13.898 1.00 24.25 C ATOM 156 O GLN A 11 -1.248 0.047 -13.378 1.00 20.22 O ATOM 157 CB GLN A 11 -3.320 2.467 -13.605 1.00 63.22 C ATOM 158 CG GLN A 11 -4.564 2.011 -12.809 1.00 33.21 C ATOM 159 CD GLN A 11 -5.137 3.057 -11.845 1.00 25.00 C ATOM 160 OE1 GLN A 11 -5.024 4.259 -12.063 1.00 13.45 O ATOM 161 NE2 GLN A 11 -5.785 2.603 -10.782 1.00 42.42 N ATOM 0 H GLN A 11 -4.694 1.501 -15.506 1.00 55.32 H new ATOM 0 HA GLN A 11 -1.884 1.834 -15.094 1.00 63.43 H new ATOM 0 HB2 GLN A 11 -2.527 2.716 -12.901 1.00 63.22 H new ATOM 0 HB3 GLN A 11 -3.566 3.381 -14.145 1.00 63.22 H new ATOM 0 HG2 GLN A 11 -5.343 1.724 -13.515 1.00 33.21 H new ATOM 0 HG3 GLN A 11 -4.305 1.118 -12.240 1.00 33.21 H new ATOM 0 HE21 GLN A 11 -5.865 1.598 -10.624 1.00 42.42 H new ATOM 0 HE22 GLN A 11 -6.204 3.258 -10.122 1.00 42.42 H new ATOM 170 N LEU A 12 -3.246 -0.898 -13.887 1.00 2.43 N ATOM 171 CA LEU A 12 -2.998 -2.214 -13.242 1.00 11.11 C ATOM 172 C LEU A 12 -1.849 -2.969 -13.934 1.00 31.23 C ATOM 173 O LEU A 12 -0.883 -3.387 -13.276 1.00 34.41 O ATOM 174 CB LEU A 12 -4.302 -3.071 -13.261 1.00 65.31 C ATOM 175 CG LEU A 12 -4.172 -4.602 -12.959 1.00 32.31 C ATOM 176 CD1 LEU A 12 -3.536 -4.872 -11.576 1.00 42.13 C ATOM 177 CD2 LEU A 12 -5.539 -5.316 -13.117 1.00 44.43 C ATOM 0 H LEU A 12 -4.164 -0.832 -14.327 1.00 2.43 H new ATOM 0 HA LEU A 12 -2.703 -2.036 -12.208 1.00 11.11 H new ATOM 0 HB2 LEU A 12 -4.994 -2.644 -12.536 1.00 65.31 H new ATOM 0 HB3 LEU A 12 -4.761 -2.961 -14.243 1.00 65.31 H new ATOM 0 HG LEU A 12 -3.490 -5.024 -13.698 1.00 32.31 H new ATOM 0 HD11 LEU A 12 -3.467 -5.947 -11.411 1.00 42.13 H new ATOM 0 HD12 LEU A 12 -2.538 -4.435 -11.543 1.00 42.13 H new ATOM 0 HD13 LEU A 12 -4.154 -4.425 -10.798 1.00 42.13 H new ATOM 0 HD21 LEU A 12 -5.422 -6.378 -12.902 1.00 44.43 H new ATOM 0 HD22 LEU A 12 -6.258 -4.882 -12.422 1.00 44.43 H new ATOM 0 HD23 LEU A 12 -5.899 -5.190 -14.138 1.00 44.43 H new ATOM 189 N GLN A 13 -1.975 -3.153 -15.259 1.00 43.01 N ATOM 190 CA GLN A 13 -0.974 -3.873 -16.068 1.00 63.32 C ATOM 191 C GLN A 13 0.401 -3.175 -16.000 1.00 71.40 C ATOM 192 O GLN A 13 1.427 -3.839 -16.092 1.00 50.20 O ATOM 193 CB GLN A 13 -1.458 -4.019 -17.537 1.00 13.01 C ATOM 194 CG GLN A 13 -1.691 -2.684 -18.259 1.00 53.24 C ATOM 195 CD GLN A 13 -2.203 -2.835 -19.687 1.00 41.45 C ATOM 196 OE1 GLN A 13 -1.420 -2.916 -20.634 1.00 45.22 O ATOM 197 NE2 GLN A 13 -3.513 -2.879 -19.850 1.00 73.12 N ATOM 0 H GLN A 13 -2.769 -2.809 -15.798 1.00 43.01 H new ATOM 0 HA GLN A 13 -0.856 -4.873 -15.651 1.00 63.32 H new ATOM 0 HB2 GLN A 13 -0.721 -4.597 -18.095 1.00 13.01 H new ATOM 0 HB3 GLN A 13 -2.386 -4.591 -17.547 1.00 13.01 H new ATOM 0 HG2 GLN A 13 -2.407 -2.093 -17.687 1.00 53.24 H new ATOM 0 HG3 GLN A 13 -0.756 -2.123 -18.276 1.00 53.24 H new ATOM 0 HE21 GLN A 13 -4.130 -2.809 -19.041 1.00 73.12 H new ATOM 0 HE22 GLN A 13 -3.907 -2.983 -20.785 1.00 73.12 H new ATOM 206 N ALA A 14 0.387 -1.833 -15.812 1.00 20.42 N ATOM 207 CA ALA A 14 1.605 -1.010 -15.663 1.00 21.45 C ATOM 208 C ALA A 14 2.245 -1.187 -14.260 1.00 55.11 C ATOM 209 O ALA A 14 3.474 -1.285 -14.152 1.00 52.12 O ATOM 210 CB ALA A 14 1.274 0.465 -15.943 1.00 5.21 C ATOM 0 H ALA A 14 -0.476 -1.291 -15.760 1.00 20.42 H new ATOM 0 HA ALA A 14 2.341 -1.349 -16.392 1.00 21.45 H new ATOM 0 HB1 ALA A 14 2.175 1.068 -15.832 1.00 5.21 H new ATOM 0 HB2 ALA A 14 0.893 0.566 -16.959 1.00 5.21 H new ATOM 0 HB3 ALA A 14 0.518 0.809 -15.237 1.00 5.21 H new ATOM 216 N ASN A 15 1.387 -1.211 -13.198 1.00 21.44 N ATOM 217 CA ASN A 15 1.800 -1.492 -11.785 1.00 43.03 C ATOM 218 C ASN A 15 2.661 -2.760 -11.711 1.00 53.43 C ATOM 219 O ASN A 15 3.797 -2.735 -11.234 1.00 64.04 O ATOM 220 CB ASN A 15 0.561 -1.694 -10.840 1.00 54.10 C ATOM 221 CG ASN A 15 -0.243 -0.430 -10.520 1.00 4.13 C ATOM 222 OD1 ASN A 15 0.308 0.662 -10.390 1.00 54.22 O ATOM 223 ND2 ASN A 15 -1.560 -0.572 -10.375 1.00 31.31 N ATOM 0 H ASN A 15 0.387 -1.036 -13.296 1.00 21.44 H new ATOM 0 HA ASN A 15 2.369 -0.624 -11.453 1.00 43.03 H new ATOM 0 HB2 ASN A 15 -0.108 -2.422 -11.299 1.00 54.10 H new ATOM 0 HB3 ASN A 15 0.909 -2.128 -9.903 1.00 54.10 H new ATOM 0 HD21 ASN A 15 -2.139 0.237 -10.150 1.00 31.31 H new ATOM 0 HD22 ASN A 15 -1.990 -1.490 -10.489 1.00 31.31 H new ATOM 230 N ARG A 16 2.089 -3.868 -12.209 1.00 13.34 N ATOM 231 CA ARG A 16 2.724 -5.196 -12.146 1.00 35.22 C ATOM 232 C ARG A 16 3.916 -5.286 -13.121 1.00 12.32 C ATOM 233 O ARG A 16 4.910 -5.922 -12.802 1.00 43.31 O ATOM 234 CB ARG A 16 1.694 -6.323 -12.431 1.00 74.24 C ATOM 235 CG ARG A 16 1.013 -6.236 -13.812 1.00 52.32 C ATOM 236 CD ARG A 16 0.194 -7.482 -14.168 1.00 70.51 C ATOM 237 NE ARG A 16 -0.869 -7.774 -13.190 1.00 20.44 N ATOM 238 CZ ARG A 16 -2.005 -8.438 -13.457 1.00 32.25 C ATOM 239 NH1 ARG A 16 -2.264 -8.891 -14.683 1.00 42.03 N ATOM 240 NH2 ARG A 16 -2.861 -8.676 -12.477 1.00 3.11 N ATOM 0 H ARG A 16 1.177 -3.870 -12.665 1.00 13.34 H new ATOM 0 HA ARG A 16 3.103 -5.334 -11.134 1.00 35.22 H new ATOM 0 HB2 ARG A 16 2.197 -7.286 -12.349 1.00 74.24 H new ATOM 0 HB3 ARG A 16 0.925 -6.298 -11.659 1.00 74.24 H new ATOM 0 HG2 ARG A 16 0.360 -5.363 -13.832 1.00 52.32 H new ATOM 0 HG3 ARG A 16 1.775 -6.081 -14.575 1.00 52.32 H new ATOM 0 HD2 ARG A 16 -0.254 -7.346 -15.152 1.00 70.51 H new ATOM 0 HD3 ARG A 16 0.862 -8.341 -14.237 1.00 70.51 H new ATOM 0 HE ARG A 16 -0.731 -7.446 -12.234 1.00 20.44 H new ATOM 0 HH11 ARG A 16 -1.594 -8.735 -15.436 1.00 42.03 H new ATOM 0 HH12 ARG A 16 -3.132 -9.394 -14.868 1.00 42.03 H new ATOM 0 HH21 ARG A 16 -2.655 -8.356 -11.531 1.00 3.11 H new ATOM 0 HH22 ARG A 16 -3.727 -9.179 -12.668 1.00 3.11 H new ATOM 254 N ASP A 17 3.809 -4.623 -14.291 1.00 50.45 N ATOM 255 CA ASP A 17 4.861 -4.631 -15.338 1.00 61.33 C ATOM 256 C ASP A 17 6.229 -4.236 -14.750 1.00 23.11 C ATOM 257 O ASP A 17 7.224 -4.956 -14.916 1.00 64.04 O ATOM 258 CB ASP A 17 4.466 -3.684 -16.507 1.00 50.32 C ATOM 259 CG ASP A 17 5.534 -3.574 -17.608 1.00 42.31 C ATOM 260 OD1 ASP A 17 5.721 -4.549 -18.363 1.00 4.15 O ATOM 261 OD2 ASP A 17 6.218 -2.527 -17.697 1.00 4.10 O ATOM 0 H ASP A 17 2.992 -4.066 -14.540 1.00 50.45 H new ATOM 0 HA ASP A 17 4.948 -5.645 -15.729 1.00 61.33 H new ATOM 0 HB2 ASP A 17 3.536 -4.039 -16.951 1.00 50.32 H new ATOM 0 HB3 ASP A 17 4.268 -2.690 -16.106 1.00 50.32 H new ATOM 266 N GLU A 18 6.245 -3.113 -14.016 1.00 63.11 N ATOM 267 CA GLU A 18 7.478 -2.559 -13.437 1.00 53.00 C ATOM 268 C GLU A 18 7.797 -3.168 -12.055 1.00 30.44 C ATOM 269 O GLU A 18 8.953 -3.492 -11.784 1.00 62.24 O ATOM 270 CB GLU A 18 7.395 -1.008 -13.352 1.00 51.40 C ATOM 271 CG GLU A 18 6.231 -0.442 -12.513 1.00 22.11 C ATOM 272 CD GLU A 18 6.264 1.086 -12.391 1.00 61.14 C ATOM 273 OE1 GLU A 18 6.069 1.780 -13.415 1.00 33.30 O ATOM 274 OE2 GLU A 18 6.520 1.604 -11.279 1.00 71.14 O ATOM 0 H GLU A 18 5.409 -2.566 -13.808 1.00 63.11 H new ATOM 0 HA GLU A 18 8.298 -2.829 -14.103 1.00 53.00 H new ATOM 0 HB2 GLU A 18 8.332 -0.635 -12.937 1.00 51.40 H new ATOM 0 HB3 GLU A 18 7.315 -0.611 -14.364 1.00 51.40 H new ATOM 0 HG2 GLU A 18 5.286 -0.744 -12.964 1.00 22.11 H new ATOM 0 HG3 GLU A 18 6.263 -0.881 -11.516 1.00 22.11 H new ATOM 281 N LYS A 19 6.772 -3.340 -11.186 1.00 54.40 N ATOM 282 CA LYS A 19 6.990 -3.684 -9.752 1.00 24.32 C ATOM 283 C LYS A 19 7.309 -5.179 -9.552 1.00 2.02 C ATOM 284 O LYS A 19 8.167 -5.536 -8.729 1.00 13.23 O ATOM 285 CB LYS A 19 5.779 -3.266 -8.877 1.00 22.15 C ATOM 286 CG LYS A 19 6.055 -3.299 -7.351 1.00 22.44 C ATOM 287 CD LYS A 19 4.835 -2.877 -6.499 1.00 71.45 C ATOM 288 CE LYS A 19 4.335 -1.463 -6.839 1.00 22.32 C ATOM 289 NZ LYS A 19 5.392 -0.431 -6.662 1.00 31.10 N ATOM 0 H LYS A 19 5.790 -3.248 -11.447 1.00 54.40 H new ATOM 0 HA LYS A 19 7.862 -3.116 -9.427 1.00 24.32 H new ATOM 0 HB2 LYS A 19 5.473 -2.258 -9.158 1.00 22.15 H new ATOM 0 HB3 LYS A 19 4.941 -3.927 -9.098 1.00 22.15 H new ATOM 0 HG2 LYS A 19 6.358 -4.306 -7.065 1.00 22.44 H new ATOM 0 HG3 LYS A 19 6.892 -2.639 -7.126 1.00 22.44 H new ATOM 0 HD2 LYS A 19 4.026 -3.591 -6.652 1.00 71.45 H new ATOM 0 HD3 LYS A 19 5.102 -2.920 -5.443 1.00 71.45 H new ATOM 0 HE2 LYS A 19 3.981 -1.444 -7.870 1.00 22.32 H new ATOM 0 HE3 LYS A 19 3.483 -1.219 -6.204 1.00 22.32 H new ATOM 0 HZ1 LYS A 19 4.951 0.508 -6.584 1.00 31.10 H new ATOM 0 HZ2 LYS A 19 5.932 -0.632 -5.797 1.00 31.10 H new ATOM 0 HZ3 LYS A 19 6.032 -0.446 -7.481 1.00 31.10 H new ATOM 303 N ASP A 20 6.634 -6.041 -10.327 1.00 71.12 N ATOM 304 CA ASP A 20 6.833 -7.515 -10.278 1.00 21.04 C ATOM 305 C ASP A 20 8.229 -7.906 -10.818 1.00 3.13 C ATOM 306 O ASP A 20 8.693 -9.031 -10.594 1.00 15.42 O ATOM 307 CB ASP A 20 5.679 -8.226 -11.043 1.00 33.22 C ATOM 308 CG ASP A 20 5.831 -9.749 -11.174 1.00 74.11 C ATOM 309 OD1 ASP A 20 5.496 -10.477 -10.223 1.00 3.35 O ATOM 310 OD2 ASP A 20 6.280 -10.224 -12.239 1.00 13.42 O ATOM 0 H ASP A 20 5.934 -5.746 -11.008 1.00 71.12 H new ATOM 0 HA ASP A 20 6.801 -7.849 -9.241 1.00 21.04 H new ATOM 0 HB2 ASP A 20 4.739 -8.012 -10.534 1.00 33.22 H new ATOM 0 HB3 ASP A 20 5.606 -7.796 -12.042 1.00 33.22 H new ATOM 315 N ARG A 21 8.905 -6.969 -11.520 1.00 52.42 N ATOM 316 CA ARG A 21 10.314 -7.153 -11.934 1.00 63.22 C ATOM 317 C ARG A 21 11.263 -6.270 -11.099 1.00 13.45 C ATOM 318 O ARG A 21 12.455 -6.534 -11.069 1.00 13.22 O ATOM 319 CB ARG A 21 10.523 -6.885 -13.453 1.00 25.35 C ATOM 320 CG ARG A 21 10.674 -5.406 -13.881 1.00 4.05 C ATOM 321 CD ARG A 21 11.294 -5.275 -15.283 1.00 22.24 C ATOM 322 NE ARG A 21 11.619 -3.875 -15.620 1.00 75.43 N ATOM 323 CZ ARG A 21 12.817 -3.423 -16.029 1.00 61.43 C ATOM 324 NH1 ARG A 21 13.856 -4.247 -16.156 1.00 75.44 N ATOM 325 NH2 ARG A 21 12.959 -2.142 -16.323 1.00 52.51 N ATOM 0 H ARG A 21 8.499 -6.080 -11.811 1.00 52.42 H new ATOM 0 HA ARG A 21 10.557 -8.199 -11.748 1.00 63.22 H new ATOM 0 HB2 ARG A 21 11.413 -7.425 -13.775 1.00 25.35 H new ATOM 0 HB3 ARG A 21 9.678 -7.312 -13.994 1.00 25.35 H new ATOM 0 HG2 ARG A 21 9.697 -4.923 -13.870 1.00 4.05 H new ATOM 0 HG3 ARG A 21 11.298 -4.881 -13.158 1.00 4.05 H new ATOM 0 HD2 ARG A 21 12.200 -5.879 -15.336 1.00 22.24 H new ATOM 0 HD3 ARG A 21 10.601 -5.674 -16.024 1.00 22.24 H new ATOM 0 HE ARG A 21 10.868 -3.190 -15.535 1.00 75.43 H new ATOM 0 HH11 ARG A 21 13.750 -5.239 -15.942 1.00 75.44 H new ATOM 0 HH12 ARG A 21 14.758 -3.886 -16.468 1.00 75.44 H new ATOM 0 HH21 ARG A 21 12.164 -1.508 -16.238 1.00 52.51 H new ATOM 0 HH22 ARG A 21 13.863 -1.787 -16.634 1.00 52.51 H new ATOM 339 N PHE A 22 10.719 -5.216 -10.450 1.00 45.32 N ATOM 340 CA PHE A 22 11.479 -4.247 -9.600 1.00 32.43 C ATOM 341 C PHE A 22 12.316 -4.990 -8.548 1.00 22.25 C ATOM 342 O PHE A 22 13.497 -4.712 -8.373 1.00 72.23 O ATOM 343 CB PHE A 22 10.471 -3.269 -8.915 1.00 4.43 C ATOM 344 CG PHE A 22 11.058 -2.129 -8.077 1.00 64.53 C ATOM 345 CD1 PHE A 22 11.403 -2.320 -6.739 1.00 51.02 C ATOM 346 CD2 PHE A 22 11.236 -0.856 -8.622 1.00 35.04 C ATOM 347 CE1 PHE A 22 11.910 -1.287 -5.981 1.00 42.35 C ATOM 348 CE2 PHE A 22 11.741 0.180 -7.859 1.00 62.12 C ATOM 349 CZ PHE A 22 12.079 -0.037 -6.539 1.00 12.03 C ATOM 0 H PHE A 22 9.723 -5.004 -10.497 1.00 45.32 H new ATOM 0 HA PHE A 22 12.165 -3.677 -10.226 1.00 32.43 H new ATOM 0 HB2 PHE A 22 9.846 -2.829 -9.693 1.00 4.43 H new ATOM 0 HB3 PHE A 22 9.815 -3.856 -8.273 1.00 4.43 H new ATOM 0 HD1 PHE A 22 11.271 -3.293 -6.290 1.00 51.02 H new ATOM 0 HD2 PHE A 22 10.975 -0.678 -9.655 1.00 35.04 H new ATOM 0 HE1 PHE A 22 12.176 -1.456 -4.948 1.00 42.35 H new ATOM 0 HE2 PHE A 22 11.871 1.159 -8.296 1.00 62.12 H new ATOM 0 HZ PHE A 22 12.476 0.772 -5.943 1.00 12.03 H new ATOM 359 N PHE A 23 11.683 -5.970 -7.895 1.00 33.51 N ATOM 360 CA PHE A 23 12.306 -6.774 -6.819 1.00 72.45 C ATOM 361 C PHE A 23 13.343 -7.792 -7.362 1.00 22.13 C ATOM 362 O PHE A 23 14.045 -8.428 -6.582 1.00 41.31 O ATOM 363 CB PHE A 23 11.212 -7.521 -6.012 1.00 62.11 C ATOM 364 CG PHE A 23 10.290 -6.661 -5.128 1.00 30.02 C ATOM 365 CD1 PHE A 23 9.784 -5.430 -5.553 1.00 45.40 C ATOM 366 CD2 PHE A 23 9.909 -7.113 -3.862 1.00 34.41 C ATOM 367 CE1 PHE A 23 8.937 -4.691 -4.740 1.00 52.01 C ATOM 368 CE2 PHE A 23 9.064 -6.382 -3.058 1.00 32.14 C ATOM 369 CZ PHE A 23 8.578 -5.175 -3.495 1.00 30.21 C ATOM 0 H PHE A 23 10.718 -6.235 -8.093 1.00 33.51 H new ATOM 0 HA PHE A 23 12.840 -6.080 -6.170 1.00 72.45 H new ATOM 0 HB2 PHE A 23 10.589 -8.073 -6.716 1.00 62.11 H new ATOM 0 HB3 PHE A 23 11.703 -8.257 -5.375 1.00 62.11 H new ATOM 0 HD1 PHE A 23 10.056 -5.049 -6.526 1.00 45.40 H new ATOM 0 HD2 PHE A 23 10.287 -8.060 -3.505 1.00 34.41 H new ATOM 0 HE1 PHE A 23 8.558 -3.738 -5.079 1.00 52.01 H new ATOM 0 HE2 PHE A 23 8.784 -6.758 -2.085 1.00 32.14 H new ATOM 0 HZ PHE A 23 7.914 -4.602 -2.865 1.00 30.21 H new ATOM 379 N SER A 24 13.430 -7.955 -8.690 1.00 52.14 N ATOM 380 CA SER A 24 14.363 -8.916 -9.325 1.00 21.12 C ATOM 381 C SER A 24 15.366 -8.233 -10.281 1.00 21.12 C ATOM 382 O SER A 24 16.373 -8.846 -10.659 1.00 3.45 O ATOM 383 CB SER A 24 13.555 -9.989 -10.071 1.00 11.32 C ATOM 384 OG SER A 24 12.697 -10.679 -9.176 1.00 73.10 O ATOM 0 H SER A 24 12.862 -7.431 -9.356 1.00 52.14 H new ATOM 0 HA SER A 24 14.955 -9.375 -8.534 1.00 21.12 H new ATOM 0 HB2 SER A 24 12.967 -9.524 -10.862 1.00 11.32 H new ATOM 0 HB3 SER A 24 14.233 -10.695 -10.551 1.00 11.32 H new ATOM 0 HG SER A 24 12.189 -11.357 -9.668 1.00 73.10 H new ATOM 390 N GLU A 25 15.121 -6.960 -10.639 1.00 54.33 N ATOM 391 CA GLU A 25 15.904 -6.228 -11.671 1.00 31.21 C ATOM 392 C GLU A 25 16.540 -4.967 -11.065 1.00 51.12 C ATOM 393 O GLU A 25 17.764 -4.796 -11.088 1.00 64.53 O ATOM 394 CB GLU A 25 14.977 -5.856 -12.880 1.00 24.24 C ATOM 395 CG GLU A 25 14.503 -7.063 -13.720 1.00 13.54 C ATOM 396 CD GLU A 25 15.617 -7.651 -14.599 1.00 62.50 C ATOM 397 OE1 GLU A 25 16.364 -8.540 -14.138 1.00 4.05 O ATOM 398 OE2 GLU A 25 15.762 -7.199 -15.756 1.00 34.44 O ATOM 0 H GLU A 25 14.375 -6.402 -10.225 1.00 54.33 H new ATOM 0 HA GLU A 25 16.705 -6.873 -12.032 1.00 31.21 H new ATOM 0 HB2 GLU A 25 14.102 -5.327 -12.501 1.00 24.24 H new ATOM 0 HB3 GLU A 25 15.511 -5.164 -13.531 1.00 24.24 H new ATOM 0 HG2 GLU A 25 14.126 -7.838 -13.053 1.00 13.54 H new ATOM 0 HG3 GLU A 25 13.671 -6.755 -14.353 1.00 13.54 H new ATOM 405 N HIS A 26 15.687 -4.104 -10.503 1.00 54.15 N ATOM 406 CA HIS A 26 16.094 -2.795 -9.960 1.00 11.54 C ATOM 407 C HIS A 26 16.765 -2.965 -8.585 1.00 40.54 C ATOM 408 O HIS A 26 17.849 -2.446 -8.321 1.00 22.01 O ATOM 409 CB HIS A 26 14.855 -1.872 -9.840 1.00 41.03 C ATOM 410 CG HIS A 26 15.172 -0.498 -9.292 1.00 2.11 C ATOM 411 ND1 HIS A 26 15.138 -0.238 -7.943 1.00 74.43 N ATOM 412 CD2 HIS A 26 15.545 0.625 -9.944 1.00 1.05 C ATOM 413 CE1 HIS A 26 15.495 1.026 -7.806 1.00 11.12 C ATOM 414 NE2 HIS A 26 15.750 1.592 -8.990 1.00 61.02 N ATOM 0 H HIS A 26 14.689 -4.291 -10.410 1.00 54.15 H new ATOM 0 HA HIS A 26 16.815 -2.341 -10.639 1.00 11.54 H new ATOM 0 HB2 HIS A 26 14.396 -1.765 -10.823 1.00 41.03 H new ATOM 0 HB3 HIS A 26 14.118 -2.350 -9.195 1.00 41.03 H new ATOM 0 HD2 HIS A 26 15.660 0.740 -11.012 1.00 1.05 H new ATOM 0 HE1 HIS A 26 15.571 1.538 -6.858 1.00 11.12 H new ATOM 0 HE2 HIS A 26 16.041 2.556 -9.153 1.00 61.02 H new ATOM 422 N ARG A 27 16.092 -3.736 -7.744 1.00 45.41 N ATOM 423 CA ARG A 27 16.420 -3.955 -6.331 1.00 50.13 C ATOM 424 C ARG A 27 16.499 -5.455 -6.058 1.00 52.22 C ATOM 425 O ARG A 27 15.906 -6.245 -6.793 1.00 65.33 O ATOM 426 CB ARG A 27 15.343 -3.273 -5.426 1.00 42.42 C ATOM 427 CG ARG A 27 15.652 -1.809 -5.046 1.00 54.04 C ATOM 428 CD ARG A 27 16.824 -1.712 -4.056 1.00 43.12 C ATOM 429 NE ARG A 27 16.578 -2.534 -2.854 1.00 1.01 N ATOM 430 CZ ARG A 27 17.519 -3.033 -2.034 1.00 35.11 C ATOM 431 NH1 ARG A 27 18.804 -2.808 -2.254 1.00 51.21 N ATOM 432 NH2 ARG A 27 17.152 -3.759 -0.986 1.00 72.43 N ATOM 0 H ARG A 27 15.262 -4.253 -8.035 1.00 45.41 H new ATOM 0 HA ARG A 27 17.387 -3.509 -6.100 1.00 50.13 H new ATOM 0 HB2 ARG A 27 14.383 -3.305 -5.940 1.00 42.42 H new ATOM 0 HB3 ARG A 27 15.235 -3.856 -4.512 1.00 42.42 H new ATOM 0 HG2 ARG A 27 15.889 -1.242 -5.946 1.00 54.04 H new ATOM 0 HG3 ARG A 27 14.765 -1.353 -4.606 1.00 54.04 H new ATOM 0 HD2 ARG A 27 17.742 -2.040 -4.543 1.00 43.12 H new ATOM 0 HD3 ARG A 27 16.972 -0.672 -3.765 1.00 43.12 H new ATOM 0 HE ARG A 27 15.606 -2.742 -2.625 1.00 1.01 H new ATOM 0 HH11 ARG A 27 19.094 -2.248 -3.056 1.00 51.21 H new ATOM 0 HH12 ARG A 27 19.505 -3.194 -1.622 1.00 51.21 H new ATOM 0 HH21 ARG A 27 16.163 -3.934 -0.808 1.00 72.43 H new ATOM 0 HH22 ARG A 27 17.859 -4.142 -0.358 1.00 72.43 H new ATOM 446 N GLN A 28 17.282 -5.835 -5.043 1.00 10.23 N ATOM 447 CA GLN A 28 17.387 -7.232 -4.587 1.00 32.01 C ATOM 448 C GLN A 28 16.056 -7.704 -3.965 1.00 73.24 C ATOM 449 O GLN A 28 15.370 -6.921 -3.292 1.00 14.40 O ATOM 450 CB GLN A 28 18.556 -7.377 -3.574 1.00 31.02 C ATOM 451 CG GLN A 28 18.395 -6.547 -2.288 1.00 23.54 C ATOM 452 CD GLN A 28 19.643 -6.538 -1.415 1.00 23.04 C ATOM 453 OE1 GLN A 28 19.812 -7.391 -0.550 1.00 31.22 O ATOM 454 NE2 GLN A 28 20.528 -5.576 -1.644 1.00 42.43 N ATOM 0 H GLN A 28 17.862 -5.186 -4.512 1.00 10.23 H new ATOM 0 HA GLN A 28 17.597 -7.866 -5.448 1.00 32.01 H new ATOM 0 HB2 GLN A 28 18.656 -8.428 -3.303 1.00 31.02 H new ATOM 0 HB3 GLN A 28 19.484 -7.085 -4.066 1.00 31.02 H new ATOM 0 HG2 GLN A 28 18.140 -5.522 -2.556 1.00 23.54 H new ATOM 0 HG3 GLN A 28 17.559 -6.943 -1.711 1.00 23.54 H new ATOM 0 HE21 GLN A 28 20.352 -4.884 -2.373 1.00 42.43 H new ATOM 0 HE22 GLN A 28 21.384 -5.529 -1.091 1.00 42.43 H new ATOM 463 N SER A 29 15.692 -8.957 -4.261 1.00 32.20 N ATOM 464 CA SER A 29 14.490 -9.596 -3.715 1.00 33.14 C ATOM 465 C SER A 29 14.548 -9.723 -2.176 1.00 70.02 C ATOM 466 O SER A 29 15.516 -10.265 -1.639 1.00 71.03 O ATOM 467 CB SER A 29 14.295 -10.977 -4.395 1.00 31.04 C ATOM 468 OG SER A 29 15.481 -11.763 -4.354 1.00 2.44 O ATOM 0 H SER A 29 16.225 -9.558 -4.889 1.00 32.20 H new ATOM 0 HA SER A 29 13.629 -8.964 -3.933 1.00 33.14 H new ATOM 0 HB2 SER A 29 13.486 -11.514 -3.899 1.00 31.04 H new ATOM 0 HB3 SER A 29 13.992 -10.831 -5.432 1.00 31.04 H new ATOM 0 HG SER A 29 15.965 -11.581 -3.522 1.00 2.44 H new ATOM 474 N PRO A 30 13.518 -9.177 -1.442 1.00 1.40 N ATOM 475 CA PRO A 30 13.272 -9.516 -0.027 1.00 54.23 C ATOM 476 C PRO A 30 12.698 -10.937 0.079 1.00 11.33 C ATOM 477 O PRO A 30 12.849 -11.602 1.100 1.00 4.34 O ATOM 478 CB PRO A 30 12.228 -8.463 0.419 1.00 24.34 C ATOM 479 CG PRO A 30 11.490 -8.123 -0.829 1.00 62.41 C ATOM 480 CD PRO A 30 12.537 -8.156 -1.924 1.00 24.33 C ATOM 0 HA PRO A 30 14.172 -9.500 0.588 1.00 54.23 H new ATOM 0 HB2 PRO A 30 11.559 -8.864 1.180 1.00 24.34 H new ATOM 0 HB3 PRO A 30 12.708 -7.584 0.849 1.00 24.34 H new ATOM 0 HG2 PRO A 30 10.692 -8.840 -1.024 1.00 62.41 H new ATOM 0 HG3 PRO A 30 11.025 -7.140 -0.757 1.00 62.41 H new ATOM 0 HD2 PRO A 30 12.104 -8.438 -2.884 1.00 24.33 H new ATOM 0 HD3 PRO A 30 13.006 -7.182 -2.059 1.00 24.33 H new ATOM 488 N ILE A 31 12.009 -11.363 -0.998 1.00 74.11 N ATOM 489 CA ILE A 31 11.453 -12.718 -1.125 1.00 14.54 C ATOM 490 C ILE A 31 12.611 -13.744 -1.045 1.00 32.52 C ATOM 491 O ILE A 31 13.495 -13.708 -1.914 1.00 72.33 O ATOM 492 CB ILE A 31 10.679 -12.912 -2.497 1.00 42.34 C ATOM 493 CG1 ILE A 31 9.828 -11.653 -2.883 1.00 13.53 C ATOM 494 CG2 ILE A 31 9.796 -14.190 -2.455 1.00 31.22 C ATOM 495 CD1 ILE A 31 8.708 -11.276 -1.928 1.00 3.53 C ATOM 0 H ILE A 31 11.823 -10.770 -1.807 1.00 74.11 H new ATOM 0 HA ILE A 31 10.741 -12.871 -0.314 1.00 14.54 H new ATOM 0 HB ILE A 31 11.431 -13.036 -3.276 1.00 42.34 H new ATOM 0 HG12 ILE A 31 10.501 -10.800 -2.974 1.00 13.53 H new ATOM 0 HG13 ILE A 31 9.394 -11.823 -3.868 1.00 13.53 H new ATOM 0 HG21 ILE A 31 9.275 -14.303 -3.405 1.00 31.22 H new ATOM 0 HG22 ILE A 31 10.426 -15.062 -2.281 1.00 31.22 H new ATOM 0 HG23 ILE A 31 9.067 -14.102 -1.649 1.00 31.22 H new ATOM 0 HD11 ILE A 31 8.193 -10.391 -2.302 1.00 3.53 H new ATOM 0 HD12 ILE A 31 8.001 -12.102 -1.852 1.00 3.53 H new ATOM 0 HD13 ILE A 31 9.125 -11.064 -0.944 1.00 3.53 H new ATOM 507 N PRO A 32 12.660 -14.630 0.013 1.00 42.21 N ATOM 508 CA PRO A 32 13.755 -15.613 0.190 1.00 32.31 C ATOM 509 C PRO A 32 13.924 -16.509 -1.065 1.00 32.43 C ATOM 510 O PRO A 32 12.918 -16.964 -1.625 1.00 13.24 O ATOM 511 CB PRO A 32 13.325 -16.444 1.444 1.00 72.01 C ATOM 512 CG PRO A 32 11.877 -16.133 1.643 1.00 11.25 C ATOM 513 CD PRO A 32 11.669 -14.734 1.117 1.00 60.35 C ATOM 0 HA PRO A 32 14.725 -15.135 0.326 1.00 32.31 H new ATOM 0 HB2 PRO A 32 13.480 -17.511 1.281 1.00 72.01 H new ATOM 0 HB3 PRO A 32 13.911 -16.167 2.320 1.00 72.01 H new ATOM 0 HG2 PRO A 32 11.249 -16.847 1.109 1.00 11.25 H new ATOM 0 HG3 PRO A 32 11.607 -16.196 2.697 1.00 11.25 H new ATOM 0 HD2 PRO A 32 10.650 -14.587 0.758 1.00 60.35 H new ATOM 0 HD3 PRO A 32 11.846 -13.984 1.888 1.00 60.35 H new ATOM 521 N PRO A 33 15.204 -16.745 -1.528 1.00 74.43 N ATOM 522 CA PRO A 33 15.521 -17.664 -2.654 1.00 4.35 C ATOM 523 C PRO A 33 14.853 -19.045 -2.503 1.00 41.34 C ATOM 524 O PRO A 33 14.492 -19.693 -3.492 1.00 63.22 O ATOM 525 CB PRO A 33 17.065 -17.792 -2.597 1.00 12.53 C ATOM 526 CG PRO A 33 17.531 -16.523 -1.958 1.00 4.53 C ATOM 527 CD PRO A 33 16.439 -16.100 -1.000 1.00 1.14 C ATOM 0 HA PRO A 33 15.149 -17.280 -3.604 1.00 4.35 H new ATOM 0 HB2 PRO A 33 17.368 -18.662 -2.015 1.00 12.53 H new ATOM 0 HB3 PRO A 33 17.489 -17.912 -3.594 1.00 12.53 H new ATOM 0 HG2 PRO A 33 18.472 -16.677 -1.430 1.00 4.53 H new ATOM 0 HG3 PRO A 33 17.709 -15.753 -2.709 1.00 4.53 H new ATOM 0 HD2 PRO A 33 16.654 -16.429 0.017 1.00 1.14 H new ATOM 0 HD3 PRO A 33 16.337 -15.015 -0.969 1.00 1.14 H new ATOM 535 N GLU A 34 14.687 -19.447 -1.236 1.00 41.31 N ATOM 536 CA GLU A 34 14.104 -20.738 -0.853 1.00 22.12 C ATOM 537 C GLU A 34 12.626 -20.835 -1.282 1.00 54.15 C ATOM 538 O GLU A 34 12.230 -21.788 -1.963 1.00 11.34 O ATOM 539 CB GLU A 34 14.233 -20.938 0.687 1.00 14.35 C ATOM 540 CG GLU A 34 15.602 -20.537 1.287 1.00 64.55 C ATOM 541 CD GLU A 34 16.809 -21.186 0.582 1.00 21.22 C ATOM 542 OE1 GLU A 34 17.079 -22.379 0.813 1.00 1.24 O ATOM 543 OE2 GLU A 34 17.498 -20.497 -0.210 1.00 72.33 O ATOM 0 H GLU A 34 14.959 -18.875 -0.436 1.00 41.31 H new ATOM 0 HA GLU A 34 14.652 -21.527 -1.368 1.00 22.12 H new ATOM 0 HB2 GLU A 34 13.453 -20.357 1.180 1.00 14.35 H new ATOM 0 HB3 GLU A 34 14.045 -21.986 0.919 1.00 14.35 H new ATOM 0 HG2 GLU A 34 15.705 -19.453 1.238 1.00 64.55 H new ATOM 0 HG3 GLU A 34 15.619 -20.811 2.342 1.00 64.55 H new ATOM 550 N GLU A 35 11.829 -19.815 -0.899 1.00 2.45 N ATOM 551 CA GLU A 35 10.373 -19.814 -1.138 1.00 55.12 C ATOM 552 C GLU A 35 10.019 -19.403 -2.564 1.00 3.14 C ATOM 553 O GLU A 35 9.044 -19.917 -3.115 1.00 72.00 O ATOM 554 CB GLU A 35 9.629 -18.899 -0.139 1.00 21.11 C ATOM 555 CG GLU A 35 9.806 -19.292 1.334 1.00 33.32 C ATOM 556 CD GLU A 35 8.824 -18.567 2.267 1.00 44.21 C ATOM 557 OE1 GLU A 35 8.743 -17.321 2.209 1.00 4.11 O ATOM 558 OE2 GLU A 35 8.140 -19.234 3.077 1.00 54.41 O ATOM 0 H GLU A 35 12.172 -18.981 -0.422 1.00 2.45 H new ATOM 0 HA GLU A 35 10.046 -20.843 -0.987 1.00 55.12 H new ATOM 0 HB2 GLU A 35 9.978 -17.875 -0.274 1.00 21.11 H new ATOM 0 HB3 GLU A 35 8.566 -18.908 -0.379 1.00 21.11 H new ATOM 0 HG2 GLU A 35 9.670 -20.369 1.437 1.00 33.32 H new ATOM 0 HG3 GLU A 35 10.827 -19.069 1.644 1.00 33.32 H new ATOM 565 N ARG A 36 10.807 -18.492 -3.183 1.00 64.41 N ATOM 566 CA ARG A 36 10.482 -17.943 -4.529 1.00 23.43 C ATOM 567 C ARG A 36 10.618 -19.015 -5.637 1.00 45.54 C ATOM 568 O ARG A 36 10.275 -18.765 -6.793 1.00 50.52 O ATOM 569 CB ARG A 36 11.367 -16.700 -4.851 1.00 72.45 C ATOM 570 CG ARG A 36 12.846 -17.004 -5.159 1.00 32.40 C ATOM 571 CD ARG A 36 13.657 -15.737 -5.509 1.00 22.24 C ATOM 572 NE ARG A 36 13.083 -14.976 -6.643 1.00 45.44 N ATOM 573 CZ ARG A 36 13.673 -13.940 -7.271 1.00 63.21 C ATOM 574 NH1 ARG A 36 14.884 -13.505 -6.913 1.00 63.44 N ATOM 575 NH2 ARG A 36 13.032 -13.336 -8.260 1.00 51.33 N ATOM 0 H ARG A 36 11.667 -18.122 -2.779 1.00 64.41 H new ATOM 0 HA ARG A 36 9.439 -17.628 -4.507 1.00 23.43 H new ATOM 0 HB2 ARG A 36 10.935 -16.179 -5.706 1.00 72.45 H new ATOM 0 HB3 ARG A 36 11.323 -16.015 -4.005 1.00 72.45 H new ATOM 0 HG2 ARG A 36 13.299 -17.493 -4.297 1.00 32.40 H new ATOM 0 HG3 ARG A 36 12.902 -17.707 -5.990 1.00 32.40 H new ATOM 0 HD2 ARG A 36 13.706 -15.090 -4.633 1.00 22.24 H new ATOM 0 HD3 ARG A 36 14.680 -16.023 -5.752 1.00 22.24 H new ATOM 0 HE ARG A 36 12.162 -15.261 -6.977 1.00 45.44 H new ATOM 0 HH11 ARG A 36 15.384 -13.959 -6.148 1.00 63.44 H new ATOM 0 HH12 ARG A 36 15.309 -12.719 -7.404 1.00 63.44 H new ATOM 0 HH21 ARG A 36 12.104 -13.656 -8.537 1.00 51.33 H new ATOM 0 HH22 ARG A 36 13.466 -12.550 -8.745 1.00 51.33 H new ATOM 589 N ASP A 37 11.149 -20.194 -5.271 1.00 34.54 N ATOM 590 CA ASP A 37 11.195 -21.376 -6.150 1.00 45.22 C ATOM 591 C ASP A 37 9.783 -21.996 -6.273 1.00 4.01 C ATOM 592 O ASP A 37 9.362 -22.391 -7.366 1.00 55.02 O ATOM 593 CB ASP A 37 12.221 -22.404 -5.598 1.00 0.54 C ATOM 594 CG ASP A 37 12.290 -23.703 -6.428 1.00 4.41 C ATOM 595 OD1 ASP A 37 12.903 -23.695 -7.518 1.00 21.44 O ATOM 596 OD2 ASP A 37 11.716 -24.734 -6.006 1.00 62.53 O ATOM 0 H ASP A 37 11.561 -20.355 -4.352 1.00 34.54 H new ATOM 0 HA ASP A 37 11.519 -21.078 -7.147 1.00 45.22 H new ATOM 0 HB2 ASP A 37 13.209 -21.944 -5.574 1.00 0.54 H new ATOM 0 HB3 ASP A 37 11.959 -22.652 -4.569 1.00 0.54 H new ATOM 601 N ASP A 38 9.062 -22.067 -5.138 1.00 12.41 N ATOM 602 CA ASP A 38 7.660 -22.550 -5.102 1.00 45.02 C ATOM 603 C ASP A 38 6.704 -21.474 -5.641 1.00 72.12 C ATOM 604 O ASP A 38 5.737 -21.776 -6.354 1.00 54.10 O ATOM 605 CB ASP A 38 7.259 -22.898 -3.646 1.00 22.31 C ATOM 606 CG ASP A 38 5.795 -23.376 -3.502 1.00 52.23 C ATOM 607 OD1 ASP A 38 4.887 -22.530 -3.305 1.00 44.10 O ATOM 608 OD2 ASP A 38 5.544 -24.597 -3.597 1.00 0.31 O ATOM 0 H ASP A 38 9.427 -21.795 -4.225 1.00 12.41 H new ATOM 0 HA ASP A 38 7.588 -23.439 -5.728 1.00 45.02 H new ATOM 0 HB2 ASP A 38 7.924 -23.676 -3.271 1.00 22.31 H new ATOM 0 HB3 ASP A 38 7.409 -22.020 -3.017 1.00 22.31 H new ATOM 613 N PHE A 39 7.000 -20.219 -5.293 1.00 74.00 N ATOM 614 CA PHE A 39 6.189 -19.063 -5.680 1.00 3.01 C ATOM 615 C PHE A 39 6.567 -18.580 -7.086 1.00 2.32 C ATOM 616 O PHE A 39 7.654 -18.852 -7.596 1.00 31.12 O ATOM 617 CB PHE A 39 6.350 -17.891 -4.664 1.00 72.34 C ATOM 618 CG PHE A 39 5.634 -18.087 -3.321 1.00 75.44 C ATOM 619 CD1 PHE A 39 4.281 -17.761 -3.180 1.00 33.34 C ATOM 620 CD2 PHE A 39 6.308 -18.574 -2.200 1.00 51.03 C ATOM 621 CE1 PHE A 39 3.634 -17.915 -1.965 1.00 32.21 C ATOM 622 CE2 PHE A 39 5.661 -18.722 -0.986 1.00 60.34 C ATOM 623 CZ PHE A 39 4.325 -18.393 -0.871 1.00 31.24 C ATOM 0 H PHE A 39 7.815 -19.975 -4.731 1.00 74.00 H new ATOM 0 HA PHE A 39 5.147 -19.382 -5.679 1.00 3.01 H new ATOM 0 HB2 PHE A 39 7.412 -17.741 -4.472 1.00 72.34 H new ATOM 0 HB3 PHE A 39 5.977 -16.977 -5.126 1.00 72.34 H new ATOM 0 HD1 PHE A 39 3.733 -17.384 -4.031 1.00 33.34 H new ATOM 0 HD2 PHE A 39 7.352 -18.840 -2.282 1.00 51.03 H new ATOM 0 HE1 PHE A 39 2.588 -17.661 -1.874 1.00 32.21 H new ATOM 0 HE2 PHE A 39 6.201 -19.095 -0.128 1.00 60.34 H new ATOM 0 HZ PHE A 39 3.820 -18.510 0.077 1.00 31.24 H new ATOM 633 N ASP A 40 5.619 -17.880 -7.693 1.00 54.41 N ATOM 634 CA ASP A 40 5.841 -16.970 -8.827 1.00 15.41 C ATOM 635 C ASP A 40 6.379 -15.628 -8.247 1.00 15.43 C ATOM 636 O ASP A 40 6.707 -15.581 -7.059 1.00 64.02 O ATOM 637 CB ASP A 40 4.524 -16.792 -9.640 1.00 65.23 C ATOM 638 CG ASP A 40 4.698 -16.094 -11.005 1.00 13.21 C ATOM 639 OD1 ASP A 40 5.803 -16.138 -11.583 1.00 75.13 O ATOM 640 OD2 ASP A 40 3.715 -15.523 -11.520 1.00 32.51 O ATOM 0 H ASP A 40 4.641 -17.925 -7.407 1.00 54.41 H new ATOM 0 HA ASP A 40 6.574 -17.372 -9.527 1.00 15.41 H new ATOM 0 HB2 ASP A 40 4.078 -17.773 -9.803 1.00 65.23 H new ATOM 0 HB3 ASP A 40 3.818 -16.217 -9.041 1.00 65.23 H new ATOM 645 N GLY A 41 6.653 -14.616 -9.094 1.00 11.54 N ATOM 646 CA GLY A 41 6.960 -13.225 -8.646 1.00 73.31 C ATOM 647 C GLY A 41 6.058 -12.657 -7.515 1.00 43.11 C ATOM 648 O GLY A 41 5.542 -13.403 -6.674 1.00 50.15 O ATOM 0 H GLY A 41 6.670 -14.730 -10.107 1.00 11.54 H new ATOM 0 HA2 GLY A 41 7.996 -13.194 -8.307 1.00 73.31 H new ATOM 0 HA3 GLY A 41 6.887 -12.563 -9.509 1.00 73.31 H new ATOM 652 N LEU A 42 5.889 -11.315 -7.466 1.00 25.22 N ATOM 653 CA LEU A 42 5.217 -10.647 -6.324 1.00 72.14 C ATOM 654 C LEU A 42 3.805 -11.193 -6.104 1.00 60.42 C ATOM 655 O LEU A 42 2.914 -10.993 -6.934 1.00 11.02 O ATOM 656 CB LEU A 42 5.169 -9.108 -6.487 1.00 32.23 C ATOM 657 CG LEU A 42 6.539 -8.373 -6.459 1.00 72.10 C ATOM 658 CD1 LEU A 42 6.341 -6.845 -6.338 1.00 11.32 C ATOM 659 CD2 LEU A 42 7.446 -8.930 -5.334 1.00 61.22 C ATOM 0 H LEU A 42 6.205 -10.677 -8.197 1.00 25.22 H new ATOM 0 HA LEU A 42 5.820 -10.872 -5.444 1.00 72.14 H new ATOM 0 HB2 LEU A 42 4.676 -8.878 -7.432 1.00 32.23 H new ATOM 0 HB3 LEU A 42 4.544 -8.698 -5.693 1.00 32.23 H new ATOM 0 HG LEU A 42 7.048 -8.561 -7.404 1.00 72.10 H new ATOM 0 HD11 LEU A 42 7.313 -6.352 -6.320 1.00 11.32 H new ATOM 0 HD12 LEU A 42 5.767 -6.484 -7.191 1.00 11.32 H new ATOM 0 HD13 LEU A 42 5.803 -6.620 -5.417 1.00 11.32 H new ATOM 0 HD21 LEU A 42 8.398 -8.398 -5.337 1.00 61.22 H new ATOM 0 HD22 LEU A 42 6.956 -8.792 -4.370 1.00 61.22 H new ATOM 0 HD23 LEU A 42 7.623 -9.992 -5.502 1.00 61.22 H new ATOM 671 N SER A 43 3.645 -11.943 -5.003 1.00 63.52 N ATOM 672 CA SER A 43 2.353 -12.450 -4.575 1.00 13.13 C ATOM 673 C SER A 43 1.598 -11.311 -3.880 1.00 45.01 C ATOM 674 O SER A 43 2.045 -10.783 -2.856 1.00 44.44 O ATOM 675 CB SER A 43 2.557 -13.653 -3.634 1.00 52.03 C ATOM 676 OG SER A 43 3.352 -14.657 -4.255 1.00 12.25 O ATOM 0 H SER A 43 4.416 -12.210 -4.390 1.00 63.52 H new ATOM 0 HA SER A 43 1.767 -12.795 -5.427 1.00 13.13 H new ATOM 0 HB2 SER A 43 3.037 -13.322 -2.713 1.00 52.03 H new ATOM 0 HB3 SER A 43 1.589 -14.070 -3.356 1.00 52.03 H new ATOM 0 HG SER A 43 3.860 -15.142 -3.571 1.00 12.25 H new ATOM 682 N TYR A 44 0.473 -10.924 -4.472 1.00 75.42 N ATOM 683 CA TYR A 44 -0.410 -9.881 -3.944 1.00 60.10 C ATOM 684 C TYR A 44 -1.861 -10.343 -4.073 1.00 33.52 C ATOM 685 O TYR A 44 -2.121 -11.494 -4.457 1.00 24.13 O ATOM 686 CB TYR A 44 -0.133 -8.502 -4.644 1.00 10.14 C ATOM 687 CG TYR A 44 -0.299 -8.442 -6.183 1.00 72.44 C ATOM 688 CD1 TYR A 44 0.696 -8.912 -7.042 1.00 54.24 C ATOM 689 CD2 TYR A 44 -1.448 -7.907 -6.773 1.00 45.30 C ATOM 690 CE1 TYR A 44 0.546 -8.852 -8.418 1.00 4.11 C ATOM 691 CE2 TYR A 44 -1.602 -7.850 -8.142 1.00 11.43 C ATOM 692 CZ TYR A 44 -0.607 -8.322 -8.958 1.00 2.34 C ATOM 693 OH TYR A 44 -0.764 -8.260 -10.321 1.00 60.31 O ATOM 0 H TYR A 44 0.141 -11.331 -5.346 1.00 75.42 H new ATOM 0 HA TYR A 44 -0.207 -9.719 -2.885 1.00 60.10 H new ATOM 0 HB2 TYR A 44 -0.799 -7.760 -4.203 1.00 10.14 H new ATOM 0 HB3 TYR A 44 0.886 -8.199 -4.402 1.00 10.14 H new ATOM 0 HD1 TYR A 44 1.600 -9.331 -6.626 1.00 54.24 H new ATOM 0 HD2 TYR A 44 -2.236 -7.528 -6.139 1.00 45.30 H new ATOM 0 HE1 TYR A 44 1.329 -9.219 -9.065 1.00 4.11 H new ATOM 0 HE2 TYR A 44 -2.503 -7.435 -8.570 1.00 11.43 H new ATOM 0 HH TYR A 44 -0.881 -9.165 -10.678 1.00 60.31 H new ATOM 703 N PHE A 45 -2.801 -9.473 -3.703 1.00 51.24 N ATOM 704 CA PHE A 45 -4.235 -9.771 -3.835 1.00 72.21 C ATOM 705 C PHE A 45 -4.622 -9.665 -5.314 1.00 32.12 C ATOM 706 O PHE A 45 -4.148 -8.772 -6.010 1.00 10.32 O ATOM 707 CB PHE A 45 -5.083 -8.828 -2.964 1.00 65.52 C ATOM 708 CG PHE A 45 -4.831 -8.971 -1.466 1.00 4.15 C ATOM 709 CD1 PHE A 45 -3.843 -8.225 -0.834 1.00 74.23 C ATOM 710 CD2 PHE A 45 -5.586 -9.846 -0.693 1.00 51.24 C ATOM 711 CE1 PHE A 45 -3.617 -8.343 0.523 1.00 51.42 C ATOM 712 CE2 PHE A 45 -5.357 -9.968 0.662 1.00 71.32 C ATOM 713 CZ PHE A 45 -4.375 -9.217 1.273 1.00 21.02 C ATOM 0 H PHE A 45 -2.599 -8.554 -3.309 1.00 51.24 H new ATOM 0 HA PHE A 45 -4.431 -10.783 -3.481 1.00 72.21 H new ATOM 0 HB2 PHE A 45 -4.881 -7.798 -3.259 1.00 65.52 H new ATOM 0 HB3 PHE A 45 -6.138 -9.016 -3.164 1.00 65.52 H new ATOM 0 HD1 PHE A 45 -3.242 -7.541 -1.415 1.00 74.23 H new ATOM 0 HD2 PHE A 45 -6.361 -10.437 -1.159 1.00 51.24 H new ATOM 0 HE1 PHE A 45 -2.847 -7.751 0.996 1.00 51.42 H new ATOM 0 HE2 PHE A 45 -5.950 -10.655 1.247 1.00 71.32 H new ATOM 0 HZ PHE A 45 -4.200 -9.313 2.334 1.00 21.02 H new ATOM 723 N ASP A 46 -5.460 -10.582 -5.798 1.00 54.40 N ATOM 724 CA ASP A 46 -5.825 -10.648 -7.225 1.00 53.31 C ATOM 725 C ASP A 46 -6.894 -9.581 -7.518 1.00 74.44 C ATOM 726 O ASP A 46 -7.839 -9.469 -6.730 1.00 22.21 O ATOM 727 CB ASP A 46 -6.318 -12.075 -7.561 1.00 43.04 C ATOM 728 CG ASP A 46 -6.761 -12.278 -9.022 1.00 54.22 C ATOM 729 OD1 ASP A 46 -5.885 -12.408 -9.908 1.00 1.34 O ATOM 730 OD2 ASP A 46 -7.986 -12.342 -9.284 1.00 10.32 O ATOM 0 H ASP A 46 -5.905 -11.297 -5.223 1.00 54.40 H new ATOM 0 HA ASP A 46 -4.961 -10.440 -7.857 1.00 53.31 H new ATOM 0 HB2 ASP A 46 -5.520 -12.782 -7.337 1.00 43.04 H new ATOM 0 HB3 ASP A 46 -7.154 -12.319 -6.905 1.00 43.04 H new ATOM 735 N PRO A 47 -6.746 -8.763 -8.627 1.00 73.33 N ATOM 736 CA PRO A 47 -7.640 -7.608 -8.925 1.00 33.12 C ATOM 737 C PRO A 47 -9.151 -7.944 -8.810 1.00 11.24 C ATOM 738 O PRO A 47 -9.747 -8.568 -9.700 1.00 3.13 O ATOM 739 CB PRO A 47 -7.240 -7.216 -10.386 1.00 44.43 C ATOM 740 CG PRO A 47 -6.360 -8.330 -10.886 1.00 74.34 C ATOM 741 CD PRO A 47 -5.678 -8.871 -9.660 1.00 31.21 C ATOM 0 HA PRO A 47 -7.511 -6.800 -8.205 1.00 33.12 H new ATOM 0 HB2 PRO A 47 -8.123 -7.103 -11.016 1.00 44.43 H new ATOM 0 HB3 PRO A 47 -6.712 -6.263 -10.404 1.00 44.43 H new ATOM 0 HG2 PRO A 47 -6.946 -9.102 -11.384 1.00 74.34 H new ATOM 0 HG3 PRO A 47 -5.634 -7.963 -11.612 1.00 74.34 H new ATOM 0 HD2 PRO A 47 -5.350 -9.901 -9.799 1.00 31.21 H new ATOM 0 HD3 PRO A 47 -4.796 -8.288 -9.395 1.00 31.21 H new ATOM 749 N ASP A 48 -9.739 -7.504 -7.686 1.00 71.53 N ATOM 750 CA ASP A 48 -11.113 -7.824 -7.274 1.00 35.00 C ATOM 751 C ASP A 48 -11.909 -6.512 -7.066 1.00 5.31 C ATOM 752 O ASP A 48 -11.582 -5.737 -6.159 1.00 13.12 O ATOM 753 CB ASP A 48 -11.038 -8.656 -5.965 1.00 64.21 C ATOM 754 CG ASP A 48 -12.406 -9.071 -5.407 1.00 12.12 C ATOM 755 OD1 ASP A 48 -13.003 -8.292 -4.638 1.00 42.44 O ATOM 756 OD2 ASP A 48 -12.884 -10.182 -5.722 1.00 51.42 O ATOM 0 H ASP A 48 -9.257 -6.899 -7.021 1.00 71.53 H new ATOM 0 HA ASP A 48 -11.628 -8.405 -8.039 1.00 35.00 H new ATOM 0 HB2 ASP A 48 -10.446 -9.552 -6.150 1.00 64.21 H new ATOM 0 HB3 ASP A 48 -10.510 -8.076 -5.208 1.00 64.21 H new ATOM 761 N PRO A 49 -12.955 -6.228 -7.900 1.00 45.12 N ATOM 762 CA PRO A 49 -13.764 -4.983 -7.786 1.00 25.50 C ATOM 763 C PRO A 49 -14.759 -5.003 -6.595 1.00 32.11 C ATOM 764 O PRO A 49 -15.162 -3.947 -6.097 1.00 12.32 O ATOM 765 CB PRO A 49 -14.496 -4.929 -9.150 1.00 31.11 C ATOM 766 CG PRO A 49 -14.645 -6.362 -9.562 1.00 61.03 C ATOM 767 CD PRO A 49 -13.420 -7.081 -9.032 1.00 70.51 C ATOM 0 HA PRO A 49 -13.150 -4.106 -7.582 1.00 25.50 H new ATOM 0 HB2 PRO A 49 -15.466 -4.441 -9.059 1.00 31.11 H new ATOM 0 HB3 PRO A 49 -13.922 -4.364 -9.885 1.00 31.11 H new ATOM 0 HG2 PRO A 49 -15.558 -6.793 -9.151 1.00 61.03 H new ATOM 0 HG3 PRO A 49 -14.711 -6.451 -10.646 1.00 61.03 H new ATOM 0 HD2 PRO A 49 -13.664 -8.089 -8.697 1.00 70.51 H new ATOM 0 HD3 PRO A 49 -12.652 -7.178 -9.799 1.00 70.51 H new ATOM 775 N ASP A 50 -15.138 -6.220 -6.164 1.00 4.42 N ATOM 776 CA ASP A 50 -16.114 -6.462 -5.076 1.00 21.10 C ATOM 777 C ASP A 50 -15.643 -5.892 -3.723 1.00 54.53 C ATOM 778 O ASP A 50 -16.467 -5.464 -2.901 1.00 41.14 O ATOM 779 CB ASP A 50 -16.383 -7.988 -4.949 1.00 13.23 C ATOM 780 CG ASP A 50 -17.025 -8.596 -6.212 1.00 35.44 C ATOM 781 OD1 ASP A 50 -16.345 -8.671 -7.262 1.00 41.04 O ATOM 782 OD2 ASP A 50 -18.214 -8.993 -6.169 1.00 0.22 O ATOM 0 H ASP A 50 -14.770 -7.082 -6.567 1.00 4.42 H new ATOM 0 HA ASP A 50 -17.035 -5.940 -5.338 1.00 21.10 H new ATOM 0 HB2 ASP A 50 -15.443 -8.501 -4.744 1.00 13.23 H new ATOM 0 HB3 ASP A 50 -17.036 -8.166 -4.095 1.00 13.23 H new ATOM 787 N TYR A 51 -14.321 -5.892 -3.498 1.00 35.20 N ATOM 788 CA TYR A 51 -13.715 -5.388 -2.244 1.00 63.44 C ATOM 789 C TYR A 51 -13.163 -3.953 -2.442 1.00 14.10 C ATOM 790 O TYR A 51 -12.853 -3.258 -1.467 1.00 22.11 O ATOM 791 CB TYR A 51 -12.597 -6.364 -1.766 1.00 55.03 C ATOM 792 CG TYR A 51 -12.266 -6.254 -0.268 1.00 43.42 C ATOM 793 CD1 TYR A 51 -12.975 -6.999 0.678 1.00 61.33 C ATOM 794 CD2 TYR A 51 -11.279 -5.386 0.203 1.00 31.30 C ATOM 795 CE1 TYR A 51 -12.716 -6.876 2.028 1.00 31.22 C ATOM 796 CE2 TYR A 51 -11.015 -5.267 1.553 1.00 11.14 C ATOM 797 CZ TYR A 51 -11.734 -6.009 2.461 1.00 1.40 C ATOM 798 OH TYR A 51 -11.478 -5.867 3.811 1.00 12.34 O ATOM 0 H TYR A 51 -13.639 -6.238 -4.173 1.00 35.20 H new ATOM 0 HA TYR A 51 -14.483 -5.341 -1.472 1.00 63.44 H new ATOM 0 HB2 TYR A 51 -12.904 -7.387 -1.985 1.00 55.03 H new ATOM 0 HB3 TYR A 51 -11.692 -6.173 -2.342 1.00 55.03 H new ATOM 0 HD1 TYR A 51 -13.741 -7.685 0.346 1.00 61.33 H new ATOM 0 HD2 TYR A 51 -10.711 -4.797 -0.502 1.00 31.30 H new ATOM 0 HE1 TYR A 51 -13.280 -7.456 2.743 1.00 31.22 H new ATOM 0 HE2 TYR A 51 -10.245 -4.592 1.896 1.00 11.14 H new ATOM 0 HH TYR A 51 -11.518 -6.744 4.246 1.00 12.34 H new ATOM 808 N ARG A 52 -13.059 -3.524 -3.715 1.00 62.11 N ATOM 809 CA ARG A 52 -12.472 -2.217 -4.088 1.00 24.14 C ATOM 810 C ARG A 52 -13.362 -1.052 -3.601 1.00 31.23 C ATOM 811 O ARG A 52 -14.570 -1.029 -3.873 1.00 62.53 O ATOM 812 CB ARG A 52 -12.272 -2.137 -5.630 1.00 23.52 C ATOM 813 CG ARG A 52 -11.418 -0.940 -6.098 1.00 55.25 C ATOM 814 CD ARG A 52 -11.267 -0.857 -7.628 1.00 61.53 C ATOM 815 NE ARG A 52 -10.234 0.119 -7.981 1.00 61.32 N ATOM 816 CZ ARG A 52 -10.275 1.030 -8.948 1.00 54.11 C ATOM 817 NH1 ARG A 52 -11.327 1.150 -9.742 1.00 14.50 N ATOM 818 NH2 ARG A 52 -9.228 1.820 -9.104 1.00 53.22 N ATOM 0 H ARG A 52 -13.378 -4.071 -4.514 1.00 62.11 H new ATOM 0 HA ARG A 52 -11.501 -2.128 -3.601 1.00 24.14 H new ATOM 0 HB2 ARG A 52 -11.802 -3.059 -5.972 1.00 23.52 H new ATOM 0 HB3 ARG A 52 -13.249 -2.080 -6.109 1.00 23.52 H new ATOM 0 HG2 ARG A 52 -11.870 -0.017 -5.734 1.00 55.25 H new ATOM 0 HG3 ARG A 52 -10.429 -1.010 -5.646 1.00 55.25 H new ATOM 0 HD2 ARG A 52 -11.005 -1.836 -8.029 1.00 61.53 H new ATOM 0 HD3 ARG A 52 -12.217 -0.572 -8.080 1.00 61.53 H new ATOM 0 HE ARG A 52 -9.383 0.097 -7.419 1.00 61.32 H new ATOM 0 HH11 ARG A 52 -12.131 0.535 -9.619 1.00 14.50 H new ATOM 0 HH12 ARG A 52 -11.333 1.857 -10.477 1.00 14.50 H new ATOM 0 HH21 ARG A 52 -8.419 1.721 -8.491 1.00 53.22 H new ATOM 0 HH22 ARG A 52 -9.229 2.529 -9.837 1.00 53.22 H new ATOM 832 N VAL A 53 -12.756 -0.085 -2.885 1.00 74.34 N ATOM 833 CA VAL A 53 -13.479 1.051 -2.273 1.00 73.44 C ATOM 834 C VAL A 53 -12.850 2.389 -2.709 1.00 24.22 C ATOM 835 O VAL A 53 -11.820 2.411 -3.383 1.00 3.42 O ATOM 836 CB VAL A 53 -13.481 0.948 -0.696 1.00 25.14 C ATOM 837 CG1 VAL A 53 -14.217 -0.323 -0.206 1.00 42.10 C ATOM 838 CG2 VAL A 53 -12.043 1.022 -0.130 1.00 21.45 C ATOM 0 H VAL A 53 -11.751 -0.068 -2.714 1.00 74.34 H new ATOM 0 HA VAL A 53 -14.511 1.011 -2.620 1.00 73.44 H new ATOM 0 HB VAL A 53 -14.033 1.806 -0.313 1.00 25.14 H new ATOM 0 HG11 VAL A 53 -14.197 -0.358 0.883 1.00 42.10 H new ATOM 0 HG12 VAL A 53 -15.251 -0.300 -0.549 1.00 42.10 H new ATOM 0 HG13 VAL A 53 -13.722 -1.207 -0.607 1.00 42.10 H new ATOM 0 HG21 VAL A 53 -12.076 0.949 0.957 1.00 21.45 H new ATOM 0 HG22 VAL A 53 -11.451 0.200 -0.532 1.00 21.45 H new ATOM 0 HG23 VAL A 53 -11.588 1.970 -0.416 1.00 21.45 H new ATOM 848 N GLU A 54 -13.481 3.493 -2.293 1.00 51.01 N ATOM 849 CA GLU A 54 -13.041 4.873 -2.588 1.00 43.21 C ATOM 850 C GLU A 54 -13.059 5.693 -1.285 1.00 2.13 C ATOM 851 O GLU A 54 -13.851 5.392 -0.394 1.00 43.11 O ATOM 852 CB GLU A 54 -13.977 5.504 -3.652 1.00 35.33 C ATOM 853 CG GLU A 54 -15.481 5.426 -3.293 1.00 21.31 C ATOM 854 CD GLU A 54 -16.382 6.173 -4.280 1.00 43.03 C ATOM 855 OE1 GLU A 54 -16.638 7.380 -4.068 1.00 64.40 O ATOM 856 OE2 GLU A 54 -16.835 5.564 -5.273 1.00 50.24 O ATOM 0 H GLU A 54 -14.330 3.458 -1.729 1.00 51.01 H new ATOM 0 HA GLU A 54 -12.027 4.867 -2.988 1.00 43.21 H new ATOM 0 HB2 GLU A 54 -13.701 6.549 -3.790 1.00 35.33 H new ATOM 0 HB3 GLU A 54 -13.815 5.003 -4.606 1.00 35.33 H new ATOM 0 HG2 GLU A 54 -15.784 4.380 -3.256 1.00 21.31 H new ATOM 0 HG3 GLU A 54 -15.630 5.836 -2.294 1.00 21.31 H new ATOM 863 N ALA A 55 -12.220 6.745 -1.189 1.00 74.23 N ATOM 864 CA ALA A 55 -11.987 7.486 0.075 1.00 31.42 C ATOM 865 C ALA A 55 -11.772 8.987 -0.161 1.00 33.22 C ATOM 866 O ALA A 55 -11.509 9.412 -1.284 1.00 20.13 O ATOM 867 CB ALA A 55 -10.765 6.911 0.804 1.00 1.01 C ATOM 0 H ALA A 55 -11.686 7.106 -1.979 1.00 74.23 H new ATOM 0 HA ALA A 55 -12.882 7.366 0.685 1.00 31.42 H new ATOM 0 HB1 ALA A 55 -10.602 7.461 1.731 1.00 1.01 H new ATOM 0 HB2 ALA A 55 -10.939 5.859 1.032 1.00 1.01 H new ATOM 0 HB3 ALA A 55 -9.885 7.003 0.168 1.00 1.01 H new ATOM 873 N THR A 56 -11.881 9.775 0.924 1.00 72.23 N ATOM 874 CA THR A 56 -11.556 11.210 0.932 1.00 5.31 C ATOM 875 C THR A 56 -10.181 11.438 1.589 1.00 51.14 C ATOM 876 O THR A 56 -9.904 10.906 2.667 1.00 22.05 O ATOM 877 CB THR A 56 -12.650 12.012 1.709 1.00 54.12 C ATOM 878 OG1 THR A 56 -13.929 11.746 1.124 1.00 24.43 O ATOM 879 CG2 THR A 56 -12.403 13.536 1.705 1.00 43.12 C ATOM 0 H THR A 56 -12.201 9.428 1.828 1.00 72.23 H new ATOM 0 HA THR A 56 -11.524 11.563 -0.099 1.00 5.31 H new ATOM 0 HB THR A 56 -12.611 11.683 2.747 1.00 54.12 H new ATOM 0 HG1 THR A 56 -14.620 12.245 1.608 1.00 24.43 H new ATOM 0 HG21 THR A 56 -13.197 14.035 2.261 1.00 43.12 H new ATOM 0 HG22 THR A 56 -11.443 13.750 2.174 1.00 43.12 H new ATOM 0 HG23 THR A 56 -12.395 13.901 0.678 1.00 43.12 H new ATOM 887 N VAL A 57 -9.343 12.226 0.914 1.00 75.10 N ATOM 888 CA VAL A 57 -8.020 12.650 1.389 1.00 2.41 C ATOM 889 C VAL A 57 -8.187 13.756 2.448 1.00 41.22 C ATOM 890 O VAL A 57 -8.751 14.811 2.155 1.00 3.21 O ATOM 891 CB VAL A 57 -7.166 13.192 0.178 1.00 15.13 C ATOM 892 CG1 VAL A 57 -5.716 13.533 0.590 1.00 42.25 C ATOM 893 CG2 VAL A 57 -7.192 12.192 -0.997 1.00 12.02 C ATOM 0 H VAL A 57 -9.571 12.600 -0.007 1.00 75.10 H new ATOM 0 HA VAL A 57 -7.504 11.799 1.833 1.00 2.41 H new ATOM 0 HB VAL A 57 -7.625 14.124 -0.152 1.00 15.13 H new ATOM 0 HG11 VAL A 57 -5.168 13.902 -0.277 1.00 42.25 H new ATOM 0 HG12 VAL A 57 -5.729 14.300 1.364 1.00 42.25 H new ATOM 0 HG13 VAL A 57 -5.227 12.638 0.974 1.00 42.25 H new ATOM 0 HG21 VAL A 57 -6.597 12.584 -1.822 1.00 12.02 H new ATOM 0 HG22 VAL A 57 -6.777 11.238 -0.672 1.00 12.02 H new ATOM 0 HG23 VAL A 57 -8.220 12.046 -1.328 1.00 12.02 H new ATOM 903 N THR A 58 -7.713 13.492 3.671 1.00 2.42 N ATOM 904 CA THR A 58 -7.789 14.440 4.787 1.00 12.13 C ATOM 905 C THR A 58 -6.371 14.913 5.126 1.00 30.01 C ATOM 906 O THR A 58 -5.641 14.226 5.846 1.00 60.30 O ATOM 907 CB THR A 58 -8.466 13.771 6.026 1.00 24.40 C ATOM 908 OG1 THR A 58 -9.729 13.202 5.640 1.00 44.32 O ATOM 909 CG2 THR A 58 -8.683 14.761 7.181 1.00 43.23 C ATOM 0 H THR A 58 -7.263 12.609 3.915 1.00 2.42 H new ATOM 0 HA THR A 58 -8.398 15.298 4.503 1.00 12.13 H new ATOM 0 HB THR A 58 -7.792 12.992 6.382 1.00 24.40 H new ATOM 0 HG1 THR A 58 -9.594 12.279 5.339 1.00 44.32 H new ATOM 0 HG21 THR A 58 -9.156 14.246 8.017 1.00 43.23 H new ATOM 0 HG22 THR A 58 -7.722 15.164 7.500 1.00 43.23 H new ATOM 0 HG23 THR A 58 -9.325 15.576 6.846 1.00 43.23 H new ATOM 917 N VAL A 59 -5.979 16.089 4.608 1.00 4.33 N ATOM 918 CA VAL A 59 -4.587 16.562 4.696 1.00 52.04 C ATOM 919 C VAL A 59 -4.379 17.273 6.039 1.00 75.03 C ATOM 920 O VAL A 59 -5.145 18.169 6.396 1.00 32.13 O ATOM 921 CB VAL A 59 -4.186 17.487 3.478 1.00 5.32 C ATOM 922 CG1 VAL A 59 -2.800 18.159 3.684 1.00 41.33 C ATOM 923 CG2 VAL A 59 -4.200 16.665 2.169 1.00 23.20 C ATOM 0 H VAL A 59 -6.607 16.730 4.123 1.00 4.33 H new ATOM 0 HA VAL A 59 -3.926 15.697 4.642 1.00 52.04 H new ATOM 0 HB VAL A 59 -4.922 18.288 3.412 1.00 5.32 H new ATOM 0 HG11 VAL A 59 -2.567 18.784 2.822 1.00 41.33 H new ATOM 0 HG12 VAL A 59 -2.824 18.775 4.583 1.00 41.33 H new ATOM 0 HG13 VAL A 59 -2.035 17.390 3.791 1.00 41.33 H new ATOM 0 HG21 VAL A 59 -3.923 17.307 1.333 1.00 23.20 H new ATOM 0 HG22 VAL A 59 -3.487 15.844 2.247 1.00 23.20 H new ATOM 0 HG23 VAL A 59 -5.199 16.263 2.002 1.00 23.20 H new ATOM 933 N HIS A 60 -3.348 16.827 6.778 1.00 42.23 N ATOM 934 CA HIS A 60 -2.986 17.345 8.099 1.00 74.32 C ATOM 935 C HIS A 60 -1.837 18.356 7.962 1.00 14.23 C ATOM 936 O HIS A 60 -0.835 18.080 7.291 1.00 34.42 O ATOM 937 CB HIS A 60 -2.612 16.156 9.022 1.00 21.32 C ATOM 938 CG HIS A 60 -3.810 15.312 9.394 1.00 13.43 C ATOM 939 ND1 HIS A 60 -4.679 15.425 10.426 1.00 22.40 N flip ATOM 940 CD2 HIS A 60 -4.275 14.262 8.624 1.00 40.52 C flip ATOM 941 CE1 HIS A 60 -5.642 14.465 10.259 1.00 63.43 C flip ATOM 942 NE2 HIS A 60 -5.375 13.774 9.173 1.00 12.03 N flip ATOM 0 H HIS A 60 -2.732 16.078 6.461 1.00 42.23 H new ATOM 0 HA HIS A 60 -3.828 17.870 8.549 1.00 74.32 H new ATOM 0 HB2 HIS A 60 -1.872 15.531 8.522 1.00 21.32 H new ATOM 0 HB3 HIS A 60 -2.145 16.538 9.930 1.00 21.32 H new ATOM 0 HD1 HIS A 60 -4.626 16.101 11.188 1.00 22.40 H new ATOM 0 HD2 HIS A 60 -3.813 13.898 7.718 1.00 40.52 H new ATOM 0 HE1 HIS A 60 -6.485 14.302 10.914 1.00 63.43 H new ATOM 951 N GLU A 61 -2.015 19.520 8.611 1.00 23.44 N ATOM 952 CA GLU A 61 -1.100 20.675 8.512 1.00 31.30 C ATOM 953 C GLU A 61 0.238 20.417 9.228 1.00 13.52 C ATOM 954 O GLU A 61 1.276 20.951 8.822 1.00 63.33 O ATOM 955 CB GLU A 61 -1.780 21.944 9.096 1.00 60.12 C ATOM 956 CG GLU A 61 -2.219 21.830 10.574 1.00 51.22 C ATOM 957 CD GLU A 61 -2.830 23.127 11.118 1.00 64.04 C ATOM 958 OE1 GLU A 61 -4.017 23.407 10.826 1.00 21.42 O ATOM 959 OE2 GLU A 61 -2.124 23.888 11.814 1.00 1.12 O ATOM 0 H GLU A 61 -2.809 19.689 9.228 1.00 23.44 H new ATOM 0 HA GLU A 61 -0.881 20.830 7.455 1.00 31.30 H new ATOM 0 HB2 GLU A 61 -1.091 22.783 9.001 1.00 60.12 H new ATOM 0 HB3 GLU A 61 -2.655 22.180 8.490 1.00 60.12 H new ATOM 0 HG2 GLU A 61 -2.946 21.024 10.670 1.00 51.22 H new ATOM 0 HG3 GLU A 61 -1.358 21.557 11.183 1.00 51.22 H new ATOM 966 N THR A 62 0.198 19.606 10.300 1.00 32.13 N ATOM 967 CA THR A 62 1.371 19.275 11.116 1.00 44.02 C ATOM 968 C THR A 62 1.631 17.749 11.039 1.00 4.43 C ATOM 969 O THR A 62 1.017 16.977 11.787 1.00 62.55 O ATOM 970 CB THR A 62 1.162 19.760 12.600 1.00 12.21 C ATOM 971 OG1 THR A 62 -0.092 19.273 13.114 1.00 55.52 O ATOM 972 CG2 THR A 62 1.166 21.292 12.713 1.00 51.34 C ATOM 0 H THR A 62 -0.660 19.160 10.624 1.00 32.13 H new ATOM 0 HA THR A 62 2.249 19.793 10.730 1.00 44.02 H new ATOM 0 HB THR A 62 1.995 19.362 13.180 1.00 12.21 H new ATOM 0 HG1 THR A 62 -0.195 18.326 12.883 1.00 55.52 H new ATOM 0 HG21 THR A 62 1.019 21.580 13.754 1.00 51.34 H new ATOM 0 HG22 THR A 62 2.122 21.680 12.361 1.00 51.34 H new ATOM 0 HG23 THR A 62 0.361 21.704 12.105 1.00 51.34 H new ATOM 980 N PRO A 63 2.509 17.289 10.087 1.00 1.42 N ATOM 981 CA PRO A 63 2.764 15.853 9.859 1.00 30.23 C ATOM 982 C PRO A 63 3.713 15.226 10.919 1.00 13.04 C ATOM 983 O PRO A 63 4.800 15.755 11.192 1.00 63.35 O ATOM 984 CB PRO A 63 3.383 15.847 8.442 1.00 33.40 C ATOM 985 CG PRO A 63 4.106 17.153 8.325 1.00 74.24 C ATOM 986 CD PRO A 63 3.312 18.140 9.157 1.00 45.33 C ATOM 0 HA PRO A 63 1.863 15.245 9.945 1.00 30.23 H new ATOM 0 HB2 PRO A 63 4.065 15.006 8.314 1.00 33.40 H new ATOM 0 HB3 PRO A 63 2.613 15.753 7.676 1.00 33.40 H new ATOM 0 HG2 PRO A 63 5.129 17.068 8.690 1.00 74.24 H new ATOM 0 HG3 PRO A 63 4.165 17.476 7.286 1.00 74.24 H new ATOM 0 HD2 PRO A 63 3.969 18.815 9.705 1.00 45.33 H new ATOM 0 HD3 PRO A 63 2.669 18.759 8.531 1.00 45.33 H new ATOM 994 N GLU A 64 3.270 14.106 11.519 1.00 60.24 N ATOM 995 CA GLU A 64 4.041 13.352 12.536 1.00 14.50 C ATOM 996 C GLU A 64 4.989 12.325 11.876 1.00 14.10 C ATOM 997 O GLU A 64 4.716 11.834 10.774 1.00 73.10 O ATOM 998 CB GLU A 64 3.052 12.661 13.524 1.00 70.35 C ATOM 999 CG GLU A 64 1.977 11.775 12.853 1.00 1.33 C ATOM 1000 CD GLU A 64 0.945 11.209 13.835 1.00 23.12 C ATOM 1001 OE1 GLU A 64 0.023 11.950 14.239 1.00 55.11 O ATOM 1002 OE2 GLU A 64 1.050 10.028 14.216 1.00 62.25 O ATOM 0 H GLU A 64 2.361 13.692 11.313 1.00 60.24 H new ATOM 0 HA GLU A 64 4.669 14.047 13.093 1.00 14.50 H new ATOM 0 HB2 GLU A 64 3.625 12.048 14.220 1.00 70.35 H new ATOM 0 HB3 GLU A 64 2.553 13.430 14.113 1.00 70.35 H new ATOM 0 HG2 GLU A 64 1.459 12.360 12.093 1.00 1.33 H new ATOM 0 HG3 GLU A 64 2.468 10.949 12.340 1.00 1.33 H new ATOM 1009 N SER A 65 6.096 12.002 12.571 1.00 23.15 N ATOM 1010 CA SER A 65 7.168 11.138 12.039 1.00 64.14 C ATOM 1011 C SER A 65 6.856 9.644 12.310 1.00 13.12 C ATOM 1012 O SER A 65 6.911 9.182 13.456 1.00 73.13 O ATOM 1013 CB SER A 65 8.507 11.566 12.683 1.00 22.21 C ATOM 1014 OG SER A 65 8.406 11.633 14.099 1.00 30.33 O ATOM 0 H SER A 65 6.273 12.333 13.519 1.00 23.15 H new ATOM 0 HA SER A 65 7.238 11.254 10.957 1.00 64.14 H new ATOM 0 HB2 SER A 65 9.288 10.858 12.406 1.00 22.21 H new ATOM 0 HB3 SER A 65 8.805 12.539 12.292 1.00 22.21 H new ATOM 0 HG SER A 65 7.872 10.879 14.425 1.00 30.33 H new ATOM 1020 N VAL A 66 6.529 8.905 11.235 1.00 13.23 N ATOM 1021 CA VAL A 66 6.092 7.495 11.291 1.00 72.11 C ATOM 1022 C VAL A 66 7.071 6.610 10.485 1.00 10.23 C ATOM 1023 O VAL A 66 7.161 6.741 9.266 1.00 21.30 O ATOM 1024 CB VAL A 66 4.630 7.368 10.705 1.00 72.21 C ATOM 1025 CG1 VAL A 66 4.107 5.918 10.750 1.00 22.45 C ATOM 1026 CG2 VAL A 66 3.653 8.343 11.424 1.00 35.43 C ATOM 0 H VAL A 66 6.561 9.276 10.285 1.00 13.23 H new ATOM 0 HA VAL A 66 6.088 7.159 12.328 1.00 72.11 H new ATOM 0 HB VAL A 66 4.681 7.653 9.654 1.00 72.21 H new ATOM 0 HG11 VAL A 66 3.099 5.882 10.337 1.00 22.45 H new ATOM 0 HG12 VAL A 66 4.763 5.276 10.162 1.00 22.45 H new ATOM 0 HG13 VAL A 66 4.088 5.570 11.783 1.00 22.45 H new ATOM 0 HG21 VAL A 66 2.654 8.235 11.001 1.00 35.43 H new ATOM 0 HG22 VAL A 66 3.624 8.110 12.488 1.00 35.43 H new ATOM 0 HG23 VAL A 66 3.996 9.369 11.287 1.00 35.43 H new ATOM 1036 N ASP A 67 7.777 5.699 11.176 1.00 62.40 N ATOM 1037 CA ASP A 67 8.832 4.851 10.565 1.00 62.20 C ATOM 1038 C ASP A 67 8.220 3.669 9.799 1.00 2.11 C ATOM 1039 O ASP A 67 7.610 2.777 10.399 1.00 64.44 O ATOM 1040 CB ASP A 67 9.811 4.338 11.648 1.00 52.24 C ATOM 1041 CG ASP A 67 10.669 5.462 12.231 1.00 62.35 C ATOM 1042 OD1 ASP A 67 11.657 5.853 11.574 1.00 10.22 O ATOM 1043 OD2 ASP A 67 10.349 5.976 13.326 1.00 73.21 O ATOM 0 H ASP A 67 7.638 5.525 12.171 1.00 62.40 H new ATOM 0 HA ASP A 67 9.384 5.466 9.855 1.00 62.20 H new ATOM 0 HB2 ASP A 67 9.246 3.861 12.449 1.00 52.24 H new ATOM 0 HB3 ASP A 67 10.459 3.575 11.217 1.00 52.24 H new ATOM 1048 N LEU A 68 8.396 3.676 8.463 1.00 65.32 N ATOM 1049 CA LEU A 68 7.844 2.651 7.548 1.00 54.24 C ATOM 1050 C LEU A 68 8.965 2.082 6.659 1.00 60.51 C ATOM 1051 O LEU A 68 9.976 2.751 6.431 1.00 22.10 O ATOM 1052 CB LEU A 68 6.717 3.260 6.673 1.00 60.05 C ATOM 1053 CG LEU A 68 5.619 4.060 7.431 1.00 32.52 C ATOM 1054 CD1 LEU A 68 4.651 4.724 6.455 1.00 74.34 C ATOM 1055 CD2 LEU A 68 4.860 3.185 8.449 1.00 54.21 C ATOM 0 H LEU A 68 8.930 4.399 7.982 1.00 65.32 H new ATOM 0 HA LEU A 68 7.420 1.841 8.141 1.00 54.24 H new ATOM 0 HB2 LEU A 68 7.174 3.919 5.935 1.00 60.05 H new ATOM 0 HB3 LEU A 68 6.235 2.452 6.123 1.00 60.05 H new ATOM 0 HG LEU A 68 6.127 4.842 7.995 1.00 32.52 H new ATOM 0 HD11 LEU A 68 3.894 5.276 7.012 1.00 74.34 H new ATOM 0 HD12 LEU A 68 5.199 5.410 5.809 1.00 74.34 H new ATOM 0 HD13 LEU A 68 4.168 3.960 5.846 1.00 74.34 H new ATOM 0 HD21 LEU A 68 4.104 3.787 8.953 1.00 54.21 H new ATOM 0 HD22 LEU A 68 4.378 2.357 7.929 1.00 54.21 H new ATOM 0 HD23 LEU A 68 5.561 2.792 9.185 1.00 54.21 H new ATOM 1067 N GLU A 69 8.756 0.859 6.149 1.00 33.14 N ATOM 1068 CA GLU A 69 9.744 0.134 5.324 1.00 62.12 C ATOM 1069 C GLU A 69 10.005 0.854 3.978 1.00 42.03 C ATOM 1070 O GLU A 69 9.102 1.492 3.417 1.00 24.41 O ATOM 1071 CB GLU A 69 9.235 -1.318 5.070 1.00 22.34 C ATOM 1072 CG GLU A 69 7.922 -1.399 4.236 1.00 52.12 C ATOM 1073 CD GLU A 69 7.308 -2.806 4.138 1.00 1.00 C ATOM 1074 OE1 GLU A 69 8.046 -3.765 3.853 1.00 32.34 O ATOM 1075 OE2 GLU A 69 6.080 -2.957 4.334 1.00 22.31 O ATOM 0 H GLU A 69 7.891 0.338 6.296 1.00 33.14 H new ATOM 0 HA GLU A 69 10.689 0.106 5.866 1.00 62.12 H new ATOM 0 HB2 GLU A 69 10.014 -1.879 4.554 1.00 22.34 H new ATOM 0 HB3 GLU A 69 9.073 -1.807 6.031 1.00 22.34 H new ATOM 0 HG2 GLU A 69 7.186 -0.726 4.676 1.00 52.12 H new ATOM 0 HG3 GLU A 69 8.124 -1.035 3.229 1.00 52.12 H new ATOM 1082 N THR A 70 11.262 0.788 3.508 1.00 61.45 N ATOM 1083 CA THR A 70 11.638 1.192 2.139 1.00 62.14 C ATOM 1084 C THR A 70 12.245 -0.015 1.407 1.00 74.53 C ATOM 1085 O THR A 70 12.460 -1.078 2.017 1.00 1.12 O ATOM 1086 CB THR A 70 12.635 2.413 2.140 1.00 65.41 C ATOM 1087 OG1 THR A 70 12.786 2.938 0.808 1.00 43.41 O ATOM 1088 CG2 THR A 70 14.027 2.058 2.707 1.00 43.33 C ATOM 0 H THR A 70 12.048 0.453 4.065 1.00 61.45 H new ATOM 0 HA THR A 70 10.741 1.522 1.615 1.00 62.14 H new ATOM 0 HB THR A 70 12.196 3.164 2.796 1.00 65.41 H new ATOM 0 HG1 THR A 70 13.406 3.697 0.824 1.00 43.41 H new ATOM 0 HG21 THR A 70 14.667 2.940 2.680 1.00 43.33 H new ATOM 0 HG22 THR A 70 13.924 1.715 3.737 1.00 43.33 H new ATOM 0 HG23 THR A 70 14.474 1.267 2.105 1.00 43.33 H new ATOM 1096 N SER A 71 12.535 0.152 0.107 1.00 64.14 N ATOM 1097 CA SER A 71 13.073 -0.922 -0.724 1.00 62.44 C ATOM 1098 C SER A 71 14.562 -1.125 -0.448 1.00 60.05 C ATOM 1099 O SER A 71 14.984 -2.259 -0.276 1.00 0.41 O ATOM 1100 CB SER A 71 12.830 -0.634 -2.228 1.00 22.15 C ATOM 1101 OG SER A 71 13.177 -1.757 -3.022 1.00 5.03 O ATOM 0 H SER A 71 12.402 1.033 -0.390 1.00 64.14 H new ATOM 0 HA SER A 71 12.548 -1.842 -0.467 1.00 62.44 H new ATOM 0 HB2 SER A 71 11.782 -0.380 -2.389 1.00 22.15 H new ATOM 0 HB3 SER A 71 13.419 0.230 -2.536 1.00 22.15 H new ATOM 0 HG SER A 71 12.608 -2.517 -2.780 1.00 5.03 H new ATOM 1107 N ASP A 72 15.335 -0.019 -0.503 1.00 52.24 N ATOM 1108 CA ASP A 72 16.811 0.025 -0.293 1.00 13.21 C ATOM 1109 C ASP A 72 17.332 -0.403 1.124 1.00 71.11 C ATOM 1110 O ASP A 72 17.888 0.423 1.857 1.00 54.22 O ATOM 1111 CB ASP A 72 17.311 1.461 -0.681 1.00 31.44 C ATOM 1112 CG ASP A 72 18.826 1.523 -0.938 1.00 22.24 C ATOM 1113 OD1 ASP A 72 19.291 0.863 -1.890 1.00 43.31 O ATOM 1114 OD2 ASP A 72 19.554 2.228 -0.202 1.00 52.24 O ATOM 0 H ASP A 72 14.943 0.901 -0.701 1.00 52.24 H new ATOM 0 HA ASP A 72 17.236 -0.743 -0.939 1.00 13.21 H new ATOM 0 HB2 ASP A 72 16.783 1.794 -1.575 1.00 31.44 H new ATOM 0 HB3 ASP A 72 17.055 2.157 0.118 1.00 31.44 H new ATOM 1119 N ASP A 73 17.061 -1.666 1.531 1.00 2.42 N ATOM 1120 CA ASP A 73 17.755 -2.359 2.663 1.00 21.15 C ATOM 1121 C ASP A 73 17.574 -1.677 4.026 1.00 74.13 C ATOM 1122 O ASP A 73 18.352 -1.941 4.951 1.00 44.21 O ATOM 1123 CB ASP A 73 19.275 -2.552 2.368 1.00 43.12 C ATOM 1124 CG ASP A 73 19.540 -3.485 1.186 1.00 12.50 C ATOM 1125 OD1 ASP A 73 19.044 -4.627 1.212 1.00 10.12 O ATOM 1126 OD2 ASP A 73 20.235 -3.091 0.225 1.00 31.23 O ATOM 0 H ASP A 73 16.350 -2.245 1.084 1.00 2.42 H new ATOM 0 HA ASP A 73 17.267 -3.331 2.733 1.00 21.15 H new ATOM 0 HB2 ASP A 73 19.726 -1.581 2.166 1.00 43.12 H new ATOM 0 HB3 ASP A 73 19.764 -2.952 3.256 1.00 43.12 H new ATOM 1131 N ARG A 74 16.535 -0.849 4.186 1.00 55.02 N ATOM 1132 CA ARG A 74 16.434 0.048 5.348 1.00 31.21 C ATOM 1133 C ARG A 74 14.946 0.291 5.714 1.00 62.13 C ATOM 1134 O ARG A 74 14.026 -0.304 5.130 1.00 72.34 O ATOM 1135 CB ARG A 74 17.211 1.379 4.989 1.00 11.43 C ATOM 1136 CG ARG A 74 17.675 2.270 6.177 1.00 4.12 C ATOM 1137 CD ARG A 74 18.531 3.478 5.747 1.00 65.53 C ATOM 1138 NE ARG A 74 18.776 4.416 6.867 1.00 5.21 N ATOM 1139 CZ ARG A 74 17.986 5.460 7.189 1.00 52.13 C ATOM 1140 NH1 ARG A 74 16.884 5.718 6.488 1.00 54.03 N ATOM 1141 NH2 ARG A 74 18.311 6.241 8.206 1.00 12.13 N ATOM 0 H ARG A 74 15.756 -0.780 3.531 1.00 55.02 H new ATOM 0 HA ARG A 74 16.888 -0.393 6.235 1.00 31.21 H new ATOM 0 HB2 ARG A 74 18.090 1.110 4.404 1.00 11.43 H new ATOM 0 HB3 ARG A 74 16.571 1.981 4.344 1.00 11.43 H new ATOM 0 HG2 ARG A 74 16.798 2.630 6.714 1.00 4.12 H new ATOM 0 HG3 ARG A 74 18.248 1.660 6.875 1.00 4.12 H new ATOM 0 HD2 ARG A 74 19.485 3.124 5.356 1.00 65.53 H new ATOM 0 HD3 ARG A 74 18.030 4.006 4.936 1.00 65.53 H new ATOM 0 HE ARG A 74 19.606 4.260 7.439 1.00 5.21 H new ATOM 0 HH11 ARG A 74 16.631 5.123 5.699 1.00 54.03 H new ATOM 0 HH12 ARG A 74 16.293 6.510 6.740 1.00 54.03 H new ATOM 0 HH21 ARG A 74 19.157 6.053 8.744 1.00 12.13 H new ATOM 0 HH22 ARG A 74 17.716 7.032 8.452 1.00 12.13 H new ATOM 1155 N THR A 75 14.750 1.196 6.662 1.00 5.40 N ATOM 1156 CA THR A 75 13.468 1.669 7.148 1.00 50.02 C ATOM 1157 C THR A 75 13.645 3.178 7.328 1.00 43.32 C ATOM 1158 O THR A 75 14.689 3.634 7.821 1.00 25.44 O ATOM 1159 CB THR A 75 13.076 0.961 8.479 1.00 21.05 C ATOM 1160 OG1 THR A 75 13.059 -0.455 8.257 1.00 54.44 O ATOM 1161 CG2 THR A 75 11.707 1.408 9.021 1.00 21.14 C ATOM 0 H THR A 75 15.531 1.645 7.139 1.00 5.40 H new ATOM 0 HA THR A 75 12.656 1.446 6.456 1.00 50.02 H new ATOM 0 HB THR A 75 13.817 1.238 9.229 1.00 21.05 H new ATOM 0 HG1 THR A 75 12.179 -0.813 8.497 1.00 54.44 H new ATOM 0 HG21 THR A 75 11.493 0.878 9.949 1.00 21.14 H new ATOM 0 HG22 THR A 75 11.724 2.481 9.211 1.00 21.14 H new ATOM 0 HG23 THR A 75 10.934 1.182 8.287 1.00 21.14 H new ATOM 1169 N VAL A 76 12.640 3.946 6.931 1.00 73.44 N ATOM 1170 CA VAL A 76 12.766 5.400 6.750 1.00 31.14 C ATOM 1171 C VAL A 76 11.628 6.112 7.462 1.00 63.43 C ATOM 1172 O VAL A 76 10.512 5.583 7.575 1.00 14.43 O ATOM 1173 CB VAL A 76 12.809 5.830 5.228 1.00 12.22 C ATOM 1174 CG1 VAL A 76 14.164 5.475 4.578 1.00 53.32 C ATOM 1175 CG2 VAL A 76 11.648 5.206 4.426 1.00 63.41 C ATOM 0 H VAL A 76 11.709 3.585 6.723 1.00 73.44 H new ATOM 0 HA VAL A 76 13.720 5.693 7.188 1.00 31.14 H new ATOM 0 HB VAL A 76 12.692 6.913 5.203 1.00 12.22 H new ATOM 0 HG11 VAL A 76 14.158 5.784 3.533 1.00 53.32 H new ATOM 0 HG12 VAL A 76 14.967 5.991 5.105 1.00 53.32 H new ATOM 0 HG13 VAL A 76 14.325 4.399 4.637 1.00 53.32 H new ATOM 0 HG21 VAL A 76 11.712 5.525 3.386 1.00 63.41 H new ATOM 0 HG22 VAL A 76 11.713 4.119 4.477 1.00 63.41 H new ATOM 0 HG23 VAL A 76 10.698 5.533 4.848 1.00 63.41 H new ATOM 1185 N ARG A 77 11.929 7.317 7.938 1.00 40.32 N ATOM 1186 CA ARG A 77 10.954 8.195 8.568 1.00 42.25 C ATOM 1187 C ARG A 77 10.042 8.767 7.477 1.00 61.34 C ATOM 1188 O ARG A 77 10.525 9.335 6.493 1.00 52.41 O ATOM 1189 CB ARG A 77 11.704 9.305 9.362 1.00 53.21 C ATOM 1190 CG ARG A 77 10.831 10.431 9.992 1.00 35.12 C ATOM 1191 CD ARG A 77 10.607 11.653 9.067 1.00 31.32 C ATOM 1192 NE ARG A 77 11.883 12.333 8.738 1.00 31.22 N ATOM 1193 CZ ARG A 77 12.465 12.390 7.522 1.00 25.52 C ATOM 1194 NH1 ARG A 77 11.904 11.809 6.467 1.00 24.31 N ATOM 1195 NH2 ARG A 77 13.609 13.034 7.378 1.00 71.00 N ATOM 0 H ARG A 77 12.868 7.713 7.895 1.00 40.32 H new ATOM 0 HA ARG A 77 10.330 7.654 9.280 1.00 42.25 H new ATOM 0 HB2 ARG A 77 12.270 8.827 10.161 1.00 53.21 H new ATOM 0 HB3 ARG A 77 12.428 9.771 8.693 1.00 53.21 H new ATOM 0 HG2 ARG A 77 9.862 10.014 10.265 1.00 35.12 H new ATOM 0 HG3 ARG A 77 11.304 10.769 10.914 1.00 35.12 H new ATOM 0 HD2 ARG A 77 10.120 11.329 8.147 1.00 31.32 H new ATOM 0 HD3 ARG A 77 9.933 12.359 9.553 1.00 31.32 H new ATOM 0 HE ARG A 77 12.367 12.802 9.504 1.00 31.22 H new ATOM 0 HH11 ARG A 77 11.020 11.310 6.569 1.00 24.31 H new ATOM 0 HH12 ARG A 77 12.357 11.862 5.555 1.00 24.31 H new ATOM 0 HH21 ARG A 77 14.046 13.484 8.183 1.00 71.00 H new ATOM 0 HH22 ARG A 77 14.056 13.082 6.462 1.00 71.00 H new ATOM 1209 N TYR A 78 8.744 8.543 7.646 1.00 12.21 N ATOM 1210 CA TYR A 78 7.682 9.169 6.850 1.00 2.54 C ATOM 1211 C TYR A 78 7.049 10.293 7.663 1.00 13.24 C ATOM 1212 O TYR A 78 7.279 10.414 8.871 1.00 44.34 O ATOM 1213 CB TYR A 78 6.609 8.129 6.437 1.00 71.12 C ATOM 1214 CG TYR A 78 6.973 7.250 5.230 1.00 72.03 C ATOM 1215 CD1 TYR A 78 7.978 6.292 5.306 1.00 15.34 C ATOM 1216 CD2 TYR A 78 6.281 7.357 4.022 1.00 33.11 C ATOM 1217 CE1 TYR A 78 8.272 5.478 4.225 1.00 33.41 C ATOM 1218 CE2 TYR A 78 6.568 6.545 2.947 1.00 11.43 C ATOM 1219 CZ TYR A 78 7.563 5.604 3.052 1.00 74.11 C ATOM 1220 OH TYR A 78 7.843 4.783 1.981 1.00 62.32 O ATOM 0 H TYR A 78 8.387 7.905 8.357 1.00 12.21 H new ATOM 0 HA TYR A 78 8.115 9.576 5.936 1.00 2.54 H new ATOM 0 HB2 TYR A 78 6.409 7.481 7.290 1.00 71.12 H new ATOM 0 HB3 TYR A 78 5.682 8.657 6.214 1.00 71.12 H new ATOM 0 HD1 TYR A 78 8.538 6.181 6.223 1.00 15.34 H new ATOM 0 HD2 TYR A 78 5.500 8.096 3.928 1.00 33.11 H new ATOM 0 HE1 TYR A 78 9.059 4.743 4.302 1.00 33.41 H new ATOM 0 HE2 TYR A 78 6.013 6.648 2.026 1.00 11.43 H new ATOM 0 HH TYR A 78 7.249 5.006 1.234 1.00 62.32 H new ATOM 1230 N LEU A 79 6.282 11.130 6.978 1.00 34.13 N ATOM 1231 CA LEU A 79 5.496 12.206 7.587 1.00 23.13 C ATOM 1232 C LEU A 79 4.021 11.999 7.229 1.00 13.21 C ATOM 1233 O LEU A 79 3.692 11.760 6.059 1.00 62.43 O ATOM 1234 CB LEU A 79 6.022 13.589 7.107 1.00 42.25 C ATOM 1235 CG LEU A 79 7.418 14.028 7.671 1.00 32.14 C ATOM 1236 CD1 LEU A 79 7.809 15.436 7.159 1.00 62.20 C ATOM 1237 CD2 LEU A 79 7.446 13.969 9.227 1.00 22.21 C ATOM 0 H LEU A 79 6.184 11.083 5.964 1.00 34.13 H new ATOM 0 HA LEU A 79 5.596 12.184 8.672 1.00 23.13 H new ATOM 0 HB2 LEU A 79 6.080 13.575 6.019 1.00 42.25 H new ATOM 0 HB3 LEU A 79 5.288 14.348 7.377 1.00 42.25 H new ATOM 0 HG LEU A 79 8.160 13.320 7.301 1.00 32.14 H new ATOM 0 HD11 LEU A 79 8.781 15.714 7.566 1.00 62.20 H new ATOM 0 HD12 LEU A 79 7.861 15.426 6.070 1.00 62.20 H new ATOM 0 HD13 LEU A 79 7.061 16.161 7.480 1.00 62.20 H new ATOM 0 HD21 LEU A 79 8.428 14.279 9.585 1.00 22.21 H new ATOM 0 HD22 LEU A 79 6.685 14.637 9.630 1.00 22.21 H new ATOM 0 HD23 LEU A 79 7.245 12.949 9.556 1.00 22.21 H new ATOM 1249 N HIS A 80 3.135 12.073 8.241 1.00 3.03 N ATOM 1250 CA HIS A 80 1.700 11.825 8.057 1.00 11.35 C ATOM 1251 C HIS A 80 1.034 13.071 7.457 1.00 11.32 C ATOM 1252 O HIS A 80 0.731 14.041 8.165 1.00 2.25 O ATOM 1253 CB HIS A 80 1.050 11.414 9.404 1.00 21.01 C ATOM 1254 CG HIS A 80 -0.445 11.256 9.346 1.00 33.03 C ATOM 1255 ND1 HIS A 80 -1.266 11.837 10.281 1.00 14.03 N ATOM 1256 CD2 HIS A 80 -1.206 10.620 8.428 1.00 43.31 C ATOM 1257 CE1 HIS A 80 -2.495 11.553 9.907 1.00 62.32 C ATOM 1258 NE2 HIS A 80 -2.508 10.820 8.789 1.00 33.43 N ATOM 0 H HIS A 80 3.395 12.305 9.200 1.00 3.03 H new ATOM 0 HA HIS A 80 1.556 10.999 7.361 1.00 11.35 H new ATOM 0 HB2 HIS A 80 1.491 10.474 9.735 1.00 21.01 H new ATOM 0 HB3 HIS A 80 1.296 12.163 10.156 1.00 21.01 H new ATOM 0 HD2 HIS A 80 -0.853 10.061 7.574 1.00 43.31 H new ATOM 0 HE1 HIS A 80 -3.381 11.872 10.436 1.00 62.32 H new ATOM 0 HE2 HIS A 80 -3.333 10.476 8.299 1.00 33.43 H new ATOM 1266 N VAL A 81 0.802 13.020 6.145 1.00 32.13 N ATOM 1267 CA VAL A 81 0.289 14.162 5.379 1.00 4.45 C ATOM 1268 C VAL A 81 -1.219 14.056 5.141 1.00 0.21 C ATOM 1269 O VAL A 81 -1.872 15.073 4.964 1.00 34.03 O ATOM 1270 CB VAL A 81 1.042 14.305 4.010 1.00 23.31 C ATOM 1271 CG1 VAL A 81 2.571 14.419 4.243 1.00 31.22 C ATOM 1272 CG2 VAL A 81 0.686 13.138 3.049 1.00 65.14 C ATOM 0 H VAL A 81 0.964 12.186 5.581 1.00 32.13 H new ATOM 0 HA VAL A 81 0.473 15.055 5.977 1.00 4.45 H new ATOM 0 HB VAL A 81 0.711 15.224 3.527 1.00 23.31 H new ATOM 0 HG11 VAL A 81 3.079 14.518 3.284 1.00 31.22 H new ATOM 0 HG12 VAL A 81 2.781 15.295 4.857 1.00 31.22 H new ATOM 0 HG13 VAL A 81 2.929 13.525 4.753 1.00 31.22 H new ATOM 0 HG21 VAL A 81 1.223 13.264 2.109 1.00 65.14 H new ATOM 0 HG22 VAL A 81 0.972 12.190 3.506 1.00 65.14 H new ATOM 0 HG23 VAL A 81 -0.387 13.139 2.857 1.00 65.14 H new ATOM 1282 N ALA A 82 -1.763 12.822 5.128 1.00 12.22 N ATOM 1283 CA ALA A 82 -3.178 12.590 4.781 1.00 64.44 C ATOM 1284 C ALA A 82 -3.762 11.382 5.521 1.00 44.23 C ATOM 1285 O ALA A 82 -3.030 10.510 5.970 1.00 62.33 O ATOM 1286 CB ALA A 82 -3.331 12.405 3.261 1.00 63.45 C ATOM 0 H ALA A 82 -1.244 11.973 5.353 1.00 12.22 H new ATOM 0 HA ALA A 82 -3.738 13.470 5.097 1.00 64.44 H new ATOM 0 HB1 ALA A 82 -4.380 12.235 3.019 1.00 63.45 H new ATOM 0 HB2 ALA A 82 -2.981 13.301 2.748 1.00 63.45 H new ATOM 0 HB3 ALA A 82 -2.740 11.548 2.937 1.00 63.45 H new ATOM 1292 N THR A 83 -5.095 11.363 5.648 1.00 21.23 N ATOM 1293 CA THR A 83 -5.857 10.202 6.122 1.00 75.52 C ATOM 1294 C THR A 83 -6.994 9.940 5.127 1.00 1.51 C ATOM 1295 O THR A 83 -7.925 10.744 5.002 1.00 11.21 O ATOM 1296 CB THR A 83 -6.436 10.417 7.562 1.00 43.41 C ATOM 1297 OG1 THR A 83 -5.364 10.687 8.474 1.00 51.34 O ATOM 1298 CG2 THR A 83 -7.226 9.188 8.064 1.00 74.44 C ATOM 0 H THR A 83 -5.682 12.166 5.421 1.00 21.23 H new ATOM 0 HA THR A 83 -5.187 9.344 6.182 1.00 75.52 H new ATOM 0 HB THR A 83 -7.124 11.261 7.514 1.00 43.41 H new ATOM 0 HG1 THR A 83 -5.347 11.644 8.685 1.00 51.34 H new ATOM 0 HG21 THR A 83 -7.607 9.385 9.066 1.00 74.44 H new ATOM 0 HG22 THR A 83 -8.060 8.992 7.390 1.00 74.44 H new ATOM 0 HG23 THR A 83 -6.569 8.319 8.090 1.00 74.44 H new ATOM 1306 N LEU A 84 -6.868 8.839 4.388 1.00 1.51 N ATOM 1307 CA LEU A 84 -7.866 8.400 3.407 1.00 74.14 C ATOM 1308 C LEU A 84 -9.018 7.698 4.158 1.00 71.30 C ATOM 1309 O LEU A 84 -8.873 6.554 4.589 1.00 11.14 O ATOM 1310 CB LEU A 84 -7.188 7.458 2.364 1.00 41.14 C ATOM 1311 CG LEU A 84 -5.769 7.901 1.857 1.00 0.15 C ATOM 1312 CD1 LEU A 84 -5.213 6.919 0.797 1.00 65.51 C ATOM 1313 CD2 LEU A 84 -5.762 9.368 1.340 1.00 42.24 C ATOM 0 H LEU A 84 -6.062 8.218 4.452 1.00 1.51 H new ATOM 0 HA LEU A 84 -8.279 9.249 2.862 1.00 74.14 H new ATOM 0 HB2 LEU A 84 -7.101 6.464 2.804 1.00 41.14 H new ATOM 0 HB3 LEU A 84 -7.849 7.368 1.502 1.00 41.14 H new ATOM 0 HG LEU A 84 -5.100 7.868 2.717 1.00 0.15 H new ATOM 0 HD11 LEU A 84 -4.230 7.256 0.469 1.00 65.51 H new ATOM 0 HD12 LEU A 84 -5.128 5.923 1.232 1.00 65.51 H new ATOM 0 HD13 LEU A 84 -5.889 6.885 -0.057 1.00 65.51 H new ATOM 0 HD21 LEU A 84 -4.760 9.629 1.000 1.00 42.24 H new ATOM 0 HD22 LEU A 84 -6.463 9.465 0.511 1.00 42.24 H new ATOM 0 HD23 LEU A 84 -6.058 10.039 2.146 1.00 42.24 H new ATOM 1325 N SER A 85 -10.128 8.429 4.366 1.00 42.41 N ATOM 1326 CA SER A 85 -11.292 7.946 5.138 1.00 41.13 C ATOM 1327 C SER A 85 -12.434 7.506 4.197 1.00 61.42 C ATOM 1328 O SER A 85 -12.868 8.267 3.327 1.00 5.21 O ATOM 1329 CB SER A 85 -11.752 9.056 6.108 1.00 72.31 C ATOM 1330 OG SER A 85 -10.709 9.384 7.020 1.00 23.24 O ATOM 0 H SER A 85 -10.245 9.375 4.003 1.00 42.41 H new ATOM 0 HA SER A 85 -11.004 7.070 5.718 1.00 41.13 H new ATOM 0 HB2 SER A 85 -12.042 9.943 5.544 1.00 72.31 H new ATOM 0 HB3 SER A 85 -12.633 8.725 6.658 1.00 72.31 H new ATOM 0 HG SER A 85 -11.015 10.090 7.627 1.00 23.24 H new ATOM 1336 N PHE A 86 -12.923 6.276 4.405 1.00 15.44 N ATOM 1337 CA PHE A 86 -13.872 5.594 3.512 1.00 52.13 C ATOM 1338 C PHE A 86 -14.852 4.729 4.317 1.00 73.21 C ATOM 1339 O PHE A 86 -14.786 4.663 5.552 1.00 5.34 O ATOM 1340 CB PHE A 86 -13.094 4.720 2.479 1.00 40.54 C ATOM 1341 CG PHE A 86 -12.043 3.772 3.072 1.00 42.43 C ATOM 1342 CD1 PHE A 86 -10.760 4.232 3.386 1.00 21.41 C ATOM 1343 CD2 PHE A 86 -12.330 2.430 3.308 1.00 22.35 C ATOM 1344 CE1 PHE A 86 -9.808 3.386 3.919 1.00 23.34 C ATOM 1345 CE2 PHE A 86 -11.378 1.587 3.839 1.00 75.12 C ATOM 1346 CZ PHE A 86 -10.117 2.064 4.148 1.00 70.10 C ATOM 0 H PHE A 86 -12.665 5.714 5.216 1.00 15.44 H new ATOM 0 HA PHE A 86 -14.449 6.347 2.976 1.00 52.13 H new ATOM 0 HB2 PHE A 86 -13.815 4.128 1.915 1.00 40.54 H new ATOM 0 HB3 PHE A 86 -12.600 5.382 1.768 1.00 40.54 H new ATOM 0 HD1 PHE A 86 -10.510 5.267 3.208 1.00 21.41 H new ATOM 0 HD2 PHE A 86 -13.311 2.045 3.072 1.00 22.35 H new ATOM 0 HE1 PHE A 86 -8.823 3.760 4.156 1.00 23.34 H new ATOM 0 HE2 PHE A 86 -11.618 0.549 4.015 1.00 75.12 H new ATOM 0 HZ PHE A 86 -9.376 1.400 4.568 1.00 70.10 H new ATOM 1356 N ASP A 87 -15.774 4.088 3.592 1.00 1.41 N ATOM 1357 CA ASP A 87 -16.678 3.066 4.132 1.00 41.34 C ATOM 1358 C ASP A 87 -16.255 1.696 3.584 1.00 21.55 C ATOM 1359 O ASP A 87 -15.960 1.559 2.388 1.00 14.35 O ATOM 1360 CB ASP A 87 -18.162 3.382 3.776 1.00 0.10 C ATOM 1361 CG ASP A 87 -18.451 3.458 2.263 1.00 14.22 C ATOM 1362 OD1 ASP A 87 -17.972 4.409 1.603 1.00 62.44 O ATOM 1363 OD2 ASP A 87 -19.153 2.576 1.724 1.00 3.12 O ATOM 0 H ASP A 87 -15.916 4.267 2.598 1.00 1.41 H new ATOM 0 HA ASP A 87 -16.609 3.058 5.220 1.00 41.34 H new ATOM 0 HB2 ASP A 87 -18.800 2.616 4.218 1.00 0.10 H new ATOM 0 HB3 ASP A 87 -18.439 4.331 4.235 1.00 0.10 H new ATOM 1368 N LEU A 88 -16.207 0.708 4.483 1.00 71.54 N ATOM 1369 CA LEU A 88 -15.826 -0.679 4.183 1.00 61.04 C ATOM 1370 C LEU A 88 -16.330 -1.567 5.329 1.00 31.44 C ATOM 1371 O LEU A 88 -16.191 -1.199 6.508 1.00 64.14 O ATOM 1372 CB LEU A 88 -14.279 -0.822 4.014 1.00 14.22 C ATOM 1373 CG LEU A 88 -13.716 -2.278 3.868 1.00 32.42 C ATOM 1374 CD1 LEU A 88 -14.181 -2.954 2.553 1.00 21.01 C ATOM 1375 CD2 LEU A 88 -12.174 -2.290 4.003 1.00 71.00 C ATOM 0 H LEU A 88 -16.438 0.853 5.466 1.00 71.54 H new ATOM 0 HA LEU A 88 -16.277 -0.986 3.239 1.00 61.04 H new ATOM 0 HB2 LEU A 88 -13.979 -0.252 3.135 1.00 14.22 H new ATOM 0 HB3 LEU A 88 -13.799 -0.357 4.875 1.00 14.22 H new ATOM 0 HG LEU A 88 -14.128 -2.871 4.685 1.00 32.42 H new ATOM 0 HD11 LEU A 88 -13.767 -3.961 2.495 1.00 21.01 H new ATOM 0 HD12 LEU A 88 -15.270 -3.008 2.537 1.00 21.01 H new ATOM 0 HD13 LEU A 88 -13.834 -2.369 1.701 1.00 21.01 H new ATOM 0 HD21 LEU A 88 -11.808 -3.311 3.898 1.00 71.00 H new ATOM 0 HD22 LEU A 88 -11.736 -1.665 3.225 1.00 71.00 H new ATOM 0 HD23 LEU A 88 -11.891 -1.902 4.982 1.00 71.00 H new ATOM 1387 N ASP A 89 -16.968 -2.688 4.966 1.00 14.32 N ATOM 1388 CA ASP A 89 -17.369 -3.760 5.901 1.00 14.23 C ATOM 1389 C ASP A 89 -18.573 -3.323 6.792 1.00 2.41 C ATOM 1390 O ASP A 89 -18.806 -3.862 7.877 1.00 62.14 O ATOM 1391 CB ASP A 89 -16.139 -4.244 6.733 1.00 14.31 C ATOM 1392 CG ASP A 89 -16.393 -5.544 7.501 1.00 1.11 C ATOM 1393 OD1 ASP A 89 -16.596 -6.588 6.848 1.00 4.02 O ATOM 1394 OD2 ASP A 89 -16.363 -5.533 8.747 1.00 10.31 O ATOM 0 H ASP A 89 -17.227 -2.883 3.999 1.00 14.32 H new ATOM 0 HA ASP A 89 -17.722 -4.614 5.323 1.00 14.23 H new ATOM 0 HB2 ASP A 89 -15.291 -4.387 6.063 1.00 14.31 H new ATOM 0 HB3 ASP A 89 -15.859 -3.463 7.440 1.00 14.31 H new ATOM 1399 N GLY A 90 -19.379 -2.373 6.274 1.00 14.11 N ATOM 1400 CA GLY A 90 -20.583 -1.895 6.966 1.00 23.02 C ATOM 1401 C GLY A 90 -20.315 -0.810 8.006 1.00 41.10 C ATOM 1402 O GLY A 90 -21.223 -0.439 8.764 1.00 60.13 O ATOM 0 H GLY A 90 -19.212 -1.923 5.374 1.00 14.11 H new ATOM 0 HA2 GLY A 90 -21.285 -1.509 6.227 1.00 23.02 H new ATOM 0 HA3 GLY A 90 -21.068 -2.740 7.455 1.00 23.02 H new ATOM 1406 N GLU A 91 -19.076 -0.280 8.035 1.00 50.23 N ATOM 1407 CA GLU A 91 -18.698 0.834 8.931 1.00 4.55 C ATOM 1408 C GLU A 91 -17.642 1.724 8.258 1.00 24.32 C ATOM 1409 O GLU A 91 -17.180 1.424 7.157 1.00 22.52 O ATOM 1410 CB GLU A 91 -18.174 0.312 10.299 1.00 23.20 C ATOM 1411 CG GLU A 91 -16.881 -0.521 10.221 1.00 3.40 C ATOM 1412 CD GLU A 91 -16.313 -0.872 11.607 1.00 71.32 C ATOM 1413 OE1 GLU A 91 -16.873 -1.757 12.288 1.00 51.11 O ATOM 1414 OE2 GLU A 91 -15.299 -0.265 12.021 1.00 43.40 O ATOM 0 H GLU A 91 -18.313 -0.608 7.443 1.00 50.23 H new ATOM 0 HA GLU A 91 -19.592 1.427 9.122 1.00 4.55 H new ATOM 0 HB2 GLU A 91 -18.001 1.165 10.955 1.00 23.20 H new ATOM 0 HB3 GLU A 91 -18.952 -0.294 10.763 1.00 23.20 H new ATOM 0 HG2 GLU A 91 -17.080 -1.441 9.671 1.00 3.40 H new ATOM 0 HG3 GLU A 91 -16.131 0.033 9.656 1.00 3.40 H new ATOM 1421 N SER A 92 -17.270 2.821 8.935 1.00 23.02 N ATOM 1422 CA SER A 92 -16.236 3.741 8.451 1.00 5.22 C ATOM 1423 C SER A 92 -14.848 3.204 8.837 1.00 34.55 C ATOM 1424 O SER A 92 -14.561 2.982 10.017 1.00 3.22 O ATOM 1425 CB SER A 92 -16.468 5.163 9.022 1.00 14.44 C ATOM 1426 OG SER A 92 -15.534 6.113 8.499 1.00 2.23 O ATOM 0 H SER A 92 -17.677 3.092 9.830 1.00 23.02 H new ATOM 0 HA SER A 92 -16.291 3.809 7.364 1.00 5.22 H new ATOM 0 HB2 SER A 92 -17.482 5.486 8.788 1.00 14.44 H new ATOM 0 HB3 SER A 92 -16.385 5.135 10.108 1.00 14.44 H new ATOM 0 HG SER A 92 -15.716 6.996 8.883 1.00 2.23 H new ATOM 1432 N ARG A 93 -14.013 2.959 7.823 1.00 64.42 N ATOM 1433 CA ARG A 93 -12.604 2.553 7.985 1.00 64.35 C ATOM 1434 C ARG A 93 -11.716 3.689 7.443 1.00 33.24 C ATOM 1435 O ARG A 93 -12.156 4.455 6.578 1.00 72.11 O ATOM 1436 CB ARG A 93 -12.320 1.245 7.193 1.00 34.33 C ATOM 1437 CG ARG A 93 -13.265 0.055 7.465 1.00 2.24 C ATOM 1438 CD ARG A 93 -13.107 -0.569 8.855 1.00 25.41 C ATOM 1439 NE ARG A 93 -13.924 -1.792 8.989 1.00 41.33 N ATOM 1440 CZ ARG A 93 -13.878 -2.638 10.024 1.00 2.44 C ATOM 1441 NH1 ARG A 93 -13.074 -2.418 11.053 1.00 50.54 N ATOM 1442 NH2 ARG A 93 -14.677 -3.689 10.046 1.00 15.34 N ATOM 0 H ARG A 93 -14.298 3.037 6.847 1.00 64.42 H new ATOM 0 HA ARG A 93 -12.391 2.367 9.038 1.00 64.35 H new ATOM 0 HB2 ARG A 93 -12.360 1.476 6.128 1.00 34.33 H new ATOM 0 HB3 ARG A 93 -11.301 0.928 7.413 1.00 34.33 H new ATOM 0 HG2 ARG A 93 -14.295 0.389 7.344 1.00 2.24 H new ATOM 0 HG3 ARG A 93 -13.089 -0.713 6.712 1.00 2.24 H new ATOM 0 HD2 ARG A 93 -12.058 -0.808 9.032 1.00 25.41 H new ATOM 0 HD3 ARG A 93 -13.402 0.153 9.616 1.00 25.41 H new ATOM 0 HE ARG A 93 -14.574 -2.008 8.233 1.00 41.33 H new ATOM 0 HH11 ARG A 93 -12.476 -1.592 11.065 1.00 50.54 H new ATOM 0 HH12 ARG A 93 -13.053 -3.075 11.833 1.00 50.54 H new ATOM 0 HH21 ARG A 93 -15.326 -3.853 9.276 1.00 15.34 H new ATOM 0 HH22 ARG A 93 -14.646 -4.337 10.833 1.00 15.34 H new ATOM 1456 N ASP A 94 -10.477 3.799 7.931 1.00 20.45 N ATOM 1457 CA ASP A 94 -9.514 4.797 7.428 1.00 52.32 C ATOM 1458 C ASP A 94 -8.102 4.223 7.384 1.00 1.03 C ATOM 1459 O ASP A 94 -7.734 3.387 8.210 1.00 2.14 O ATOM 1460 CB ASP A 94 -9.547 6.101 8.276 1.00 70.22 C ATOM 1461 CG ASP A 94 -9.127 5.907 9.750 1.00 35.05 C ATOM 1462 OD1 ASP A 94 -9.963 5.437 10.557 1.00 43.12 O ATOM 1463 OD2 ASP A 94 -7.973 6.240 10.109 1.00 74.44 O ATOM 0 H ASP A 94 -10.111 3.208 8.678 1.00 20.45 H new ATOM 0 HA ASP A 94 -9.813 5.052 6.411 1.00 52.32 H new ATOM 0 HB2 ASP A 94 -8.888 6.837 7.816 1.00 70.22 H new ATOM 0 HB3 ASP A 94 -10.555 6.514 8.248 1.00 70.22 H new ATOM 1468 N LEU A 95 -7.339 4.678 6.379 1.00 30.23 N ATOM 1469 CA LEU A 95 -5.910 4.379 6.214 1.00 42.15 C ATOM 1470 C LEU A 95 -5.154 5.691 6.053 1.00 63.33 C ATOM 1471 O LEU A 95 -5.589 6.572 5.312 1.00 22.22 O ATOM 1472 CB LEU A 95 -5.648 3.463 4.991 1.00 42.34 C ATOM 1473 CG LEU A 95 -6.233 2.020 5.068 1.00 25.25 C ATOM 1474 CD1 LEU A 95 -5.760 1.181 3.874 1.00 75.41 C ATOM 1475 CD2 LEU A 95 -5.884 1.330 6.405 1.00 34.33 C ATOM 0 H LEU A 95 -7.708 5.278 5.641 1.00 30.23 H new ATOM 0 HA LEU A 95 -5.563 3.843 7.098 1.00 42.15 H new ATOM 0 HB2 LEU A 95 -6.056 3.950 4.106 1.00 42.34 H new ATOM 0 HB3 LEU A 95 -4.570 3.388 4.845 1.00 42.34 H new ATOM 0 HG LEU A 95 -7.319 2.101 5.023 1.00 25.25 H new ATOM 0 HD11 LEU A 95 -6.179 0.177 3.946 1.00 75.41 H new ATOM 0 HD12 LEU A 95 -6.093 1.648 2.947 1.00 75.41 H new ATOM 0 HD13 LEU A 95 -4.672 1.121 3.880 1.00 75.41 H new ATOM 0 HD21 LEU A 95 -6.310 0.327 6.419 1.00 34.33 H new ATOM 0 HD22 LEU A 95 -4.801 1.266 6.509 1.00 34.33 H new ATOM 0 HD23 LEU A 95 -6.294 1.910 7.232 1.00 34.33 H new ATOM 1487 N HIS A 96 -4.018 5.814 6.731 1.00 74.54 N ATOM 1488 CA HIS A 96 -3.227 7.048 6.746 1.00 63.24 C ATOM 1489 C HIS A 96 -2.199 7.014 5.607 1.00 51.34 C ATOM 1490 O HIS A 96 -1.490 6.019 5.443 1.00 62.34 O ATOM 1491 CB HIS A 96 -2.549 7.204 8.131 1.00 14.40 C ATOM 1492 CG HIS A 96 -3.523 7.418 9.273 1.00 2.42 C ATOM 1493 ND1 HIS A 96 -3.385 8.460 10.157 1.00 31.34 N ATOM 1494 CD2 HIS A 96 -4.639 6.715 9.608 1.00 52.31 C ATOM 1495 CE1 HIS A 96 -4.407 8.376 10.990 1.00 33.40 C ATOM 1496 NE2 HIS A 96 -5.193 7.332 10.695 1.00 45.45 N ATOM 0 H HIS A 96 -3.615 5.061 7.289 1.00 74.54 H new ATOM 0 HA HIS A 96 -3.870 7.913 6.586 1.00 63.24 H new ATOM 0 HB2 HIS A 96 -1.955 6.313 8.336 1.00 14.40 H new ATOM 0 HB3 HIS A 96 -1.858 8.046 8.093 1.00 14.40 H new ATOM 0 HD1 HIS A 96 -2.642 9.159 10.168 1.00 31.34 H new ATOM 0 HD2 HIS A 96 -5.016 5.835 9.109 1.00 52.31 H new ATOM 0 HE1 HIS A 96 -4.586 9.062 11.805 1.00 33.40 H new ATOM 1504 N ALA A 97 -2.144 8.102 4.821 1.00 5.01 N ATOM 1505 CA ALA A 97 -1.230 8.256 3.678 1.00 61.35 C ATOM 1506 C ALA A 97 -0.057 9.149 4.084 1.00 62.54 C ATOM 1507 O ALA A 97 -0.250 10.236 4.657 1.00 74.34 O ATOM 1508 CB ALA A 97 -1.979 8.845 2.472 1.00 64.45 C ATOM 0 H ALA A 97 -2.745 8.914 4.965 1.00 5.01 H new ATOM 0 HA ALA A 97 -0.844 7.279 3.386 1.00 61.35 H new ATOM 0 HB1 ALA A 97 -1.291 8.953 1.634 1.00 64.45 H new ATOM 0 HB2 ALA A 97 -2.794 8.178 2.189 1.00 64.45 H new ATOM 0 HB3 ALA A 97 -2.385 9.821 2.737 1.00 64.45 H new ATOM 1514 N PHE A 98 1.163 8.676 3.801 1.00 33.45 N ATOM 1515 CA PHE A 98 2.399 9.330 4.241 1.00 73.14 C ATOM 1516 C PHE A 98 3.304 9.657 3.034 1.00 64.30 C ATOM 1517 O PHE A 98 3.227 8.998 1.986 1.00 50.21 O ATOM 1518 CB PHE A 98 3.176 8.408 5.215 1.00 41.32 C ATOM 1519 CG PHE A 98 2.364 7.755 6.340 1.00 73.10 C ATOM 1520 CD1 PHE A 98 1.765 6.506 6.158 1.00 42.45 C ATOM 1521 CD2 PHE A 98 2.217 8.370 7.578 1.00 4.42 C ATOM 1522 CE1 PHE A 98 1.054 5.900 7.176 1.00 0.40 C ATOM 1523 CE2 PHE A 98 1.501 7.764 8.594 1.00 43.01 C ATOM 1524 CZ PHE A 98 0.924 6.528 8.392 1.00 24.33 C ATOM 0 H PHE A 98 1.320 7.826 3.259 1.00 33.45 H new ATOM 0 HA PHE A 98 2.126 10.256 4.748 1.00 73.14 H new ATOM 0 HB2 PHE A 98 3.647 7.617 4.632 1.00 41.32 H new ATOM 0 HB3 PHE A 98 3.978 8.991 5.668 1.00 41.32 H new ATOM 0 HD1 PHE A 98 1.859 6.006 5.206 1.00 42.45 H new ATOM 0 HD2 PHE A 98 2.669 9.336 7.749 1.00 4.42 H new ATOM 0 HE1 PHE A 98 0.600 4.933 7.016 1.00 0.40 H new ATOM 0 HE2 PHE A 98 1.394 8.260 9.547 1.00 43.01 H new ATOM 0 HZ PHE A 98 0.370 6.054 9.189 1.00 24.33 H new ATOM 1534 N ARG A 99 4.177 10.670 3.214 1.00 21.44 N ATOM 1535 CA ARG A 99 5.268 11.030 2.264 1.00 0.43 C ATOM 1536 C ARG A 99 6.555 11.080 3.100 1.00 1.30 C ATOM 1537 O ARG A 99 6.531 11.720 4.152 1.00 35.53 O ATOM 1538 CB ARG A 99 5.028 12.419 1.586 1.00 12.12 C ATOM 1539 CG ARG A 99 3.590 12.668 1.099 1.00 71.02 C ATOM 1540 CD ARG A 99 3.121 11.736 -0.029 1.00 21.03 C ATOM 1541 NE ARG A 99 3.562 12.218 -1.342 1.00 55.44 N ATOM 1542 CZ ARG A 99 4.467 11.640 -2.127 1.00 35.31 C ATOM 1543 NH1 ARG A 99 5.071 10.519 -1.763 1.00 62.33 N ATOM 1544 NH2 ARG A 99 4.803 12.223 -3.259 1.00 71.13 N ATOM 0 H ARG A 99 4.149 11.275 4.035 1.00 21.44 H new ATOM 0 HA ARG A 99 5.319 10.298 1.458 1.00 0.43 H new ATOM 0 HB2 ARG A 99 5.296 13.203 2.295 1.00 12.12 H new ATOM 0 HB3 ARG A 99 5.704 12.513 0.736 1.00 12.12 H new ATOM 0 HG2 ARG A 99 2.911 12.561 1.945 1.00 71.02 H new ATOM 0 HG3 ARG A 99 3.511 13.699 0.755 1.00 71.02 H new ATOM 0 HD2 ARG A 99 3.511 10.732 0.141 1.00 21.03 H new ATOM 0 HD3 ARG A 99 2.034 11.663 -0.013 1.00 21.03 H new ATOM 0 HE ARG A 99 3.134 13.078 -1.686 1.00 55.44 H new ATOM 0 HH11 ARG A 99 4.845 10.085 -0.868 1.00 62.33 H new ATOM 0 HH12 ARG A 99 5.763 10.090 -2.378 1.00 62.33 H new ATOM 0 HH21 ARG A 99 4.371 13.108 -3.525 1.00 71.13 H new ATOM 0 HH22 ARG A 99 5.496 11.790 -3.870 1.00 71.13 H new ATOM 1558 N GLN A 100 7.645 10.413 2.642 1.00 61.21 N ATOM 1559 CA GLN A 100 8.901 10.230 3.427 1.00 34.45 C ATOM 1560 C GLN A 100 9.368 11.518 4.165 1.00 65.43 C ATOM 1561 O GLN A 100 9.243 11.609 5.396 1.00 55.01 O ATOM 1562 CB GLN A 100 10.021 9.662 2.515 1.00 54.35 C ATOM 1563 CG GLN A 100 9.721 8.264 1.935 1.00 44.11 C ATOM 1564 CD GLN A 100 10.845 7.653 1.087 1.00 31.20 C ATOM 1565 OE1 GLN A 100 12.100 7.953 1.405 1.00 41.14 O flip ATOM 1566 NE2 GLN A 100 10.584 6.891 0.162 1.00 23.41 N flip ATOM 0 H GLN A 100 7.681 9.985 1.717 1.00 61.21 H new ATOM 0 HA GLN A 100 8.679 9.510 4.215 1.00 34.45 H new ATOM 0 HB2 GLN A 100 10.189 10.356 1.691 1.00 54.35 H new ATOM 0 HB3 GLN A 100 10.948 9.614 3.086 1.00 54.35 H new ATOM 0 HG2 GLN A 100 9.500 7.586 2.759 1.00 44.11 H new ATOM 0 HG3 GLN A 100 8.820 8.327 1.324 1.00 44.11 H new ATOM 0 HE21 GLN A 100 9.613 6.676 -0.063 1.00 23.41 H new ATOM 0 HE22 GLN A 100 11.338 6.472 -0.382 1.00 23.41 H new ATOM 1575 N ALA A 101 9.894 12.506 3.427 1.00 44.52 N ATOM 1576 CA ALA A 101 10.213 13.832 3.999 1.00 11.13 C ATOM 1577 C ALA A 101 9.324 14.897 3.337 1.00 3.21 C ATOM 1578 O ALA A 101 8.329 15.345 3.917 1.00 70.41 O ATOM 1579 CB ALA A 101 11.725 14.136 3.842 1.00 1.25 C ATOM 0 H ALA A 101 10.109 12.417 2.434 1.00 44.52 H new ATOM 0 HA ALA A 101 10.002 13.841 5.068 1.00 11.13 H new ATOM 0 HB1 ALA A 101 11.945 15.115 4.267 1.00 1.25 H new ATOM 0 HB2 ALA A 101 12.305 13.375 4.364 1.00 1.25 H new ATOM 0 HB3 ALA A 101 11.989 14.132 2.784 1.00 1.25 H new ATOM 1585 N ALA A 102 9.667 15.254 2.094 1.00 45.43 N ATOM 1586 CA ALA A 102 8.923 16.231 1.284 1.00 2.11 C ATOM 1587 C ALA A 102 8.682 15.657 -0.120 1.00 22.23 C ATOM 1588 O ALA A 102 8.658 16.408 -1.102 1.00 0.14 O ATOM 1589 CB ALA A 102 9.723 17.553 1.237 1.00 13.41 C ATOM 0 H ALA A 102 10.480 14.868 1.614 1.00 45.43 H new ATOM 0 HA ALA A 102 7.949 16.437 1.727 1.00 2.11 H new ATOM 0 HB1 ALA A 102 9.181 18.285 0.639 1.00 13.41 H new ATOM 0 HB2 ALA A 102 9.853 17.936 2.249 1.00 13.41 H new ATOM 0 HB3 ALA A 102 10.700 17.371 0.790 1.00 13.41 H new ATOM 1595 N ASP A 103 8.448 14.321 -0.189 1.00 22.04 N ATOM 1596 CA ASP A 103 8.401 13.569 -1.466 1.00 51.30 C ATOM 1597 C ASP A 103 7.290 14.121 -2.393 1.00 42.34 C ATOM 1598 O ASP A 103 6.187 14.431 -1.926 1.00 31.34 O ATOM 1599 CB ASP A 103 8.185 12.050 -1.194 1.00 1.40 C ATOM 1600 CG ASP A 103 8.379 11.163 -2.448 1.00 73.21 C ATOM 1601 OD1 ASP A 103 7.411 10.964 -3.218 1.00 21.44 O ATOM 1602 OD2 ASP A 103 9.504 10.675 -2.680 1.00 25.45 O ATOM 0 H ASP A 103 8.288 13.740 0.634 1.00 22.04 H new ATOM 0 HA ASP A 103 9.357 13.698 -1.973 1.00 51.30 H new ATOM 0 HB2 ASP A 103 8.879 11.726 -0.419 1.00 1.40 H new ATOM 0 HB3 ASP A 103 7.178 11.899 -0.804 1.00 1.40 H new ATOM 1607 N GLU A 104 7.604 14.241 -3.698 1.00 13.13 N ATOM 1608 CA GLU A 104 6.714 14.847 -4.721 1.00 45.03 C ATOM 1609 C GLU A 104 6.411 13.856 -5.872 1.00 52.14 C ATOM 1610 O GLU A 104 5.814 14.239 -6.881 1.00 40.10 O ATOM 1611 CB GLU A 104 7.366 16.150 -5.272 1.00 54.10 C ATOM 1612 CG GLU A 104 7.548 17.276 -4.234 1.00 51.44 C ATOM 1613 CD GLU A 104 8.175 18.543 -4.836 1.00 22.41 C ATOM 1614 OE1 GLU A 104 7.429 19.403 -5.362 1.00 44.01 O ATOM 1615 OE2 GLU A 104 9.418 18.671 -4.810 1.00 54.01 O ATOM 0 H GLU A 104 8.492 13.917 -4.081 1.00 13.13 H new ATOM 0 HA GLU A 104 5.763 15.092 -4.249 1.00 45.03 H new ATOM 0 HB2 GLU A 104 8.341 15.901 -5.691 1.00 54.10 H new ATOM 0 HB3 GLU A 104 6.753 16.527 -6.091 1.00 54.10 H new ATOM 0 HG2 GLU A 104 6.579 17.526 -3.801 1.00 51.44 H new ATOM 0 HG3 GLU A 104 8.177 16.916 -3.420 1.00 51.44 H new ATOM 1622 N SER A 105 6.783 12.574 -5.698 1.00 11.50 N ATOM 1623 CA SER A 105 6.572 11.508 -6.714 1.00 24.32 C ATOM 1624 C SER A 105 5.138 10.899 -6.663 1.00 11.11 C ATOM 1625 O SER A 105 4.899 9.826 -7.227 1.00 54.01 O ATOM 1626 CB SER A 105 7.668 10.421 -6.519 1.00 22.05 C ATOM 1627 OG SER A 105 7.660 9.441 -7.553 1.00 74.22 O ATOM 0 H SER A 105 7.240 12.240 -4.849 1.00 11.50 H new ATOM 0 HA SER A 105 6.659 11.948 -7.707 1.00 24.32 H new ATOM 0 HB2 SER A 105 8.647 10.900 -6.485 1.00 22.05 H new ATOM 0 HB3 SER A 105 7.520 9.930 -5.557 1.00 22.05 H new ATOM 0 HG SER A 105 6.735 9.232 -7.798 1.00 74.22 H new ATOM 1633 N ARG A 106 4.190 11.609 -5.986 1.00 44.12 N ATOM 1634 CA ARG A 106 2.744 11.225 -5.878 1.00 23.31 C ATOM 1635 C ARG A 106 2.530 9.938 -5.045 1.00 62.50 C ATOM 1636 O ARG A 106 1.384 9.544 -4.812 1.00 52.12 O ATOM 1637 CB ARG A 106 2.083 11.062 -7.288 1.00 15.42 C ATOM 1638 CG ARG A 106 2.240 12.262 -8.262 1.00 61.13 C ATOM 1639 CD ARG A 106 1.434 13.529 -7.872 1.00 43.14 C ATOM 1640 NE ARG A 106 2.017 14.282 -6.735 1.00 13.24 N ATOM 1641 CZ ARG A 106 2.868 15.320 -6.843 1.00 65.21 C ATOM 1642 NH1 ARG A 106 3.275 15.759 -8.025 1.00 71.21 N ATOM 1643 NH2 ARG A 106 3.270 15.947 -5.753 1.00 64.33 N ATOM 0 H ARG A 106 4.408 12.475 -5.493 1.00 44.12 H new ATOM 0 HA ARG A 106 2.256 12.046 -5.353 1.00 23.31 H new ATOM 0 HB2 ARG A 106 2.505 10.177 -7.764 1.00 15.42 H new ATOM 0 HB3 ARG A 106 1.019 10.872 -7.148 1.00 15.42 H new ATOM 0 HG2 ARG A 106 3.296 12.525 -8.324 1.00 61.13 H new ATOM 0 HG3 ARG A 106 1.932 11.945 -9.258 1.00 61.13 H new ATOM 0 HD2 ARG A 106 1.370 14.188 -8.738 1.00 43.14 H new ATOM 0 HD3 ARG A 106 0.415 13.236 -7.618 1.00 43.14 H new ATOM 0 HE ARG A 106 1.752 13.990 -5.794 1.00 13.24 H new ATOM 0 HH11 ARG A 106 2.943 15.309 -8.878 1.00 71.21 H new ATOM 0 HH12 ARG A 106 3.920 16.547 -8.082 1.00 71.21 H new ATOM 0 HH21 ARG A 106 2.936 15.644 -4.838 1.00 64.33 H new ATOM 0 HH22 ARG A 106 3.915 16.734 -5.826 1.00 64.33 H new ATOM 1657 N THR A 107 3.621 9.325 -4.552 1.00 54.31 N ATOM 1658 CA THR A 107 3.600 7.968 -4.010 1.00 3.55 C ATOM 1659 C THR A 107 3.037 7.961 -2.569 1.00 3.41 C ATOM 1660 O THR A 107 3.767 8.182 -1.590 1.00 34.32 O ATOM 1661 CB THR A 107 5.037 7.339 -4.061 1.00 34.03 C ATOM 1662 OG1 THR A 107 5.640 7.601 -5.347 1.00 11.34 O ATOM 1663 CG2 THR A 107 5.023 5.818 -3.815 1.00 53.05 C ATOM 0 H THR A 107 4.541 9.764 -4.521 1.00 54.31 H new ATOM 0 HA THR A 107 2.940 7.358 -4.626 1.00 3.55 H new ATOM 0 HB THR A 107 5.617 7.802 -3.263 1.00 34.03 H new ATOM 0 HG1 THR A 107 5.143 7.124 -6.044 1.00 11.34 H new ATOM 0 HG21 THR A 107 6.042 5.433 -3.861 1.00 53.05 H new ATOM 0 HG22 THR A 107 4.601 5.612 -2.831 1.00 53.05 H new ATOM 0 HG23 THR A 107 4.416 5.331 -4.579 1.00 53.05 H new ATOM 1671 N LEU A 108 1.723 7.736 -2.461 1.00 34.42 N ATOM 1672 CA LEU A 108 1.034 7.609 -1.178 1.00 32.33 C ATOM 1673 C LEU A 108 1.225 6.179 -0.681 1.00 60.35 C ATOM 1674 O LEU A 108 0.780 5.216 -1.315 1.00 22.54 O ATOM 1675 CB LEU A 108 -0.475 7.923 -1.326 1.00 63.40 C ATOM 1676 CG LEU A 108 -0.843 9.374 -1.756 1.00 61.32 C ATOM 1677 CD1 LEU A 108 -2.370 9.513 -1.933 1.00 11.42 C ATOM 1678 CD2 LEU A 108 -0.293 10.420 -0.752 1.00 13.55 C ATOM 0 H LEU A 108 1.107 7.637 -3.268 1.00 34.42 H new ATOM 0 HA LEU A 108 1.450 8.321 -0.466 1.00 32.33 H new ATOM 0 HB2 LEU A 108 -0.897 7.233 -2.057 1.00 63.40 H new ATOM 0 HB3 LEU A 108 -0.962 7.715 -0.373 1.00 63.40 H new ATOM 0 HG LEU A 108 -0.369 9.573 -2.717 1.00 61.32 H new ATOM 0 HD11 LEU A 108 -2.610 10.533 -2.234 1.00 11.42 H new ATOM 0 HD12 LEU A 108 -2.712 8.819 -2.700 1.00 11.42 H new ATOM 0 HD13 LEU A 108 -2.868 9.286 -0.990 1.00 11.42 H new ATOM 0 HD21 LEU A 108 -0.568 11.422 -1.083 1.00 13.55 H new ATOM 0 HD22 LEU A 108 -0.717 10.235 0.235 1.00 13.55 H new ATOM 0 HD23 LEU A 108 0.793 10.340 -0.702 1.00 13.55 H new ATOM 1690 N PHE A 109 1.925 6.062 0.433 1.00 25.15 N ATOM 1691 CA PHE A 109 2.280 4.784 1.026 1.00 55.34 C ATOM 1692 C PHE A 109 1.346 4.563 2.220 1.00 4.34 C ATOM 1693 O PHE A 109 1.437 5.296 3.210 1.00 0.44 O ATOM 1694 CB PHE A 109 3.764 4.847 1.452 1.00 2.01 C ATOM 1695 CG PHE A 109 4.381 3.513 1.878 1.00 22.14 C ATOM 1696 CD1 PHE A 109 4.782 2.583 0.922 1.00 50.43 C ATOM 1697 CD2 PHE A 109 4.591 3.205 3.219 1.00 4.53 C ATOM 1698 CE1 PHE A 109 5.374 1.392 1.298 1.00 51.34 C ATOM 1699 CE2 PHE A 109 5.174 2.009 3.597 1.00 54.41 C ATOM 1700 CZ PHE A 109 5.567 1.103 2.636 1.00 44.22 C ATOM 0 H PHE A 109 2.269 6.865 0.960 1.00 25.15 H new ATOM 0 HA PHE A 109 2.166 3.951 0.332 1.00 55.34 H new ATOM 0 HB2 PHE A 109 4.346 5.249 0.623 1.00 2.01 H new ATOM 0 HB3 PHE A 109 3.858 5.552 2.278 1.00 2.01 H new ATOM 0 HD1 PHE A 109 4.629 2.795 -0.126 1.00 50.43 H new ATOM 0 HD2 PHE A 109 4.293 3.913 3.978 1.00 4.53 H new ATOM 0 HE1 PHE A 109 5.687 0.685 0.544 1.00 51.34 H new ATOM 0 HE2 PHE A 109 5.321 1.786 4.643 1.00 54.41 H new ATOM 0 HZ PHE A 109 6.025 0.169 2.927 1.00 44.22 H new ATOM 1710 N VAL A 110 0.411 3.602 2.094 1.00 55.15 N ATOM 1711 CA VAL A 110 -0.544 3.257 3.170 1.00 54.33 C ATOM 1712 C VAL A 110 -0.296 1.796 3.644 1.00 40.23 C ATOM 1713 O VAL A 110 -0.823 0.832 3.066 1.00 55.11 O ATOM 1714 CB VAL A 110 -2.073 3.516 2.771 1.00 41.11 C ATOM 1715 CG1 VAL A 110 -2.333 5.012 2.484 1.00 75.42 C ATOM 1716 CG2 VAL A 110 -2.546 2.676 1.565 1.00 20.40 C ATOM 0 H VAL A 110 0.295 3.044 1.248 1.00 55.15 H new ATOM 0 HA VAL A 110 -0.358 3.933 4.005 1.00 54.33 H new ATOM 0 HB VAL A 110 -2.653 3.199 3.638 1.00 41.11 H new ATOM 0 HG11 VAL A 110 -3.380 5.154 2.216 1.00 75.42 H new ATOM 0 HG12 VAL A 110 -2.103 5.598 3.374 1.00 75.42 H new ATOM 0 HG13 VAL A 110 -1.700 5.340 1.660 1.00 75.42 H new ATOM 0 HG21 VAL A 110 -3.590 2.903 1.351 1.00 20.40 H new ATOM 0 HG22 VAL A 110 -1.937 2.915 0.693 1.00 20.40 H new ATOM 0 HG23 VAL A 110 -2.445 1.616 1.798 1.00 20.40 H new ATOM 1726 N PRO A 111 0.584 1.595 4.673 1.00 51.42 N ATOM 1727 CA PRO A 111 0.734 0.284 5.311 1.00 33.22 C ATOM 1728 C PRO A 111 -0.460 0.037 6.251 1.00 74.31 C ATOM 1729 O PRO A 111 -0.755 0.855 7.139 1.00 4.31 O ATOM 1730 CB PRO A 111 2.074 0.414 6.075 1.00 74.34 C ATOM 1731 CG PRO A 111 2.172 1.868 6.419 1.00 2.34 C ATOM 1732 CD PRO A 111 1.488 2.614 5.288 1.00 10.53 C ATOM 0 HA PRO A 111 0.747 -0.560 4.621 1.00 33.22 H new ATOM 0 HB2 PRO A 111 2.082 -0.207 6.971 1.00 74.34 H new ATOM 0 HB3 PRO A 111 2.914 0.095 5.459 1.00 74.34 H new ATOM 0 HG2 PRO A 111 1.687 2.077 7.373 1.00 2.34 H new ATOM 0 HG3 PRO A 111 3.213 2.176 6.516 1.00 2.34 H new ATOM 0 HD2 PRO A 111 0.927 3.472 5.658 1.00 10.53 H new ATOM 0 HD3 PRO A 111 2.211 2.993 4.566 1.00 10.53 H new ATOM 1740 N PHE A 112 -1.148 -1.084 6.047 1.00 24.30 N ATOM 1741 CA PHE A 112 -2.336 -1.441 6.818 1.00 24.31 C ATOM 1742 C PHE A 112 -2.159 -2.833 7.411 1.00 42.11 C ATOM 1743 O PHE A 112 -1.447 -3.677 6.852 1.00 52.31 O ATOM 1744 CB PHE A 112 -3.629 -1.364 5.957 1.00 51.15 C ATOM 1745 CG PHE A 112 -3.761 -2.395 4.828 1.00 15.14 C ATOM 1746 CD1 PHE A 112 -3.174 -2.175 3.584 1.00 32.53 C ATOM 1747 CD2 PHE A 112 -4.486 -3.578 5.013 1.00 11.54 C ATOM 1748 CE1 PHE A 112 -3.306 -3.100 2.567 1.00 33.11 C ATOM 1749 CE2 PHE A 112 -4.612 -4.501 3.993 1.00 73.14 C ATOM 1750 CZ PHE A 112 -4.026 -4.262 2.770 1.00 60.01 C ATOM 0 H PHE A 112 -0.896 -1.773 5.339 1.00 24.30 H new ATOM 0 HA PHE A 112 -2.451 -0.718 7.626 1.00 24.31 H new ATOM 0 HB2 PHE A 112 -4.487 -1.472 6.620 1.00 51.15 H new ATOM 0 HB3 PHE A 112 -3.688 -0.368 5.518 1.00 51.15 H new ATOM 0 HD1 PHE A 112 -2.609 -1.271 3.413 1.00 32.53 H new ATOM 0 HD2 PHE A 112 -4.954 -3.772 5.967 1.00 11.54 H new ATOM 0 HE1 PHE A 112 -2.844 -2.914 1.608 1.00 33.11 H new ATOM 0 HE2 PHE A 112 -5.171 -5.411 4.155 1.00 73.14 H new ATOM 0 HZ PHE A 112 -4.129 -4.981 1.971 1.00 60.01 H new ATOM 1760 N ARG A 113 -2.801 -3.061 8.550 1.00 51.52 N ATOM 1761 CA ARG A 113 -2.881 -4.383 9.169 1.00 63.50 C ATOM 1762 C ARG A 113 -4.358 -4.772 9.265 1.00 32.21 C ATOM 1763 O ARG A 113 -5.177 -3.977 9.734 1.00 43.14 O ATOM 1764 CB ARG A 113 -2.222 -4.381 10.572 1.00 3.44 C ATOM 1765 CG ARG A 113 -2.328 -5.732 11.312 1.00 52.15 C ATOM 1766 CD ARG A 113 -1.777 -5.673 12.744 1.00 75.10 C ATOM 1767 NE ARG A 113 -0.326 -5.430 12.779 1.00 32.24 N ATOM 1768 CZ ARG A 113 0.426 -5.420 13.891 1.00 54.32 C ATOM 1769 NH1 ARG A 113 -0.126 -5.627 15.086 1.00 35.23 N ATOM 1770 NH2 ARG A 113 1.733 -5.240 13.791 1.00 74.20 N ATOM 0 H ARG A 113 -3.284 -2.332 9.075 1.00 51.52 H new ATOM 0 HA ARG A 113 -2.340 -5.109 8.562 1.00 63.50 H new ATOM 0 HB2 ARG A 113 -1.170 -4.116 10.469 1.00 3.44 H new ATOM 0 HB3 ARG A 113 -2.688 -3.606 11.181 1.00 3.44 H new ATOM 0 HG2 ARG A 113 -3.372 -6.043 11.342 1.00 52.15 H new ATOM 0 HG3 ARG A 113 -1.785 -6.492 10.750 1.00 52.15 H new ATOM 0 HD2 ARG A 113 -2.288 -4.883 13.294 1.00 75.10 H new ATOM 0 HD3 ARG A 113 -1.998 -6.611 13.254 1.00 75.10 H new ATOM 0 HE ARG A 113 0.144 -5.256 11.891 1.00 32.24 H new ATOM 0 HH11 ARG A 113 -1.129 -5.795 15.162 1.00 35.23 H new ATOM 0 HH12 ARG A 113 0.455 -5.617 15.925 1.00 35.23 H new ATOM 0 HH21 ARG A 113 2.161 -5.110 12.874 1.00 74.20 H new ATOM 0 HH22 ARG A 113 2.312 -5.231 14.631 1.00 74.20 H new ATOM 1784 N ASP A 114 -4.694 -5.982 8.814 1.00 4.02 N ATOM 1785 CA ASP A 114 -6.049 -6.533 8.914 1.00 34.31 C ATOM 1786 C ASP A 114 -5.974 -7.799 9.799 1.00 0.23 C ATOM 1787 O ASP A 114 -4.922 -8.073 10.405 1.00 43.53 O ATOM 1788 CB ASP A 114 -6.606 -6.815 7.485 1.00 33.42 C ATOM 1789 CG ASP A 114 -6.050 -8.099 6.856 1.00 52.53 C ATOM 1790 OD1 ASP A 114 -4.852 -8.141 6.506 1.00 10.11 O ATOM 1791 OD2 ASP A 114 -6.810 -9.082 6.743 1.00 32.44 O ATOM 0 H ASP A 114 -4.029 -6.613 8.366 1.00 4.02 H new ATOM 0 HA ASP A 114 -6.742 -5.831 9.378 1.00 34.31 H new ATOM 0 HB2 ASP A 114 -7.693 -6.884 7.534 1.00 33.42 H new ATOM 0 HB3 ASP A 114 -6.369 -5.970 6.838 1.00 33.42 H new ATOM 1796 N LYS A 115 -7.057 -8.586 9.853 1.00 20.42 N ATOM 1797 CA LYS A 115 -7.158 -9.726 10.789 1.00 15.42 C ATOM 1798 C LYS A 115 -6.399 -10.976 10.307 1.00 33.44 C ATOM 1799 O LYS A 115 -6.127 -11.868 11.112 1.00 62.30 O ATOM 1800 CB LYS A 115 -8.643 -10.061 11.064 1.00 43.31 C ATOM 1801 CG LYS A 115 -9.505 -8.866 11.531 1.00 24.51 C ATOM 1802 CD LYS A 115 -8.898 -8.056 12.697 1.00 12.12 C ATOM 1803 CE LYS A 115 -8.729 -8.871 13.979 1.00 43.42 C ATOM 1804 NZ LYS A 115 -8.179 -8.042 15.076 1.00 11.50 N ATOM 0 H LYS A 115 -7.878 -8.458 9.262 1.00 20.42 H new ATOM 0 HA LYS A 115 -6.677 -9.415 11.716 1.00 15.42 H new ATOM 0 HB2 LYS A 115 -9.082 -10.473 10.155 1.00 43.31 H new ATOM 0 HB3 LYS A 115 -8.689 -10.842 11.823 1.00 43.31 H new ATOM 0 HG2 LYS A 115 -9.665 -8.197 10.685 1.00 24.51 H new ATOM 0 HG3 LYS A 115 -10.484 -9.237 11.834 1.00 24.51 H new ATOM 0 HD2 LYS A 115 -7.927 -7.667 12.392 1.00 12.12 H new ATOM 0 HD3 LYS A 115 -9.536 -7.196 12.903 1.00 12.12 H new ATOM 0 HE2 LYS A 115 -9.692 -9.283 14.280 1.00 43.42 H new ATOM 0 HE3 LYS A 115 -8.066 -9.715 13.791 1.00 43.42 H new ATOM 0 HZ1 LYS A 115 -8.356 -8.511 15.987 1.00 11.50 H new ATOM 0 HZ2 LYS A 115 -7.155 -7.923 14.941 1.00 11.50 H new ATOM 0 HZ3 LYS A 115 -8.640 -7.110 15.071 1.00 11.50 H new ATOM 1818 N THR A 116 -6.076 -11.046 9.003 1.00 41.42 N ATOM 1819 CA THR A 116 -5.331 -12.186 8.433 1.00 62.42 C ATOM 1820 C THR A 116 -3.814 -12.033 8.662 1.00 72.13 C ATOM 1821 O THR A 116 -3.100 -13.034 8.827 1.00 42.14 O ATOM 1822 CB THR A 116 -5.608 -12.370 6.905 1.00 31.33 C ATOM 1823 OG1 THR A 116 -5.065 -11.274 6.145 1.00 12.32 O ATOM 1824 CG2 THR A 116 -7.113 -12.513 6.605 1.00 22.14 C ATOM 0 H THR A 116 -6.319 -10.326 8.322 1.00 41.42 H new ATOM 0 HA THR A 116 -5.687 -13.074 8.955 1.00 62.42 H new ATOM 0 HB THR A 116 -5.112 -13.293 6.606 1.00 31.33 H new ATOM 0 HG1 THR A 116 -5.685 -10.516 6.176 1.00 12.32 H new ATOM 0 HG21 THR A 116 -7.260 -12.639 5.532 1.00 22.14 H new ATOM 0 HG22 THR A 116 -7.508 -13.383 7.130 1.00 22.14 H new ATOM 0 HG23 THR A 116 -7.638 -11.618 6.941 1.00 22.14 H new ATOM 1832 N THR A 117 -3.340 -10.769 8.697 1.00 14.31 N ATOM 1833 CA THR A 117 -1.914 -10.434 8.855 1.00 73.34 C ATOM 1834 C THR A 117 -1.415 -10.866 10.251 1.00 25.24 C ATOM 1835 O THR A 117 -2.104 -10.653 11.248 1.00 34.13 O ATOM 1836 CB THR A 117 -1.687 -8.898 8.618 1.00 74.24 C ATOM 1837 OG1 THR A 117 -1.933 -8.588 7.237 1.00 53.10 O ATOM 1838 CG2 THR A 117 -0.270 -8.432 8.980 1.00 44.12 C ATOM 0 H THR A 117 -3.942 -9.950 8.616 1.00 14.31 H new ATOM 0 HA THR A 117 -1.336 -10.978 8.108 1.00 73.34 H new ATOM 0 HB THR A 117 -2.381 -8.374 9.275 1.00 74.24 H new ATOM 0 HG1 THR A 117 -2.895 -8.463 7.096 1.00 53.10 H new ATOM 0 HG21 THR A 117 -0.180 -7.362 8.793 1.00 44.12 H new ATOM 0 HG22 THR A 117 -0.079 -8.633 10.034 1.00 44.12 H new ATOM 0 HG23 THR A 117 0.457 -8.969 8.370 1.00 44.12 H new ATOM 1846 N GLY A 118 -0.218 -11.495 10.297 1.00 71.42 N ATOM 1847 CA GLY A 118 0.350 -12.044 11.536 1.00 14.40 C ATOM 1848 C GLY A 118 -0.355 -13.293 12.082 1.00 64.14 C ATOM 1849 O GLY A 118 0.108 -13.881 13.067 1.00 52.25 O ATOM 0 H GLY A 118 0.373 -11.632 9.477 1.00 71.42 H new ATOM 0 HA2 GLY A 118 1.398 -12.286 11.360 1.00 14.40 H new ATOM 0 HA3 GLY A 118 0.326 -11.269 12.302 1.00 14.40 H new ATOM 1853 N GLN A 119 -1.481 -13.698 11.459 1.00 12.55 N ATOM 1854 CA GLN A 119 -2.298 -14.845 11.909 1.00 35.23 C ATOM 1855 C GLN A 119 -2.171 -16.000 10.895 1.00 23.42 C ATOM 1856 O GLN A 119 -1.456 -16.980 11.135 1.00 62.12 O ATOM 1857 CB GLN A 119 -3.787 -14.400 12.094 1.00 2.13 C ATOM 1858 CG GLN A 119 -3.998 -13.221 13.076 1.00 4.31 C ATOM 1859 CD GLN A 119 -3.608 -13.539 14.522 1.00 14.44 C ATOM 1860 OE1 GLN A 119 -4.435 -14.007 15.310 1.00 71.22 O ATOM 1861 NE2 GLN A 119 -2.357 -13.287 14.884 1.00 13.54 N ATOM 0 H GLN A 119 -1.851 -13.238 10.627 1.00 12.55 H new ATOM 0 HA GLN A 119 -1.936 -15.201 12.874 1.00 35.23 H new ATOM 0 HB2 GLN A 119 -4.191 -14.120 11.121 1.00 2.13 H new ATOM 0 HB3 GLN A 119 -4.365 -15.254 12.445 1.00 2.13 H new ATOM 0 HG2 GLN A 119 -3.415 -12.366 12.733 1.00 4.31 H new ATOM 0 HG3 GLN A 119 -5.046 -12.923 13.050 1.00 4.31 H new ATOM 0 HE21 GLN A 119 -1.699 -12.900 14.208 1.00 13.54 H new ATOM 0 HE22 GLN A 119 -2.054 -13.480 15.838 1.00 13.54 H new ATOM 1870 N GLN A 120 -2.858 -15.857 9.747 1.00 50.42 N ATOM 1871 CA GLN A 120 -2.812 -16.832 8.634 1.00 65.12 C ATOM 1872 C GLN A 120 -1.946 -16.288 7.480 1.00 15.04 C ATOM 1873 O GLN A 120 -1.906 -16.856 6.399 1.00 32.42 O ATOM 1874 CB GLN A 120 -4.249 -17.135 8.118 1.00 35.04 C ATOM 1875 CG GLN A 120 -5.009 -15.909 7.585 1.00 53.51 C ATOM 1876 CD GLN A 120 -6.359 -16.254 6.955 1.00 32.44 C ATOM 1877 OE1 GLN A 120 -6.445 -16.509 5.757 1.00 24.31 O ATOM 1878 NE2 GLN A 120 -7.417 -16.268 7.752 1.00 21.00 N ATOM 0 H GLN A 120 -3.465 -15.059 9.561 1.00 50.42 H new ATOM 0 HA GLN A 120 -2.368 -17.756 9.005 1.00 65.12 H new ATOM 0 HB2 GLN A 120 -4.187 -17.880 7.325 1.00 35.04 H new ATOM 0 HB3 GLN A 120 -4.826 -17.580 8.929 1.00 35.04 H new ATOM 0 HG2 GLN A 120 -5.168 -15.206 8.403 1.00 53.51 H new ATOM 0 HG3 GLN A 120 -4.391 -15.402 6.844 1.00 53.51 H new ATOM 0 HE21 GLN A 120 -7.312 -16.051 8.743 1.00 21.00 H new ATOM 0 HE22 GLN A 120 -8.337 -16.495 7.375 1.00 21.00 H new ATOM 1887 N SER A 121 -1.225 -15.205 7.739 1.00 45.51 N ATOM 1888 CA SER A 121 -0.468 -14.466 6.719 1.00 1.33 C ATOM 1889 C SER A 121 0.731 -13.799 7.387 1.00 0.02 C ATOM 1890 O SER A 121 0.824 -13.773 8.621 1.00 21.34 O ATOM 1891 CB SER A 121 -1.374 -13.428 5.992 1.00 1.12 C ATOM 1892 OG SER A 121 -2.438 -14.064 5.293 1.00 34.32 O ATOM 0 H SER A 121 -1.144 -14.804 8.673 1.00 45.51 H new ATOM 0 HA SER A 121 -0.111 -15.156 5.955 1.00 1.33 H new ATOM 0 HB2 SER A 121 -1.783 -12.727 6.720 1.00 1.12 H new ATOM 0 HB3 SER A 121 -0.774 -12.846 5.292 1.00 1.12 H new ATOM 0 HG SER A 121 -2.288 -13.986 4.328 1.00 34.32 H new ATOM 1898 N TYR A 122 1.615 -13.247 6.550 1.00 23.34 N ATOM 1899 CA TYR A 122 2.912 -12.678 6.955 1.00 33.42 C ATOM 1900 C TYR A 122 2.731 -11.614 8.062 1.00 63.54 C ATOM 1901 O TYR A 122 1.743 -10.875 8.050 1.00 34.42 O ATOM 1902 CB TYR A 122 3.601 -12.064 5.706 1.00 72.12 C ATOM 1903 CG TYR A 122 3.702 -13.017 4.500 1.00 44.54 C ATOM 1904 CD1 TYR A 122 4.775 -13.894 4.359 1.00 4.11 C ATOM 1905 CD2 TYR A 122 2.703 -13.054 3.517 1.00 64.21 C ATOM 1906 CE1 TYR A 122 4.851 -14.769 3.294 1.00 20.40 C ATOM 1907 CE2 TYR A 122 2.779 -13.927 2.452 1.00 63.21 C ATOM 1908 CZ TYR A 122 3.853 -14.783 2.347 1.00 71.42 C ATOM 1909 OH TYR A 122 3.935 -15.647 1.278 1.00 61.31 O ATOM 0 H TYR A 122 1.448 -13.180 5.546 1.00 23.34 H new ATOM 0 HA TYR A 122 3.540 -13.468 7.367 1.00 33.42 H new ATOM 0 HB2 TYR A 122 3.050 -11.173 5.404 1.00 72.12 H new ATOM 0 HB3 TYR A 122 4.604 -11.740 5.982 1.00 72.12 H new ATOM 0 HD1 TYR A 122 5.563 -13.889 5.097 1.00 4.11 H new ATOM 0 HD2 TYR A 122 1.858 -12.386 3.595 1.00 64.21 H new ATOM 0 HE1 TYR A 122 5.692 -15.441 3.204 1.00 20.40 H new ATOM 0 HE2 TYR A 122 2.000 -13.939 1.704 1.00 63.21 H new ATOM 0 HH TYR A 122 3.150 -15.531 0.703 1.00 61.31 H new ATOM 1919 N ASP A 123 3.650 -11.572 9.028 1.00 32.02 N ATOM 1920 CA ASP A 123 3.566 -10.642 10.179 1.00 34.43 C ATOM 1921 C ASP A 123 3.779 -9.168 9.774 1.00 11.03 C ATOM 1922 O ASP A 123 4.151 -8.862 8.629 1.00 64.30 O ATOM 1923 CB ASP A 123 4.572 -11.056 11.282 1.00 42.10 C ATOM 1924 CG ASP A 123 6.046 -10.889 10.858 1.00 10.13 C ATOM 1925 OD1 ASP A 123 6.569 -11.769 10.134 1.00 34.23 O ATOM 1926 OD2 ASP A 123 6.687 -9.884 11.254 1.00 4.12 O ATOM 0 H ASP A 123 4.473 -12.174 9.044 1.00 32.02 H new ATOM 0 HA ASP A 123 2.552 -10.714 10.572 1.00 34.43 H new ATOM 0 HB2 ASP A 123 4.388 -10.458 12.175 1.00 42.10 H new ATOM 0 HB3 ASP A 123 4.395 -12.097 11.553 1.00 42.10 H new ATOM 1931 N GLY A 124 3.521 -8.265 10.735 1.00 33.22 N ATOM 1932 CA GLY A 124 3.673 -6.829 10.531 1.00 52.52 C ATOM 1933 C GLY A 124 2.456 -6.199 9.872 1.00 42.43 C ATOM 1934 O GLY A 124 1.477 -5.857 10.549 1.00 55.50 O ATOM 0 H GLY A 124 3.202 -8.517 11.670 1.00 33.22 H new ATOM 0 HA2 GLY A 124 3.852 -6.346 11.492 1.00 52.52 H new ATOM 0 HA3 GLY A 124 4.552 -6.645 9.913 1.00 52.52 H new ATOM 1938 N GLY A 125 2.506 -6.088 8.541 1.00 42.24 N ATOM 1939 CA GLY A 125 1.457 -5.432 7.767 1.00 62.13 C ATOM 1940 C GLY A 125 1.661 -5.602 6.279 1.00 42.12 C ATOM 1941 O GLY A 125 2.721 -6.061 5.838 1.00 73.41 O ATOM 0 H GLY A 125 3.273 -6.450 7.975 1.00 42.24 H new ATOM 0 HA2 GLY A 125 0.488 -5.843 8.049 1.00 62.13 H new ATOM 0 HA3 GLY A 125 1.437 -4.370 8.011 1.00 62.13 H new ATOM 1945 N ARG A 126 0.645 -5.221 5.498 1.00 60.23 N ATOM 1946 CA ARG A 126 0.697 -5.221 4.028 1.00 31.43 C ATOM 1947 C ARG A 126 0.783 -3.760 3.628 1.00 1.35 C ATOM 1948 O ARG A 126 -0.017 -2.956 4.120 1.00 41.33 O ATOM 1949 CB ARG A 126 -0.595 -5.839 3.390 1.00 42.24 C ATOM 1950 CG ARG A 126 -0.943 -7.296 3.775 1.00 63.52 C ATOM 1951 CD ARG A 126 0.133 -8.327 3.373 1.00 62.42 C ATOM 1952 NE ARG A 126 1.293 -8.291 4.283 1.00 72.14 N ATOM 1953 CZ ARG A 126 1.438 -9.061 5.371 1.00 44.33 C ATOM 1954 NH1 ARG A 126 0.512 -9.957 5.705 1.00 2.15 N ATOM 1955 NH2 ARG A 126 2.503 -8.897 6.142 1.00 75.03 N ATOM 0 H ARG A 126 -0.248 -4.900 5.871 1.00 60.23 H new ATOM 0 HA ARG A 126 1.540 -5.819 3.682 1.00 31.43 H new ATOM 0 HB2 ARG A 126 -1.441 -5.207 3.659 1.00 42.24 H new ATOM 0 HB3 ARG A 126 -0.493 -5.791 2.306 1.00 42.24 H new ATOM 0 HG2 ARG A 126 -1.097 -7.349 4.853 1.00 63.52 H new ATOM 0 HG3 ARG A 126 -1.887 -7.570 3.304 1.00 63.52 H new ATOM 0 HD2 ARG A 126 -0.302 -9.327 3.378 1.00 62.42 H new ATOM 0 HD3 ARG A 126 0.464 -8.128 2.354 1.00 62.42 H new ATOM 0 HE ARG A 126 2.041 -7.631 4.069 1.00 72.14 H new ATOM 0 HH11 ARG A 126 -0.323 -10.066 5.130 1.00 2.15 H new ATOM 0 HH12 ARG A 126 0.638 -10.535 6.536 1.00 2.15 H new ATOM 0 HH21 ARG A 126 3.200 -8.192 5.905 1.00 75.03 H new ATOM 0 HH22 ARG A 126 2.625 -9.476 6.973 1.00 75.03 H new ATOM 1969 N TYR A 127 1.715 -3.384 2.750 1.00 2.23 N ATOM 1970 CA TYR A 127 1.748 -2.011 2.254 1.00 22.24 C ATOM 1971 C TYR A 127 0.934 -1.944 0.962 1.00 51.24 C ATOM 1972 O TYR A 127 0.982 -2.859 0.120 1.00 51.02 O ATOM 1973 CB TYR A 127 3.196 -1.478 2.078 1.00 4.54 C ATOM 1974 CG TYR A 127 3.976 -1.993 0.854 1.00 25.14 C ATOM 1975 CD1 TYR A 127 3.922 -1.313 -0.373 1.00 53.12 C ATOM 1976 CD2 TYR A 127 4.764 -3.136 0.927 1.00 1.31 C ATOM 1977 CE1 TYR A 127 4.628 -1.760 -1.472 1.00 63.52 C ATOM 1978 CE2 TYR A 127 5.470 -3.583 -0.169 1.00 3.03 C ATOM 1979 CZ TYR A 127 5.400 -2.899 -1.363 1.00 52.05 C ATOM 1980 OH TYR A 127 6.103 -3.352 -2.452 1.00 23.21 O ATOM 0 H TYR A 127 2.440 -3.996 2.376 1.00 2.23 H new ATOM 0 HA TYR A 127 1.297 -1.350 2.994 1.00 22.24 H new ATOM 0 HB2 TYR A 127 3.154 -0.390 2.022 1.00 4.54 H new ATOM 0 HB3 TYR A 127 3.763 -1.730 2.974 1.00 4.54 H new ATOM 0 HD1 TYR A 127 3.316 -0.423 -0.459 1.00 53.12 H new ATOM 0 HD2 TYR A 127 4.824 -3.682 1.857 1.00 1.31 H new ATOM 0 HE1 TYR A 127 4.577 -1.224 -2.408 1.00 63.52 H new ATOM 0 HE2 TYR A 127 6.079 -4.471 -0.092 1.00 3.03 H new ATOM 0 HH TYR A 127 6.350 -2.593 -3.021 1.00 23.21 H new ATOM 1990 N MET A 128 0.168 -0.873 0.839 1.00 61.33 N ATOM 1991 CA MET A 128 -0.652 -0.599 -0.334 1.00 24.14 C ATOM 1992 C MET A 128 -0.194 0.756 -0.876 1.00 12.21 C ATOM 1993 O MET A 128 -0.072 1.719 -0.118 1.00 30.21 O ATOM 1994 CB MET A 128 -2.163 -0.630 0.054 1.00 42.21 C ATOM 1995 CG MET A 128 -3.067 -1.176 -1.053 1.00 14.03 C ATOM 1996 SD MET A 128 -3.178 -0.088 -2.490 1.00 33.50 S ATOM 1997 CE MET A 128 -4.339 1.128 -1.886 1.00 25.13 C ATOM 0 H MET A 128 0.096 -0.157 1.562 1.00 61.33 H new ATOM 0 HA MET A 128 -0.534 -1.353 -1.112 1.00 24.14 H new ATOM 0 HB2 MET A 128 -2.288 -1.241 0.948 1.00 42.21 H new ATOM 0 HB3 MET A 128 -2.485 0.379 0.310 1.00 42.21 H new ATOM 0 HG2 MET A 128 -2.692 -2.149 -1.371 1.00 14.03 H new ATOM 0 HG3 MET A 128 -4.067 -1.336 -0.650 1.00 14.03 H new ATOM 0 HE1 MET A 128 -4.720 1.714 -2.722 1.00 25.13 H new ATOM 0 HE2 MET A 128 -5.167 0.624 -1.388 1.00 25.13 H new ATOM 0 HE3 MET A 128 -3.838 1.789 -1.178 1.00 25.13 H new ATOM 2007 N GLU A 129 0.114 0.811 -2.166 1.00 4.25 N ATOM 2008 CA GLU A 129 0.814 1.953 -2.767 1.00 34.23 C ATOM 2009 C GLU A 129 -0.055 2.581 -3.870 1.00 53.21 C ATOM 2010 O GLU A 129 -0.357 1.929 -4.876 1.00 44.23 O ATOM 2011 CB GLU A 129 2.167 1.450 -3.329 1.00 13.30 C ATOM 2012 CG GLU A 129 3.111 2.541 -3.856 1.00 30.41 C ATOM 2013 CD GLU A 129 4.302 1.955 -4.636 1.00 23.44 C ATOM 2014 OE1 GLU A 129 5.222 1.378 -4.014 1.00 51.31 O ATOM 2015 OE2 GLU A 129 4.299 2.036 -5.883 1.00 73.12 O ATOM 0 H GLU A 129 -0.112 0.069 -2.829 1.00 4.25 H new ATOM 0 HA GLU A 129 1.001 2.725 -2.021 1.00 34.23 H new ATOM 0 HB2 GLU A 129 2.683 0.896 -2.545 1.00 13.30 H new ATOM 0 HB3 GLU A 129 1.966 0.747 -4.137 1.00 13.30 H new ATOM 0 HG2 GLU A 129 2.554 3.219 -4.503 1.00 30.41 H new ATOM 0 HG3 GLU A 129 3.483 3.132 -3.019 1.00 30.41 H new ATOM 2022 N LEU A 130 -0.471 3.840 -3.653 1.00 54.41 N ATOM 2023 CA LEU A 130 -1.269 4.617 -4.613 1.00 13.40 C ATOM 2024 C LEU A 130 -0.366 5.682 -5.240 1.00 1.21 C ATOM 2025 O LEU A 130 0.419 6.315 -4.528 1.00 63.30 O ATOM 2026 CB LEU A 130 -2.493 5.319 -3.924 1.00 54.23 C ATOM 2027 CG LEU A 130 -3.255 4.500 -2.819 1.00 23.24 C ATOM 2028 CD1 LEU A 130 -2.590 4.663 -1.433 1.00 21.31 C ATOM 2029 CD2 LEU A 130 -4.745 4.875 -2.744 1.00 22.32 C ATOM 0 H LEU A 130 -0.260 4.351 -2.796 1.00 54.41 H new ATOM 0 HA LEU A 130 -1.660 3.936 -5.369 1.00 13.40 H new ATOM 0 HB2 LEU A 130 -2.142 6.249 -3.476 1.00 54.23 H new ATOM 0 HB3 LEU A 130 -3.209 5.590 -4.700 1.00 54.23 H new ATOM 0 HG LEU A 130 -3.190 3.452 -3.111 1.00 23.24 H new ATOM 0 HD11 LEU A 130 -3.143 4.083 -0.694 1.00 21.31 H new ATOM 0 HD12 LEU A 130 -1.561 4.306 -1.479 1.00 21.31 H new ATOM 0 HD13 LEU A 130 -2.596 5.715 -1.148 1.00 21.31 H new ATOM 0 HD21 LEU A 130 -5.230 4.284 -1.967 1.00 22.32 H new ATOM 0 HD22 LEU A 130 -4.842 5.935 -2.508 1.00 22.32 H new ATOM 0 HD23 LEU A 130 -5.220 4.672 -3.704 1.00 22.32 H new ATOM 2041 N GLU A 131 -0.472 5.878 -6.557 1.00 24.25 N ATOM 2042 CA GLU A 131 0.155 7.016 -7.255 1.00 21.34 C ATOM 2043 C GLU A 131 -0.922 7.695 -8.116 1.00 3.30 C ATOM 2044 O GLU A 131 -1.155 7.274 -9.260 1.00 74.24 O ATOM 2045 CB GLU A 131 1.382 6.589 -8.115 1.00 71.11 C ATOM 2046 CG GLU A 131 2.534 5.957 -7.314 1.00 51.24 C ATOM 2047 CD GLU A 131 3.786 5.695 -8.163 1.00 45.32 C ATOM 2048 OE1 GLU A 131 3.835 4.656 -8.866 1.00 23.42 O ATOM 2049 OE2 GLU A 131 4.731 6.512 -8.119 1.00 30.15 O ATOM 0 H GLU A 131 -0.994 5.255 -7.174 1.00 24.25 H new ATOM 0 HA GLU A 131 0.546 7.715 -6.516 1.00 21.34 H new ATOM 0 HB2 GLU A 131 1.050 5.878 -8.872 1.00 71.11 H new ATOM 0 HB3 GLU A 131 1.761 7.464 -8.644 1.00 71.11 H new ATOM 0 HG2 GLU A 131 2.796 6.615 -6.485 1.00 51.24 H new ATOM 0 HG3 GLU A 131 2.194 5.017 -6.880 1.00 51.24 H new ATOM 2056 N PRO A 132 -1.648 8.719 -7.545 1.00 44.41 N ATOM 2057 CA PRO A 132 -2.696 9.474 -8.274 1.00 3.52 C ATOM 2058 C PRO A 132 -2.131 10.222 -9.499 1.00 64.01 C ATOM 2059 O PRO A 132 -0.934 10.525 -9.568 1.00 52.04 O ATOM 2060 CB PRO A 132 -3.243 10.467 -7.203 1.00 3.00 C ATOM 2061 CG PRO A 132 -2.137 10.579 -6.195 1.00 4.42 C ATOM 2062 CD PRO A 132 -1.508 9.213 -6.145 1.00 62.14 C ATOM 0 HA PRO A 132 -3.466 8.821 -8.684 1.00 3.52 H new ATOM 0 HB2 PRO A 132 -3.478 11.436 -7.643 1.00 3.00 H new ATOM 0 HB3 PRO A 132 -4.160 10.093 -6.747 1.00 3.00 H new ATOM 0 HG2 PRO A 132 -1.411 11.336 -6.490 1.00 4.42 H new ATOM 0 HG3 PRO A 132 -2.523 10.871 -5.218 1.00 4.42 H new ATOM 0 HD2 PRO A 132 -0.463 9.262 -5.839 1.00 62.14 H new ATOM 0 HD3 PRO A 132 -2.018 8.561 -5.436 1.00 62.14 H new ATOM 2070 N ASP A 133 -3.039 10.556 -10.429 1.00 54.44 N ATOM 2071 CA ASP A 133 -2.723 11.272 -11.688 1.00 61.03 C ATOM 2072 C ASP A 133 -2.402 12.753 -11.403 1.00 21.52 C ATOM 2073 O ASP A 133 -1.853 13.473 -12.243 1.00 22.53 O ATOM 2074 CB ASP A 133 -3.937 11.134 -12.641 1.00 30.13 C ATOM 2075 CG ASP A 133 -3.754 11.838 -13.996 1.00 44.44 C ATOM 2076 OD1 ASP A 133 -2.972 11.342 -14.834 1.00 30.33 O ATOM 2077 OD2 ASP A 133 -4.399 12.885 -14.234 1.00 54.22 O ATOM 0 H ASP A 133 -4.030 10.336 -10.332 1.00 54.44 H new ATOM 0 HA ASP A 133 -1.840 10.837 -12.157 1.00 61.03 H new ATOM 0 HB2 ASP A 133 -4.129 10.076 -12.817 1.00 30.13 H new ATOM 0 HB3 ASP A 133 -4.820 11.541 -12.148 1.00 30.13 H new ATOM 2082 N ARG A 134 -2.707 13.166 -10.177 1.00 61.33 N ATOM 2083 CA ARG A 134 -2.568 14.530 -9.696 1.00 21.43 C ATOM 2084 C ARG A 134 -2.045 14.483 -8.262 1.00 24.33 C ATOM 2085 O ARG A 134 -1.950 13.404 -7.668 1.00 4.33 O ATOM 2086 CB ARG A 134 -3.948 15.227 -9.725 1.00 72.45 C ATOM 2087 CG ARG A 134 -5.068 14.430 -9.002 1.00 0.52 C ATOM 2088 CD ARG A 134 -6.283 15.289 -8.680 1.00 41.22 C ATOM 2089 NE ARG A 134 -7.389 14.531 -8.061 1.00 74.40 N ATOM 2090 CZ ARG A 134 -8.480 14.064 -8.692 1.00 34.32 C ATOM 2091 NH1 ARG A 134 -8.645 14.248 -9.997 1.00 71.15 N ATOM 2092 NH2 ARG A 134 -9.405 13.417 -8.003 1.00 41.21 N ATOM 0 H ARG A 134 -3.072 12.532 -9.466 1.00 61.33 H new ATOM 0 HA ARG A 134 -1.876 15.086 -10.328 1.00 21.43 H new ATOM 0 HB2 ARG A 134 -3.858 16.210 -9.263 1.00 72.45 H new ATOM 0 HB3 ARG A 134 -4.241 15.388 -10.762 1.00 72.45 H new ATOM 0 HG2 ARG A 134 -5.375 13.593 -9.628 1.00 0.52 H new ATOM 0 HG3 ARG A 134 -4.671 14.008 -8.079 1.00 0.52 H new ATOM 0 HD2 ARG A 134 -5.983 16.093 -8.008 1.00 41.22 H new ATOM 0 HD3 ARG A 134 -6.641 15.757 -9.597 1.00 41.22 H new ATOM 0 HE ARG A 134 -7.318 14.344 -7.061 1.00 74.40 H new ATOM 0 HH11 ARG A 134 -7.938 14.750 -10.535 1.00 71.15 H new ATOM 0 HH12 ARG A 134 -9.478 13.888 -10.462 1.00 71.15 H new ATOM 0 HH21 ARG A 134 -9.288 13.275 -7.000 1.00 41.21 H new ATOM 0 HH22 ARG A 134 -10.236 13.060 -8.475 1.00 41.21 H new ATOM 2106 N ASP A 135 -1.706 15.642 -7.696 1.00 14.24 N ATOM 2107 CA ASP A 135 -1.391 15.745 -6.260 1.00 21.12 C ATOM 2108 C ASP A 135 -2.702 16.021 -5.516 1.00 63.41 C ATOM 2109 O ASP A 135 -3.496 16.848 -5.971 1.00 63.01 O ATOM 2110 CB ASP A 135 -0.359 16.863 -5.995 1.00 43.01 C ATOM 2111 CG ASP A 135 0.165 16.876 -4.543 1.00 23.51 C ATOM 2112 OD1 ASP A 135 0.772 15.861 -4.116 1.00 22.33 O ATOM 2113 OD2 ASP A 135 0.008 17.902 -3.843 1.00 30.33 O ATOM 0 H ASP A 135 -1.641 16.524 -8.204 1.00 14.24 H new ATOM 0 HA ASP A 135 -0.944 14.816 -5.906 1.00 21.12 H new ATOM 0 HB2 ASP A 135 0.483 16.741 -6.677 1.00 43.01 H new ATOM 0 HB3 ASP A 135 -0.813 17.828 -6.219 1.00 43.01 H new ATOM 2118 N LEU A 136 -2.925 15.333 -4.390 1.00 25.22 N ATOM 2119 CA LEU A 136 -4.221 15.347 -3.676 1.00 14.25 C ATOM 2120 C LEU A 136 -4.215 16.379 -2.535 1.00 12.45 C ATOM 2121 O LEU A 136 -3.170 16.656 -1.934 1.00 62.04 O ATOM 2122 CB LEU A 136 -4.551 13.929 -3.144 1.00 25.14 C ATOM 2123 CG LEU A 136 -4.535 12.790 -4.217 1.00 24.22 C ATOM 2124 CD1 LEU A 136 -4.869 11.431 -3.591 1.00 42.41 C ATOM 2125 CD2 LEU A 136 -5.488 13.086 -5.396 1.00 61.32 C ATOM 0 H LEU A 136 -2.217 14.750 -3.943 1.00 25.22 H new ATOM 0 HA LEU A 136 -4.999 15.643 -4.379 1.00 14.25 H new ATOM 0 HB2 LEU A 136 -3.836 13.677 -2.361 1.00 25.14 H new ATOM 0 HB3 LEU A 136 -5.537 13.954 -2.679 1.00 25.14 H new ATOM 0 HG LEU A 136 -3.521 12.750 -4.614 1.00 24.22 H new ATOM 0 HD11 LEU A 136 -4.850 10.661 -4.362 1.00 42.41 H new ATOM 0 HD12 LEU A 136 -4.133 11.194 -2.823 1.00 42.41 H new ATOM 0 HD13 LEU A 136 -5.862 11.471 -3.143 1.00 42.41 H new ATOM 0 HD21 LEU A 136 -5.443 12.268 -6.115 1.00 61.32 H new ATOM 0 HD22 LEU A 136 -6.508 13.186 -5.024 1.00 61.32 H new ATOM 0 HD23 LEU A 136 -5.187 14.014 -5.883 1.00 61.32 H new ATOM 2137 N SER A 137 -5.402 16.948 -2.268 1.00 74.21 N ATOM 2138 CA SER A 137 -5.618 17.964 -1.218 1.00 70.25 C ATOM 2139 C SER A 137 -6.739 17.514 -0.262 1.00 3.25 C ATOM 2140 O SER A 137 -7.375 16.479 -0.478 1.00 22.34 O ATOM 2141 CB SER A 137 -5.965 19.321 -1.881 1.00 23.21 C ATOM 2142 OG SER A 137 -4.916 19.744 -2.737 1.00 50.01 O ATOM 0 H SER A 137 -6.252 16.714 -2.781 1.00 74.21 H new ATOM 0 HA SER A 137 -4.707 18.082 -0.632 1.00 70.25 H new ATOM 0 HB2 SER A 137 -6.890 19.227 -2.450 1.00 23.21 H new ATOM 0 HB3 SER A 137 -6.139 20.073 -1.112 1.00 23.21 H new ATOM 0 HG SER A 137 -5.154 20.601 -3.147 1.00 50.01 H new ATOM 2148 N ASP A 138 -6.956 18.292 0.814 1.00 73.31 N ATOM 2149 CA ASP A 138 -8.023 18.028 1.800 1.00 35.21 C ATOM 2150 C ASP A 138 -9.405 18.276 1.168 1.00 33.05 C ATOM 2151 O ASP A 138 -9.751 19.419 0.849 1.00 30.32 O ATOM 2152 CB ASP A 138 -7.814 18.911 3.057 1.00 14.14 C ATOM 2153 CG ASP A 138 -8.846 18.633 4.164 1.00 5.31 C ATOM 2154 OD1 ASP A 138 -8.719 17.601 4.845 1.00 21.34 O ATOM 2155 OD2 ASP A 138 -9.795 19.431 4.351 1.00 23.41 O ATOM 0 H ASP A 138 -6.399 19.120 1.025 1.00 73.31 H new ATOM 0 HA ASP A 138 -7.977 16.983 2.107 1.00 35.21 H new ATOM 0 HB2 ASP A 138 -6.812 18.742 3.451 1.00 14.14 H new ATOM 0 HB3 ASP A 138 -7.870 19.961 2.770 1.00 14.14 H new ATOM 2160 N GLY A 139 -10.161 17.190 0.942 1.00 31.34 N ATOM 2161 CA GLY A 139 -11.475 17.256 0.285 1.00 31.24 C ATOM 2162 C GLY A 139 -11.459 16.580 -1.082 1.00 34.34 C ATOM 2163 O GLY A 139 -12.513 16.354 -1.675 1.00 74.45 O ATOM 0 H GLY A 139 -9.880 16.246 1.208 1.00 31.34 H new ATOM 0 HA2 GLY A 139 -12.222 16.778 0.918 1.00 31.24 H new ATOM 0 HA3 GLY A 139 -11.773 18.298 0.172 1.00 31.24 H new ATOM 2167 N ASP A 140 -10.246 16.279 -1.582 1.00 73.31 N ATOM 2168 CA ASP A 140 -10.037 15.515 -2.833 1.00 12.02 C ATOM 2169 C ASP A 140 -10.322 14.026 -2.547 1.00 12.33 C ATOM 2170 O ASP A 140 -10.238 13.599 -1.400 1.00 4.01 O ATOM 2171 CB ASP A 140 -8.563 15.720 -3.315 1.00 13.34 C ATOM 2172 CG ASP A 140 -8.259 15.362 -4.789 1.00 71.44 C ATOM 2173 OD1 ASP A 140 -8.886 14.452 -5.368 1.00 33.23 O ATOM 2174 OD2 ASP A 140 -7.349 15.986 -5.372 1.00 74.54 O ATOM 0 H ASP A 140 -9.376 16.559 -1.129 1.00 73.31 H new ATOM 0 HA ASP A 140 -10.708 15.861 -3.619 1.00 12.02 H new ATOM 0 HB2 ASP A 140 -8.295 16.765 -3.156 1.00 13.34 H new ATOM 0 HB3 ASP A 140 -7.910 15.123 -2.678 1.00 13.34 H new ATOM 2179 N GLU A 141 -10.678 13.243 -3.575 1.00 21.43 N ATOM 2180 CA GLU A 141 -10.940 11.798 -3.422 1.00 53.34 C ATOM 2181 C GLU A 141 -9.766 10.961 -3.962 1.00 12.35 C ATOM 2182 O GLU A 141 -8.860 11.488 -4.618 1.00 23.14 O ATOM 2183 CB GLU A 141 -12.260 11.424 -4.136 1.00 21.45 C ATOM 2184 CG GLU A 141 -13.489 12.191 -3.614 1.00 61.32 C ATOM 2185 CD GLU A 141 -14.792 11.772 -4.304 1.00 1.43 C ATOM 2186 OE1 GLU A 141 -15.091 12.290 -5.401 1.00 62.13 O ATOM 2187 OE2 GLU A 141 -15.520 10.913 -3.762 1.00 53.22 O ATOM 0 H GLU A 141 -10.793 13.586 -4.529 1.00 21.43 H new ATOM 0 HA GLU A 141 -11.040 11.574 -2.360 1.00 53.34 H new ATOM 0 HB2 GLU A 141 -12.151 11.615 -5.204 1.00 21.45 H new ATOM 0 HB3 GLU A 141 -12.435 10.354 -4.019 1.00 21.45 H new ATOM 0 HG2 GLU A 141 -13.584 12.028 -2.540 1.00 61.32 H new ATOM 0 HG3 GLU A 141 -13.333 13.260 -3.761 1.00 61.32 H new ATOM 2194 N ILE A 142 -9.806 9.647 -3.670 1.00 65.04 N ATOM 2195 CA ILE A 142 -8.784 8.668 -4.096 1.00 31.41 C ATOM 2196 C ILE A 142 -9.363 7.243 -3.938 1.00 22.24 C ATOM 2197 O ILE A 142 -10.086 6.970 -2.980 1.00 44.45 O ATOM 2198 CB ILE A 142 -7.447 8.815 -3.263 1.00 24.40 C ATOM 2199 CG1 ILE A 142 -6.322 7.850 -3.783 1.00 34.10 C ATOM 2200 CG2 ILE A 142 -7.698 8.625 -1.742 1.00 35.33 C ATOM 2201 CD1 ILE A 142 -5.833 8.113 -5.208 1.00 73.02 C ATOM 0 H ILE A 142 -10.559 9.228 -3.124 1.00 65.04 H new ATOM 0 HA ILE A 142 -8.533 8.857 -5.140 1.00 31.41 H new ATOM 0 HB ILE A 142 -7.090 9.834 -3.412 1.00 24.40 H new ATOM 0 HG12 ILE A 142 -5.469 7.917 -3.107 1.00 34.10 H new ATOM 0 HG13 ILE A 142 -6.692 6.826 -3.728 1.00 34.10 H new ATOM 0 HG21 ILE A 142 -6.757 8.733 -1.202 1.00 35.33 H new ATOM 0 HG22 ILE A 142 -8.405 9.378 -1.393 1.00 35.33 H new ATOM 0 HG23 ILE A 142 -8.108 7.631 -1.562 1.00 35.33 H new ATOM 0 HD11 ILE A 142 -5.058 7.391 -5.466 1.00 73.02 H new ATOM 0 HD12 ILE A 142 -6.667 8.014 -5.903 1.00 73.02 H new ATOM 0 HD13 ILE A 142 -5.425 9.122 -5.272 1.00 73.02 H new ATOM 2213 N THR A 143 -9.049 6.336 -4.875 1.00 4.24 N ATOM 2214 CA THR A 143 -9.569 4.956 -4.855 1.00 31.41 C ATOM 2215 C THR A 143 -8.540 4.012 -4.190 1.00 74.44 C ATOM 2216 O THR A 143 -7.359 4.039 -4.544 1.00 3.05 O ATOM 2217 CB THR A 143 -9.912 4.482 -6.302 1.00 24.25 C ATOM 2218 OG1 THR A 143 -10.650 5.512 -6.981 1.00 61.15 O ATOM 2219 CG2 THR A 143 -10.754 3.204 -6.300 1.00 11.33 C ATOM 0 H THR A 143 -8.432 6.534 -5.663 1.00 4.24 H new ATOM 0 HA THR A 143 -10.487 4.931 -4.268 1.00 31.41 H new ATOM 0 HB THR A 143 -8.970 4.275 -6.811 1.00 24.25 H new ATOM 0 HG1 THR A 143 -10.864 5.216 -7.890 1.00 61.15 H new ATOM 0 HG21 THR A 143 -10.970 2.909 -7.327 1.00 11.33 H new ATOM 0 HG22 THR A 143 -10.203 2.406 -5.802 1.00 11.33 H new ATOM 0 HG23 THR A 143 -11.689 3.385 -5.770 1.00 11.33 H new ATOM 2227 N LEU A 144 -9.012 3.186 -3.234 1.00 70.11 N ATOM 2228 CA LEU A 144 -8.173 2.326 -2.369 1.00 15.21 C ATOM 2229 C LEU A 144 -8.291 0.852 -2.833 1.00 54.01 C ATOM 2230 O LEU A 144 -9.282 0.167 -2.528 1.00 52.53 O ATOM 2231 CB LEU A 144 -8.623 2.478 -0.873 1.00 3.24 C ATOM 2232 CG LEU A 144 -7.968 3.624 -0.014 1.00 15.40 C ATOM 2233 CD1 LEU A 144 -6.485 3.311 0.320 1.00 44.43 C ATOM 2234 CD2 LEU A 144 -8.106 5.007 -0.691 1.00 2.12 C ATOM 0 H LEU A 144 -10.008 3.095 -3.036 1.00 70.11 H new ATOM 0 HA LEU A 144 -7.130 2.633 -2.447 1.00 15.21 H new ATOM 0 HB2 LEU A 144 -9.702 2.629 -0.863 1.00 3.24 H new ATOM 0 HB3 LEU A 144 -8.429 1.531 -0.369 1.00 3.24 H new ATOM 0 HG LEU A 144 -8.519 3.667 0.926 1.00 15.40 H new ATOM 0 HD11 LEU A 144 -6.066 4.124 0.913 1.00 44.43 H new ATOM 0 HD12 LEU A 144 -6.428 2.381 0.886 1.00 44.43 H new ATOM 0 HD13 LEU A 144 -5.918 3.208 -0.605 1.00 44.43 H new ATOM 0 HD21 LEU A 144 -7.640 5.767 -0.064 1.00 2.12 H new ATOM 0 HD22 LEU A 144 -7.613 4.987 -1.663 1.00 2.12 H new ATOM 0 HD23 LEU A 144 -9.162 5.243 -0.824 1.00 2.12 H new ATOM 2246 N ASP A 145 -7.290 0.401 -3.604 1.00 64.04 N ATOM 2247 CA ASP A 145 -7.180 -0.993 -4.082 1.00 0.23 C ATOM 2248 C ASP A 145 -6.446 -1.889 -3.068 1.00 11.23 C ATOM 2249 O ASP A 145 -5.228 -2.058 -3.155 1.00 62.31 O ATOM 2250 CB ASP A 145 -6.429 -1.033 -5.443 1.00 11.41 C ATOM 2251 CG ASP A 145 -7.291 -0.606 -6.627 1.00 4.40 C ATOM 2252 OD1 ASP A 145 -7.384 0.613 -6.920 1.00 23.44 O ATOM 2253 OD2 ASP A 145 -7.906 -1.487 -7.256 1.00 45.40 O ATOM 0 H ASP A 145 -6.524 0.997 -3.919 1.00 64.04 H new ATOM 0 HA ASP A 145 -8.193 -1.377 -4.204 1.00 0.23 H new ATOM 0 HB2 ASP A 145 -5.556 -0.383 -5.386 1.00 11.41 H new ATOM 0 HB3 ASP A 145 -6.062 -2.045 -5.617 1.00 11.41 H new ATOM 2258 N PHE A 146 -7.190 -2.496 -2.126 1.00 4.20 N ATOM 2259 CA PHE A 146 -6.622 -3.515 -1.194 1.00 31.24 C ATOM 2260 C PHE A 146 -6.502 -4.846 -1.932 1.00 61.44 C ATOM 2261 O PHE A 146 -5.763 -5.745 -1.529 1.00 61.34 O ATOM 2262 CB PHE A 146 -7.507 -3.690 0.060 1.00 34.33 C ATOM 2263 CG PHE A 146 -7.957 -2.386 0.677 1.00 24.13 C ATOM 2264 CD1 PHE A 146 -7.062 -1.336 0.845 1.00 32.34 C ATOM 2265 CD2 PHE A 146 -9.277 -2.197 1.066 1.00 74.30 C ATOM 2266 CE1 PHE A 146 -7.477 -0.150 1.378 1.00 70.24 C ATOM 2267 CE2 PHE A 146 -9.689 -1.007 1.601 1.00 71.23 C ATOM 2268 CZ PHE A 146 -8.790 0.018 1.760 1.00 72.45 C ATOM 0 H PHE A 146 -8.182 -2.307 -1.982 1.00 4.20 H new ATOM 0 HA PHE A 146 -5.641 -3.175 -0.862 1.00 31.24 H new ATOM 0 HB2 PHE A 146 -8.386 -4.277 -0.206 1.00 34.33 H new ATOM 0 HB3 PHE A 146 -6.955 -4.262 0.806 1.00 34.33 H new ATOM 0 HD1 PHE A 146 -6.030 -1.460 0.551 1.00 32.34 H new ATOM 0 HD2 PHE A 146 -9.988 -3.001 0.944 1.00 74.30 H new ATOM 0 HE1 PHE A 146 -6.773 0.660 1.501 1.00 70.24 H new ATOM 0 HE2 PHE A 146 -10.719 -0.874 1.897 1.00 71.23 H new ATOM 0 HZ PHE A 146 -9.112 0.957 2.185 1.00 72.45 H new ATOM 2278 N ASN A 147 -7.251 -4.920 -3.039 1.00 12.13 N ATOM 2279 CA ASN A 147 -7.219 -6.003 -4.010 1.00 33.31 C ATOM 2280 C ASN A 147 -5.950 -5.960 -4.884 1.00 0.21 C ATOM 2281 O ASN A 147 -5.856 -6.735 -5.827 1.00 31.50 O ATOM 2282 CB ASN A 147 -8.486 -5.917 -4.897 1.00 53.03 C ATOM 2283 CG ASN A 147 -8.623 -4.577 -5.632 1.00 43.41 C ATOM 2284 OD1 ASN A 147 -8.100 -4.486 -6.850 1.00 32.31 O flip ATOM 2285 ND2 ASN A 147 -9.191 -3.627 -5.095 1.00 45.43 N flip ATOM 0 H ASN A 147 -7.922 -4.192 -3.286 1.00 12.13 H new ATOM 0 HA ASN A 147 -7.200 -6.950 -3.470 1.00 33.31 H new ATOM 0 HB2 ASN A 147 -8.464 -6.724 -5.629 1.00 53.03 H new ATOM 0 HB3 ASN A 147 -9.367 -6.074 -4.275 1.00 53.03 H new ATOM 0 HD21 ASN A 147 -9.582 -3.730 -4.159 1.00 45.43 H new ATOM 0 HD22 ASN A 147 -9.271 -2.737 -5.586 1.00 45.43 H new ATOM 2292 N LEU A 148 -5.005 -5.026 -4.589 1.00 4.30 N ATOM 2293 CA LEU A 148 -3.691 -4.928 -5.252 1.00 21.44 C ATOM 2294 C LEU A 148 -2.565 -4.708 -4.202 1.00 44.22 C ATOM 2295 O LEU A 148 -1.486 -4.254 -4.558 1.00 52.21 O ATOM 2296 CB LEU A 148 -3.702 -3.747 -6.288 1.00 31.12 C ATOM 2297 CG LEU A 148 -4.710 -3.856 -7.487 1.00 0.43 C ATOM 2298 CD1 LEU A 148 -4.581 -2.651 -8.458 1.00 65.41 C ATOM 2299 CD2 LEU A 148 -4.555 -5.198 -8.237 1.00 5.13 C ATOM 0 H LEU A 148 -5.145 -4.314 -3.873 1.00 4.30 H new ATOM 0 HA LEU A 148 -3.495 -5.862 -5.778 1.00 21.44 H new ATOM 0 HB2 LEU A 148 -3.918 -2.825 -5.748 1.00 31.12 H new ATOM 0 HB3 LEU A 148 -2.697 -3.648 -6.699 1.00 31.12 H new ATOM 0 HG LEU A 148 -5.714 -3.828 -7.065 1.00 0.43 H new ATOM 0 HD11 LEU A 148 -5.295 -2.763 -9.274 1.00 65.41 H new ATOM 0 HD12 LEU A 148 -4.788 -1.726 -7.920 1.00 65.41 H new ATOM 0 HD13 LEU A 148 -3.570 -2.617 -8.863 1.00 65.41 H new ATOM 0 HD21 LEU A 148 -5.268 -5.239 -9.060 1.00 5.13 H new ATOM 0 HD22 LEU A 148 -3.542 -5.280 -8.630 1.00 5.13 H new ATOM 0 HD23 LEU A 148 -4.746 -6.023 -7.550 1.00 5.13 H new ATOM 2311 N ALA A 149 -2.815 -5.039 -2.908 1.00 74.15 N ATOM 2312 CA ALA A 149 -1.807 -4.821 -1.823 1.00 72.45 C ATOM 2313 C ALA A 149 -0.599 -5.782 -1.958 1.00 10.12 C ATOM 2314 O ALA A 149 -0.776 -7.000 -2.004 1.00 55.45 O ATOM 2315 CB ALA A 149 -2.458 -4.959 -0.445 1.00 23.25 C ATOM 0 H ALA A 149 -3.691 -5.452 -2.588 1.00 74.15 H new ATOM 0 HA ALA A 149 -1.428 -3.804 -1.928 1.00 72.45 H new ATOM 0 HB1 ALA A 149 -1.708 -4.797 0.329 1.00 23.25 H new ATOM 0 HB2 ALA A 149 -3.252 -4.219 -0.342 1.00 23.25 H new ATOM 0 HB3 ALA A 149 -2.878 -5.959 -0.340 1.00 23.25 H new ATOM 2321 N TYR A 150 0.625 -5.208 -1.923 1.00 42.11 N ATOM 2322 CA TYR A 150 1.859 -5.863 -2.434 1.00 50.12 C ATOM 2323 C TYR A 150 2.667 -6.560 -1.321 1.00 74.02 C ATOM 2324 O TYR A 150 2.490 -6.258 -0.132 1.00 23.31 O ATOM 2325 CB TYR A 150 2.747 -4.806 -3.141 1.00 72.41 C ATOM 2326 CG TYR A 150 1.985 -3.867 -4.099 1.00 11.15 C ATOM 2327 CD1 TYR A 150 1.613 -4.280 -5.383 1.00 74.05 C ATOM 2328 CD2 TYR A 150 1.648 -2.563 -3.713 1.00 71.34 C ATOM 2329 CE1 TYR A 150 0.940 -3.426 -6.245 1.00 11.31 C ATOM 2330 CE2 TYR A 150 0.971 -1.712 -4.571 1.00 22.43 C ATOM 2331 CZ TYR A 150 0.622 -2.143 -5.837 1.00 62.15 C ATOM 2332 OH TYR A 150 -0.051 -1.294 -6.700 1.00 53.32 O ATOM 0 H TYR A 150 0.789 -4.277 -1.540 1.00 42.11 H new ATOM 0 HA TYR A 150 1.551 -6.636 -3.138 1.00 50.12 H new ATOM 0 HB2 TYR A 150 3.246 -4.203 -2.382 1.00 72.41 H new ATOM 0 HB3 TYR A 150 3.527 -5.322 -3.702 1.00 72.41 H new ATOM 0 HD1 TYR A 150 1.854 -5.281 -5.709 1.00 74.05 H new ATOM 0 HD2 TYR A 150 1.921 -2.215 -2.728 1.00 71.34 H new ATOM 0 HE1 TYR A 150 0.665 -3.763 -7.234 1.00 11.31 H new ATOM 0 HE2 TYR A 150 0.716 -0.713 -4.251 1.00 22.43 H new ATOM 0 HH TYR A 150 -0.199 -0.431 -6.260 1.00 53.32 H new ATOM 2342 N SER A 151 3.545 -7.508 -1.747 1.00 62.31 N ATOM 2343 CA SER A 151 4.521 -8.219 -0.885 1.00 23.15 C ATOM 2344 C SER A 151 5.428 -7.251 -0.073 1.00 43.32 C ATOM 2345 O SER A 151 6.261 -6.566 -0.676 1.00 1.53 O ATOM 2346 CB SER A 151 5.421 -9.129 -1.766 1.00 24.41 C ATOM 2347 OG SER A 151 4.651 -10.022 -2.546 1.00 10.20 O ATOM 0 H SER A 151 3.592 -7.804 -2.722 1.00 62.31 H new ATOM 0 HA SER A 151 3.945 -8.808 -0.171 1.00 23.15 H new ATOM 0 HB2 SER A 151 6.036 -8.511 -2.420 1.00 24.41 H new ATOM 0 HB3 SER A 151 6.102 -9.694 -1.130 1.00 24.41 H new ATOM 0 HG SER A 151 3.709 -9.958 -2.283 1.00 10.20 H new ATOM 2353 N PRO A 152 5.277 -7.188 1.300 1.00 61.41 N ATOM 2354 CA PRO A 152 6.097 -6.306 2.173 1.00 25.10 C ATOM 2355 C PRO A 152 7.527 -6.862 2.414 1.00 14.42 C ATOM 2356 O PRO A 152 7.693 -8.016 2.833 1.00 44.25 O ATOM 2357 CB PRO A 152 5.271 -6.257 3.484 1.00 74.22 C ATOM 2358 CG PRO A 152 4.574 -7.577 3.533 1.00 50.41 C ATOM 2359 CD PRO A 152 4.286 -7.963 2.097 1.00 40.12 C ATOM 0 HA PRO A 152 6.271 -5.325 1.731 1.00 25.10 H new ATOM 0 HB2 PRO A 152 5.913 -6.114 4.353 1.00 74.22 H new ATOM 0 HB3 PRO A 152 4.559 -5.432 3.475 1.00 74.22 H new ATOM 0 HG2 PRO A 152 5.197 -8.327 4.019 1.00 50.41 H new ATOM 0 HG3 PRO A 152 3.651 -7.508 4.109 1.00 50.41 H new ATOM 0 HD2 PRO A 152 4.403 -9.036 1.943 1.00 40.12 H new ATOM 0 HD3 PRO A 152 3.264 -7.710 1.815 1.00 40.12 H new ATOM 2367 N PHE A 153 8.540 -6.017 2.125 1.00 24.22 N ATOM 2368 CA PHE A 153 9.984 -6.296 2.341 1.00 31.42 C ATOM 2369 C PHE A 153 10.276 -6.903 3.729 1.00 53.43 C ATOM 2370 O PHE A 153 10.969 -7.926 3.848 1.00 63.32 O ATOM 2371 CB PHE A 153 10.806 -4.975 2.182 1.00 24.52 C ATOM 2372 CG PHE A 153 10.526 -4.199 0.888 1.00 34.14 C ATOM 2373 CD1 PHE A 153 11.225 -4.477 -0.284 1.00 4.33 C ATOM 2374 CD2 PHE A 153 9.549 -3.194 0.848 1.00 23.11 C ATOM 2375 CE1 PHE A 153 10.962 -3.782 -1.450 1.00 51.33 C ATOM 2376 CE2 PHE A 153 9.285 -2.501 -0.319 1.00 51.12 C ATOM 2377 CZ PHE A 153 9.992 -2.793 -1.468 1.00 20.32 C ATOM 0 H PHE A 153 8.375 -5.094 1.723 1.00 24.22 H new ATOM 0 HA PHE A 153 10.279 -7.030 1.591 1.00 31.42 H new ATOM 0 HB2 PHE A 153 10.594 -4.326 3.032 1.00 24.52 H new ATOM 0 HB3 PHE A 153 11.868 -5.217 2.222 1.00 24.52 H new ATOM 0 HD1 PHE A 153 11.983 -5.246 -0.282 1.00 4.33 H new ATOM 0 HD2 PHE A 153 8.994 -2.957 1.743 1.00 23.11 H new ATOM 0 HE1 PHE A 153 11.514 -4.011 -2.349 1.00 51.33 H new ATOM 0 HE2 PHE A 153 8.527 -1.732 -0.332 1.00 51.12 H new ATOM 0 HZ PHE A 153 9.789 -2.251 -2.380 1.00 20.32 H new ATOM 2387 N CYS A 154 9.708 -6.255 4.748 1.00 44.14 N ATOM 2388 CA CYS A 154 9.938 -6.559 6.164 1.00 13.23 C ATOM 2389 C CYS A 154 9.521 -7.987 6.539 1.00 61.44 C ATOM 2390 O CYS A 154 10.268 -8.702 7.212 1.00 71.51 O ATOM 2391 CB CYS A 154 9.150 -5.548 6.999 1.00 72.14 C ATOM 2392 SG CYS A 154 7.366 -5.571 6.683 1.00 13.44 S ATOM 0 H CYS A 154 9.057 -5.482 4.608 1.00 44.14 H new ATOM 0 HA CYS A 154 11.007 -6.488 6.363 1.00 13.23 H new ATOM 0 HB2 CYS A 154 9.325 -5.749 8.056 1.00 72.14 H new ATOM 0 HB3 CYS A 154 9.532 -4.547 6.797 1.00 72.14 H new ATOM 0 HG CYS A 154 6.734 -5.860 7.782 1.00 13.44 H new ATOM 2398 N ALA A 155 8.315 -8.384 6.118 1.00 41.31 N ATOM 2399 CA ALA A 155 7.760 -9.709 6.427 1.00 13.33 C ATOM 2400 C ALA A 155 8.626 -10.851 5.861 1.00 33.43 C ATOM 2401 O ALA A 155 8.861 -11.854 6.534 1.00 30.23 O ATOM 2402 CB ALA A 155 6.332 -9.790 5.902 1.00 13.30 C ATOM 0 H ALA A 155 7.697 -7.799 5.555 1.00 41.31 H new ATOM 0 HA ALA A 155 7.757 -9.835 7.510 1.00 13.33 H new ATOM 0 HB1 ALA A 155 5.916 -10.772 6.129 1.00 13.30 H new ATOM 0 HB2 ALA A 155 5.725 -9.020 6.378 1.00 13.30 H new ATOM 0 HB3 ALA A 155 6.332 -9.637 4.823 1.00 13.30 H new ATOM 2408 N TYR A 156 9.116 -10.659 4.627 1.00 73.42 N ATOM 2409 CA TYR A 156 9.921 -11.671 3.912 1.00 54.12 C ATOM 2410 C TYR A 156 11.412 -11.649 4.328 1.00 4.54 C ATOM 2411 O TYR A 156 12.140 -12.594 4.015 1.00 62.12 O ATOM 2412 CB TYR A 156 9.791 -11.473 2.383 1.00 53.00 C ATOM 2413 CG TYR A 156 8.416 -11.838 1.781 1.00 64.43 C ATOM 2414 CD1 TYR A 156 7.355 -10.930 1.798 1.00 3.14 C ATOM 2415 CD2 TYR A 156 8.193 -13.076 1.161 1.00 23.23 C ATOM 2416 CE1 TYR A 156 6.139 -11.232 1.226 1.00 60.41 C ATOM 2417 CE2 TYR A 156 6.969 -13.381 0.589 1.00 11.13 C ATOM 2418 CZ TYR A 156 5.950 -12.452 0.621 1.00 41.15 C ATOM 2419 OH TYR A 156 4.738 -12.744 0.034 1.00 13.44 O ATOM 0 H TYR A 156 8.968 -9.802 4.095 1.00 73.42 H new ATOM 0 HA TYR A 156 9.526 -12.648 4.190 1.00 54.12 H new ATOM 0 HB2 TYR A 156 10.005 -10.430 2.149 1.00 53.00 H new ATOM 0 HB3 TYR A 156 10.555 -12.074 1.890 1.00 53.00 H new ATOM 0 HD1 TYR A 156 7.491 -9.969 2.271 1.00 3.14 H new ATOM 0 HD2 TYR A 156 8.990 -13.804 1.129 1.00 23.23 H new ATOM 0 HE1 TYR A 156 5.335 -10.511 1.253 1.00 60.41 H new ATOM 0 HE2 TYR A 156 6.813 -14.341 0.120 1.00 11.13 H new ATOM 0 HH TYR A 156 4.199 -13.286 0.648 1.00 13.44 H new ATOM 2429 N SER A 157 11.873 -10.567 4.998 1.00 71.41 N ATOM 2430 CA SER A 157 13.278 -10.445 5.465 1.00 24.23 C ATOM 2431 C SER A 157 13.368 -9.529 6.700 1.00 31.23 C ATOM 2432 O SER A 157 12.977 -8.357 6.642 1.00 35.21 O ATOM 2433 CB SER A 157 14.190 -9.888 4.346 1.00 51.14 C ATOM 2434 OG SER A 157 14.320 -10.779 3.259 1.00 23.53 O ATOM 0 H SER A 157 11.291 -9.762 5.229 1.00 71.41 H new ATOM 0 HA SER A 157 13.619 -11.444 5.735 1.00 24.23 H new ATOM 0 HB2 SER A 157 13.784 -8.942 3.989 1.00 51.14 H new ATOM 0 HB3 SER A 157 15.177 -9.677 4.758 1.00 51.14 H new ATOM 0 HG SER A 157 13.514 -10.737 2.703 1.00 23.53 H new ATOM 2440 N ASP A 158 13.956 -10.061 7.795 1.00 73.12 N ATOM 2441 CA ASP A 158 14.102 -9.344 9.093 1.00 13.53 C ATOM 2442 C ASP A 158 15.235 -8.293 9.057 1.00 12.34 C ATOM 2443 O ASP A 158 15.438 -7.554 10.028 1.00 12.02 O ATOM 2444 CB ASP A 158 14.347 -10.355 10.248 1.00 24.40 C ATOM 2445 CG ASP A 158 13.176 -11.333 10.464 1.00 21.22 C ATOM 2446 OD1 ASP A 158 13.033 -12.285 9.668 1.00 52.52 O ATOM 2447 OD2 ASP A 158 12.408 -11.169 11.442 1.00 4.25 O ATOM 0 H ASP A 158 14.346 -11.003 7.809 1.00 73.12 H new ATOM 0 HA ASP A 158 13.168 -8.812 9.271 1.00 13.53 H new ATOM 0 HB2 ASP A 158 15.252 -10.925 10.037 1.00 24.40 H new ATOM 0 HB3 ASP A 158 14.526 -9.804 11.171 1.00 24.40 H new ATOM 2452 N THR A 159 15.971 -8.239 7.933 1.00 13.04 N ATOM 2453 CA THR A 159 16.985 -7.198 7.674 1.00 71.52 C ATOM 2454 C THR A 159 16.323 -5.854 7.288 1.00 41.54 C ATOM 2455 O THR A 159 16.991 -4.814 7.234 1.00 4.40 O ATOM 2456 CB THR A 159 17.991 -7.666 6.570 1.00 53.21 C ATOM 2457 OG1 THR A 159 19.060 -6.720 6.437 1.00 52.34 O ATOM 2458 CG2 THR A 159 17.305 -7.867 5.206 1.00 35.53 C ATOM 0 H THR A 159 15.880 -8.917 7.176 1.00 13.04 H new ATOM 0 HA THR A 159 17.544 -7.038 8.596 1.00 71.52 H new ATOM 0 HB THR A 159 18.389 -8.630 6.888 1.00 53.21 H new ATOM 0 HG1 THR A 159 18.777 -5.854 6.799 1.00 52.34 H new ATOM 0 HG21 THR A 159 18.043 -8.192 4.472 1.00 35.53 H new ATOM 0 HG22 THR A 159 16.527 -8.625 5.298 1.00 35.53 H new ATOM 0 HG23 THR A 159 16.859 -6.927 4.881 1.00 35.53 H new ATOM 2466 N PHE A 160 15.004 -5.883 7.025 1.00 3.11 N ATOM 2467 CA PHE A 160 14.178 -4.678 6.883 1.00 60.42 C ATOM 2468 C PHE A 160 13.335 -4.588 8.165 1.00 35.03 C ATOM 2469 O PHE A 160 12.644 -5.559 8.488 1.00 24.11 O ATOM 2470 CB PHE A 160 13.223 -4.779 5.657 1.00 3.22 C ATOM 2471 CG PHE A 160 13.892 -4.996 4.297 1.00 63.33 C ATOM 2472 CD1 PHE A 160 14.174 -6.281 3.831 1.00 74.31 C ATOM 2473 CD2 PHE A 160 14.213 -3.918 3.474 1.00 21.52 C ATOM 2474 CE1 PHE A 160 14.761 -6.480 2.593 1.00 62.22 C ATOM 2475 CE2 PHE A 160 14.792 -4.121 2.237 1.00 41.54 C ATOM 2476 CZ PHE A 160 15.070 -5.398 1.794 1.00 1.12 C ATOM 0 H PHE A 160 14.481 -6.751 6.905 1.00 3.11 H new ATOM 0 HA PHE A 160 14.811 -3.804 6.731 1.00 60.42 H new ATOM 0 HB2 PHE A 160 12.527 -5.599 5.831 1.00 3.22 H new ATOM 0 HB3 PHE A 160 12.632 -3.865 5.606 1.00 3.22 H new ATOM 0 HD1 PHE A 160 13.930 -7.134 4.446 1.00 74.31 H new ATOM 0 HD2 PHE A 160 14.006 -2.912 3.808 1.00 21.52 H new ATOM 0 HE1 PHE A 160 14.977 -7.482 2.253 1.00 62.22 H new ATOM 0 HE2 PHE A 160 15.029 -3.273 1.611 1.00 41.54 H new ATOM 0 HZ PHE A 160 15.527 -5.550 0.827 1.00 1.12 H new ATOM 2486 N SER A 161 13.404 -3.471 8.909 1.00 70.02 N ATOM 2487 CA SER A 161 12.546 -3.279 10.092 1.00 75.04 C ATOM 2488 C SER A 161 11.106 -3.009 9.625 1.00 11.43 C ATOM 2489 O SER A 161 10.898 -2.271 8.650 1.00 62.05 O ATOM 2490 CB SER A 161 13.078 -2.130 10.974 1.00 72.53 C ATOM 2491 OG SER A 161 14.419 -2.382 11.363 1.00 24.35 O ATOM 0 H SER A 161 14.037 -2.695 8.716 1.00 70.02 H new ATOM 0 HA SER A 161 12.557 -4.182 10.703 1.00 75.04 H new ATOM 0 HB2 SER A 161 13.023 -1.189 10.427 1.00 72.53 H new ATOM 0 HB3 SER A 161 12.451 -2.022 11.859 1.00 72.53 H new ATOM 0 HG SER A 161 14.742 -1.644 11.920 1.00 24.35 H new ATOM 2497 N CYS A 162 10.131 -3.634 10.303 1.00 21.25 N ATOM 2498 CA CYS A 162 8.711 -3.589 9.923 1.00 60.21 C ATOM 2499 C CYS A 162 8.142 -2.163 10.026 1.00 12.02 C ATOM 2500 O CYS A 162 8.552 -1.415 10.918 1.00 23.42 O ATOM 2501 CB CYS A 162 7.919 -4.567 10.823 1.00 74.00 C ATOM 2502 SG CYS A 162 6.140 -4.610 10.518 1.00 14.13 S ATOM 0 H CYS A 162 10.308 -4.191 11.139 1.00 21.25 H new ATOM 0 HA CYS A 162 8.615 -3.892 8.881 1.00 60.21 H new ATOM 0 HB2 CYS A 162 8.321 -5.571 10.685 1.00 74.00 H new ATOM 0 HB3 CYS A 162 8.088 -4.296 11.865 1.00 74.00 H new ATOM 0 HG CYS A 162 5.638 -3.426 10.708 1.00 14.13 H new ATOM 2508 N PRO A 163 7.199 -1.752 9.106 1.00 64.43 N ATOM 2509 CA PRO A 163 6.513 -0.452 9.217 1.00 34.50 C ATOM 2510 C PRO A 163 5.715 -0.356 10.528 1.00 24.01 C ATOM 2511 O PRO A 163 5.357 -1.384 11.126 1.00 33.34 O ATOM 2512 CB PRO A 163 5.587 -0.407 7.967 1.00 74.54 C ATOM 2513 CG PRO A 163 5.421 -1.832 7.550 1.00 11.44 C ATOM 2514 CD PRO A 163 6.726 -2.510 7.908 1.00 72.32 C ATOM 0 HA PRO A 163 7.204 0.390 9.245 1.00 34.50 H new ATOM 0 HB2 PRO A 163 4.626 0.048 8.206 1.00 74.54 H new ATOM 0 HB3 PRO A 163 6.032 0.187 7.169 1.00 74.54 H new ATOM 0 HG2 PRO A 163 4.582 -2.297 8.067 1.00 11.44 H new ATOM 0 HG3 PRO A 163 5.219 -1.908 6.482 1.00 11.44 H new ATOM 0 HD2 PRO A 163 6.580 -3.566 8.134 1.00 72.32 H new ATOM 0 HD3 PRO A 163 7.444 -2.455 7.090 1.00 72.32 H new ATOM 2522 N LEU A 164 5.447 0.873 10.977 1.00 21.11 N ATOM 2523 CA LEU A 164 4.695 1.134 12.213 1.00 22.22 C ATOM 2524 C LEU A 164 3.362 1.809 11.829 1.00 1.33 C ATOM 2525 O LEU A 164 3.298 3.043 11.752 1.00 31.42 O ATOM 2526 CB LEU A 164 5.529 2.038 13.178 1.00 25.54 C ATOM 2527 CG LEU A 164 6.944 1.501 13.573 1.00 44.13 C ATOM 2528 CD1 LEU A 164 7.719 2.533 14.431 1.00 62.34 C ATOM 2529 CD2 LEU A 164 6.852 0.116 14.278 1.00 15.24 C ATOM 0 H LEU A 164 5.745 1.720 10.494 1.00 21.11 H new ATOM 0 HA LEU A 164 4.494 0.201 12.739 1.00 22.22 H new ATOM 0 HB2 LEU A 164 5.651 3.016 12.712 1.00 25.54 H new ATOM 0 HB3 LEU A 164 4.952 2.189 14.091 1.00 25.54 H new ATOM 0 HG LEU A 164 7.510 1.355 12.653 1.00 44.13 H new ATOM 0 HD11 LEU A 164 8.698 2.130 14.689 1.00 62.34 H new ATOM 0 HD12 LEU A 164 7.844 3.456 13.865 1.00 62.34 H new ATOM 0 HD13 LEU A 164 7.160 2.740 15.344 1.00 62.34 H new ATOM 0 HD21 LEU A 164 7.853 -0.227 14.538 1.00 15.24 H new ATOM 0 HD22 LEU A 164 6.253 0.208 15.184 1.00 15.24 H new ATOM 0 HD23 LEU A 164 6.385 -0.604 13.606 1.00 15.24 H new ATOM 2541 N PRO A 165 2.283 1.020 11.510 1.00 10.14 N ATOM 2542 CA PRO A 165 0.962 1.584 11.171 1.00 3.24 C ATOM 2543 C PRO A 165 0.290 2.161 12.438 1.00 35.31 C ATOM 2544 O PRO A 165 0.216 1.452 13.452 1.00 14.51 O ATOM 2545 CB PRO A 165 0.168 0.364 10.588 1.00 31.32 C ATOM 2546 CG PRO A 165 1.193 -0.722 10.404 1.00 43.32 C ATOM 2547 CD PRO A 165 2.237 -0.461 11.460 1.00 14.13 C ATOM 0 HA PRO A 165 1.010 2.409 10.461 1.00 3.24 H new ATOM 0 HB2 PRO A 165 -0.623 0.048 11.268 1.00 31.32 H new ATOM 0 HB3 PRO A 165 -0.309 0.620 9.642 1.00 31.32 H new ATOM 0 HG2 PRO A 165 0.747 -1.709 10.526 1.00 43.32 H new ATOM 0 HG3 PRO A 165 1.627 -0.689 9.405 1.00 43.32 H new ATOM 0 HD2 PRO A 165 1.957 -0.891 12.422 1.00 14.13 H new ATOM 0 HD3 PRO A 165 3.203 -0.888 11.189 1.00 14.13 H new ATOM 2555 N PRO A 166 -0.138 3.470 12.426 1.00 12.11 N ATOM 2556 CA PRO A 166 -0.976 4.057 13.498 1.00 64.11 C ATOM 2557 C PRO A 166 -2.187 3.162 13.874 1.00 4.43 C ATOM 2558 O PRO A 166 -2.742 2.446 13.032 1.00 32.11 O ATOM 2559 CB PRO A 166 -1.437 5.429 12.903 1.00 75.41 C ATOM 2560 CG PRO A 166 -0.972 5.433 11.473 1.00 52.41 C ATOM 2561 CD PRO A 166 0.215 4.502 11.419 1.00 73.30 C ATOM 0 HA PRO A 166 -0.424 4.161 14.432 1.00 64.11 H new ATOM 0 HB2 PRO A 166 -2.520 5.537 12.962 1.00 75.41 H new ATOM 0 HB3 PRO A 166 -1.003 6.261 13.457 1.00 75.41 H new ATOM 0 HG2 PRO A 166 -1.764 5.095 10.804 1.00 52.41 H new ATOM 0 HG3 PRO A 166 -0.694 6.438 11.156 1.00 52.41 H new ATOM 0 HD2 PRO A 166 0.348 4.071 10.426 1.00 73.30 H new ATOM 0 HD3 PRO A 166 1.144 5.014 11.671 1.00 73.30 H new ATOM 2569 N GLU A 167 -2.584 3.237 15.149 1.00 73.13 N ATOM 2570 CA GLU A 167 -3.675 2.420 15.729 1.00 71.23 C ATOM 2571 C GLU A 167 -5.047 2.743 15.078 1.00 24.10 C ATOM 2572 O GLU A 167 -5.968 1.917 15.106 1.00 64.33 O ATOM 2573 CB GLU A 167 -3.692 2.647 17.265 1.00 72.24 C ATOM 2574 CG GLU A 167 -2.348 2.333 17.960 1.00 53.20 C ATOM 2575 CD GLU A 167 -2.304 2.784 19.427 1.00 23.30 C ATOM 2576 OE1 GLU A 167 -2.023 3.980 19.681 1.00 11.02 O ATOM 2577 OE2 GLU A 167 -2.548 1.954 20.328 1.00 2.43 O ATOM 0 H GLU A 167 -2.156 3.873 15.822 1.00 73.13 H new ATOM 0 HA GLU A 167 -3.491 1.366 15.521 1.00 71.23 H new ATOM 0 HB2 GLU A 167 -3.960 3.684 17.466 1.00 72.24 H new ATOM 0 HB3 GLU A 167 -4.471 2.025 17.706 1.00 72.24 H new ATOM 0 HG2 GLU A 167 -2.163 1.260 17.911 1.00 53.20 H new ATOM 0 HG3 GLU A 167 -1.541 2.820 17.413 1.00 53.20 H new ATOM 2584 N SER A 168 -5.139 3.944 14.472 1.00 31.32 N ATOM 2585 CA SER A 168 -6.331 4.414 13.747 1.00 72.41 C ATOM 2586 C SER A 168 -6.544 3.675 12.402 1.00 25.22 C ATOM 2587 O SER A 168 -7.679 3.599 11.928 1.00 12.02 O ATOM 2588 CB SER A 168 -6.225 5.936 13.491 1.00 64.32 C ATOM 2589 OG SER A 168 -6.099 6.667 14.705 1.00 74.51 O ATOM 0 H SER A 168 -4.376 4.621 14.474 1.00 31.32 H new ATOM 0 HA SER A 168 -7.193 4.196 14.377 1.00 72.41 H new ATOM 0 HB2 SER A 168 -5.364 6.139 12.853 1.00 64.32 H new ATOM 0 HB3 SER A 168 -7.109 6.277 12.951 1.00 64.32 H new ATOM 0 HG SER A 168 -6.033 7.624 14.505 1.00 74.51 H new ATOM 2595 N ASN A 169 -5.474 3.102 11.793 1.00 71.33 N ATOM 2596 CA ASN A 169 -5.585 2.466 10.450 1.00 34.22 C ATOM 2597 C ASN A 169 -5.581 0.928 10.558 1.00 1.21 C ATOM 2598 O ASN A 169 -5.613 0.223 9.537 1.00 62.33 O ATOM 2599 CB ASN A 169 -4.486 2.981 9.464 1.00 3.52 C ATOM 2600 CG ASN A 169 -3.122 2.305 9.601 1.00 25.24 C ATOM 2601 OD1 ASN A 169 -2.271 2.763 10.331 1.00 55.33 O ATOM 2602 ND2 ASN A 169 -2.916 1.205 8.895 1.00 73.13 N ATOM 0 H ASN A 169 -4.539 3.066 12.200 1.00 71.33 H new ATOM 0 HA ASN A 169 -6.546 2.763 10.030 1.00 34.22 H new ATOM 0 HB2 ASN A 169 -4.842 2.842 8.443 1.00 3.52 H new ATOM 0 HB3 ASN A 169 -4.359 4.053 9.614 1.00 3.52 H new ATOM 0 HD21 ASN A 169 -2.021 0.719 8.957 1.00 73.13 H new ATOM 0 HD22 ASN A 169 -3.652 0.843 8.289 1.00 73.13 H new ATOM 2609 N TRP A 170 -5.558 0.411 11.799 1.00 35.24 N ATOM 2610 CA TRP A 170 -5.656 -1.035 12.056 1.00 33.54 C ATOM 2611 C TRP A 170 -7.097 -1.494 11.754 1.00 22.42 C ATOM 2612 O TRP A 170 -8.018 -1.204 12.526 1.00 10.53 O ATOM 2613 CB TRP A 170 -5.264 -1.376 13.522 1.00 74.21 C ATOM 2614 CG TRP A 170 -3.798 -1.174 13.871 1.00 21.33 C ATOM 2615 CD1 TRP A 170 -2.759 -0.889 13.020 1.00 1.44 C ATOM 2616 CD2 TRP A 170 -3.219 -1.280 15.181 1.00 41.13 C ATOM 2617 NE1 TRP A 170 -1.585 -0.796 13.727 1.00 65.52 N ATOM 2618 CE2 TRP A 170 -1.839 -1.032 15.054 1.00 11.03 C ATOM 2619 CE3 TRP A 170 -3.742 -1.553 16.450 1.00 5.43 C ATOM 2620 CZ2 TRP A 170 -0.977 -1.051 16.150 1.00 61.21 C ATOM 2621 CZ3 TRP A 170 -2.887 -1.572 17.535 1.00 24.52 C ATOM 2622 CH2 TRP A 170 -1.517 -1.323 17.381 1.00 62.23 C ATOM 0 H TRP A 170 -5.472 0.977 12.643 1.00 35.24 H new ATOM 0 HA TRP A 170 -4.957 -1.563 11.407 1.00 33.54 H new ATOM 0 HB2 TRP A 170 -5.867 -0.764 14.193 1.00 74.21 H new ATOM 0 HB3 TRP A 170 -5.526 -2.416 13.717 1.00 74.21 H new ATOM 0 HD1 TRP A 170 -2.851 -0.757 11.952 1.00 1.44 H new ATOM 0 HE1 TRP A 170 -0.670 -0.585 13.329 1.00 65.52 H new ATOM 0 HE3 TRP A 170 -4.797 -1.746 16.579 1.00 5.43 H new ATOM 0 HZ2 TRP A 170 0.079 -0.858 16.033 1.00 61.21 H new ATOM 0 HZ3 TRP A 170 -3.281 -1.782 18.518 1.00 24.52 H new ATOM 0 HH2 TRP A 170 -0.874 -1.346 18.248 1.00 62.23 H new ATOM 2633 N LEU A 171 -7.281 -2.203 10.627 1.00 52.15 N ATOM 2634 CA LEU A 171 -8.607 -2.584 10.129 1.00 22.14 C ATOM 2635 C LEU A 171 -9.085 -3.828 10.885 1.00 10.24 C ATOM 2636 O LEU A 171 -8.432 -4.880 10.837 1.00 14.32 O ATOM 2637 CB LEU A 171 -8.562 -2.852 8.594 1.00 34.40 C ATOM 2638 CG LEU A 171 -8.088 -1.661 7.694 1.00 72.12 C ATOM 2639 CD1 LEU A 171 -8.091 -2.055 6.190 1.00 54.53 C ATOM 2640 CD2 LEU A 171 -8.939 -0.384 7.948 1.00 50.50 C ATOM 0 H LEU A 171 -6.513 -2.526 10.039 1.00 52.15 H new ATOM 0 HA LEU A 171 -9.308 -1.767 10.300 1.00 22.14 H new ATOM 0 HB2 LEU A 171 -7.902 -3.700 8.414 1.00 34.40 H new ATOM 0 HB3 LEU A 171 -9.559 -3.150 8.270 1.00 34.40 H new ATOM 0 HG LEU A 171 -7.060 -1.428 7.971 1.00 72.12 H new ATOM 0 HD11 LEU A 171 -7.757 -1.208 5.591 1.00 54.53 H new ATOM 0 HD12 LEU A 171 -7.418 -2.898 6.033 1.00 54.53 H new ATOM 0 HD13 LEU A 171 -9.100 -2.336 5.890 1.00 54.53 H new ATOM 0 HD21 LEU A 171 -8.584 0.423 7.308 1.00 50.50 H new ATOM 0 HD22 LEU A 171 -9.985 -0.593 7.722 1.00 50.50 H new ATOM 0 HD23 LEU A 171 -8.846 -0.086 8.992 1.00 50.50 H new ATOM 2652 N GLU A 172 -10.215 -3.694 11.605 1.00 55.22 N ATOM 2653 CA GLU A 172 -10.849 -4.809 12.338 1.00 72.44 C ATOM 2654 C GLU A 172 -11.781 -5.590 11.376 1.00 15.12 C ATOM 2655 O GLU A 172 -12.989 -5.719 11.592 1.00 10.40 O ATOM 2656 CB GLU A 172 -11.603 -4.241 13.584 1.00 11.03 C ATOM 2657 CG GLU A 172 -12.154 -5.295 14.576 1.00 54.14 C ATOM 2658 CD GLU A 172 -11.076 -6.173 15.230 1.00 20.34 C ATOM 2659 OE1 GLU A 172 -10.019 -5.640 15.636 1.00 51.44 O ATOM 2660 OE2 GLU A 172 -11.288 -7.398 15.369 1.00 43.21 O ATOM 0 H GLU A 172 -10.715 -2.810 11.696 1.00 55.22 H new ATOM 0 HA GLU A 172 -10.100 -5.512 12.704 1.00 72.44 H new ATOM 0 HB2 GLU A 172 -10.926 -3.580 14.125 1.00 11.03 H new ATOM 0 HB3 GLU A 172 -12.434 -3.629 13.234 1.00 11.03 H new ATOM 0 HG2 GLU A 172 -12.713 -4.782 15.359 1.00 54.14 H new ATOM 0 HG3 GLU A 172 -12.860 -5.938 14.050 1.00 54.14 H new ATOM 2667 N THR A 173 -11.184 -6.051 10.271 1.00 42.32 N ATOM 2668 CA THR A 173 -11.844 -6.841 9.230 1.00 15.23 C ATOM 2669 C THR A 173 -10.770 -7.604 8.436 1.00 23.10 C ATOM 2670 O THR A 173 -9.587 -7.242 8.494 1.00 75.14 O ATOM 2671 CB THR A 173 -12.691 -5.943 8.266 1.00 71.05 C ATOM 2672 OG1 THR A 173 -13.403 -6.768 7.338 1.00 51.23 O ATOM 2673 CG2 THR A 173 -11.843 -4.916 7.485 1.00 51.41 C ATOM 0 H THR A 173 -10.199 -5.878 10.072 1.00 42.32 H new ATOM 0 HA THR A 173 -12.532 -7.539 9.706 1.00 15.23 H new ATOM 0 HB THR A 173 -13.381 -5.379 8.893 1.00 71.05 H new ATOM 0 HG1 THR A 173 -13.804 -6.207 6.642 1.00 51.23 H new ATOM 0 HG21 THR A 173 -12.491 -4.327 6.836 1.00 51.41 H new ATOM 0 HG22 THR A 173 -11.335 -4.255 8.187 1.00 51.41 H new ATOM 0 HG23 THR A 173 -11.103 -5.440 6.880 1.00 51.41 H new ATOM 2681 N ALA A 174 -11.175 -8.660 7.730 1.00 12.23 N ATOM 2682 CA ALA A 174 -10.277 -9.460 6.890 1.00 52.20 C ATOM 2683 C ALA A 174 -10.319 -8.928 5.454 1.00 14.51 C ATOM 2684 O ALA A 174 -11.404 -8.773 4.878 1.00 64.12 O ATOM 2685 CB ALA A 174 -10.687 -10.943 6.943 1.00 53.12 C ATOM 0 H ALA A 174 -12.141 -8.988 7.723 1.00 12.23 H new ATOM 0 HA ALA A 174 -9.256 -9.380 7.262 1.00 52.20 H new ATOM 0 HB1 ALA A 174 -10.015 -11.529 6.316 1.00 53.12 H new ATOM 0 HB2 ALA A 174 -10.628 -11.300 7.971 1.00 53.12 H new ATOM 0 HB3 ALA A 174 -11.709 -11.051 6.579 1.00 53.12 H new ATOM 2691 N VAL A 175 -9.141 -8.625 4.886 1.00 34.11 N ATOM 2692 CA VAL A 175 -9.011 -8.248 3.479 1.00 52.11 C ATOM 2693 C VAL A 175 -8.922 -9.541 2.662 1.00 32.14 C ATOM 2694 O VAL A 175 -7.850 -10.139 2.507 1.00 31.31 O ATOM 2695 CB VAL A 175 -7.770 -7.301 3.222 1.00 73.04 C ATOM 2696 CG1 VAL A 175 -7.577 -7.000 1.709 1.00 21.12 C ATOM 2697 CG2 VAL A 175 -7.913 -5.986 4.038 1.00 5.11 C ATOM 0 H VAL A 175 -8.256 -8.636 5.393 1.00 34.11 H new ATOM 0 HA VAL A 175 -9.881 -7.667 3.172 1.00 52.11 H new ATOM 0 HB VAL A 175 -6.876 -7.825 3.561 1.00 73.04 H new ATOM 0 HG11 VAL A 175 -6.715 -6.347 1.575 1.00 21.12 H new ATOM 0 HG12 VAL A 175 -7.412 -7.933 1.170 1.00 21.12 H new ATOM 0 HG13 VAL A 175 -8.468 -6.509 1.319 1.00 21.12 H new ATOM 0 HG21 VAL A 175 -7.051 -5.346 3.850 1.00 5.11 H new ATOM 0 HG22 VAL A 175 -8.823 -5.468 3.736 1.00 5.11 H new ATOM 0 HG23 VAL A 175 -7.965 -6.221 5.101 1.00 5.11 H new ATOM 2707 N THR A 176 -10.095 -10.039 2.265 1.00 24.54 N ATOM 2708 CA THR A 176 -10.232 -11.123 1.307 1.00 72.40 C ATOM 2709 C THR A 176 -10.597 -10.533 -0.064 1.00 51.41 C ATOM 2710 O THR A 176 -11.708 -10.021 -0.252 1.00 4.51 O ATOM 2711 CB THR A 176 -11.317 -12.145 1.803 1.00 31.11 C ATOM 2712 OG1 THR A 176 -12.514 -11.449 2.211 1.00 41.03 O ATOM 2713 CG2 THR A 176 -10.804 -12.999 2.980 1.00 33.13 C ATOM 0 H THR A 176 -10.989 -9.689 2.610 1.00 24.54 H new ATOM 0 HA THR A 176 -9.290 -11.664 1.214 1.00 72.40 H new ATOM 0 HB THR A 176 -11.539 -12.808 0.967 1.00 31.11 H new ATOM 0 HG1 THR A 176 -12.715 -10.738 1.567 1.00 41.03 H new ATOM 0 HG21 THR A 176 -11.584 -13.693 3.293 1.00 33.13 H new ATOM 0 HG22 THR A 176 -9.924 -13.560 2.666 1.00 33.13 H new ATOM 0 HG23 THR A 176 -10.541 -12.348 3.814 1.00 33.13 H new ATOM 2721 N ALA A 177 -9.623 -10.545 -0.989 1.00 71.14 N ATOM 2722 CA ALA A 177 -9.795 -10.061 -2.364 1.00 24.44 C ATOM 2723 C ALA A 177 -9.006 -10.959 -3.328 1.00 74.25 C ATOM 2724 O ALA A 177 -7.770 -11.023 -3.233 1.00 3.14 O ATOM 2725 CB ALA A 177 -9.338 -8.597 -2.455 1.00 62.30 C ATOM 0 H ALA A 177 -8.684 -10.896 -0.798 1.00 71.14 H new ATOM 0 HA ALA A 177 -10.847 -10.104 -2.647 1.00 24.44 H new ATOM 0 HB1 ALA A 177 -9.466 -8.239 -3.476 1.00 62.30 H new ATOM 0 HB2 ALA A 177 -9.936 -7.986 -1.779 1.00 62.30 H new ATOM 0 HB3 ALA A 177 -8.287 -8.526 -2.175 1.00 62.30 H new ATOM 2731 N GLY A 178 -9.744 -11.640 -4.239 1.00 75.24 N ATOM 2732 CA GLY A 178 -9.171 -12.625 -5.170 1.00 72.33 C ATOM 2733 C GLY A 178 -8.287 -13.686 -4.497 1.00 75.52 C ATOM 2734 O GLY A 178 -8.547 -14.083 -3.359 1.00 64.51 O ATOM 0 H GLY A 178 -10.751 -11.517 -4.343 1.00 75.24 H new ATOM 0 HA2 GLY A 178 -9.983 -13.126 -5.697 1.00 72.33 H new ATOM 0 HA3 GLY A 178 -8.581 -12.099 -5.920 1.00 72.33 H new ATOM 2738 N GLU A 179 -7.274 -14.173 -5.237 1.00 24.23 N ATOM 2739 CA GLU A 179 -6.117 -14.906 -4.673 1.00 10.14 C ATOM 2740 C GLU A 179 -5.271 -13.927 -3.820 1.00 11.41 C ATOM 2741 O GLU A 179 -5.014 -12.811 -4.239 1.00 73.12 O ATOM 2742 CB GLU A 179 -5.273 -15.520 -5.841 1.00 73.32 C ATOM 2743 CG GLU A 179 -3.896 -16.120 -5.455 1.00 32.13 C ATOM 2744 CD GLU A 179 -3.979 -17.257 -4.427 1.00 63.54 C ATOM 2745 OE1 GLU A 179 -4.427 -18.370 -4.781 1.00 21.54 O ATOM 2746 OE2 GLU A 179 -3.610 -17.039 -3.255 1.00 20.34 O ATOM 0 H GLU A 179 -7.232 -14.070 -6.251 1.00 24.23 H new ATOM 0 HA GLU A 179 -6.454 -15.722 -4.033 1.00 10.14 H new ATOM 0 HB2 GLU A 179 -5.865 -16.302 -6.316 1.00 73.32 H new ATOM 0 HB3 GLU A 179 -5.110 -14.744 -6.589 1.00 73.32 H new ATOM 0 HG2 GLU A 179 -3.408 -16.493 -6.356 1.00 32.13 H new ATOM 0 HG3 GLU A 179 -3.264 -15.327 -5.055 1.00 32.13 H new ATOM 2753 N ARG A 180 -4.818 -14.371 -2.645 1.00 13.40 N ATOM 2754 CA ARG A 180 -4.214 -13.493 -1.623 1.00 33.34 C ATOM 2755 C ARG A 180 -2.722 -13.800 -1.460 1.00 65.21 C ATOM 2756 O ARG A 180 -2.339 -14.980 -1.502 1.00 23.20 O ATOM 2757 CB ARG A 180 -4.911 -13.741 -0.261 1.00 74.41 C ATOM 2758 CG ARG A 180 -6.425 -13.432 -0.195 1.00 24.33 C ATOM 2759 CD ARG A 180 -7.014 -13.726 1.208 1.00 54.40 C ATOM 2760 NE ARG A 180 -6.255 -13.037 2.283 1.00 14.41 N ATOM 2761 CZ ARG A 180 -5.345 -13.613 3.104 1.00 4.20 C ATOM 2762 NH1 ARG A 180 -5.068 -14.907 3.019 1.00 54.53 N ATOM 2763 NH2 ARG A 180 -4.674 -12.867 3.952 1.00 74.53 N ATOM 0 H ARG A 180 -4.857 -15.352 -2.369 1.00 13.40 H new ATOM 0 HA ARG A 180 -4.339 -12.458 -1.941 1.00 33.34 H new ATOM 0 HB2 ARG A 180 -4.764 -14.786 0.013 1.00 74.41 H new ATOM 0 HB3 ARG A 180 -4.407 -13.139 0.495 1.00 74.41 H new ATOM 0 HG2 ARG A 180 -6.593 -12.385 -0.447 1.00 24.33 H new ATOM 0 HG3 ARG A 180 -6.950 -14.028 -0.941 1.00 24.33 H new ATOM 0 HD2 ARG A 180 -8.056 -13.408 1.238 1.00 54.40 H new ATOM 0 HD3 ARG A 180 -7.004 -14.801 1.388 1.00 54.40 H new ATOM 0 HE ARG A 180 -6.435 -12.042 2.414 1.00 14.41 H new ATOM 0 HH11 ARG A 180 -5.543 -15.486 2.327 1.00 54.53 H new ATOM 0 HH12 ARG A 180 -4.380 -15.323 3.646 1.00 54.53 H new ATOM 0 HH21 ARG A 180 -4.840 -11.861 3.989 1.00 74.53 H new ATOM 0 HH22 ARG A 180 -3.987 -13.294 4.574 1.00 74.53 H new