USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1088 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 85 THR OG1 : rot 180:sc= 0.132 USER MOD Set 1.2: A 119 LYS NZ :NH3+ -177:sc= 1.31 (180deg=1.15) USER MOD Set 2.1: A 97 ASN : amide:sc= 1.01 K(o=2.2,f=-11!) USER MOD Set 2.2: A 101 LYS NZ :NH3+ 153:sc= 1.23 (180deg=0) USER MOD Set 3.1: A 60 GLN : amide:sc= 0.823 X(o=0.94,f=1) USER MOD Set 3.2: A 63 GLN : amide:sc= 0.112 X(o=0.94,f=1) USER MOD Set 4.1: A 18 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 21 ASN :FLIP amide:sc= -1.21 F(o=-1,f=-0.18) USER MOD Set 4.3: A 25 ASN : amide:sc= 1.03 K(o=-0.18,f=-1) USER MOD Set 5.1: A 9 GLN : amide:sc= -0.0197! K(o=1.3!,f=-6.4) USER MOD Set 5.2: A 11 LYS NZ :NH3+ 172:sc= 1.28 (180deg=0) USER MOD Single : A 4 GLN :FLIP amide:sc= -3.08! C(o=-3.6!,f=-3.1!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 CYS SG : rot 180:sc= -0.474 USER MOD Single : A 13 MET CE :methyl -178:sc= -0.153 (180deg=-0.17) USER MOD Single : A 14 THR OG1 : rot 160:sc= 0.0522 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 66:sc= 1.21 USER MOD Single : A 20 SER OG : rot 161:sc= 1.18 USER MOD Single : A 27 GLN :FLIP amide:sc= -0.0468 F(o=-0.85,f=-0.047) USER MOD Single : A 28 LYS NZ :NH3+ -160:sc= -0.0434 (180deg=-0.342) USER MOD Single : A 34 SER OG : rot -170:sc= 0 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -0.205 X(o=-0.21,f=-0.17) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -2.68! X(o=-2.7!,f=-2.6) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 177:sc= -0.495 (180deg=-0.517) USER MOD Single : A 90 THR OG1 : rot -36:sc= 0.132 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot -72:sc= -0.252 USER MOD Single : A 96 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.0037) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -72:sc= 1.22 USER MOD Single : A 105 THR OG1 : rot 92:sc= 0.291 USER MOD Single : A 106 ASN : amide:sc= -0.205 K(o=-0.21,f=-7.2!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 8:sc= 0.77 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -108:sc= 0.466 (180deg=-2.09!) USER MOD Single : A 136 LYS NZ :NH3+ 150:sc= 1.24 (180deg=1.12) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 SER OG : rot 116:sc= 1.34 USER MOD Single : A 149 GLN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD ----------------------------------------------------------------- ATOM 44 N GLN A 4 -8.642 -4.206 5.341 1.00 1.89 N ATOM 45 CA GLN A 4 -7.339 -3.697 4.929 1.00 1.73 C ATOM 46 C GLN A 4 -7.349 -2.183 4.954 1.00 1.51 C ATOM 47 O GLN A 4 -8.357 -1.576 4.598 1.00 1.54 O ATOM 48 CB GLN A 4 -6.934 -4.202 3.539 1.00 1.83 C ATOM 49 CG GLN A 4 -8.055 -4.241 2.496 1.00 2.33 C ATOM 50 CD GLN A 4 -9.081 -5.328 2.807 1.00 2.89 C ATOM 51 OE1 GLN A 4 -8.690 -6.595 2.755 1.00 4.51 O flip ATOM 52 NE2 GLN A 4 -10.221 -5.032 3.141 1.00 2.25 N flip ATOM 0 HA GLN A 4 -6.599 -4.071 5.636 1.00 1.73 H new ATOM 0 HB2 GLN A 4 -6.132 -3.567 3.161 1.00 1.83 H new ATOM 0 HB3 GLN A 4 -6.523 -5.206 3.643 1.00 1.83 H new ATOM 0 HG2 GLN A 4 -8.552 -3.272 2.460 1.00 2.33 H new ATOM 0 HG3 GLN A 4 -7.627 -4.417 1.509 1.00 2.33 H new ATOM 0 HE21 GLN A 4 -10.504 -4.053 3.175 1.00 2.25 H new ATOM 0 HE22 GLN A 4 -10.887 -5.765 3.385 1.00 2.25 H new ATOM 61 N LYS A 5 -6.226 -1.586 5.367 1.00 1.48 N ATOM 62 CA LYS A 5 -6.080 -0.145 5.377 1.00 1.44 C ATOM 63 C LYS A 5 -5.327 0.324 4.141 1.00 1.40 C ATOM 64 O LYS A 5 -4.511 -0.422 3.600 1.00 1.45 O ATOM 65 CB LYS A 5 -5.465 0.363 6.692 1.00 1.70 C ATOM 66 CG LYS A 5 -3.982 0.013 6.871 1.00 2.05 C ATOM 67 CD LYS A 5 -3.736 -0.999 7.995 1.00 2.17 C ATOM 68 CE LYS A 5 -4.057 -0.393 9.375 1.00 2.89 C ATOM 69 NZ LYS A 5 -2.990 -0.662 10.361 1.00 3.45 N ATOM 0 H LYS A 5 -5.405 -2.092 5.699 1.00 1.48 H new ATOM 0 HA LYS A 5 -7.074 0.301 5.332 1.00 1.44 H new ATOM 0 HB2 LYS A 5 -5.579 1.446 6.738 1.00 1.70 H new ATOM 0 HB3 LYS A 5 -6.028 -0.053 7.528 1.00 1.70 H new ATOM 0 HG2 LYS A 5 -3.594 -0.390 5.936 1.00 2.05 H new ATOM 0 HG3 LYS A 5 -3.422 0.924 7.081 1.00 2.05 H new ATOM 0 HD2 LYS A 5 -4.352 -1.884 7.832 1.00 2.17 H new ATOM 0 HD3 LYS A 5 -2.696 -1.326 7.972 1.00 2.17 H new ATOM 0 HE2 LYS A 5 -4.195 0.684 9.275 1.00 2.89 H new ATOM 0 HE3 LYS A 5 -4.999 -0.802 9.740 1.00 2.89 H new ATOM 0 HZ1 LYS A 5 -3.247 -0.237 11.275 1.00 3.45 H new ATOM 0 HZ2 LYS A 5 -2.875 -1.689 10.477 1.00 3.45 H new ATOM 0 HZ3 LYS A 5 -2.096 -0.250 10.026 1.00 3.45 H new ATOM 83 N CYS A 6 -5.595 1.559 3.717 1.00 1.42 N ATOM 84 CA CYS A 6 -4.792 2.241 2.705 1.00 1.41 C ATOM 85 C CYS A 6 -4.214 3.507 3.318 1.00 1.35 C ATOM 86 O CYS A 6 -4.906 4.186 4.073 1.00 1.29 O ATOM 87 CB CYS A 6 -5.599 2.544 1.442 1.00 1.39 C ATOM 88 SG CYS A 6 -4.544 3.461 0.300 1.00 2.06 S ATOM 0 H CYS A 6 -6.376 2.114 4.067 1.00 1.42 H new ATOM 0 HA CYS A 6 -3.980 1.585 2.391 1.00 1.41 H new ATOM 0 HB2 CYS A 6 -5.943 1.618 0.981 1.00 1.39 H new ATOM 0 HB3 CYS A 6 -6.487 3.126 1.689 1.00 1.39 H new ATOM 0 HG CYS A 6 -5.209 3.729 -0.785 1.00 2.06 H new ATOM 94 N PHE A 7 -2.937 3.769 3.029 1.00 1.40 N ATOM 95 CA PHE A 7 -2.141 4.844 3.593 1.00 1.38 C ATOM 96 C PHE A 7 -2.039 5.972 2.574 1.00 1.30 C ATOM 97 O PHE A 7 -1.245 5.875 1.636 1.00 1.45 O ATOM 98 CB PHE A 7 -0.734 4.316 3.894 1.00 1.63 C ATOM 99 CG PHE A 7 -0.621 3.442 5.126 1.00 1.94 C ATOM 100 CD1 PHE A 7 -0.983 2.083 5.078 1.00 3.21 C ATOM 101 CD2 PHE A 7 -0.106 3.987 6.319 1.00 2.04 C ATOM 102 CE1 PHE A 7 -0.819 1.273 6.214 1.00 3.67 C ATOM 103 CE2 PHE A 7 0.031 3.182 7.461 1.00 2.44 C ATOM 104 CZ PHE A 7 -0.329 1.826 7.411 1.00 2.94 C ATOM 0 H PHE A 7 -2.411 3.205 2.361 1.00 1.40 H new ATOM 0 HA PHE A 7 -2.605 5.210 4.509 1.00 1.38 H new ATOM 0 HB2 PHE A 7 -0.385 3.747 3.032 1.00 1.63 H new ATOM 0 HB3 PHE A 7 -0.061 5.166 4.009 1.00 1.63 H new ATOM 0 HD1 PHE A 7 -1.387 1.663 4.169 1.00 3.21 H new ATOM 0 HD2 PHE A 7 0.184 5.027 6.355 1.00 2.04 H new ATOM 0 HE1 PHE A 7 -1.070 0.223 6.168 1.00 3.67 H new ATOM 0 HE2 PHE A 7 0.413 3.606 8.378 1.00 2.44 H new ATOM 0 HZ PHE A 7 -0.230 1.208 8.291 1.00 2.94 H new ATOM 114 N LEU A 8 -2.793 7.054 2.768 1.00 1.09 N ATOM 115 CA LEU A 8 -2.642 8.252 1.964 1.00 0.98 C ATOM 116 C LEU A 8 -2.420 9.471 2.833 1.00 0.89 C ATOM 117 O LEU A 8 -2.388 9.397 4.061 1.00 0.95 O ATOM 118 CB LEU A 8 -3.790 8.416 0.948 1.00 0.94 C ATOM 119 CG LEU A 8 -5.210 8.599 1.467 1.00 1.30 C ATOM 120 CD1 LEU A 8 -6.047 9.249 0.358 1.00 2.61 C ATOM 121 CD2 LEU A 8 -5.884 7.273 1.843 1.00 1.61 C ATOM 0 H LEU A 8 -3.518 7.118 3.482 1.00 1.09 H new ATOM 0 HA LEU A 8 -1.741 8.142 1.361 1.00 0.98 H new ATOM 0 HB2 LEU A 8 -3.555 9.276 0.321 1.00 0.94 H new ATOM 0 HB3 LEU A 8 -3.786 7.539 0.301 1.00 0.94 H new ATOM 0 HG LEU A 8 -5.152 9.214 2.365 1.00 1.30 H new ATOM 0 HD11 LEU A 8 -7.069 9.390 0.709 1.00 2.61 H new ATOM 0 HD12 LEU A 8 -5.617 10.216 0.097 1.00 2.61 H new ATOM 0 HD13 LEU A 8 -6.050 8.604 -0.521 1.00 2.61 H new ATOM 0 HD21 LEU A 8 -6.893 7.468 2.206 1.00 1.61 H new ATOM 0 HD22 LEU A 8 -5.932 6.628 0.966 1.00 1.61 H new ATOM 0 HD23 LEU A 8 -5.306 6.780 2.625 1.00 1.61 H new ATOM 133 N GLN A 9 -2.207 10.607 2.180 1.00 0.83 N ATOM 134 CA GLN A 9 -2.056 11.867 2.862 1.00 0.74 C ATOM 135 C GLN A 9 -2.788 12.930 2.063 1.00 0.67 C ATOM 136 O GLN A 9 -2.724 12.957 0.832 1.00 0.88 O ATOM 137 CB GLN A 9 -0.583 12.172 3.186 1.00 0.89 C ATOM 138 CG GLN A 9 0.509 11.573 2.278 1.00 1.46 C ATOM 139 CD GLN A 9 1.087 12.589 1.306 1.00 1.21 C ATOM 140 OE1 GLN A 9 1.979 13.359 1.652 1.00 1.79 O ATOM 141 NE2 GLN A 9 0.580 12.647 0.085 1.00 1.33 N ATOM 0 H GLN A 9 -2.136 10.671 1.164 1.00 0.83 H new ATOM 0 HA GLN A 9 -2.519 11.837 3.848 1.00 0.74 H new ATOM 0 HB2 GLN A 9 -0.460 13.255 3.182 1.00 0.89 H new ATOM 0 HB3 GLN A 9 -0.390 11.833 4.204 1.00 0.89 H new ATOM 0 HG2 GLN A 9 1.311 11.172 2.898 1.00 1.46 H new ATOM 0 HG3 GLN A 9 0.091 10.737 1.717 1.00 1.46 H new ATOM 0 HE21 GLN A 9 -0.161 12.002 -0.191 1.00 1.33 H new ATOM 0 HE22 GLN A 9 0.930 13.337 -0.580 1.00 1.33 H new ATOM 150 N ILE A 10 -3.518 13.777 2.789 1.00 0.57 N ATOM 151 CA ILE A 10 -4.456 14.713 2.225 1.00 0.54 C ATOM 152 C ILE A 10 -3.716 16.023 2.036 1.00 0.60 C ATOM 153 O ILE A 10 -3.166 16.587 2.981 1.00 0.72 O ATOM 154 CB ILE A 10 -5.649 14.892 3.177 1.00 0.65 C ATOM 155 CG1 ILE A 10 -6.480 13.611 3.315 1.00 0.67 C ATOM 156 CG2 ILE A 10 -6.529 16.068 2.753 1.00 0.79 C ATOM 157 CD1 ILE A 10 -6.988 13.031 1.993 1.00 0.60 C ATOM 0 H ILE A 10 -3.463 13.822 3.807 1.00 0.57 H new ATOM 0 HA ILE A 10 -4.846 14.358 1.271 1.00 0.54 H new ATOM 0 HB ILE A 10 -5.233 15.115 4.160 1.00 0.65 H new ATOM 0 HG12 ILE A 10 -5.877 12.856 3.819 1.00 0.67 H new ATOM 0 HG13 ILE A 10 -7.336 13.817 3.958 1.00 0.67 H new ATOM 0 HG21 ILE A 10 -7.363 16.167 3.447 1.00 0.79 H new ATOM 0 HG22 ILE A 10 -5.940 16.985 2.761 1.00 0.79 H new ATOM 0 HG23 ILE A 10 -6.912 15.892 1.748 1.00 0.79 H new ATOM 0 HD11 ILE A 10 -7.565 12.127 2.190 1.00 0.60 H new ATOM 0 HD12 ILE A 10 -7.621 13.764 1.494 1.00 0.60 H new ATOM 0 HD13 ILE A 10 -6.140 12.788 1.353 1.00 0.60 H new ATOM 169 N LYS A 11 -3.682 16.476 0.791 1.00 0.64 N ATOM 170 CA LYS A 11 -3.074 17.717 0.384 1.00 0.78 C ATOM 171 C LYS A 11 -4.257 18.662 0.130 1.00 0.78 C ATOM 172 O LYS A 11 -4.982 18.521 -0.855 1.00 0.94 O ATOM 173 CB LYS A 11 -2.165 17.419 -0.824 1.00 1.03 C ATOM 174 CG LYS A 11 -0.705 17.111 -0.449 1.00 1.00 C ATOM 175 CD LYS A 11 -0.535 15.834 0.393 1.00 2.46 C ATOM 176 CE LYS A 11 -0.066 16.107 1.834 1.00 3.50 C ATOM 177 NZ LYS A 11 1.401 15.980 1.981 1.00 4.09 N ATOM 0 H LYS A 11 -4.096 15.963 0.013 1.00 0.64 H new ATOM 0 HA LYS A 11 -2.417 18.196 1.111 1.00 0.78 H new ATOM 0 HB2 LYS A 11 -2.575 16.571 -1.373 1.00 1.03 H new ATOM 0 HB3 LYS A 11 -2.183 18.275 -1.499 1.00 1.03 H new ATOM 0 HG2 LYS A 11 -0.118 17.013 -1.362 1.00 1.00 H new ATOM 0 HG3 LYS A 11 -0.296 17.957 0.104 1.00 1.00 H new ATOM 0 HD2 LYS A 11 -1.484 15.299 0.423 1.00 2.46 H new ATOM 0 HD3 LYS A 11 0.185 15.178 -0.097 1.00 2.46 H new ATOM 0 HE2 LYS A 11 -0.373 17.110 2.130 1.00 3.50 H new ATOM 0 HE3 LYS A 11 -0.559 15.410 2.512 1.00 3.50 H new ATOM 0 HZ1 LYS A 11 1.684 16.303 2.928 1.00 4.09 H new ATOM 0 HZ2 LYS A 11 1.677 14.985 1.857 1.00 4.09 H new ATOM 0 HZ3 LYS A 11 1.874 16.563 1.261 1.00 4.09 H new ATOM 191 N GLY A 12 -4.510 19.558 1.092 1.00 0.76 N ATOM 192 CA GLY A 12 -5.641 20.475 1.083 1.00 0.83 C ATOM 193 C GLY A 12 -5.747 21.180 2.437 1.00 0.86 C ATOM 194 O GLY A 12 -5.144 22.229 2.627 1.00 1.16 O ATOM 0 H GLY A 12 -3.916 19.663 1.915 1.00 0.76 H new ATOM 0 HA2 GLY A 12 -5.518 21.211 0.288 1.00 0.83 H new ATOM 0 HA3 GLY A 12 -6.561 19.930 0.873 1.00 0.83 H new ATOM 198 N MET A 13 -6.488 20.579 3.378 1.00 0.83 N ATOM 199 CA MET A 13 -6.704 21.061 4.744 1.00 1.02 C ATOM 200 C MET A 13 -7.068 22.554 4.814 1.00 1.13 C ATOM 201 O MET A 13 -6.255 23.386 5.204 1.00 1.30 O ATOM 202 CB MET A 13 -5.488 20.776 5.633 1.00 1.29 C ATOM 203 CG MET A 13 -5.076 19.305 5.730 1.00 1.16 C ATOM 204 SD MET A 13 -6.244 18.222 6.591 1.00 2.28 S ATOM 205 CE MET A 13 -5.165 16.798 6.847 1.00 1.75 C ATOM 0 H MET A 13 -6.975 19.702 3.196 1.00 0.83 H new ATOM 0 HA MET A 13 -7.563 20.505 5.119 1.00 1.02 H new ATOM 0 HB2 MET A 13 -4.641 21.349 5.255 1.00 1.29 H new ATOM 0 HB3 MET A 13 -5.699 21.144 6.637 1.00 1.29 H new ATOM 0 HG2 MET A 13 -4.927 18.920 4.721 1.00 1.16 H new ATOM 0 HG3 MET A 13 -4.113 19.248 6.238 1.00 1.16 H new ATOM 0 HE1 MET A 13 -5.724 16.002 7.339 1.00 1.75 H new ATOM 0 HE2 MET A 13 -4.797 16.442 5.884 1.00 1.75 H new ATOM 0 HE3 MET A 13 -4.321 17.089 7.473 1.00 1.75 H new ATOM 215 N THR A 14 -8.318 22.896 4.501 1.00 1.25 N ATOM 216 CA THR A 14 -8.800 24.264 4.546 1.00 1.48 C ATOM 217 C THR A 14 -8.811 24.808 5.974 1.00 1.41 C ATOM 218 O THR A 14 -8.211 25.847 6.243 1.00 1.75 O ATOM 219 CB THR A 14 -10.203 24.292 3.933 1.00 1.77 C ATOM 220 OG1 THR A 14 -10.937 23.172 4.407 1.00 2.34 O ATOM 221 CG2 THR A 14 -10.101 24.223 2.407 1.00 2.70 C ATOM 0 H THR A 14 -9.025 22.222 4.208 1.00 1.25 H new ATOM 0 HA THR A 14 -8.130 24.908 3.976 1.00 1.48 H new ATOM 0 HB THR A 14 -10.708 25.215 4.218 1.00 1.77 H new ATOM 0 HG1 THR A 14 -11.896 23.338 4.295 1.00 2.34 H new ATOM 0 HG21 THR A 14 -11.101 24.243 1.974 1.00 2.70 H new ATOM 0 HG22 THR A 14 -9.530 25.077 2.042 1.00 2.70 H new ATOM 0 HG23 THR A 14 -9.599 23.300 2.117 1.00 2.70 H new ATOM 229 N CYS A 15 -9.539 24.154 6.890 1.00 1.32 N ATOM 230 CA CYS A 15 -9.712 24.722 8.229 1.00 1.64 C ATOM 231 C CYS A 15 -10.287 23.684 9.187 1.00 1.50 C ATOM 232 O CYS A 15 -11.284 23.921 9.862 1.00 1.86 O ATOM 233 CB CYS A 15 -10.552 26.019 8.153 1.00 2.35 C ATOM 234 SG CYS A 15 -9.548 27.401 8.744 1.00 3.60 S ATOM 0 H CYS A 15 -10.003 23.259 6.734 1.00 1.32 H new ATOM 0 HA CYS A 15 -8.740 25.001 8.635 1.00 1.64 H new ATOM 0 HB2 CYS A 15 -10.876 26.199 7.128 1.00 2.35 H new ATOM 0 HB3 CYS A 15 -11.453 25.921 8.759 1.00 2.35 H new ATOM 0 HG CYS A 15 -10.242 28.499 8.683 1.00 3.60 H new ATOM 240 N ALA A 16 -9.678 22.492 9.209 1.00 2.51 N ATOM 241 CA ALA A 16 -10.128 21.363 10.022 1.00 3.74 C ATOM 242 C ALA A 16 -11.640 21.132 9.881 1.00 2.94 C ATOM 243 O ALA A 16 -12.323 20.787 10.842 1.00 2.92 O ATOM 244 CB ALA A 16 -9.721 21.583 11.483 1.00 5.31 C ATOM 0 H ALA A 16 -8.848 22.285 8.654 1.00 2.51 H new ATOM 0 HA ALA A 16 -9.641 20.457 9.660 1.00 3.74 H new ATOM 0 HB1 ALA A 16 -10.058 20.740 12.086 1.00 5.31 H new ATOM 0 HB2 ALA A 16 -8.636 21.666 11.550 1.00 5.31 H new ATOM 0 HB3 ALA A 16 -10.179 22.500 11.854 1.00 5.31 H new ATOM 250 N SER A 17 -12.151 21.352 8.665 1.00 2.43 N ATOM 251 CA SER A 17 -13.570 21.326 8.346 1.00 1.77 C ATOM 252 C SER A 17 -13.807 20.427 7.139 1.00 1.44 C ATOM 253 O SER A 17 -14.645 19.530 7.189 1.00 1.37 O ATOM 254 CB SER A 17 -14.077 22.747 8.077 1.00 2.58 C ATOM 255 OG SER A 17 -13.959 23.540 9.240 1.00 3.25 O ATOM 0 H SER A 17 -11.565 21.559 7.856 1.00 2.43 H new ATOM 0 HA SER A 17 -14.124 20.924 9.194 1.00 1.77 H new ATOM 0 HB2 SER A 17 -13.507 23.196 7.264 1.00 2.58 H new ATOM 0 HB3 SER A 17 -15.118 22.714 7.756 1.00 2.58 H new ATOM 0 HG SER A 17 -13.012 23.655 9.463 1.00 3.25 H new ATOM 261 N CYS A 18 -13.069 20.648 6.043 1.00 1.31 N ATOM 262 CA CYS A 18 -13.363 19.879 4.843 1.00 1.14 C ATOM 263 C CYS A 18 -12.985 18.418 5.060 1.00 0.94 C ATOM 264 O CYS A 18 -13.758 17.530 4.718 1.00 0.89 O ATOM 265 CB CYS A 18 -12.686 20.450 3.607 1.00 1.27 C ATOM 266 SG CYS A 18 -13.366 19.628 2.142 1.00 2.42 S ATOM 0 H CYS A 18 -12.304 21.318 5.967 1.00 1.31 H new ATOM 0 HA CYS A 18 -14.435 19.944 4.658 1.00 1.14 H new ATOM 0 HB2 CYS A 18 -12.852 21.526 3.548 1.00 1.27 H new ATOM 0 HB3 CYS A 18 -11.608 20.296 3.661 1.00 1.27 H new ATOM 0 HG CYS A 18 -12.799 20.106 1.074 1.00 2.42 H new ATOM 272 N VAL A 19 -11.818 18.160 5.671 1.00 0.94 N ATOM 273 CA VAL A 19 -11.421 16.808 6.055 1.00 0.92 C ATOM 274 C VAL A 19 -12.498 16.199 6.963 1.00 0.93 C ATOM 275 O VAL A 19 -12.855 15.025 6.859 1.00 1.01 O ATOM 276 CB VAL A 19 -10.013 16.828 6.680 1.00 1.08 C ATOM 277 CG1 VAL A 19 -9.981 17.037 8.200 1.00 2.04 C ATOM 278 CG2 VAL A 19 -9.261 15.542 6.319 1.00 2.28 C ATOM 0 H VAL A 19 -11.134 18.878 5.908 1.00 0.94 H new ATOM 0 HA VAL A 19 -11.350 16.162 5.180 1.00 0.92 H new ATOM 0 HB VAL A 19 -9.521 17.702 6.253 1.00 1.08 H new ATOM 0 HG11 VAL A 19 -8.947 17.036 8.546 1.00 2.04 H new ATOM 0 HG12 VAL A 19 -10.445 17.992 8.446 1.00 2.04 H new ATOM 0 HG13 VAL A 19 -10.528 16.231 8.690 1.00 2.04 H new ATOM 0 HG21 VAL A 19 -8.267 15.565 6.765 1.00 2.28 H new ATOM 0 HG22 VAL A 19 -9.810 14.681 6.700 1.00 2.28 H new ATOM 0 HG23 VAL A 19 -9.171 15.465 5.235 1.00 2.28 H new ATOM 288 N SER A 20 -13.044 17.043 7.835 1.00 1.02 N ATOM 289 CA SER A 20 -14.049 16.635 8.798 1.00 1.23 C ATOM 290 C SER A 20 -15.348 16.213 8.101 1.00 1.20 C ATOM 291 O SER A 20 -15.951 15.215 8.483 1.00 1.35 O ATOM 292 CB SER A 20 -14.240 17.753 9.824 1.00 1.57 C ATOM 293 OG SER A 20 -12.962 18.306 10.093 1.00 2.45 O ATOM 0 H SER A 20 -12.797 18.031 7.889 1.00 1.02 H new ATOM 0 HA SER A 20 -13.713 15.749 9.336 1.00 1.23 H new ATOM 0 HB2 SER A 20 -14.915 18.517 9.438 1.00 1.57 H new ATOM 0 HB3 SER A 20 -14.689 17.363 10.737 1.00 1.57 H new ATOM 0 HG SER A 20 -13.068 19.193 10.496 1.00 2.45 H new ATOM 299 N ASN A 21 -15.799 16.932 7.066 1.00 1.08 N ATOM 300 CA ASN A 21 -16.946 16.463 6.285 1.00 1.12 C ATOM 301 C ASN A 21 -16.584 15.252 5.420 1.00 1.00 C ATOM 302 O ASN A 21 -17.395 14.336 5.260 1.00 1.04 O ATOM 303 CB ASN A 21 -17.645 17.594 5.516 1.00 1.21 C ATOM 304 CG ASN A 21 -17.045 17.951 4.158 1.00 1.62 C ATOM 305 OD1 ASN A 21 -17.162 17.083 3.156 1.00 3.11 O flip ATOM 306 ND2 ASN A 21 -16.526 19.044 3.985 1.00 1.28 N flip ATOM 0 H ASN A 21 -15.399 17.818 6.757 1.00 1.08 H new ATOM 0 HA ASN A 21 -17.696 16.110 6.992 1.00 1.12 H new ATOM 0 HB2 ASN A 21 -18.688 17.315 5.368 1.00 1.21 H new ATOM 0 HB3 ASN A 21 -17.640 18.488 6.140 1.00 1.21 H new ATOM 0 HD21 ASN A 21 -16.444 19.698 4.763 1.00 1.28 H new ATOM 0 HD22 ASN A 21 -16.175 19.302 3.063 1.00 1.28 H new ATOM 313 N ILE A 22 -15.375 15.242 4.850 1.00 0.91 N ATOM 314 CA ILE A 22 -14.836 14.130 4.077 1.00 0.92 C ATOM 315 C ILE A 22 -15.007 12.817 4.857 1.00 0.98 C ATOM 316 O ILE A 22 -15.460 11.831 4.281 1.00 1.02 O ATOM 317 CB ILE A 22 -13.390 14.449 3.637 1.00 0.96 C ATOM 318 CG1 ILE A 22 -13.406 15.418 2.438 1.00 1.15 C ATOM 319 CG2 ILE A 22 -12.581 13.204 3.262 1.00 1.14 C ATOM 320 CD1 ILE A 22 -12.077 16.135 2.178 1.00 1.40 C ATOM 0 H ILE A 22 -14.731 16.030 4.918 1.00 0.91 H new ATOM 0 HA ILE A 22 -15.395 13.989 3.152 1.00 0.92 H new ATOM 0 HB ILE A 22 -12.902 14.905 4.498 1.00 0.96 H new ATOM 0 HG12 ILE A 22 -13.685 14.862 1.543 1.00 1.15 H new ATOM 0 HG13 ILE A 22 -14.181 16.166 2.603 1.00 1.15 H new ATOM 0 HG21 ILE A 22 -11.576 13.500 2.963 1.00 1.14 H new ATOM 0 HG22 ILE A 22 -12.522 12.536 4.121 1.00 1.14 H new ATOM 0 HG23 ILE A 22 -13.069 12.689 2.435 1.00 1.14 H new ATOM 0 HD11 ILE A 22 -12.182 16.795 1.317 1.00 1.40 H new ATOM 0 HD12 ILE A 22 -11.803 16.722 3.054 1.00 1.40 H new ATOM 0 HD13 ILE A 22 -11.299 15.398 1.977 1.00 1.40 H new ATOM 332 N GLU A 23 -14.739 12.809 6.170 1.00 1.07 N ATOM 333 CA GLU A 23 -15.022 11.665 7.041 1.00 1.26 C ATOM 334 C GLU A 23 -16.379 11.009 6.730 1.00 1.10 C ATOM 335 O GLU A 23 -16.468 9.811 6.434 1.00 1.08 O ATOM 336 CB GLU A 23 -14.959 12.122 8.506 1.00 1.58 C ATOM 337 CG GLU A 23 -15.239 10.997 9.504 1.00 2.77 C ATOM 338 CD GLU A 23 -15.125 11.506 10.933 1.00 3.41 C ATOM 339 OE1 GLU A 23 -13.978 11.556 11.423 1.00 3.66 O ATOM 340 OE2 GLU A 23 -16.189 11.850 11.491 1.00 4.44 O ATOM 0 H GLU A 23 -14.318 13.600 6.658 1.00 1.07 H new ATOM 0 HA GLU A 23 -14.265 10.903 6.857 1.00 1.26 H new ATOM 0 HB2 GLU A 23 -13.972 12.539 8.707 1.00 1.58 H new ATOM 0 HB3 GLU A 23 -15.681 12.923 8.661 1.00 1.58 H new ATOM 0 HG2 GLU A 23 -16.238 10.594 9.335 1.00 2.77 H new ATOM 0 HG3 GLU A 23 -14.535 10.180 9.346 1.00 2.77 H new ATOM 347 N ARG A 24 -17.443 11.817 6.787 1.00 1.05 N ATOM 348 CA ARG A 24 -18.816 11.364 6.616 1.00 1.06 C ATOM 349 C ARG A 24 -19.065 10.921 5.177 1.00 0.96 C ATOM 350 O ARG A 24 -19.958 10.105 4.938 1.00 1.11 O ATOM 351 CB ARG A 24 -19.801 12.484 6.975 1.00 1.15 C ATOM 352 CG ARG A 24 -19.730 12.863 8.459 1.00 1.74 C ATOM 353 CD ARG A 24 -20.619 14.079 8.756 1.00 2.67 C ATOM 354 NE ARG A 24 -22.053 13.776 8.597 1.00 2.96 N ATOM 355 CZ ARG A 24 -23.033 14.697 8.537 1.00 4.09 C ATOM 356 NH1 ARG A 24 -22.731 15.997 8.611 1.00 5.03 N ATOM 357 NH2 ARG A 24 -24.309 14.315 8.407 1.00 5.04 N ATOM 0 H ARG A 24 -17.367 12.820 6.956 1.00 1.05 H new ATOM 0 HA ARG A 24 -18.972 10.516 7.284 1.00 1.06 H new ATOM 0 HB2 ARG A 24 -19.587 13.363 6.367 1.00 1.15 H new ATOM 0 HB3 ARG A 24 -20.815 12.166 6.731 1.00 1.15 H new ATOM 0 HG2 ARG A 24 -20.047 12.018 9.070 1.00 1.74 H new ATOM 0 HG3 ARG A 24 -18.699 13.086 8.733 1.00 1.74 H new ATOM 0 HD2 ARG A 24 -20.433 14.422 9.774 1.00 2.67 H new ATOM 0 HD3 ARG A 24 -20.347 14.897 8.089 1.00 2.67 H new ATOM 0 HE ARG A 24 -22.323 12.795 8.527 1.00 2.96 H new ATOM 0 HH11 ARG A 24 -21.759 16.290 8.713 1.00 5.03 H new ATOM 0 HH12 ARG A 24 -23.472 16.696 8.566 1.00 5.03 H new ATOM 0 HH21 ARG A 24 -24.542 13.323 8.353 1.00 5.04 H new ATOM 0 HH22 ARG A 24 -25.049 15.016 8.362 1.00 5.04 H new ATOM 371 N ASN A 25 -18.311 11.498 4.235 1.00 0.87 N ATOM 372 CA ASN A 25 -18.383 11.139 2.832 1.00 0.86 C ATOM 373 C ASN A 25 -17.808 9.739 2.663 1.00 0.90 C ATOM 374 O ASN A 25 -18.521 8.854 2.201 1.00 0.96 O ATOM 375 CB ASN A 25 -17.671 12.169 1.942 1.00 0.90 C ATOM 376 CG ASN A 25 -18.505 13.429 1.731 1.00 0.99 C ATOM 377 OD1 ASN A 25 -19.010 13.666 0.642 1.00 1.21 O ATOM 378 ND2 ASN A 25 -18.680 14.253 2.762 1.00 1.00 N ATOM 0 H ASN A 25 -17.632 12.232 4.436 1.00 0.87 H new ATOM 0 HA ASN A 25 -19.424 11.140 2.508 1.00 0.86 H new ATOM 0 HB2 ASN A 25 -16.717 12.439 2.395 1.00 0.90 H new ATOM 0 HB3 ASN A 25 -17.448 11.718 0.975 1.00 0.90 H new ATOM 0 HD21 ASN A 25 -19.242 15.097 2.651 1.00 1.00 H new ATOM 0 HD22 ASN A 25 -18.252 14.040 3.663 1.00 1.00 H new ATOM 385 N LEU A 26 -16.554 9.505 3.068 1.00 0.90 N ATOM 386 CA LEU A 26 -15.939 8.191 2.886 1.00 0.95 C ATOM 387 C LEU A 26 -16.752 7.125 3.604 1.00 0.97 C ATOM 388 O LEU A 26 -16.995 6.069 3.030 1.00 1.02 O ATOM 389 CB LEU A 26 -14.465 8.133 3.300 1.00 1.00 C ATOM 390 CG LEU A 26 -13.529 8.691 2.216 1.00 1.02 C ATOM 391 CD1 LEU A 26 -13.678 10.204 2.148 1.00 1.82 C ATOM 392 CD2 LEU A 26 -12.084 8.323 2.561 1.00 2.29 C ATOM 0 H LEU A 26 -15.956 10.198 3.517 1.00 0.90 H new ATOM 0 HA LEU A 26 -15.947 7.993 1.814 1.00 0.95 H new ATOM 0 HB2 LEU A 26 -14.327 8.698 4.222 1.00 1.00 H new ATOM 0 HB3 LEU A 26 -14.191 7.100 3.516 1.00 1.00 H new ATOM 0 HG LEU A 26 -13.788 8.264 1.247 1.00 1.02 H new ATOM 0 HD11 LEU A 26 -13.015 10.601 1.380 1.00 1.82 H new ATOM 0 HD12 LEU A 26 -14.709 10.457 1.903 1.00 1.82 H new ATOM 0 HD13 LEU A 26 -13.417 10.639 3.113 1.00 1.82 H new ATOM 0 HD21 LEU A 26 -11.416 8.716 1.795 1.00 2.29 H new ATOM 0 HD22 LEU A 26 -11.820 8.752 3.528 1.00 2.29 H new ATOM 0 HD23 LEU A 26 -11.986 7.238 2.606 1.00 2.29 H new ATOM 404 N GLN A 27 -17.248 7.419 4.811 1.00 0.99 N ATOM 405 CA GLN A 27 -18.099 6.485 5.544 1.00 1.10 C ATOM 406 C GLN A 27 -19.274 5.976 4.710 1.00 1.08 C ATOM 407 O GLN A 27 -19.840 4.935 5.033 1.00 1.20 O ATOM 408 CB GLN A 27 -18.643 7.132 6.833 1.00 1.21 C ATOM 409 CG GLN A 27 -18.218 6.361 8.094 1.00 1.34 C ATOM 410 CD GLN A 27 -17.503 7.233 9.115 1.00 1.48 C ATOM 411 OE1 GLN A 27 -16.588 8.083 8.668 1.00 2.07 O flip ATOM 412 NE2 GLN A 27 -17.773 7.141 10.307 1.00 1.38 N flip ATOM 0 H GLN A 27 -17.073 8.298 5.298 1.00 0.99 H new ATOM 0 HA GLN A 27 -17.466 5.633 5.792 1.00 1.10 H new ATOM 0 HB2 GLN A 27 -18.286 8.160 6.900 1.00 1.21 H new ATOM 0 HB3 GLN A 27 -19.731 7.175 6.785 1.00 1.21 H new ATOM 0 HG2 GLN A 27 -19.100 5.919 8.557 1.00 1.34 H new ATOM 0 HG3 GLN A 27 -17.564 5.538 7.806 1.00 1.34 H new ATOM 0 HE21 GLN A 27 -18.482 6.478 10.620 1.00 1.38 H new ATOM 0 HE22 GLN A 27 -17.289 7.728 10.986 1.00 1.38 H new ATOM 421 N LYS A 28 -19.690 6.744 3.699 1.00 1.00 N ATOM 422 CA LYS A 28 -20.791 6.383 2.826 1.00 1.05 C ATOM 423 C LYS A 28 -20.390 6.452 1.349 1.00 1.08 C ATOM 424 O LYS A 28 -21.257 6.622 0.496 1.00 1.22 O ATOM 425 CB LYS A 28 -21.989 7.282 3.154 1.00 1.27 C ATOM 426 CG LYS A 28 -22.301 7.213 4.659 1.00 1.37 C ATOM 427 CD LYS A 28 -23.764 7.585 4.938 1.00 1.66 C ATOM 428 CE LYS A 28 -23.986 9.100 4.906 1.00 2.50 C ATOM 429 NZ LYS A 28 -23.302 9.768 6.030 1.00 4.03 N ATOM 0 H LYS A 28 -19.262 7.641 3.468 1.00 1.00 H new ATOM 0 HA LYS A 28 -21.073 5.345 3.001 1.00 1.05 H new ATOM 0 HB2 LYS A 28 -21.772 8.311 2.866 1.00 1.27 H new ATOM 0 HB3 LYS A 28 -22.859 6.967 2.579 1.00 1.27 H new ATOM 0 HG2 LYS A 28 -22.101 6.207 5.029 1.00 1.37 H new ATOM 0 HG3 LYS A 28 -21.641 7.889 5.202 1.00 1.37 H new ATOM 0 HD2 LYS A 28 -24.407 7.109 4.198 1.00 1.66 H new ATOM 0 HD3 LYS A 28 -24.058 7.196 5.913 1.00 1.66 H new ATOM 0 HE2 LYS A 28 -23.618 9.503 3.963 1.00 2.50 H new ATOM 0 HE3 LYS A 28 -25.054 9.314 4.949 1.00 2.50 H new ATOM 0 HZ1 LYS A 28 -23.727 10.704 6.188 1.00 4.03 H new ATOM 0 HZ2 LYS A 28 -23.404 9.192 6.890 1.00 4.03 H new ATOM 0 HZ3 LYS A 28 -22.293 9.879 5.806 1.00 4.03 H new ATOM 443 N GLU A 29 -19.097 6.300 1.039 1.00 1.02 N ATOM 444 CA GLU A 29 -18.628 6.259 -0.337 1.00 1.14 C ATOM 445 C GLU A 29 -18.947 4.883 -0.932 1.00 1.07 C ATOM 446 O GLU A 29 -19.686 4.793 -1.911 1.00 1.13 O ATOM 447 CB GLU A 29 -17.148 6.665 -0.361 1.00 1.31 C ATOM 448 CG GLU A 29 -16.504 6.716 -1.754 1.00 1.42 C ATOM 449 CD GLU A 29 -16.035 5.355 -2.245 1.00 1.76 C ATOM 450 OE1 GLU A 29 -15.572 4.579 -1.382 1.00 2.69 O ATOM 451 OE2 GLU A 29 -16.132 5.118 -3.466 1.00 2.83 O ATOM 0 H GLU A 29 -18.357 6.203 1.734 1.00 1.02 H new ATOM 0 HA GLU A 29 -19.141 6.975 -0.979 1.00 1.14 H new ATOM 0 HB2 GLU A 29 -17.050 7.647 0.103 1.00 1.31 H new ATOM 0 HB3 GLU A 29 -16.586 5.964 0.256 1.00 1.31 H new ATOM 0 HG2 GLU A 29 -17.222 7.124 -2.465 1.00 1.42 H new ATOM 0 HG3 GLU A 29 -15.655 7.399 -1.730 1.00 1.42 H new ATOM 458 N ALA A 30 -18.442 3.808 -0.317 1.00 1.07 N ATOM 459 CA ALA A 30 -18.642 2.447 -0.803 1.00 1.11 C ATOM 460 C ALA A 30 -18.331 1.441 0.313 1.00 1.14 C ATOM 461 O ALA A 30 -18.785 1.617 1.439 1.00 1.19 O ATOM 462 CB ALA A 30 -17.790 2.233 -2.059 1.00 1.21 C ATOM 0 H ALA A 30 -17.882 3.862 0.534 1.00 1.07 H new ATOM 0 HA ALA A 30 -19.683 2.287 -1.083 1.00 1.11 H new ATOM 0 HB1 ALA A 30 -17.934 1.218 -2.428 1.00 1.21 H new ATOM 0 HB2 ALA A 30 -18.090 2.945 -2.828 1.00 1.21 H new ATOM 0 HB3 ALA A 30 -16.738 2.384 -1.815 1.00 1.21 H new ATOM 468 N GLY A 31 -17.536 0.398 0.030 1.00 1.22 N ATOM 469 CA GLY A 31 -17.199 -0.651 0.991 1.00 1.36 C ATOM 470 C GLY A 31 -16.265 -0.184 2.113 1.00 1.28 C ATOM 471 O GLY A 31 -15.928 -0.963 2.998 1.00 1.43 O ATOM 0 H GLY A 31 -17.106 0.262 -0.885 1.00 1.22 H new ATOM 0 HA2 GLY A 31 -18.118 -1.036 1.433 1.00 1.36 H new ATOM 0 HA3 GLY A 31 -16.729 -1.479 0.461 1.00 1.36 H new ATOM 475 N VAL A 32 -15.822 1.075 2.081 1.00 1.14 N ATOM 476 CA VAL A 32 -15.018 1.676 3.131 1.00 1.11 C ATOM 477 C VAL A 32 -15.930 2.110 4.285 1.00 1.09 C ATOM 478 O VAL A 32 -16.850 2.899 4.094 1.00 1.10 O ATOM 479 CB VAL A 32 -14.139 2.802 2.535 1.00 1.03 C ATOM 480 CG1 VAL A 32 -14.923 3.786 1.657 1.00 1.32 C ATOM 481 CG2 VAL A 32 -13.314 3.550 3.596 1.00 1.33 C ATOM 0 H VAL A 32 -16.019 1.711 1.308 1.00 1.14 H new ATOM 0 HA VAL A 32 -14.319 0.957 3.559 1.00 1.11 H new ATOM 0 HB VAL A 32 -13.436 2.283 1.884 1.00 1.03 H new ATOM 0 HG11 VAL A 32 -14.246 4.549 1.272 1.00 1.32 H new ATOM 0 HG12 VAL A 32 -15.376 3.249 0.824 1.00 1.32 H new ATOM 0 HG13 VAL A 32 -15.704 4.260 2.251 1.00 1.32 H new ATOM 0 HG21 VAL A 32 -12.720 4.326 3.114 1.00 1.33 H new ATOM 0 HG22 VAL A 32 -13.985 4.006 4.324 1.00 1.33 H new ATOM 0 HG23 VAL A 32 -12.652 2.848 4.103 1.00 1.33 H new ATOM 491 N LEU A 33 -15.667 1.593 5.493 1.00 1.18 N ATOM 492 CA LEU A 33 -16.405 1.949 6.703 1.00 1.18 C ATOM 493 C LEU A 33 -15.430 2.216 7.848 1.00 1.21 C ATOM 494 O LEU A 33 -15.574 1.701 8.953 1.00 1.31 O ATOM 495 CB LEU A 33 -17.386 0.814 7.054 1.00 1.30 C ATOM 496 CG LEU A 33 -16.696 -0.559 7.231 1.00 1.43 C ATOM 497 CD1 LEU A 33 -16.942 -1.160 8.621 1.00 2.56 C ATOM 498 CD2 LEU A 33 -17.201 -1.554 6.183 1.00 2.02 C ATOM 0 H LEU A 33 -14.928 0.909 5.655 1.00 1.18 H new ATOM 0 HA LEU A 33 -16.978 2.860 6.534 1.00 1.18 H new ATOM 0 HB2 LEU A 33 -17.912 1.070 7.974 1.00 1.30 H new ATOM 0 HB3 LEU A 33 -18.137 0.737 6.268 1.00 1.30 H new ATOM 0 HG LEU A 33 -15.627 -0.383 7.109 1.00 1.43 H new ATOM 0 HD11 LEU A 33 -16.437 -2.123 8.695 1.00 2.56 H new ATOM 0 HD12 LEU A 33 -16.551 -0.486 9.383 1.00 2.56 H new ATOM 0 HD13 LEU A 33 -18.012 -1.299 8.773 1.00 2.56 H new ATOM 0 HD21 LEU A 33 -16.704 -2.514 6.324 1.00 2.02 H new ATOM 0 HD22 LEU A 33 -18.278 -1.683 6.293 1.00 2.02 H new ATOM 0 HD23 LEU A 33 -16.981 -1.174 5.185 1.00 2.02 H new ATOM 510 N SER A 34 -14.440 3.070 7.607 1.00 1.12 N ATOM 511 CA SER A 34 -13.571 3.604 8.637 1.00 1.08 C ATOM 512 C SER A 34 -12.921 4.840 8.045 1.00 0.97 C ATOM 513 O SER A 34 -12.709 4.875 6.833 1.00 1.02 O ATOM 514 CB SER A 34 -12.514 2.566 9.017 1.00 1.18 C ATOM 515 OG SER A 34 -11.644 3.070 10.013 1.00 1.64 O ATOM 0 H SER A 34 -14.220 3.413 6.672 1.00 1.12 H new ATOM 0 HA SER A 34 -14.124 3.851 9.543 1.00 1.08 H new ATOM 0 HB2 SER A 34 -13.002 1.661 9.379 1.00 1.18 H new ATOM 0 HB3 SER A 34 -11.939 2.287 8.134 1.00 1.18 H new ATOM 0 HG SER A 34 -10.888 2.457 10.127 1.00 1.64 H new ATOM 521 N VAL A 35 -12.569 5.813 8.880 1.00 0.92 N ATOM 522 CA VAL A 35 -11.691 6.903 8.507 1.00 0.94 C ATOM 523 C VAL A 35 -10.794 7.156 9.711 1.00 0.97 C ATOM 524 O VAL A 35 -11.315 7.370 10.803 1.00 1.06 O ATOM 525 CB VAL A 35 -12.507 8.149 8.119 1.00 1.09 C ATOM 526 CG1 VAL A 35 -11.578 9.340 7.835 1.00 2.54 C ATOM 527 CG2 VAL A 35 -13.376 7.875 6.882 1.00 2.33 C ATOM 0 H VAL A 35 -12.893 5.862 9.846 1.00 0.92 H new ATOM 0 HA VAL A 35 -11.089 6.658 7.632 1.00 0.94 H new ATOM 0 HB VAL A 35 -13.156 8.392 8.960 1.00 1.09 H new ATOM 0 HG11 VAL A 35 -12.175 10.210 7.563 1.00 2.54 H new ATOM 0 HG12 VAL A 35 -10.993 9.566 8.727 1.00 2.54 H new ATOM 0 HG13 VAL A 35 -10.906 9.090 7.014 1.00 2.54 H new ATOM 0 HG21 VAL A 35 -13.942 8.771 6.629 1.00 2.33 H new ATOM 0 HG22 VAL A 35 -12.737 7.600 6.042 1.00 2.33 H new ATOM 0 HG23 VAL A 35 -14.066 7.058 7.096 1.00 2.33 H new ATOM 537 N LEU A 36 -9.470 7.111 9.534 1.00 0.96 N ATOM 538 CA LEU A 36 -8.545 7.559 10.564 1.00 0.98 C ATOM 539 C LEU A 36 -7.503 8.513 9.971 1.00 0.99 C ATOM 540 O LEU A 36 -6.411 8.117 9.558 1.00 1.07 O ATOM 541 CB LEU A 36 -8.002 6.379 11.388 1.00 1.04 C ATOM 542 CG LEU A 36 -7.046 5.399 10.685 1.00 2.40 C ATOM 543 CD1 LEU A 36 -5.657 5.459 11.339 1.00 2.18 C ATOM 544 CD2 LEU A 36 -7.565 3.960 10.750 1.00 4.33 C ATOM 0 H LEU A 36 -9.021 6.768 8.685 1.00 0.96 H new ATOM 0 HA LEU A 36 -9.072 8.159 11.306 1.00 0.98 H new ATOM 0 HB2 LEU A 36 -7.486 6.786 12.258 1.00 1.04 H new ATOM 0 HB3 LEU A 36 -8.853 5.809 11.760 1.00 1.04 H new ATOM 0 HG LEU A 36 -6.983 5.698 9.639 1.00 2.40 H new ATOM 0 HD11 LEU A 36 -4.987 4.762 10.835 1.00 2.18 H new ATOM 0 HD12 LEU A 36 -5.259 6.470 11.255 1.00 2.18 H new ATOM 0 HD13 LEU A 36 -5.738 5.187 12.391 1.00 2.18 H new ATOM 0 HD21 LEU A 36 -6.864 3.297 10.243 1.00 4.33 H new ATOM 0 HD22 LEU A 36 -7.664 3.656 11.792 1.00 4.33 H new ATOM 0 HD23 LEU A 36 -8.537 3.902 10.261 1.00 4.33 H new ATOM 556 N VAL A 37 -7.849 9.805 9.947 1.00 0.96 N ATOM 557 CA VAL A 37 -6.929 10.867 9.574 1.00 1.02 C ATOM 558 C VAL A 37 -6.363 11.478 10.850 1.00 1.20 C ATOM 559 O VAL A 37 -7.090 11.680 11.821 1.00 1.33 O ATOM 560 CB VAL A 37 -7.620 11.915 8.674 1.00 0.95 C ATOM 561 CG1 VAL A 37 -8.577 12.815 9.458 1.00 1.89 C ATOM 562 CG2 VAL A 37 -6.633 12.849 7.960 1.00 2.30 C ATOM 0 H VAL A 37 -8.783 10.137 10.189 1.00 0.96 H new ATOM 0 HA VAL A 37 -6.108 10.463 8.982 1.00 1.02 H new ATOM 0 HB VAL A 37 -8.160 11.313 7.943 1.00 0.95 H new ATOM 0 HG11 VAL A 37 -9.037 13.534 8.781 1.00 1.89 H new ATOM 0 HG12 VAL A 37 -9.353 12.205 9.921 1.00 1.89 H new ATOM 0 HG13 VAL A 37 -8.024 13.348 10.232 1.00 1.89 H new ATOM 0 HG21 VAL A 37 -7.185 13.560 7.345 1.00 2.30 H new ATOM 0 HG22 VAL A 37 -6.044 13.390 8.700 1.00 2.30 H new ATOM 0 HG23 VAL A 37 -5.968 12.261 7.327 1.00 2.30 H new ATOM 572 N ALA A 38 -5.070 11.793 10.839 1.00 1.26 N ATOM 573 CA ALA A 38 -4.466 12.689 11.802 1.00 1.39 C ATOM 574 C ALA A 38 -4.130 13.961 11.037 1.00 1.44 C ATOM 575 O ALA A 38 -3.127 14.001 10.329 1.00 1.55 O ATOM 576 CB ALA A 38 -3.226 12.052 12.434 1.00 1.49 C ATOM 0 H ALA A 38 -4.412 11.426 10.152 1.00 1.26 H new ATOM 0 HA ALA A 38 -5.139 12.908 12.631 1.00 1.39 H new ATOM 0 HB1 ALA A 38 -2.789 12.743 13.154 1.00 1.49 H new ATOM 0 HB2 ALA A 38 -3.509 11.130 12.942 1.00 1.49 H new ATOM 0 HB3 ALA A 38 -2.496 11.828 11.657 1.00 1.49 H new ATOM 582 N LEU A 39 -4.966 14.991 11.180 1.00 1.44 N ATOM 583 CA LEU A 39 -4.696 16.339 10.699 1.00 1.53 C ATOM 584 C LEU A 39 -3.403 16.856 11.353 1.00 1.77 C ATOM 585 O LEU A 39 -2.633 17.577 10.728 1.00 2.07 O ATOM 586 CB LEU A 39 -5.954 17.195 10.976 1.00 1.53 C ATOM 587 CG LEU A 39 -5.712 18.675 11.300 1.00 2.75 C ATOM 588 CD1 LEU A 39 -5.258 19.477 10.074 1.00 3.93 C ATOM 589 CD2 LEU A 39 -7.003 19.298 11.844 1.00 2.96 C ATOM 0 H LEU A 39 -5.870 14.905 11.645 1.00 1.44 H new ATOM 0 HA LEU A 39 -4.514 16.380 9.625 1.00 1.53 H new ATOM 0 HB2 LEU A 39 -6.605 17.138 10.104 1.00 1.53 H new ATOM 0 HB3 LEU A 39 -6.496 16.747 11.809 1.00 1.53 H new ATOM 0 HG LEU A 39 -4.915 18.715 12.043 1.00 2.75 H new ATOM 0 HD11 LEU A 39 -5.101 20.518 10.358 1.00 3.93 H new ATOM 0 HD12 LEU A 39 -4.326 19.060 9.691 1.00 3.93 H new ATOM 0 HD13 LEU A 39 -6.024 19.424 9.300 1.00 3.93 H new ATOM 0 HD21 LEU A 39 -6.831 20.349 12.074 1.00 2.96 H new ATOM 0 HD22 LEU A 39 -7.791 19.215 11.095 1.00 2.96 H new ATOM 0 HD23 LEU A 39 -7.307 18.773 12.750 1.00 2.96 H new ATOM 601 N MET A 40 -3.157 16.449 12.602 1.00 1.67 N ATOM 602 CA MET A 40 -2.005 16.865 13.397 1.00 1.86 C ATOM 603 C MET A 40 -0.697 16.510 12.685 1.00 1.88 C ATOM 604 O MET A 40 0.169 17.360 12.497 1.00 1.97 O ATOM 605 CB MET A 40 -2.091 16.211 14.794 1.00 1.93 C ATOM 606 CG MET A 40 -2.261 17.258 15.901 1.00 2.07 C ATOM 607 SD MET A 40 -0.756 18.193 16.291 1.00 3.77 S ATOM 608 CE MET A 40 -1.378 19.884 16.172 1.00 4.60 C ATOM 0 H MET A 40 -3.772 15.804 13.098 1.00 1.67 H new ATOM 0 HA MET A 40 -2.016 17.948 13.518 1.00 1.86 H new ATOM 0 HB2 MET A 40 -2.930 15.515 14.819 1.00 1.93 H new ATOM 0 HB3 MET A 40 -1.188 15.629 14.979 1.00 1.93 H new ATOM 0 HG2 MET A 40 -3.042 17.958 15.604 1.00 2.07 H new ATOM 0 HG3 MET A 40 -2.608 16.759 16.806 1.00 2.07 H new ATOM 0 HE1 MET A 40 -0.571 20.585 16.385 1.00 4.60 H new ATOM 0 HE2 MET A 40 -1.757 20.062 15.166 1.00 4.60 H new ATOM 0 HE3 MET A 40 -2.183 20.027 16.893 1.00 4.60 H new ATOM 618 N ALA A 41 -0.560 15.239 12.301 1.00 1.82 N ATOM 619 CA ALA A 41 0.630 14.728 11.629 1.00 1.84 C ATOM 620 C ALA A 41 0.522 14.881 10.108 1.00 1.69 C ATOM 621 O ALA A 41 1.536 14.932 9.418 1.00 1.82 O ATOM 622 CB ALA A 41 0.846 13.266 12.027 1.00 1.86 C ATOM 0 H ALA A 41 -1.280 14.532 12.450 1.00 1.82 H new ATOM 0 HA ALA A 41 1.494 15.314 11.944 1.00 1.84 H new ATOM 0 HB1 ALA A 41 1.734 12.880 11.527 1.00 1.86 H new ATOM 0 HB2 ALA A 41 0.979 13.199 13.107 1.00 1.86 H new ATOM 0 HB3 ALA A 41 -0.022 12.676 11.731 1.00 1.86 H new ATOM 628 N GLY A 42 -0.705 14.927 9.585 1.00 1.46 N ATOM 629 CA GLY A 42 -0.996 15.055 8.170 1.00 1.32 C ATOM 630 C GLY A 42 -0.974 13.693 7.483 1.00 1.21 C ATOM 631 O GLY A 42 -0.257 13.522 6.498 1.00 1.20 O ATOM 0 H GLY A 42 -1.546 14.874 10.160 1.00 1.46 H new ATOM 0 HA2 GLY A 42 -1.974 15.518 8.036 1.00 1.32 H new ATOM 0 HA3 GLY A 42 -0.264 15.714 7.703 1.00 1.32 H new ATOM 635 N LYS A 43 -1.770 12.728 7.965 1.00 1.17 N ATOM 636 CA LYS A 43 -1.899 11.433 7.325 1.00 1.10 C ATOM 637 C LYS A 43 -3.374 11.067 7.279 1.00 0.98 C ATOM 638 O LYS A 43 -4.061 11.305 8.268 1.00 1.01 O ATOM 639 CB LYS A 43 -1.116 10.375 8.106 1.00 1.26 C ATOM 640 CG LYS A 43 -1.357 10.360 9.625 1.00 1.44 C ATOM 641 CD LYS A 43 -0.872 9.054 10.274 1.00 1.80 C ATOM 642 CE LYS A 43 0.575 9.148 10.774 1.00 2.41 C ATOM 643 NZ LYS A 43 1.103 7.813 11.127 1.00 3.29 N ATOM 0 H LYS A 43 -2.336 12.833 8.807 1.00 1.17 H new ATOM 0 HA LYS A 43 -1.494 11.476 6.314 1.00 1.10 H new ATOM 0 HB2 LYS A 43 -1.368 9.393 7.706 1.00 1.26 H new ATOM 0 HB3 LYS A 43 -0.052 10.529 7.926 1.00 1.26 H new ATOM 0 HG2 LYS A 43 -0.841 11.205 10.082 1.00 1.44 H new ATOM 0 HG3 LYS A 43 -2.421 10.490 9.824 1.00 1.44 H new ATOM 0 HD2 LYS A 43 -1.526 8.803 11.109 1.00 1.80 H new ATOM 0 HD3 LYS A 43 -0.951 8.242 9.551 1.00 1.80 H new ATOM 0 HE2 LYS A 43 1.201 9.598 10.003 1.00 2.41 H new ATOM 0 HE3 LYS A 43 0.621 9.803 11.644 1.00 2.41 H new ATOM 0 HZ1 LYS A 43 2.083 7.905 11.462 1.00 3.29 H new ATOM 0 HZ2 LYS A 43 0.518 7.396 11.879 1.00 3.29 H new ATOM 0 HZ3 LYS A 43 1.080 7.198 10.289 1.00 3.29 H new ATOM 657 N ALA A 44 -3.844 10.488 6.169 1.00 0.89 N ATOM 658 CA ALA A 44 -5.146 9.842 6.058 1.00 0.83 C ATOM 659 C ALA A 44 -4.962 8.342 5.862 1.00 0.90 C ATOM 660 O ALA A 44 -4.639 7.896 4.762 1.00 0.90 O ATOM 661 CB ALA A 44 -5.942 10.441 4.899 1.00 0.74 C ATOM 0 H ALA A 44 -3.310 10.458 5.301 1.00 0.89 H new ATOM 0 HA ALA A 44 -5.705 10.011 6.978 1.00 0.83 H new ATOM 0 HB1 ALA A 44 -6.911 9.948 4.830 1.00 0.74 H new ATOM 0 HB2 ALA A 44 -6.089 11.507 5.071 1.00 0.74 H new ATOM 0 HB3 ALA A 44 -5.394 10.296 3.968 1.00 0.74 H new ATOM 667 N GLU A 45 -5.223 7.563 6.911 1.00 0.98 N ATOM 668 CA GLU A 45 -5.433 6.136 6.777 1.00 1.06 C ATOM 669 C GLU A 45 -6.950 5.914 6.786 1.00 0.97 C ATOM 670 O GLU A 45 -7.681 6.623 7.476 1.00 0.99 O ATOM 671 CB GLU A 45 -4.706 5.408 7.917 1.00 1.24 C ATOM 672 CG GLU A 45 -3.187 5.345 7.698 1.00 2.24 C ATOM 673 CD GLU A 45 -2.449 4.810 8.924 1.00 2.80 C ATOM 674 OE1 GLU A 45 -2.791 3.681 9.346 1.00 3.30 O ATOM 675 OE2 GLU A 45 -1.556 5.538 9.420 1.00 3.72 O ATOM 0 H GLU A 45 -5.293 7.908 7.868 1.00 0.98 H new ATOM 0 HA GLU A 45 -5.024 5.732 5.851 1.00 1.06 H new ATOM 0 HB2 GLU A 45 -4.914 5.916 8.859 1.00 1.24 H new ATOM 0 HB3 GLU A 45 -5.100 4.396 8.007 1.00 1.24 H new ATOM 0 HG2 GLU A 45 -2.971 4.708 6.840 1.00 2.24 H new ATOM 0 HG3 GLU A 45 -2.815 6.341 7.458 1.00 2.24 H new ATOM 682 N ILE A 46 -7.453 4.949 6.019 1.00 0.98 N ATOM 683 CA ILE A 46 -8.807 4.442 6.145 1.00 0.98 C ATOM 684 C ILE A 46 -8.746 2.932 5.995 1.00 1.08 C ATOM 685 O ILE A 46 -7.693 2.425 5.615 1.00 1.17 O ATOM 686 CB ILE A 46 -9.735 5.034 5.082 1.00 0.99 C ATOM 687 CG1 ILE A 46 -9.607 4.470 3.665 1.00 1.61 C ATOM 688 CG2 ILE A 46 -9.730 6.553 5.022 1.00 1.52 C ATOM 689 CD1 ILE A 46 -8.228 4.603 3.022 1.00 2.07 C ATOM 0 H ILE A 46 -6.917 4.493 5.281 1.00 0.98 H new ATOM 0 HA ILE A 46 -9.212 4.727 7.116 1.00 0.98 H new ATOM 0 HB ILE A 46 -10.700 4.695 5.459 1.00 0.99 H new ATOM 0 HG12 ILE A 46 -9.877 3.414 3.688 1.00 1.61 H new ATOM 0 HG13 ILE A 46 -10.335 4.971 3.027 1.00 1.61 H new ATOM 0 HG21 ILE A 46 -10.414 6.889 4.243 1.00 1.52 H new ATOM 0 HG22 ILE A 46 -10.049 6.956 5.983 1.00 1.52 H new ATOM 0 HG23 ILE A 46 -8.723 6.905 4.797 1.00 1.52 H new ATOM 0 HD11 ILE A 46 -8.250 4.172 2.021 1.00 2.07 H new ATOM 0 HD12 ILE A 46 -7.957 5.657 2.957 1.00 2.07 H new ATOM 0 HD13 ILE A 46 -7.491 4.076 3.628 1.00 2.07 H new ATOM 701 N LYS A 47 -9.868 2.240 6.236 1.00 1.11 N ATOM 702 CA LYS A 47 -10.033 0.833 5.891 1.00 1.21 C ATOM 703 C LYS A 47 -11.120 0.674 4.834 1.00 1.22 C ATOM 704 O LYS A 47 -12.290 0.939 5.110 1.00 1.25 O ATOM 705 CB LYS A 47 -10.272 -0.046 7.125 1.00 1.30 C ATOM 706 CG LYS A 47 -8.944 -0.260 7.860 1.00 1.87 C ATOM 707 CD LYS A 47 -9.108 -0.995 9.196 1.00 2.48 C ATOM 708 CE LYS A 47 -9.634 -0.035 10.272 1.00 2.95 C ATOM 709 NZ LYS A 47 -9.675 -0.662 11.610 1.00 3.80 N ATOM 0 H LYS A 47 -10.690 2.650 6.680 1.00 1.11 H new ATOM 0 HA LYS A 47 -9.097 0.477 5.460 1.00 1.21 H new ATOM 0 HB2 LYS A 47 -10.996 0.428 7.788 1.00 1.30 H new ATOM 0 HB3 LYS A 47 -10.694 -1.005 6.826 1.00 1.30 H new ATOM 0 HG2 LYS A 47 -8.269 -0.828 7.220 1.00 1.87 H new ATOM 0 HG3 LYS A 47 -8.475 0.707 8.039 1.00 1.87 H new ATOM 0 HD2 LYS A 47 -9.797 -1.831 9.077 1.00 2.48 H new ATOM 0 HD3 LYS A 47 -8.151 -1.413 9.509 1.00 2.48 H new ATOM 0 HE2 LYS A 47 -9.000 0.851 10.307 1.00 2.95 H new ATOM 0 HE3 LYS A 47 -10.635 0.300 9.999 1.00 2.95 H new ATOM 0 HZ1 LYS A 47 -10.036 0.023 12.304 1.00 3.80 H new ATOM 0 HZ2 LYS A 47 -10.301 -1.492 11.585 1.00 3.80 H new ATOM 0 HZ3 LYS A 47 -8.717 -0.959 11.884 1.00 3.80 H new ATOM 723 N TYR A 48 -10.695 0.268 3.635 1.00 1.25 N ATOM 724 CA TYR A 48 -11.541 -0.022 2.493 1.00 1.29 C ATOM 725 C TYR A 48 -11.655 -1.527 2.273 1.00 1.49 C ATOM 726 O TYR A 48 -10.940 -2.291 2.917 1.00 1.60 O ATOM 727 CB TYR A 48 -10.987 0.669 1.247 1.00 1.20 C ATOM 728 CG TYR A 48 -9.730 0.056 0.656 1.00 1.36 C ATOM 729 CD1 TYR A 48 -8.513 0.120 1.358 1.00 2.40 C ATOM 730 CD2 TYR A 48 -9.782 -0.611 -0.584 1.00 2.49 C ATOM 731 CE1 TYR A 48 -7.400 -0.596 0.892 1.00 2.72 C ATOM 732 CE2 TYR A 48 -8.614 -1.166 -1.134 1.00 2.66 C ATOM 733 CZ TYR A 48 -7.440 -1.212 -0.367 1.00 2.10 C ATOM 734 OH TYR A 48 -6.334 -1.870 -0.807 1.00 2.61 O ATOM 0 H TYR A 48 -9.705 0.129 3.433 1.00 1.25 H new ATOM 0 HA TYR A 48 -12.542 0.363 2.691 1.00 1.29 H new ATOM 0 HB2 TYR A 48 -11.762 0.671 0.481 1.00 1.20 H new ATOM 0 HB3 TYR A 48 -10.779 1.710 1.494 1.00 1.20 H new ATOM 0 HD1 TYR A 48 -8.435 0.719 2.253 1.00 2.40 H new ATOM 0 HD2 TYR A 48 -10.720 -0.696 -1.112 1.00 2.49 H new ATOM 0 HE1 TYR A 48 -6.513 -0.673 1.503 1.00 2.72 H new ATOM 0 HE2 TYR A 48 -8.620 -1.555 -2.142 1.00 2.66 H new ATOM 0 HH TYR A 48 -6.509 -2.247 -1.694 1.00 2.61 H new ATOM 744 N ASP A 49 -12.535 -1.922 1.348 1.00 1.59 N ATOM 745 CA ASP A 49 -12.763 -3.304 0.952 1.00 1.80 C ATOM 746 C ASP A 49 -12.391 -3.468 -0.537 1.00 1.83 C ATOM 747 O ASP A 49 -13.095 -2.938 -1.402 1.00 1.71 O ATOM 748 CB ASP A 49 -14.225 -3.669 1.238 1.00 1.89 C ATOM 749 CG ASP A 49 -14.386 -5.177 1.287 1.00 2.24 C ATOM 750 OD1 ASP A 49 -13.674 -5.831 0.498 1.00 2.69 O ATOM 751 OD2 ASP A 49 -15.191 -5.636 2.126 1.00 3.42 O ATOM 0 H ASP A 49 -13.125 -1.262 0.841 1.00 1.59 H new ATOM 0 HA ASP A 49 -12.135 -3.988 1.524 1.00 1.80 H new ATOM 0 HB2 ASP A 49 -14.539 -3.231 2.186 1.00 1.89 H new ATOM 0 HB3 ASP A 49 -14.870 -3.252 0.465 1.00 1.89 H new ATOM 756 N PRO A 50 -11.256 -4.117 -0.857 1.00 2.00 N ATOM 757 CA PRO A 50 -10.573 -4.007 -2.140 1.00 1.95 C ATOM 758 C PRO A 50 -11.308 -4.683 -3.287 1.00 1.94 C ATOM 759 O PRO A 50 -10.931 -4.455 -4.436 1.00 2.01 O ATOM 760 CB PRO A 50 -9.189 -4.636 -1.938 1.00 2.18 C ATOM 761 CG PRO A 50 -9.430 -5.632 -0.810 1.00 2.42 C ATOM 762 CD PRO A 50 -10.447 -4.892 0.053 1.00 2.23 C ATOM 0 HA PRO A 50 -10.517 -2.958 -2.431 1.00 1.95 H new ATOM 0 HB2 PRO A 50 -8.833 -5.129 -2.843 1.00 2.18 H new ATOM 0 HB3 PRO A 50 -8.442 -3.890 -1.666 1.00 2.18 H new ATOM 0 HG2 PRO A 50 -9.821 -6.580 -1.179 1.00 2.42 H new ATOM 0 HG3 PRO A 50 -8.515 -5.856 -0.261 1.00 2.42 H new ATOM 0 HD2 PRO A 50 -11.060 -5.593 0.620 1.00 2.23 H new ATOM 0 HD3 PRO A 50 -9.948 -4.247 0.777 1.00 2.23 H new ATOM 770 N GLU A 51 -12.323 -5.503 -2.989 1.00 1.95 N ATOM 771 CA GLU A 51 -13.164 -6.128 -3.998 1.00 2.00 C ATOM 772 C GLU A 51 -14.456 -5.328 -4.221 1.00 2.04 C ATOM 773 O GLU A 51 -15.282 -5.727 -5.042 1.00 2.32 O ATOM 774 CB GLU A 51 -13.424 -7.599 -3.625 1.00 2.01 C ATOM 775 CG GLU A 51 -14.049 -7.821 -2.235 1.00 2.26 C ATOM 776 CD GLU A 51 -14.335 -9.295 -1.948 1.00 2.50 C ATOM 777 OE1 GLU A 51 -14.467 -10.057 -2.931 1.00 3.18 O ATOM 778 OE2 GLU A 51 -14.429 -9.644 -0.751 1.00 2.86 O ATOM 0 H GLU A 51 -12.580 -5.748 -2.033 1.00 1.95 H new ATOM 0 HA GLU A 51 -12.641 -6.122 -4.955 1.00 2.00 H new ATOM 0 HB2 GLU A 51 -14.082 -8.037 -4.376 1.00 2.01 H new ATOM 0 HB3 GLU A 51 -12.480 -8.142 -3.672 1.00 2.01 H new ATOM 0 HG2 GLU A 51 -13.376 -7.430 -1.472 1.00 2.26 H new ATOM 0 HG3 GLU A 51 -14.977 -7.254 -2.163 1.00 2.26 H new ATOM 785 N VAL A 52 -14.639 -4.202 -3.514 1.00 1.82 N ATOM 786 CA VAL A 52 -15.816 -3.348 -3.631 1.00 1.87 C ATOM 787 C VAL A 52 -15.392 -1.958 -4.101 1.00 1.71 C ATOM 788 O VAL A 52 -15.997 -1.408 -5.017 1.00 1.86 O ATOM 789 CB VAL A 52 -16.566 -3.277 -2.287 1.00 1.87 C ATOM 790 CG1 VAL A 52 -17.839 -2.428 -2.413 1.00 2.60 C ATOM 791 CG2 VAL A 52 -16.952 -4.678 -1.793 1.00 2.44 C ATOM 0 H VAL A 52 -13.958 -3.860 -2.836 1.00 1.82 H new ATOM 0 HA VAL A 52 -16.499 -3.772 -4.368 1.00 1.87 H new ATOM 0 HB VAL A 52 -15.890 -2.815 -1.567 1.00 1.87 H new ATOM 0 HG11 VAL A 52 -18.350 -2.394 -1.451 1.00 2.60 H new ATOM 0 HG12 VAL A 52 -17.573 -1.416 -2.719 1.00 2.60 H new ATOM 0 HG13 VAL A 52 -18.499 -2.871 -3.159 1.00 2.60 H new ATOM 0 HG21 VAL A 52 -17.480 -4.596 -0.843 1.00 2.44 H new ATOM 0 HG22 VAL A 52 -17.599 -5.157 -2.527 1.00 2.44 H new ATOM 0 HG23 VAL A 52 -16.051 -5.277 -1.657 1.00 2.44 H new ATOM 801 N ILE A 53 -14.377 -1.382 -3.451 1.00 1.48 N ATOM 802 CA ILE A 53 -13.837 -0.064 -3.753 1.00 1.36 C ATOM 803 C ILE A 53 -12.360 -0.218 -4.097 1.00 1.38 C ATOM 804 O ILE A 53 -11.686 -1.104 -3.576 1.00 1.47 O ATOM 805 CB ILE A 53 -14.115 0.905 -2.582 1.00 1.24 C ATOM 806 CG1 ILE A 53 -13.276 2.200 -2.605 1.00 1.33 C ATOM 807 CG2 ILE A 53 -14.061 0.240 -1.202 1.00 1.35 C ATOM 808 CD1 ILE A 53 -11.893 2.110 -1.940 1.00 1.13 C ATOM 0 H ILE A 53 -13.897 -1.839 -2.676 1.00 1.48 H new ATOM 0 HA ILE A 53 -14.327 0.380 -4.619 1.00 1.36 H new ATOM 0 HB ILE A 53 -15.148 1.207 -2.756 1.00 1.24 H new ATOM 0 HG12 ILE A 53 -13.141 2.505 -3.643 1.00 1.33 H new ATOM 0 HG13 ILE A 53 -13.845 2.989 -2.113 1.00 1.33 H new ATOM 0 HG21 ILE A 53 -14.266 0.983 -0.432 1.00 1.35 H new ATOM 0 HG22 ILE A 53 -14.808 -0.552 -1.150 1.00 1.35 H new ATOM 0 HG23 ILE A 53 -13.070 -0.185 -1.041 1.00 1.35 H new ATOM 0 HD11 ILE A 53 -11.390 3.074 -2.013 1.00 1.13 H new ATOM 0 HD12 ILE A 53 -12.011 1.841 -0.890 1.00 1.13 H new ATOM 0 HD13 ILE A 53 -11.296 1.350 -2.444 1.00 1.13 H new ATOM 820 N GLN A 54 -11.860 0.673 -4.957 1.00 1.33 N ATOM 821 CA GLN A 54 -10.480 0.734 -5.398 1.00 1.34 C ATOM 822 C GLN A 54 -9.938 2.090 -4.947 1.00 1.30 C ATOM 823 O GLN A 54 -10.654 3.090 -5.000 1.00 1.21 O ATOM 824 CB GLN A 54 -10.408 0.540 -6.932 1.00 1.38 C ATOM 825 CG GLN A 54 -9.605 -0.687 -7.383 1.00 1.35 C ATOM 826 CD GLN A 54 -10.010 -1.920 -6.591 1.00 1.68 C ATOM 827 OE1 GLN A 54 -11.178 -2.287 -6.572 1.00 2.98 O ATOM 828 NE2 GLN A 54 -9.058 -2.522 -5.884 1.00 1.45 N ATOM 0 H GLN A 54 -12.438 1.400 -5.379 1.00 1.33 H new ATOM 0 HA GLN A 54 -9.872 -0.061 -4.965 1.00 1.34 H new ATOM 0 HB2 GLN A 54 -11.422 0.458 -7.323 1.00 1.38 H new ATOM 0 HB3 GLN A 54 -9.966 1.431 -7.378 1.00 1.38 H new ATOM 0 HG2 GLN A 54 -9.768 -0.863 -8.446 1.00 1.35 H new ATOM 0 HG3 GLN A 54 -8.540 -0.498 -7.251 1.00 1.35 H new ATOM 0 HE21 GLN A 54 -8.097 -2.183 -5.930 1.00 1.45 H new ATOM 0 HE22 GLN A 54 -9.289 -3.323 -5.296 1.00 1.45 H new ATOM 837 N PRO A 55 -8.689 2.143 -4.472 1.00 1.42 N ATOM 838 CA PRO A 55 -8.119 3.339 -3.874 1.00 1.49 C ATOM 839 C PRO A 55 -8.173 4.546 -4.830 1.00 1.41 C ATOM 840 O PRO A 55 -8.504 5.659 -4.429 1.00 1.49 O ATOM 841 CB PRO A 55 -6.710 2.915 -3.445 1.00 1.66 C ATOM 842 CG PRO A 55 -6.379 1.689 -4.290 1.00 1.61 C ATOM 843 CD PRO A 55 -7.742 1.041 -4.460 1.00 1.57 C ATOM 0 HA PRO A 55 -8.682 3.701 -3.014 1.00 1.49 H new ATOM 0 HB2 PRO A 55 -5.990 3.715 -3.616 1.00 1.66 H new ATOM 0 HB3 PRO A 55 -6.678 2.679 -2.381 1.00 1.66 H new ATOM 0 HG2 PRO A 55 -5.935 1.962 -5.248 1.00 1.61 H new ATOM 0 HG3 PRO A 55 -5.673 1.027 -3.789 1.00 1.61 H new ATOM 0 HD2 PRO A 55 -7.793 0.468 -5.386 1.00 1.57 H new ATOM 0 HD3 PRO A 55 -7.953 0.349 -3.645 1.00 1.57 H new ATOM 851 N LEU A 56 -7.931 4.311 -6.120 1.00 1.36 N ATOM 852 CA LEU A 56 -8.067 5.324 -7.170 1.00 1.34 C ATOM 853 C LEU A 56 -9.446 6.000 -7.110 1.00 1.25 C ATOM 854 O LEU A 56 -9.559 7.222 -7.217 1.00 1.17 O ATOM 855 CB LEU A 56 -7.860 4.694 -8.558 1.00 1.48 C ATOM 856 CG LEU A 56 -6.388 4.585 -8.989 1.00 2.16 C ATOM 857 CD1 LEU A 56 -5.580 3.628 -8.107 1.00 3.60 C ATOM 858 CD2 LEU A 56 -6.318 4.105 -10.444 1.00 2.29 C ATOM 0 H LEU A 56 -7.631 3.401 -6.471 1.00 1.36 H new ATOM 0 HA LEU A 56 -7.300 6.080 -7.002 1.00 1.34 H new ATOM 0 HB2 LEU A 56 -8.302 3.698 -8.562 1.00 1.48 H new ATOM 0 HB3 LEU A 56 -8.400 5.286 -9.297 1.00 1.48 H new ATOM 0 HG LEU A 56 -5.948 5.577 -8.883 1.00 2.16 H new ATOM 0 HD11 LEU A 56 -4.549 3.592 -8.459 1.00 3.60 H new ATOM 0 HD12 LEU A 56 -5.599 3.980 -7.076 1.00 3.60 H new ATOM 0 HD13 LEU A 56 -6.016 2.630 -8.158 1.00 3.60 H new ATOM 0 HD21 LEU A 56 -5.275 4.027 -10.752 1.00 2.29 H new ATOM 0 HD22 LEU A 56 -6.795 3.129 -10.528 1.00 2.29 H new ATOM 0 HD23 LEU A 56 -6.834 4.818 -11.087 1.00 2.29 H new ATOM 870 N GLU A 57 -10.500 5.203 -6.926 1.00 1.29 N ATOM 871 CA GLU A 57 -11.871 5.690 -6.929 1.00 1.20 C ATOM 872 C GLU A 57 -12.067 6.646 -5.748 1.00 1.10 C ATOM 873 O GLU A 57 -12.684 7.706 -5.872 1.00 1.03 O ATOM 874 CB GLU A 57 -12.844 4.504 -6.873 1.00 1.34 C ATOM 875 CG GLU A 57 -12.422 3.311 -7.758 1.00 1.22 C ATOM 876 CD GLU A 57 -13.546 2.848 -8.670 1.00 2.01 C ATOM 877 OE1 GLU A 57 -13.827 3.588 -9.637 1.00 2.43 O ATOM 878 OE2 GLU A 57 -14.089 1.759 -8.390 1.00 3.35 O ATOM 0 H GLU A 57 -10.421 4.198 -6.770 1.00 1.29 H new ATOM 0 HA GLU A 57 -12.076 6.239 -7.848 1.00 1.20 H new ATOM 0 HB2 GLU A 57 -12.931 4.166 -5.840 1.00 1.34 H new ATOM 0 HB3 GLU A 57 -13.833 4.842 -7.182 1.00 1.34 H new ATOM 0 HG2 GLU A 57 -11.560 3.595 -8.362 1.00 1.22 H new ATOM 0 HG3 GLU A 57 -12.107 2.483 -7.123 1.00 1.22 H new ATOM 885 N ILE A 58 -11.466 6.291 -4.607 1.00 1.12 N ATOM 886 CA ILE A 58 -11.405 7.146 -3.436 1.00 1.05 C ATOM 887 C ILE A 58 -10.800 8.474 -3.870 1.00 0.99 C ATOM 888 O ILE A 58 -11.383 9.529 -3.630 1.00 0.91 O ATOM 889 CB ILE A 58 -10.611 6.441 -2.307 1.00 1.14 C ATOM 890 CG1 ILE A 58 -11.499 6.248 -1.069 1.00 1.27 C ATOM 891 CG2 ILE A 58 -9.335 7.187 -1.839 1.00 1.08 C ATOM 892 CD1 ILE A 58 -10.968 5.097 -0.208 1.00 1.32 C ATOM 0 H ILE A 58 -11.006 5.390 -4.478 1.00 1.12 H new ATOM 0 HA ILE A 58 -12.394 7.342 -3.022 1.00 1.05 H new ATOM 0 HB ILE A 58 -10.299 5.495 -2.750 1.00 1.14 H new ATOM 0 HG12 ILE A 58 -11.524 7.167 -0.484 1.00 1.27 H new ATOM 0 HG13 ILE A 58 -12.523 6.038 -1.377 1.00 1.27 H new ATOM 0 HG21 ILE A 58 -8.849 6.616 -1.048 1.00 1.08 H new ATOM 0 HG22 ILE A 58 -8.650 7.298 -2.679 1.00 1.08 H new ATOM 0 HG23 ILE A 58 -9.608 8.172 -1.460 1.00 1.08 H new ATOM 0 HD11 ILE A 58 -11.607 4.972 0.666 1.00 1.32 H new ATOM 0 HD12 ILE A 58 -10.967 4.176 -0.792 1.00 1.32 H new ATOM 0 HD13 ILE A 58 -9.952 5.323 0.115 1.00 1.32 H new ATOM 904 N ALA A 59 -9.642 8.409 -4.531 1.00 1.08 N ATOM 905 CA ALA A 59 -8.887 9.594 -4.884 1.00 1.09 C ATOM 906 C ALA A 59 -9.741 10.531 -5.737 1.00 1.05 C ATOM 907 O ALA A 59 -9.825 11.728 -5.465 1.00 1.06 O ATOM 908 CB ALA A 59 -7.564 9.207 -5.553 1.00 1.24 C ATOM 0 H ALA A 59 -9.211 7.535 -4.831 1.00 1.08 H new ATOM 0 HA ALA A 59 -8.626 10.144 -3.980 1.00 1.09 H new ATOM 0 HB1 ALA A 59 -7.010 10.109 -5.812 1.00 1.24 H new ATOM 0 HB2 ALA A 59 -6.972 8.602 -4.866 1.00 1.24 H new ATOM 0 HB3 ALA A 59 -7.768 8.634 -6.458 1.00 1.24 H new ATOM 914 N GLN A 60 -10.430 9.961 -6.729 1.00 1.06 N ATOM 915 CA GLN A 60 -11.408 10.680 -7.532 1.00 1.09 C ATOM 916 C GLN A 60 -12.449 11.362 -6.644 1.00 0.96 C ATOM 917 O GLN A 60 -12.756 12.531 -6.855 1.00 0.97 O ATOM 918 CB GLN A 60 -12.078 9.737 -8.540 1.00 1.19 C ATOM 919 CG GLN A 60 -11.407 9.765 -9.919 1.00 1.52 C ATOM 920 CD GLN A 60 -9.979 9.226 -9.910 1.00 2.07 C ATOM 921 OE1 GLN A 60 -9.746 8.071 -10.250 1.00 3.31 O ATOM 922 NE2 GLN A 60 -8.999 10.058 -9.570 1.00 1.99 N ATOM 0 H GLN A 60 -10.321 8.982 -6.995 1.00 1.06 H new ATOM 0 HA GLN A 60 -10.885 11.457 -8.090 1.00 1.09 H new ATOM 0 HB2 GLN A 60 -12.054 8.719 -8.150 1.00 1.19 H new ATOM 0 HB3 GLN A 60 -13.127 10.013 -8.646 1.00 1.19 H new ATOM 0 HG2 GLN A 60 -12.004 9.179 -10.617 1.00 1.52 H new ATOM 0 HG3 GLN A 60 -11.398 10.790 -10.290 1.00 1.52 H new ATOM 0 HE21 GLN A 60 -9.216 11.015 -9.290 1.00 1.99 H new ATOM 0 HE22 GLN A 60 -8.030 9.740 -9.589 1.00 1.99 H new ATOM 931 N PHE A 61 -12.985 10.655 -5.647 1.00 0.89 N ATOM 932 CA PHE A 61 -13.983 11.225 -4.750 1.00 0.81 C ATOM 933 C PHE A 61 -13.402 12.451 -4.036 1.00 0.80 C ATOM 934 O PHE A 61 -14.017 13.517 -3.989 1.00 0.84 O ATOM 935 CB PHE A 61 -14.480 10.145 -3.772 1.00 0.78 C ATOM 936 CG PHE A 61 -15.915 10.309 -3.300 1.00 1.02 C ATOM 937 CD1 PHE A 61 -16.954 10.306 -4.249 1.00 1.97 C ATOM 938 CD2 PHE A 61 -16.229 10.245 -1.928 1.00 2.22 C ATOM 939 CE1 PHE A 61 -18.295 10.281 -3.835 1.00 2.18 C ATOM 940 CE2 PHE A 61 -17.572 10.166 -1.517 1.00 2.52 C ATOM 941 CZ PHE A 61 -18.606 10.203 -2.468 1.00 1.84 C ATOM 0 H PHE A 61 -12.742 9.686 -5.443 1.00 0.89 H new ATOM 0 HA PHE A 61 -14.848 11.567 -5.318 1.00 0.81 H new ATOM 0 HB2 PHE A 61 -14.381 9.171 -4.251 1.00 0.78 H new ATOM 0 HB3 PHE A 61 -13.826 10.139 -2.900 1.00 0.78 H new ATOM 0 HD1 PHE A 61 -16.718 10.323 -5.303 1.00 1.97 H new ATOM 0 HD2 PHE A 61 -15.439 10.257 -1.192 1.00 2.22 H new ATOM 0 HE1 PHE A 61 -19.087 10.322 -4.568 1.00 2.18 H new ATOM 0 HE2 PHE A 61 -17.809 10.077 -0.467 1.00 2.52 H new ATOM 0 HZ PHE A 61 -19.637 10.172 -2.148 1.00 1.84 H new ATOM 951 N ILE A 62 -12.182 12.316 -3.510 1.00 0.78 N ATOM 952 CA ILE A 62 -11.490 13.426 -2.859 1.00 0.77 C ATOM 953 C ILE A 62 -11.312 14.608 -3.827 1.00 0.85 C ATOM 954 O ILE A 62 -11.541 15.760 -3.455 1.00 0.89 O ATOM 955 CB ILE A 62 -10.143 12.965 -2.270 1.00 0.70 C ATOM 956 CG1 ILE A 62 -10.221 11.672 -1.444 1.00 1.41 C ATOM 957 CG2 ILE A 62 -9.548 14.068 -1.390 1.00 1.24 C ATOM 958 CD1 ILE A 62 -11.462 11.549 -0.568 1.00 2.76 C ATOM 0 H ILE A 62 -11.653 11.444 -3.524 1.00 0.78 H new ATOM 0 HA ILE A 62 -12.108 13.773 -2.031 1.00 0.77 H new ATOM 0 HB ILE A 62 -9.510 12.755 -3.132 1.00 0.70 H new ATOM 0 HG12 ILE A 62 -10.187 10.820 -2.124 1.00 1.41 H new ATOM 0 HG13 ILE A 62 -9.337 11.609 -0.809 1.00 1.41 H new ATOM 0 HG21 ILE A 62 -8.596 13.732 -0.979 1.00 1.24 H new ATOM 0 HG22 ILE A 62 -9.388 14.965 -1.989 1.00 1.24 H new ATOM 0 HG23 ILE A 62 -10.236 14.294 -0.575 1.00 1.24 H new ATOM 0 HD11 ILE A 62 -11.430 10.606 -0.023 1.00 2.76 H new ATOM 0 HD12 ILE A 62 -11.491 12.377 0.140 1.00 2.76 H new ATOM 0 HD13 ILE A 62 -12.354 11.576 -1.194 1.00 2.76 H new ATOM 970 N GLN A 63 -10.908 14.326 -5.067 1.00 0.91 N ATOM 971 CA GLN A 63 -10.728 15.339 -6.102 1.00 0.99 C ATOM 972 C GLN A 63 -12.050 16.023 -6.453 1.00 1.02 C ATOM 973 O GLN A 63 -12.074 17.236 -6.639 1.00 1.07 O ATOM 974 CB GLN A 63 -10.059 14.705 -7.326 1.00 1.07 C ATOM 975 CG GLN A 63 -8.581 14.418 -7.015 1.00 1.37 C ATOM 976 CD GLN A 63 -8.098 13.081 -7.570 1.00 1.62 C ATOM 977 OE1 GLN A 63 -8.520 12.639 -8.637 1.00 3.22 O ATOM 978 NE2 GLN A 63 -7.214 12.410 -6.834 1.00 1.55 N ATOM 0 H GLN A 63 -10.695 13.379 -5.381 1.00 0.91 H new ATOM 0 HA GLN A 63 -10.073 16.124 -5.723 1.00 0.99 H new ATOM 0 HB2 GLN A 63 -10.571 13.781 -7.595 1.00 1.07 H new ATOM 0 HB3 GLN A 63 -10.138 15.374 -8.183 1.00 1.07 H new ATOM 0 HG2 GLN A 63 -7.967 15.218 -7.428 1.00 1.37 H new ATOM 0 HG3 GLN A 63 -8.435 14.430 -5.935 1.00 1.37 H new ATOM 0 HE21 GLN A 63 -6.882 12.802 -5.953 1.00 1.55 H new ATOM 0 HE22 GLN A 63 -6.869 11.504 -7.151 1.00 1.55 H new ATOM 987 N ASP A 64 -13.148 15.267 -6.519 1.00 1.02 N ATOM 988 CA ASP A 64 -14.475 15.816 -6.760 1.00 1.09 C ATOM 989 C ASP A 64 -14.859 16.760 -5.616 1.00 1.08 C ATOM 990 O ASP A 64 -15.283 17.891 -5.847 1.00 1.19 O ATOM 991 CB ASP A 64 -15.475 14.670 -6.931 1.00 1.09 C ATOM 992 CG ASP A 64 -16.863 15.207 -7.254 1.00 1.29 C ATOM 993 OD1 ASP A 64 -17.008 15.764 -8.363 1.00 2.12 O ATOM 994 OD2 ASP A 64 -17.751 15.042 -6.391 1.00 1.94 O ATOM 0 H ASP A 64 -13.137 14.253 -6.406 1.00 1.02 H new ATOM 0 HA ASP A 64 -14.483 16.401 -7.679 1.00 1.09 H new ATOM 0 HB2 ASP A 64 -15.142 14.007 -7.729 1.00 1.09 H new ATOM 0 HB3 ASP A 64 -15.513 14.076 -6.018 1.00 1.09 H new ATOM 999 N LEU A 65 -14.644 16.316 -4.373 1.00 0.98 N ATOM 1000 CA LEU A 65 -14.802 17.167 -3.196 1.00 0.99 C ATOM 1001 C LEU A 65 -13.895 18.405 -3.263 1.00 1.00 C ATOM 1002 O LEU A 65 -14.304 19.484 -2.838 1.00 1.08 O ATOM 1003 CB LEU A 65 -14.585 16.349 -1.913 1.00 0.94 C ATOM 1004 CG LEU A 65 -15.866 15.575 -1.551 1.00 1.30 C ATOM 1005 CD1 LEU A 65 -15.570 14.271 -0.806 1.00 1.90 C ATOM 1006 CD2 LEU A 65 -16.776 16.448 -0.675 1.00 1.72 C ATOM 0 H LEU A 65 -14.357 15.361 -4.158 1.00 0.98 H new ATOM 0 HA LEU A 65 -15.825 17.543 -3.178 1.00 0.99 H new ATOM 0 HB2 LEU A 65 -13.758 15.653 -2.053 1.00 0.94 H new ATOM 0 HB3 LEU A 65 -14.308 17.012 -1.093 1.00 0.94 H new ATOM 0 HG LEU A 65 -16.360 15.325 -2.490 1.00 1.30 H new ATOM 0 HD11 LEU A 65 -16.507 13.764 -0.574 1.00 1.90 H new ATOM 0 HD12 LEU A 65 -14.953 13.626 -1.432 1.00 1.90 H new ATOM 0 HD13 LEU A 65 -15.039 14.493 0.120 1.00 1.90 H new ATOM 0 HD21 LEU A 65 -17.680 15.893 -0.423 1.00 1.72 H new ATOM 0 HD22 LEU A 65 -16.249 16.718 0.240 1.00 1.72 H new ATOM 0 HD23 LEU A 65 -17.046 17.353 -1.219 1.00 1.72 H new ATOM 1018 N GLY A 66 -12.679 18.259 -3.798 1.00 0.96 N ATOM 1019 CA GLY A 66 -11.805 19.369 -4.169 1.00 0.98 C ATOM 1020 C GLY A 66 -10.489 19.357 -3.399 1.00 0.88 C ATOM 1021 O GLY A 66 -9.865 20.404 -3.234 1.00 0.93 O ATOM 0 H GLY A 66 -12.269 17.345 -3.988 1.00 0.96 H new ATOM 0 HA2 GLY A 66 -11.597 19.322 -5.238 1.00 0.98 H new ATOM 0 HA3 GLY A 66 -12.321 20.311 -3.985 1.00 0.98 H new ATOM 1025 N PHE A 67 -10.064 18.185 -2.917 1.00 0.82 N ATOM 1026 CA PHE A 67 -8.809 17.974 -2.211 1.00 0.73 C ATOM 1027 C PHE A 67 -7.914 17.055 -3.044 1.00 0.71 C ATOM 1028 O PHE A 67 -8.415 16.296 -3.871 1.00 0.79 O ATOM 1029 CB PHE A 67 -9.130 17.310 -0.865 1.00 0.68 C ATOM 1030 CG PHE A 67 -9.273 18.212 0.339 1.00 0.74 C ATOM 1031 CD1 PHE A 67 -9.631 19.564 0.206 1.00 1.95 C ATOM 1032 CD2 PHE A 67 -9.120 17.656 1.619 1.00 2.16 C ATOM 1033 CE1 PHE A 67 -9.698 20.380 1.342 1.00 2.10 C ATOM 1034 CE2 PHE A 67 -9.141 18.481 2.754 1.00 2.35 C ATOM 1035 CZ PHE A 67 -9.384 19.855 2.607 1.00 1.45 C ATOM 0 H PHE A 67 -10.610 17.329 -3.015 1.00 0.82 H new ATOM 0 HA PHE A 67 -8.291 18.919 -2.048 1.00 0.73 H new ATOM 0 HB2 PHE A 67 -10.058 16.750 -0.979 1.00 0.68 H new ATOM 0 HB3 PHE A 67 -8.345 16.585 -0.651 1.00 0.68 H new ATOM 0 HD1 PHE A 67 -9.854 19.972 -0.769 1.00 1.95 H new ATOM 0 HD2 PHE A 67 -8.986 16.590 1.731 1.00 2.16 H new ATOM 0 HE1 PHE A 67 -9.992 21.415 1.246 1.00 2.10 H new ATOM 0 HE2 PHE A 67 -8.971 18.061 3.734 1.00 2.35 H new ATOM 0 HZ PHE A 67 -9.330 20.508 3.465 1.00 1.45 H new ATOM 1045 N GLU A 68 -6.606 17.056 -2.770 1.00 0.67 N ATOM 1046 CA GLU A 68 -5.679 16.145 -3.421 1.00 0.71 C ATOM 1047 C GLU A 68 -5.437 14.959 -2.489 1.00 0.66 C ATOM 1048 O GLU A 68 -4.944 15.116 -1.370 1.00 0.69 O ATOM 1049 CB GLU A 68 -4.371 16.867 -3.753 1.00 0.79 C ATOM 1050 CG GLU A 68 -4.545 17.906 -4.867 1.00 1.02 C ATOM 1051 CD GLU A 68 -4.702 17.227 -6.221 1.00 2.51 C ATOM 1052 OE1 GLU A 68 -3.707 16.604 -6.648 1.00 3.14 O ATOM 1053 OE2 GLU A 68 -5.814 17.311 -6.782 1.00 4.04 O ATOM 0 H GLU A 68 -6.170 17.685 -2.096 1.00 0.67 H new ATOM 0 HA GLU A 68 -6.098 15.785 -4.361 1.00 0.71 H new ATOM 0 HB2 GLU A 68 -3.993 17.359 -2.857 1.00 0.79 H new ATOM 0 HB3 GLU A 68 -3.622 16.135 -4.056 1.00 0.79 H new ATOM 0 HG2 GLU A 68 -5.420 18.523 -4.661 1.00 1.02 H new ATOM 0 HG3 GLU A 68 -3.682 18.572 -4.887 1.00 1.02 H new ATOM 1060 N ALA A 69 -5.788 13.766 -2.967 1.00 0.75 N ATOM 1061 CA ALA A 69 -5.571 12.499 -2.291 1.00 0.85 C ATOM 1062 C ALA A 69 -4.316 11.870 -2.868 1.00 0.80 C ATOM 1063 O ALA A 69 -4.381 11.129 -3.847 1.00 0.88 O ATOM 1064 CB ALA A 69 -6.767 11.588 -2.553 1.00 1.15 C ATOM 0 H ALA A 69 -6.249 13.657 -3.871 1.00 0.75 H new ATOM 0 HA ALA A 69 -5.459 12.646 -1.217 1.00 0.85 H new ATOM 0 HB1 ALA A 69 -6.614 10.633 -2.050 1.00 1.15 H new ATOM 0 HB2 ALA A 69 -7.673 12.059 -2.172 1.00 1.15 H new ATOM 0 HB3 ALA A 69 -6.869 11.421 -3.625 1.00 1.15 H new ATOM 1070 N ALA A 70 -3.173 12.160 -2.253 1.00 0.94 N ATOM 1071 CA ALA A 70 -1.913 11.585 -2.668 1.00 1.04 C ATOM 1072 C ALA A 70 -1.637 10.421 -1.730 1.00 1.06 C ATOM 1073 O ALA A 70 -1.190 10.593 -0.594 1.00 0.91 O ATOM 1074 CB ALA A 70 -0.838 12.672 -2.683 1.00 1.07 C ATOM 0 H ALA A 70 -3.102 12.797 -1.459 1.00 0.94 H new ATOM 0 HA ALA A 70 -1.928 11.195 -3.686 1.00 1.04 H new ATOM 0 HB1 ALA A 70 0.112 12.240 -2.996 1.00 1.07 H new ATOM 0 HB2 ALA A 70 -1.126 13.459 -3.380 1.00 1.07 H new ATOM 0 HB3 ALA A 70 -0.733 13.094 -1.683 1.00 1.07 H new ATOM 1080 N VAL A 71 -1.987 9.232 -2.218 1.00 1.53 N ATOM 1081 CA VAL A 71 -1.641 7.964 -1.619 1.00 1.72 C ATOM 1082 C VAL A 71 -0.129 7.806 -1.566 1.00 1.98 C ATOM 1083 O VAL A 71 0.586 8.413 -2.359 1.00 2.14 O ATOM 1084 CB VAL A 71 -2.335 6.795 -2.341 1.00 2.29 C ATOM 1085 CG1 VAL A 71 -2.706 5.688 -1.356 1.00 2.85 C ATOM 1086 CG2 VAL A 71 -3.630 7.200 -3.055 1.00 4.00 C ATOM 0 H VAL A 71 -2.538 9.132 -3.071 1.00 1.53 H new ATOM 0 HA VAL A 71 -2.008 7.946 -0.593 1.00 1.72 H new ATOM 0 HB VAL A 71 -1.609 6.454 -3.080 1.00 2.29 H new ATOM 0 HG11 VAL A 71 -3.195 4.874 -1.891 1.00 2.85 H new ATOM 0 HG12 VAL A 71 -1.804 5.314 -0.872 1.00 2.85 H new ATOM 0 HG13 VAL A 71 -3.385 6.085 -0.601 1.00 2.85 H new ATOM 0 HG21 VAL A 71 -4.065 6.327 -3.542 1.00 4.00 H new ATOM 0 HG22 VAL A 71 -4.337 7.600 -2.328 1.00 4.00 H new ATOM 0 HG23 VAL A 71 -3.410 7.961 -3.804 1.00 4.00 H new ATOM 1096 N MET A 72 0.354 6.980 -0.635 1.00 2.23 N ATOM 1097 CA MET A 72 1.750 6.579 -0.657 1.00 2.97 C ATOM 1098 C MET A 72 2.047 5.925 -2.005 1.00 3.70 C ATOM 1099 O MET A 72 3.004 6.309 -2.671 1.00 4.34 O ATOM 1100 CB MET A 72 2.044 5.631 0.507 1.00 3.33 C ATOM 1101 CG MET A 72 2.011 6.363 1.858 1.00 2.84 C ATOM 1102 SD MET A 72 3.523 6.279 2.854 1.00 3.66 S ATOM 1103 CE MET A 72 4.618 7.334 1.879 1.00 4.89 C ATOM 0 H MET A 72 -0.195 6.585 0.128 1.00 2.23 H new ATOM 0 HA MET A 72 2.397 7.448 -0.537 1.00 2.97 H new ATOM 0 HB2 MET A 72 1.312 4.823 0.513 1.00 3.33 H new ATOM 0 HB3 MET A 72 3.023 5.173 0.365 1.00 3.33 H new ATOM 0 HG2 MET A 72 1.781 7.412 1.673 1.00 2.84 H new ATOM 0 HG3 MET A 72 1.190 5.956 2.448 1.00 2.84 H new ATOM 0 HE1 MET A 72 5.595 7.387 2.359 1.00 4.89 H new ATOM 0 HE2 MET A 72 4.728 6.917 0.878 1.00 4.89 H new ATOM 0 HE3 MET A 72 4.193 8.335 1.811 1.00 4.89 H new ATOM 1201 N GLY A 80 -2.792 -9.599 -0.509 1.00 1.60 N ATOM 1202 CA GLY A 80 -1.510 -10.013 -0.985 1.00 2.22 C ATOM 1203 C GLY A 80 -0.731 -8.811 -1.481 1.00 1.81 C ATOM 1204 O GLY A 80 0.386 -9.007 -1.936 1.00 2.11 O ATOM 0 HA2 GLY A 80 -0.959 -10.510 -0.187 1.00 2.22 H new ATOM 0 HA3 GLY A 80 -1.628 -10.738 -1.790 1.00 2.22 H new ATOM 1208 N ASN A 81 -1.256 -7.583 -1.351 1.00 1.38 N ATOM 1209 CA ASN A 81 -0.553 -6.384 -1.801 1.00 1.21 C ATOM 1210 C ASN A 81 0.159 -5.787 -0.600 1.00 1.35 C ATOM 1211 O ASN A 81 -0.197 -4.712 -0.118 1.00 1.88 O ATOM 1212 CB ASN A 81 -1.524 -5.382 -2.438 1.00 1.23 C ATOM 1213 CG ASN A 81 -0.828 -4.233 -3.167 1.00 1.70 C ATOM 1214 OD1 ASN A 81 -1.189 -3.891 -4.288 1.00 2.59 O ATOM 1215 ND2 ASN A 81 0.211 -3.647 -2.590 1.00 1.86 N ATOM 0 H ASN A 81 -2.169 -7.400 -0.935 1.00 1.38 H new ATOM 0 HA ASN A 81 0.175 -6.638 -2.572 1.00 1.21 H new ATOM 0 HB2 ASN A 81 -2.168 -5.910 -3.141 1.00 1.23 H new ATOM 0 HB3 ASN A 81 -2.169 -4.971 -1.662 1.00 1.23 H new ATOM 0 HD21 ASN A 81 0.715 -2.907 -3.078 1.00 1.86 H new ATOM 0 HD22 ASN A 81 0.506 -3.936 -1.657 1.00 1.86 H new ATOM 1222 N ILE A 82 1.198 -6.470 -0.134 1.00 1.10 N ATOM 1223 CA ILE A 82 1.941 -6.034 1.034 1.00 1.15 C ATOM 1224 C ILE A 82 3.305 -5.523 0.578 1.00 1.04 C ATOM 1225 O ILE A 82 3.737 -5.807 -0.543 1.00 0.98 O ATOM 1226 CB ILE A 82 2.020 -7.138 2.113 1.00 1.28 C ATOM 1227 CG1 ILE A 82 1.060 -8.332 1.928 1.00 1.81 C ATOM 1228 CG2 ILE A 82 1.752 -6.492 3.479 1.00 2.03 C ATOM 1229 CD1 ILE A 82 -0.418 -8.025 2.196 1.00 2.87 C ATOM 0 H ILE A 82 1.544 -7.333 -0.553 1.00 1.10 H new ATOM 0 HA ILE A 82 1.418 -5.213 1.524 1.00 1.15 H new ATOM 0 HB ILE A 82 3.020 -7.564 2.028 1.00 1.28 H new ATOM 0 HG12 ILE A 82 1.159 -8.703 0.908 1.00 1.81 H new ATOM 0 HG13 ILE A 82 1.374 -9.137 2.592 1.00 1.81 H new ATOM 0 HG21 ILE A 82 1.803 -7.253 4.258 1.00 2.03 H new ATOM 0 HG22 ILE A 82 2.502 -5.725 3.672 1.00 2.03 H new ATOM 0 HG23 ILE A 82 0.761 -6.038 3.479 1.00 2.03 H new ATOM 0 HD11 ILE A 82 -1.011 -8.926 2.040 1.00 2.87 H new ATOM 0 HD12 ILE A 82 -0.538 -7.685 3.225 1.00 2.87 H new ATOM 0 HD13 ILE A 82 -0.757 -7.245 1.514 1.00 2.87 H new ATOM 1241 N GLU A 83 3.970 -4.738 1.429 1.00 1.10 N ATOM 1242 CA GLU A 83 5.289 -4.226 1.172 1.00 1.05 C ATOM 1243 C GLU A 83 6.243 -4.708 2.253 1.00 1.05 C ATOM 1244 O GLU A 83 5.839 -4.927 3.397 1.00 1.18 O ATOM 1245 CB GLU A 83 5.254 -2.706 1.023 1.00 1.24 C ATOM 1246 CG GLU A 83 4.931 -1.911 2.291 1.00 1.49 C ATOM 1247 CD GLU A 83 6.157 -1.368 3.018 1.00 2.02 C ATOM 1248 OE1 GLU A 83 7.227 -2.012 2.991 1.00 2.87 O ATOM 1249 OE2 GLU A 83 6.044 -0.253 3.573 1.00 2.74 O ATOM 0 H GLU A 83 3.587 -4.444 2.328 1.00 1.10 H new ATOM 0 HA GLU A 83 5.663 -4.611 0.224 1.00 1.05 H new ATOM 0 HB2 GLU A 83 6.223 -2.376 0.649 1.00 1.24 H new ATOM 0 HB3 GLU A 83 4.516 -2.453 0.262 1.00 1.24 H new ATOM 0 HG2 GLU A 83 4.280 -1.077 2.028 1.00 1.49 H new ATOM 0 HG3 GLU A 83 4.371 -2.550 2.974 1.00 1.49 H new ATOM 1256 N LEU A 84 7.496 -4.903 1.860 1.00 0.95 N ATOM 1257 CA LEU A 84 8.602 -5.205 2.741 1.00 0.97 C ATOM 1258 C LEU A 84 9.751 -4.278 2.405 1.00 0.93 C ATOM 1259 O LEU A 84 9.932 -3.907 1.250 1.00 0.92 O ATOM 1260 CB LEU A 84 9.003 -6.693 2.684 1.00 0.98 C ATOM 1261 CG LEU A 84 8.839 -7.365 1.301 1.00 1.81 C ATOM 1262 CD1 LEU A 84 10.115 -8.051 0.804 1.00 2.68 C ATOM 1263 CD2 LEU A 84 7.707 -8.393 1.367 1.00 2.33 C ATOM 0 H LEU A 84 7.773 -4.852 0.880 1.00 0.95 H new ATOM 0 HA LEU A 84 8.300 -5.034 3.774 1.00 0.97 H new ATOM 0 HB2 LEU A 84 10.044 -6.785 2.994 1.00 0.98 H new ATOM 0 HB3 LEU A 84 8.405 -7.242 3.411 1.00 0.98 H new ATOM 0 HG LEU A 84 8.608 -6.571 0.591 1.00 1.81 H new ATOM 0 HD11 LEU A 84 9.930 -8.502 -0.171 1.00 2.68 H new ATOM 0 HD12 LEU A 84 10.914 -7.315 0.718 1.00 2.68 H new ATOM 0 HD13 LEU A 84 10.411 -8.826 1.511 1.00 2.68 H new ATOM 0 HD21 LEU A 84 7.590 -8.868 0.393 1.00 2.33 H new ATOM 0 HD22 LEU A 84 7.946 -9.150 2.114 1.00 2.33 H new ATOM 0 HD23 LEU A 84 6.778 -7.894 1.642 1.00 2.33 H new ATOM 1275 N THR A 85 10.530 -3.919 3.419 1.00 0.96 N ATOM 1276 CA THR A 85 11.747 -3.157 3.252 1.00 0.97 C ATOM 1277 C THR A 85 12.884 -4.174 3.264 1.00 0.90 C ATOM 1278 O THR A 85 12.949 -4.993 4.180 1.00 0.93 O ATOM 1279 CB THR A 85 11.831 -2.085 4.352 1.00 1.13 C ATOM 1280 OG1 THR A 85 10.928 -1.035 4.025 1.00 1.69 O ATOM 1281 CG2 THR A 85 13.240 -1.497 4.488 1.00 1.85 C ATOM 0 H THR A 85 10.325 -4.155 4.390 1.00 0.96 H new ATOM 0 HA THR A 85 11.794 -2.602 2.315 1.00 0.97 H new ATOM 0 HB THR A 85 11.576 -2.556 5.301 1.00 1.13 H new ATOM 0 HG1 THR A 85 10.967 -0.342 4.717 1.00 1.69 H new ATOM 0 HG21 THR A 85 13.246 -0.745 5.277 1.00 1.85 H new ATOM 0 HG22 THR A 85 13.943 -2.291 4.738 1.00 1.85 H new ATOM 0 HG23 THR A 85 13.534 -1.035 3.545 1.00 1.85 H new ATOM 1289 N ILE A 86 13.740 -4.161 2.234 1.00 0.84 N ATOM 1290 CA ILE A 86 14.861 -5.093 2.148 1.00 0.82 C ATOM 1291 C ILE A 86 16.125 -4.402 2.641 1.00 0.85 C ATOM 1292 O ILE A 86 16.397 -3.260 2.277 1.00 0.98 O ATOM 1293 CB ILE A 86 15.073 -5.750 0.761 1.00 0.87 C ATOM 1294 CG1 ILE A 86 14.260 -5.157 -0.394 1.00 0.92 C ATOM 1295 CG2 ILE A 86 14.770 -7.253 0.854 1.00 1.38 C ATOM 1296 CD1 ILE A 86 14.875 -3.853 -0.901 1.00 1.47 C ATOM 0 H ILE A 86 13.673 -3.512 1.450 1.00 0.84 H new ATOM 0 HA ILE A 86 14.610 -5.934 2.794 1.00 0.82 H new ATOM 0 HB ILE A 86 16.116 -5.548 0.518 1.00 0.87 H new ATOM 0 HG12 ILE A 86 14.207 -5.877 -1.211 1.00 0.92 H new ATOM 0 HG13 ILE A 86 13.237 -4.974 -0.064 1.00 0.92 H new ATOM 0 HG21 ILE A 86 14.919 -7.715 -0.122 1.00 1.38 H new ATOM 0 HG22 ILE A 86 15.439 -7.715 1.580 1.00 1.38 H new ATOM 0 HG23 ILE A 86 13.737 -7.397 1.170 1.00 1.38 H new ATOM 0 HD11 ILE A 86 14.272 -3.461 -1.720 1.00 1.47 H new ATOM 0 HD12 ILE A 86 14.904 -3.125 -0.090 1.00 1.47 H new ATOM 0 HD13 ILE A 86 15.889 -4.042 -1.255 1.00 1.47 H new ATOM 1308 N THR A 87 16.887 -5.109 3.474 1.00 0.84 N ATOM 1309 CA THR A 87 18.194 -4.700 3.959 1.00 0.91 C ATOM 1310 C THR A 87 19.170 -5.835 3.636 1.00 0.85 C ATOM 1311 O THR A 87 18.797 -7.008 3.726 1.00 0.89 O ATOM 1312 CB THR A 87 18.099 -4.396 5.462 1.00 1.06 C ATOM 1313 OG1 THR A 87 17.097 -3.424 5.677 1.00 1.78 O ATOM 1314 CG2 THR A 87 19.409 -3.848 6.036 1.00 1.67 C ATOM 0 H THR A 87 16.596 -6.015 3.840 1.00 0.84 H new ATOM 0 HA THR A 87 18.552 -3.789 3.480 1.00 0.91 H new ATOM 0 HB THR A 87 17.869 -5.337 5.962 1.00 1.06 H new ATOM 0 HG1 THR A 87 17.032 -3.228 6.635 1.00 1.78 H new ATOM 0 HG21 THR A 87 19.285 -3.651 7.101 1.00 1.67 H new ATOM 0 HG22 THR A 87 20.204 -4.580 5.893 1.00 1.67 H new ATOM 0 HG23 THR A 87 19.672 -2.922 5.524 1.00 1.67 H new ATOM 1322 N GLY A 88 20.391 -5.474 3.219 1.00 0.96 N ATOM 1323 CA GLY A 88 21.438 -6.402 2.791 1.00 1.03 C ATOM 1324 C GLY A 88 21.978 -6.052 1.401 1.00 1.11 C ATOM 1325 O GLY A 88 23.092 -6.432 1.052 1.00 1.33 O ATOM 0 H GLY A 88 20.683 -4.498 3.170 1.00 0.96 H new ATOM 0 HA2 GLY A 88 22.255 -6.386 3.513 1.00 1.03 H new ATOM 0 HA3 GLY A 88 21.042 -7.417 2.781 1.00 1.03 H new ATOM 1329 N MET A 89 21.186 -5.329 0.603 1.00 1.19 N ATOM 1330 CA MET A 89 21.534 -4.942 -0.758 1.00 1.41 C ATOM 1331 C MET A 89 22.901 -4.264 -0.884 1.00 1.95 C ATOM 1332 O MET A 89 23.260 -3.420 -0.067 1.00 2.56 O ATOM 1333 CB MET A 89 20.427 -4.039 -1.315 1.00 1.99 C ATOM 1334 CG MET A 89 20.230 -2.767 -0.468 1.00 3.42 C ATOM 1335 SD MET A 89 18.514 -2.452 0.004 1.00 3.85 S ATOM 1336 CE MET A 89 17.844 -2.090 -1.624 1.00 2.57 C ATOM 0 H MET A 89 20.269 -4.992 0.895 1.00 1.19 H new ATOM 0 HA MET A 89 21.615 -5.859 -1.342 1.00 1.41 H new ATOM 0 HB2 MET A 89 20.672 -3.757 -2.339 1.00 1.99 H new ATOM 0 HB3 MET A 89 19.491 -4.596 -1.353 1.00 1.99 H new ATOM 0 HG2 MET A 89 20.835 -2.848 0.435 1.00 3.42 H new ATOM 0 HG3 MET A 89 20.605 -1.910 -1.027 1.00 3.42 H new ATOM 0 HE1 MET A 89 16.770 -1.920 -1.546 1.00 2.57 H new ATOM 0 HE2 MET A 89 18.325 -1.198 -2.025 1.00 2.57 H new ATOM 0 HE3 MET A 89 18.030 -2.933 -2.290 1.00 2.57 H new ATOM 1346 N THR A 90 23.636 -4.614 -1.945 1.00 1.90 N ATOM 1347 CA THR A 90 24.919 -3.997 -2.273 1.00 2.58 C ATOM 1348 C THR A 90 25.152 -3.929 -3.796 1.00 2.38 C ATOM 1349 O THR A 90 26.251 -3.622 -4.252 1.00 2.50 O ATOM 1350 CB THR A 90 26.029 -4.727 -1.491 1.00 3.13 C ATOM 1351 OG1 THR A 90 27.227 -3.978 -1.482 1.00 3.98 O ATOM 1352 CG2 THR A 90 26.308 -6.135 -2.030 1.00 3.91 C ATOM 0 H THR A 90 23.352 -5.339 -2.603 1.00 1.90 H new ATOM 0 HA THR A 90 24.928 -2.953 -1.960 1.00 2.58 H new ATOM 0 HB THR A 90 25.658 -4.829 -0.471 1.00 3.13 H new ATOM 0 HG1 THR A 90 27.330 -3.516 -2.340 1.00 3.98 H new ATOM 0 HG21 THR A 90 27.098 -6.600 -1.441 1.00 3.91 H new ATOM 0 HG22 THR A 90 25.402 -6.737 -1.961 1.00 3.91 H new ATOM 0 HG23 THR A 90 26.623 -6.070 -3.072 1.00 3.91 H new ATOM 1360 N CYS A 91 24.127 -4.204 -4.618 1.00 2.16 N ATOM 1361 CA CYS A 91 24.253 -4.134 -6.071 1.00 2.04 C ATOM 1362 C CYS A 91 22.895 -4.354 -6.725 1.00 1.70 C ATOM 1363 O CYS A 91 22.107 -5.165 -6.237 1.00 1.67 O ATOM 1364 CB CYS A 91 25.253 -5.184 -6.591 1.00 2.33 C ATOM 1365 SG CYS A 91 26.651 -4.336 -7.357 1.00 3.48 S ATOM 0 H CYS A 91 23.200 -4.478 -4.293 1.00 2.16 H new ATOM 0 HA CYS A 91 24.626 -3.143 -6.330 1.00 2.04 H new ATOM 0 HB2 CYS A 91 25.598 -5.814 -5.771 1.00 2.33 H new ATOM 0 HB3 CYS A 91 24.768 -5.840 -7.314 1.00 2.33 H new ATOM 0 HG CYS A 91 27.503 -5.214 -7.797 1.00 3.48 H new ATOM 1371 N ALA A 92 22.625 -3.673 -7.843 1.00 1.71 N ATOM 1372 CA ALA A 92 21.362 -3.787 -8.570 1.00 1.95 C ATOM 1373 C ALA A 92 21.068 -5.236 -8.976 1.00 1.53 C ATOM 1374 O ALA A 92 19.914 -5.661 -8.956 1.00 1.71 O ATOM 1375 CB ALA A 92 21.372 -2.861 -9.788 1.00 2.57 C ATOM 0 H ALA A 92 23.284 -3.022 -8.270 1.00 1.71 H new ATOM 0 HA ALA A 92 20.558 -3.477 -7.903 1.00 1.95 H new ATOM 0 HB1 ALA A 92 20.427 -2.953 -10.323 1.00 2.57 H new ATOM 0 HB2 ALA A 92 21.504 -1.830 -9.460 1.00 2.57 H new ATOM 0 HB3 ALA A 92 22.192 -3.139 -10.450 1.00 2.57 H new ATOM 1381 N SER A 93 22.116 -6.010 -9.289 1.00 1.30 N ATOM 1382 CA SER A 93 22.007 -7.456 -9.460 1.00 1.32 C ATOM 1383 C SER A 93 21.143 -8.075 -8.358 1.00 1.17 C ATOM 1384 O SER A 93 20.228 -8.841 -8.654 1.00 1.11 O ATOM 1385 CB SER A 93 23.398 -8.109 -9.480 1.00 1.70 C ATOM 1386 OG SER A 93 23.896 -8.170 -10.801 1.00 2.12 O ATOM 0 H SER A 93 23.059 -5.648 -9.429 1.00 1.30 H new ATOM 0 HA SER A 93 21.524 -7.643 -10.419 1.00 1.32 H new ATOM 0 HB2 SER A 93 24.083 -7.539 -8.853 1.00 1.70 H new ATOM 0 HB3 SER A 93 23.341 -9.113 -9.060 1.00 1.70 H new ATOM 0 HG SER A 93 24.783 -8.587 -10.797 1.00 2.12 H new ATOM 1392 N CYS A 94 21.412 -7.739 -7.090 1.00 1.17 N ATOM 1393 CA CYS A 94 20.677 -8.318 -5.974 1.00 1.09 C ATOM 1394 C CYS A 94 19.193 -7.952 -6.044 1.00 1.06 C ATOM 1395 O CYS A 94 18.342 -8.789 -5.759 1.00 1.09 O ATOM 1396 CB CYS A 94 21.319 -7.972 -4.624 1.00 1.23 C ATOM 1397 SG CYS A 94 20.539 -6.542 -3.833 1.00 2.75 S ATOM 0 H CYS A 94 22.133 -7.070 -6.819 1.00 1.17 H new ATOM 0 HA CYS A 94 20.736 -9.403 -6.059 1.00 1.09 H new ATOM 0 HB2 CYS A 94 21.249 -8.834 -3.960 1.00 1.23 H new ATOM 0 HB3 CYS A 94 22.380 -7.768 -4.771 1.00 1.23 H new ATOM 0 HG CYS A 94 20.862 -5.460 -4.477 1.00 2.75 H new ATOM 1403 N VAL A 95 18.881 -6.729 -6.483 1.00 1.06 N ATOM 1404 CA VAL A 95 17.512 -6.252 -6.609 1.00 1.12 C ATOM 1405 C VAL A 95 16.809 -7.068 -7.689 1.00 1.06 C ATOM 1406 O VAL A 95 15.799 -7.715 -7.424 1.00 1.06 O ATOM 1407 CB VAL A 95 17.503 -4.741 -6.903 1.00 1.29 C ATOM 1408 CG1 VAL A 95 16.079 -4.211 -7.115 1.00 1.63 C ATOM 1409 CG2 VAL A 95 18.163 -3.978 -5.747 1.00 1.94 C ATOM 0 H VAL A 95 19.581 -6.041 -6.762 1.00 1.06 H new ATOM 0 HA VAL A 95 16.967 -6.389 -5.675 1.00 1.12 H new ATOM 0 HB VAL A 95 18.065 -4.583 -7.823 1.00 1.29 H new ATOM 0 HG11 VAL A 95 16.116 -3.141 -7.320 1.00 1.63 H new ATOM 0 HG12 VAL A 95 15.621 -4.727 -7.959 1.00 1.63 H new ATOM 0 HG13 VAL A 95 15.487 -4.388 -6.217 1.00 1.63 H new ATOM 0 HG21 VAL A 95 18.152 -2.910 -5.963 1.00 1.94 H new ATOM 0 HG22 VAL A 95 17.613 -4.167 -4.825 1.00 1.94 H new ATOM 0 HG23 VAL A 95 19.193 -4.314 -5.630 1.00 1.94 H new ATOM 1419 N HIS A 96 17.371 -7.080 -8.900 1.00 1.06 N ATOM 1420 CA HIS A 96 16.772 -7.785 -10.029 1.00 1.07 C ATOM 1421 C HIS A 96 16.638 -9.286 -9.719 1.00 0.98 C ATOM 1422 O HIS A 96 15.667 -9.939 -10.090 1.00 0.98 O ATOM 1423 CB HIS A 96 17.604 -7.505 -11.289 1.00 1.20 C ATOM 1424 CG HIS A 96 16.858 -7.647 -12.595 1.00 1.33 C ATOM 1425 ND1 HIS A 96 17.393 -8.111 -13.776 1.00 2.08 N ATOM 1426 CD2 HIS A 96 15.622 -7.125 -12.885 1.00 2.36 C ATOM 1427 CE1 HIS A 96 16.489 -7.896 -14.747 1.00 2.44 C ATOM 1428 NE2 HIS A 96 15.395 -7.298 -14.254 1.00 2.60 N ATOM 0 H HIS A 96 18.246 -6.605 -9.122 1.00 1.06 H new ATOM 0 HA HIS A 96 15.760 -7.422 -10.210 1.00 1.07 H new ATOM 0 HB2 HIS A 96 18.003 -6.493 -11.225 1.00 1.20 H new ATOM 0 HB3 HIS A 96 18.457 -8.183 -11.300 1.00 1.20 H new ATOM 0 HD2 HIS A 96 14.945 -6.663 -12.181 1.00 2.36 H new ATOM 0 HE1 HIS A 96 16.625 -8.168 -15.783 1.00 2.44 H new ATOM 0 HE2 HIS A 96 14.562 -7.024 -14.775 1.00 2.60 H new ATOM 1436 N ASN A 97 17.617 -9.825 -8.992 1.00 0.97 N ATOM 1437 CA ASN A 97 17.647 -11.191 -8.479 1.00 1.00 C ATOM 1438 C ASN A 97 16.509 -11.436 -7.489 1.00 0.95 C ATOM 1439 O ASN A 97 15.811 -12.443 -7.591 1.00 0.96 O ATOM 1440 CB ASN A 97 19.005 -11.456 -7.821 1.00 1.13 C ATOM 1441 CG ASN A 97 18.994 -12.678 -6.915 1.00 0.96 C ATOM 1442 OD1 ASN A 97 19.163 -13.804 -7.374 1.00 1.66 O ATOM 1443 ND2 ASN A 97 18.794 -12.484 -5.614 1.00 1.26 N ATOM 0 H ASN A 97 18.449 -9.294 -8.734 1.00 0.97 H new ATOM 0 HA ASN A 97 17.508 -11.882 -9.311 1.00 1.00 H new ATOM 0 HB2 ASN A 97 19.759 -11.591 -8.597 1.00 1.13 H new ATOM 0 HB3 ASN A 97 19.299 -10.582 -7.240 1.00 1.13 H new ATOM 0 HD21 ASN A 97 18.779 -13.280 -4.976 1.00 1.26 H new ATOM 0 HD22 ASN A 97 18.656 -11.539 -5.255 1.00 1.26 H new ATOM 1450 N ILE A 98 16.333 -10.550 -6.508 1.00 0.94 N ATOM 1451 CA ILE A 98 15.232 -10.640 -5.559 1.00 0.94 C ATOM 1452 C ILE A 98 13.913 -10.608 -6.333 1.00 0.92 C ATOM 1453 O ILE A 98 13.039 -11.440 -6.106 1.00 0.92 O ATOM 1454 CB ILE A 98 15.361 -9.529 -4.498 1.00 1.02 C ATOM 1455 CG1 ILE A 98 16.471 -9.923 -3.509 1.00 1.10 C ATOM 1456 CG2 ILE A 98 14.046 -9.302 -3.741 1.00 1.06 C ATOM 1457 CD1 ILE A 98 17.022 -8.725 -2.734 1.00 1.10 C ATOM 0 H ILE A 98 16.950 -9.753 -6.352 1.00 0.94 H new ATOM 0 HA ILE A 98 15.258 -11.581 -5.009 1.00 0.94 H new ATOM 0 HB ILE A 98 15.608 -8.595 -5.003 1.00 1.02 H new ATOM 0 HG12 ILE A 98 16.081 -10.658 -2.805 1.00 1.10 H new ATOM 0 HG13 ILE A 98 17.284 -10.403 -4.054 1.00 1.10 H new ATOM 0 HG21 ILE A 98 14.183 -8.511 -3.004 1.00 1.06 H new ATOM 0 HG22 ILE A 98 13.266 -9.011 -4.445 1.00 1.06 H new ATOM 0 HG23 ILE A 98 13.753 -10.222 -3.236 1.00 1.06 H new ATOM 0 HD11 ILE A 98 17.802 -9.061 -2.051 1.00 1.10 H new ATOM 0 HD12 ILE A 98 17.439 -8.000 -3.433 1.00 1.10 H new ATOM 0 HD13 ILE A 98 16.218 -8.259 -2.165 1.00 1.10 H new ATOM 1469 N GLU A 99 13.798 -9.694 -7.295 1.00 0.94 N ATOM 1470 CA GLU A 99 12.656 -9.618 -8.188 1.00 0.96 C ATOM 1471 C GLU A 99 12.447 -10.955 -8.890 1.00 0.94 C ATOM 1472 O GLU A 99 11.342 -11.482 -8.840 1.00 0.97 O ATOM 1473 CB GLU A 99 12.745 -8.394 -9.114 1.00 1.02 C ATOM 1474 CG GLU A 99 11.784 -7.313 -8.590 1.00 1.58 C ATOM 1475 CD GLU A 99 11.836 -5.993 -9.349 1.00 2.14 C ATOM 1476 OE1 GLU A 99 12.504 -5.965 -10.404 1.00 2.47 O ATOM 1477 OE2 GLU A 99 11.203 -5.035 -8.846 1.00 3.33 O ATOM 0 H GLU A 99 14.505 -8.981 -7.474 1.00 0.94 H new ATOM 0 HA GLU A 99 11.746 -9.447 -7.612 1.00 0.96 H new ATOM 0 HB2 GLU A 99 13.766 -8.013 -9.140 1.00 1.02 H new ATOM 0 HB3 GLU A 99 12.482 -8.672 -10.135 1.00 1.02 H new ATOM 0 HG2 GLU A 99 10.766 -7.700 -8.631 1.00 1.58 H new ATOM 0 HG3 GLU A 99 12.010 -7.122 -7.541 1.00 1.58 H new ATOM 1484 N SER A 100 13.487 -11.560 -9.467 1.00 0.92 N ATOM 1485 CA SER A 100 13.406 -12.915 -10.009 1.00 0.94 C ATOM 1486 C SER A 100 12.838 -13.889 -8.966 1.00 0.95 C ATOM 1487 O SER A 100 11.865 -14.590 -9.230 1.00 1.03 O ATOM 1488 CB SER A 100 14.774 -13.368 -10.542 1.00 0.98 C ATOM 1489 OG SER A 100 14.684 -14.638 -11.163 1.00 1.39 O ATOM 0 H SER A 100 14.404 -11.126 -9.571 1.00 0.92 H new ATOM 0 HA SER A 100 12.715 -12.913 -10.852 1.00 0.94 H new ATOM 0 HB2 SER A 100 15.150 -12.636 -11.257 1.00 0.98 H new ATOM 0 HB3 SER A 100 15.491 -13.410 -9.722 1.00 0.98 H new ATOM 0 HG SER A 100 15.567 -14.903 -11.495 1.00 1.39 H new ATOM 1495 N LYS A 101 13.425 -13.938 -7.765 1.00 0.94 N ATOM 1496 CA LYS A 101 12.960 -14.815 -6.703 1.00 0.97 C ATOM 1497 C LYS A 101 11.486 -14.579 -6.367 1.00 0.99 C ATOM 1498 O LYS A 101 10.766 -15.541 -6.113 1.00 1.06 O ATOM 1499 CB LYS A 101 13.833 -14.638 -5.453 1.00 1.01 C ATOM 1500 CG LYS A 101 14.959 -15.671 -5.359 1.00 1.10 C ATOM 1501 CD LYS A 101 16.137 -15.343 -6.284 1.00 1.25 C ATOM 1502 CE LYS A 101 17.223 -16.413 -6.067 1.00 1.87 C ATOM 1503 NZ LYS A 101 18.354 -16.291 -7.007 1.00 2.81 N ATOM 0 H LYS A 101 14.233 -13.370 -7.510 1.00 0.94 H new ATOM 0 HA LYS A 101 13.048 -15.841 -7.060 1.00 0.97 H new ATOM 0 HB2 LYS A 101 14.265 -13.637 -5.457 1.00 1.01 H new ATOM 0 HB3 LYS A 101 13.205 -14.711 -4.565 1.00 1.01 H new ATOM 0 HG2 LYS A 101 15.314 -15.724 -4.330 1.00 1.10 H new ATOM 0 HG3 LYS A 101 14.566 -16.656 -5.612 1.00 1.10 H new ATOM 0 HD2 LYS A 101 15.813 -15.334 -7.325 1.00 1.25 H new ATOM 0 HD3 LYS A 101 16.530 -14.351 -6.064 1.00 1.25 H new ATOM 0 HE2 LYS A 101 17.598 -16.340 -5.046 1.00 1.87 H new ATOM 0 HE3 LYS A 101 16.776 -17.402 -6.172 1.00 1.87 H new ATOM 0 HZ1 LYS A 101 19.212 -16.684 -6.570 1.00 2.81 H new ATOM 0 HZ2 LYS A 101 18.139 -16.815 -7.879 1.00 2.81 H new ATOM 0 HZ3 LYS A 101 18.509 -15.288 -7.235 1.00 2.81 H new ATOM 1517 N LEU A 102 11.034 -13.324 -6.350 1.00 0.96 N ATOM 1518 CA LEU A 102 9.654 -13.014 -6.029 1.00 1.04 C ATOM 1519 C LEU A 102 8.797 -13.489 -7.186 1.00 1.00 C ATOM 1520 O LEU A 102 7.957 -14.361 -7.008 1.00 1.02 O ATOM 1521 CB LEU A 102 9.475 -11.510 -5.813 1.00 1.12 C ATOM 1522 CG LEU A 102 10.175 -11.024 -4.539 1.00 1.37 C ATOM 1523 CD1 LEU A 102 10.479 -9.545 -4.729 1.00 2.15 C ATOM 1524 CD2 LEU A 102 9.295 -11.207 -3.303 1.00 1.59 C ATOM 0 H LEU A 102 11.611 -12.509 -6.556 1.00 0.96 H new ATOM 0 HA LEU A 102 9.359 -13.513 -5.106 1.00 1.04 H new ATOM 0 HB2 LEU A 102 9.872 -10.971 -6.673 1.00 1.12 H new ATOM 0 HB3 LEU A 102 8.412 -11.277 -5.754 1.00 1.12 H new ATOM 0 HG LEU A 102 11.082 -11.607 -4.379 1.00 1.37 H new ATOM 0 HD11 LEU A 102 10.979 -9.159 -3.841 1.00 2.15 H new ATOM 0 HD12 LEU A 102 11.127 -9.415 -5.596 1.00 2.15 H new ATOM 0 HD13 LEU A 102 9.549 -9.000 -4.887 1.00 2.15 H new ATOM 0 HD21 LEU A 102 9.827 -10.851 -2.421 1.00 1.59 H new ATOM 0 HD22 LEU A 102 8.373 -10.638 -3.425 1.00 1.59 H new ATOM 0 HD23 LEU A 102 9.056 -12.263 -3.180 1.00 1.59 H new ATOM 1536 N THR A 103 9.041 -12.943 -8.377 1.00 1.00 N ATOM 1537 CA THR A 103 8.288 -13.258 -9.584 1.00 1.03 C ATOM 1538 C THR A 103 8.263 -14.758 -9.892 1.00 1.04 C ATOM 1539 O THR A 103 7.369 -15.214 -10.600 1.00 1.12 O ATOM 1540 CB THR A 103 8.786 -12.434 -10.775 1.00 1.02 C ATOM 1541 OG1 THR A 103 10.158 -12.640 -11.011 1.00 1.79 O ATOM 1542 CG2 THR A 103 8.522 -10.937 -10.583 1.00 2.26 C ATOM 0 H THR A 103 9.781 -12.258 -8.530 1.00 1.00 H new ATOM 0 HA THR A 103 7.252 -12.975 -9.395 1.00 1.03 H new ATOM 0 HB THR A 103 8.223 -12.779 -11.642 1.00 1.02 H new ATOM 0 HG1 THR A 103 10.681 -12.198 -10.310 1.00 1.79 H new ATOM 0 HG21 THR A 103 8.890 -10.388 -11.450 1.00 2.26 H new ATOM 0 HG22 THR A 103 7.451 -10.767 -10.475 1.00 2.26 H new ATOM 0 HG23 THR A 103 9.037 -10.589 -9.688 1.00 2.26 H new ATOM 1550 N ARG A 104 9.210 -15.537 -9.357 1.00 0.99 N ATOM 1551 CA ARG A 104 9.123 -16.995 -9.470 1.00 1.00 C ATOM 1552 C ARG A 104 7.861 -17.571 -8.810 1.00 1.05 C ATOM 1553 O ARG A 104 7.357 -18.600 -9.258 1.00 1.16 O ATOM 1554 CB ARG A 104 10.361 -17.700 -8.897 1.00 0.95 C ATOM 1555 CG ARG A 104 11.498 -17.847 -9.917 1.00 1.69 C ATOM 1556 CD ARG A 104 12.243 -19.164 -9.653 1.00 1.64 C ATOM 1557 NE ARG A 104 13.345 -19.381 -10.601 1.00 2.82 N ATOM 1558 CZ ARG A 104 14.544 -18.783 -10.535 1.00 4.34 C ATOM 1559 NH1 ARG A 104 14.768 -17.865 -9.590 1.00 5.07 N ATOM 1560 NH2 ARG A 104 15.505 -19.109 -11.406 1.00 5.60 N ATOM 0 H ARG A 104 10.027 -15.192 -8.853 1.00 0.99 H new ATOM 0 HA ARG A 104 9.069 -17.191 -10.541 1.00 1.00 H new ATOM 0 HB2 ARG A 104 10.724 -17.140 -8.036 1.00 0.95 H new ATOM 0 HB3 ARG A 104 10.075 -18.688 -8.537 1.00 0.95 H new ATOM 0 HG2 ARG A 104 11.097 -17.838 -10.931 1.00 1.69 H new ATOM 0 HG3 ARG A 104 12.185 -17.004 -9.839 1.00 1.69 H new ATOM 0 HD2 ARG A 104 12.637 -19.159 -8.637 1.00 1.64 H new ATOM 0 HD3 ARG A 104 11.541 -19.995 -9.719 1.00 1.64 H new ATOM 0 HE ARG A 104 13.186 -20.036 -11.367 1.00 2.82 H new ATOM 0 HH11 ARG A 104 14.031 -17.625 -8.927 1.00 5.07 H new ATOM 0 HH12 ARG A 104 15.676 -17.405 -9.531 1.00 5.07 H new ATOM 0 HH21 ARG A 104 15.327 -19.813 -12.122 1.00 5.60 H new ATOM 0 HH22 ARG A 104 16.416 -18.653 -11.354 1.00 5.60 H new ATOM 1574 N THR A 105 7.391 -16.977 -7.712 1.00 1.06 N ATOM 1575 CA THR A 105 6.228 -17.444 -6.982 1.00 1.14 C ATOM 1576 C THR A 105 4.982 -17.506 -7.881 1.00 1.16 C ATOM 1577 O THR A 105 4.842 -16.739 -8.827 1.00 1.26 O ATOM 1578 CB THR A 105 6.043 -16.523 -5.770 1.00 1.19 C ATOM 1579 OG1 THR A 105 7.258 -16.444 -5.051 1.00 1.74 O ATOM 1580 CG2 THR A 105 4.975 -17.042 -4.817 1.00 1.41 C ATOM 0 H THR A 105 7.819 -16.146 -7.305 1.00 1.06 H new ATOM 0 HA THR A 105 6.378 -18.467 -6.637 1.00 1.14 H new ATOM 0 HB THR A 105 5.736 -15.548 -6.149 1.00 1.19 H new ATOM 0 HG1 THR A 105 7.781 -15.682 -5.376 1.00 1.74 H new ATOM 0 HG21 THR A 105 4.877 -16.359 -3.973 1.00 1.41 H new ATOM 0 HG22 THR A 105 4.022 -17.110 -5.341 1.00 1.41 H new ATOM 0 HG23 THR A 105 5.260 -18.029 -4.453 1.00 1.41 H new ATOM 1588 N ASN A 106 4.069 -18.431 -7.576 1.00 1.16 N ATOM 1589 CA ASN A 106 2.880 -18.705 -8.378 1.00 1.20 C ATOM 1590 C ASN A 106 1.870 -17.555 -8.333 1.00 1.10 C ATOM 1591 O ASN A 106 1.464 -17.053 -9.375 1.00 1.13 O ATOM 1592 CB ASN A 106 2.239 -20.038 -7.954 1.00 1.36 C ATOM 1593 CG ASN A 106 1.780 -20.061 -6.495 1.00 1.74 C ATOM 1594 OD1 ASN A 106 2.332 -19.357 -5.651 1.00 2.69 O ATOM 1595 ND2 ASN A 106 0.765 -20.854 -6.178 1.00 1.70 N ATOM 0 H ASN A 106 4.139 -19.021 -6.747 1.00 1.16 H new ATOM 0 HA ASN A 106 3.198 -18.793 -9.417 1.00 1.20 H new ATOM 0 HB2 ASN A 106 1.384 -20.241 -8.598 1.00 1.36 H new ATOM 0 HB3 ASN A 106 2.956 -20.843 -8.113 1.00 1.36 H new ATOM 0 HD21 ASN A 106 0.426 -20.889 -5.217 1.00 1.70 H new ATOM 0 HD22 ASN A 106 0.323 -21.429 -6.896 1.00 1.70 H new ATOM 1602 N GLY A 107 1.433 -17.161 -7.134 1.00 1.07 N ATOM 1603 CA GLY A 107 0.361 -16.182 -6.978 1.00 1.06 C ATOM 1604 C GLY A 107 0.829 -14.766 -7.303 1.00 1.00 C ATOM 1605 O GLY A 107 0.039 -13.903 -7.685 1.00 1.05 O ATOM 0 H GLY A 107 1.810 -17.510 -6.253 1.00 1.07 H new ATOM 0 HA2 GLY A 107 -0.471 -16.448 -7.631 1.00 1.06 H new ATOM 0 HA3 GLY A 107 -0.014 -16.214 -5.955 1.00 1.06 H new ATOM 1609 N ILE A 108 2.123 -14.496 -7.105 1.00 0.94 N ATOM 1610 CA ILE A 108 2.645 -13.157 -7.299 1.00 0.89 C ATOM 1611 C ILE A 108 2.416 -12.727 -8.748 1.00 0.95 C ATOM 1612 O ILE A 108 2.843 -13.414 -9.672 1.00 1.05 O ATOM 1613 CB ILE A 108 4.098 -13.051 -6.811 1.00 0.85 C ATOM 1614 CG1 ILE A 108 4.400 -11.716 -6.118 1.00 1.02 C ATOM 1615 CG2 ILE A 108 5.139 -13.301 -7.900 1.00 0.87 C ATOM 1616 CD1 ILE A 108 4.458 -10.507 -7.052 1.00 1.95 C ATOM 0 H ILE A 108 2.816 -15.186 -6.813 1.00 0.94 H new ATOM 0 HA ILE A 108 2.102 -12.443 -6.680 1.00 0.89 H new ATOM 0 HB ILE A 108 4.183 -13.855 -6.080 1.00 0.85 H new ATOM 0 HG12 ILE A 108 3.638 -11.536 -5.360 1.00 1.02 H new ATOM 0 HG13 ILE A 108 5.354 -11.801 -5.597 1.00 1.02 H new ATOM 0 HG21 ILE A 108 6.139 -13.208 -7.476 1.00 0.87 H new ATOM 0 HG22 ILE A 108 5.008 -14.305 -8.305 1.00 0.87 H new ATOM 0 HG23 ILE A 108 5.014 -12.569 -8.698 1.00 0.87 H new ATOM 0 HD11 ILE A 108 4.677 -9.610 -6.473 1.00 1.95 H new ATOM 0 HD12 ILE A 108 5.241 -10.659 -7.795 1.00 1.95 H new ATOM 0 HD13 ILE A 108 3.498 -10.389 -7.555 1.00 1.95 H new ATOM 1628 N THR A 109 1.715 -11.610 -8.944 1.00 0.95 N ATOM 1629 CA THR A 109 1.388 -11.124 -10.277 1.00 1.05 C ATOM 1630 C THR A 109 2.262 -9.937 -10.661 1.00 0.91 C ATOM 1631 O THR A 109 2.734 -9.864 -11.792 1.00 0.95 O ATOM 1632 CB THR A 109 -0.115 -10.842 -10.363 1.00 1.33 C ATOM 1633 OG1 THR A 109 -0.821 -12.035 -10.079 1.00 2.03 O ATOM 1634 CG2 THR A 109 -0.517 -10.369 -11.764 1.00 1.81 C ATOM 0 H THR A 109 1.362 -11.024 -8.188 1.00 0.95 H new ATOM 0 HA THR A 109 1.611 -11.892 -11.018 1.00 1.05 H new ATOM 0 HB THR A 109 -0.355 -10.058 -9.645 1.00 1.33 H new ATOM 0 HG1 THR A 109 -1.785 -11.865 -10.130 1.00 2.03 H new ATOM 0 HG21 THR A 109 -1.590 -10.178 -11.790 1.00 1.81 H new ATOM 0 HG22 THR A 109 0.021 -9.452 -12.007 1.00 1.81 H new ATOM 0 HG23 THR A 109 -0.268 -11.140 -12.494 1.00 1.81 H new ATOM 1642 N TYR A 110 2.506 -9.014 -9.727 1.00 0.88 N ATOM 1643 CA TYR A 110 3.453 -7.937 -9.948 1.00 0.89 C ATOM 1644 C TYR A 110 4.280 -7.734 -8.681 1.00 0.88 C ATOM 1645 O TYR A 110 3.721 -7.523 -7.610 1.00 1.04 O ATOM 1646 CB TYR A 110 2.742 -6.678 -10.490 1.00 1.22 C ATOM 1647 CG TYR A 110 1.650 -5.996 -9.668 1.00 0.86 C ATOM 1648 CD1 TYR A 110 0.342 -6.529 -9.621 1.00 2.36 C ATOM 1649 CD2 TYR A 110 1.868 -4.686 -9.193 1.00 1.93 C ATOM 1650 CE1 TYR A 110 -0.723 -5.759 -9.105 1.00 2.83 C ATOM 1651 CE2 TYR A 110 0.827 -3.966 -8.574 1.00 1.77 C ATOM 1652 CZ TYR A 110 -0.488 -4.464 -8.625 1.00 1.61 C ATOM 1653 OH TYR A 110 -1.505 -3.786 -8.024 1.00 2.21 O ATOM 0 H TYR A 110 2.056 -8.998 -8.812 1.00 0.88 H new ATOM 0 HA TYR A 110 4.164 -8.193 -10.733 1.00 0.89 H new ATOM 0 HB2 TYR A 110 3.512 -5.932 -10.686 1.00 1.22 H new ATOM 0 HB3 TYR A 110 2.303 -6.944 -11.452 1.00 1.22 H new ATOM 0 HD1 TYR A 110 0.156 -7.530 -9.981 1.00 2.36 H new ATOM 0 HD2 TYR A 110 2.841 -4.231 -9.305 1.00 1.93 H new ATOM 0 HE1 TYR A 110 -1.722 -6.169 -9.080 1.00 2.83 H new ATOM 0 HE2 TYR A 110 1.037 -3.038 -8.064 1.00 1.77 H new ATOM 0 HH TYR A 110 -1.188 -2.902 -7.743 1.00 2.21 H new ATOM 1663 N ALA A 111 5.609 -7.841 -8.775 1.00 0.79 N ATOM 1664 CA ALA A 111 6.509 -7.339 -7.745 1.00 0.85 C ATOM 1665 C ALA A 111 7.135 -6.054 -8.273 1.00 0.86 C ATOM 1666 O ALA A 111 7.532 -6.023 -9.435 1.00 1.05 O ATOM 1667 CB ALA A 111 7.592 -8.374 -7.434 1.00 0.90 C ATOM 0 H ALA A 111 6.084 -8.277 -9.565 1.00 0.79 H new ATOM 0 HA ALA A 111 5.964 -7.146 -6.821 1.00 0.85 H new ATOM 0 HB1 ALA A 111 8.257 -7.985 -6.663 1.00 0.90 H new ATOM 0 HB2 ALA A 111 7.126 -9.294 -7.081 1.00 0.90 H new ATOM 0 HB3 ALA A 111 8.166 -8.582 -8.337 1.00 0.90 H new ATOM 1673 N SER A 112 7.207 -5.002 -7.451 1.00 0.74 N ATOM 1674 CA SER A 112 8.068 -3.853 -7.751 1.00 0.79 C ATOM 1675 C SER A 112 8.976 -3.538 -6.559 1.00 0.77 C ATOM 1676 O SER A 112 8.468 -3.294 -5.461 1.00 0.83 O ATOM 1677 CB SER A 112 7.217 -2.642 -8.151 1.00 0.89 C ATOM 1678 OG SER A 112 8.030 -1.624 -8.697 1.00 2.17 O ATOM 0 H SER A 112 6.684 -4.922 -6.579 1.00 0.74 H new ATOM 0 HA SER A 112 8.710 -4.101 -8.596 1.00 0.79 H new ATOM 0 HB2 SER A 112 6.464 -2.944 -8.879 1.00 0.89 H new ATOM 0 HB3 SER A 112 6.684 -2.261 -7.280 1.00 0.89 H new ATOM 0 HG SER A 112 7.472 -0.859 -8.949 1.00 2.17 H new ATOM 1684 N VAL A 113 10.300 -3.556 -6.768 1.00 0.77 N ATOM 1685 CA VAL A 113 11.312 -3.284 -5.752 1.00 0.81 C ATOM 1686 C VAL A 113 12.076 -1.989 -6.065 1.00 0.89 C ATOM 1687 O VAL A 113 12.807 -1.903 -7.049 1.00 1.07 O ATOM 1688 CB VAL A 113 12.232 -4.507 -5.590 1.00 0.83 C ATOM 1689 CG1 VAL A 113 13.230 -4.290 -4.444 1.00 2.48 C ATOM 1690 CG2 VAL A 113 11.403 -5.764 -5.282 1.00 1.87 C ATOM 0 H VAL A 113 10.703 -3.768 -7.681 1.00 0.77 H new ATOM 0 HA VAL A 113 10.826 -3.117 -4.791 1.00 0.81 H new ATOM 0 HB VAL A 113 12.774 -4.639 -6.527 1.00 0.83 H new ATOM 0 HG11 VAL A 113 13.870 -5.167 -4.348 1.00 2.48 H new ATOM 0 HG12 VAL A 113 13.844 -3.415 -4.657 1.00 2.48 H new ATOM 0 HG13 VAL A 113 12.686 -4.134 -3.512 1.00 2.48 H new ATOM 0 HG21 VAL A 113 12.068 -6.620 -5.170 1.00 1.87 H new ATOM 0 HG22 VAL A 113 10.845 -5.615 -4.357 1.00 1.87 H new ATOM 0 HG23 VAL A 113 10.707 -5.950 -6.100 1.00 1.87 H new ATOM 1700 N ALA A 114 11.916 -0.976 -5.205 1.00 0.91 N ATOM 1701 CA ALA A 114 12.473 0.362 -5.354 1.00 1.03 C ATOM 1702 C ALA A 114 13.632 0.571 -4.374 1.00 1.04 C ATOM 1703 O ALA A 114 13.471 1.075 -3.264 1.00 1.20 O ATOM 1704 CB ALA A 114 11.364 1.388 -5.145 1.00 1.09 C ATOM 0 H ALA A 114 11.369 -1.077 -4.350 1.00 0.91 H new ATOM 0 HA ALA A 114 12.877 0.487 -6.359 1.00 1.03 H new ATOM 0 HB1 ALA A 114 11.772 2.393 -5.255 1.00 1.09 H new ATOM 0 HB2 ALA A 114 10.580 1.232 -5.886 1.00 1.09 H new ATOM 0 HB3 ALA A 114 10.946 1.274 -4.145 1.00 1.09 H new ATOM 1710 N LEU A 115 14.829 0.212 -4.824 1.00 1.01 N ATOM 1711 CA LEU A 115 16.071 0.208 -4.065 1.00 1.07 C ATOM 1712 C LEU A 115 16.403 1.596 -3.518 1.00 1.14 C ATOM 1713 O LEU A 115 16.913 1.708 -2.409 1.00 1.16 O ATOM 1714 CB LEU A 115 17.194 -0.424 -4.909 1.00 1.20 C ATOM 1715 CG LEU A 115 17.938 0.535 -5.859 1.00 1.34 C ATOM 1716 CD1 LEU A 115 19.258 0.981 -5.217 1.00 1.89 C ATOM 1717 CD2 LEU A 115 18.243 -0.136 -7.201 1.00 1.98 C ATOM 0 H LEU A 115 14.965 -0.102 -5.785 1.00 1.01 H new ATOM 0 HA LEU A 115 15.955 -0.416 -3.179 1.00 1.07 H new ATOM 0 HB2 LEU A 115 17.922 -0.873 -4.233 1.00 1.20 H new ATOM 0 HB3 LEU A 115 16.767 -1.233 -5.501 1.00 1.20 H new ATOM 0 HG LEU A 115 17.293 1.396 -6.036 1.00 1.34 H new ATOM 0 HD11 LEU A 115 19.780 1.659 -5.892 1.00 1.89 H new ATOM 0 HD12 LEU A 115 19.051 1.493 -4.277 1.00 1.89 H new ATOM 0 HD13 LEU A 115 19.882 0.108 -5.025 1.00 1.89 H new ATOM 0 HD21 LEU A 115 18.768 0.567 -7.848 1.00 1.98 H new ATOM 0 HD22 LEU A 115 18.868 -1.013 -7.035 1.00 1.98 H new ATOM 0 HD23 LEU A 115 17.310 -0.440 -7.676 1.00 1.98 H new ATOM 1729 N ALA A 116 16.040 2.650 -4.260 1.00 1.20 N ATOM 1730 CA ALA A 116 16.202 4.039 -3.851 1.00 1.29 C ATOM 1731 C ALA A 116 15.552 4.302 -2.491 1.00 1.28 C ATOM 1732 O ALA A 116 16.006 5.160 -1.739 1.00 1.38 O ATOM 1733 CB ALA A 116 15.585 4.950 -4.917 1.00 1.36 C ATOM 0 H ALA A 116 15.616 2.551 -5.182 1.00 1.20 H new ATOM 0 HA ALA A 116 17.267 4.251 -3.752 1.00 1.29 H new ATOM 0 HB1 ALA A 116 15.702 5.992 -4.618 1.00 1.36 H new ATOM 0 HB2 ALA A 116 16.088 4.787 -5.870 1.00 1.36 H new ATOM 0 HB3 ALA A 116 14.525 4.720 -5.023 1.00 1.36 H new ATOM 1739 N THR A 117 14.470 3.575 -2.198 1.00 1.21 N ATOM 1740 CA THR A 117 13.721 3.659 -0.957 1.00 1.25 C ATOM 1741 C THR A 117 13.801 2.324 -0.186 1.00 1.12 C ATOM 1742 O THR A 117 13.192 2.180 0.871 1.00 1.19 O ATOM 1743 CB THR A 117 12.290 4.142 -1.289 1.00 1.36 C ATOM 1744 OG1 THR A 117 11.389 3.749 -0.293 1.00 1.75 O ATOM 1745 CG2 THR A 117 11.701 3.585 -2.584 1.00 1.29 C ATOM 0 H THR A 117 14.084 2.889 -2.847 1.00 1.21 H new ATOM 0 HA THR A 117 14.150 4.391 -0.273 1.00 1.25 H new ATOM 0 HB THR A 117 12.407 5.222 -1.378 1.00 1.36 H new ATOM 0 HG1 THR A 117 11.883 3.365 0.462 1.00 1.75 H new ATOM 0 HG21 THR A 117 10.696 3.983 -2.727 1.00 1.29 H new ATOM 0 HG22 THR A 117 12.330 3.877 -3.425 1.00 1.29 H new ATOM 0 HG23 THR A 117 11.656 2.498 -2.525 1.00 1.29 H new ATOM 1753 N SER A 118 14.500 1.322 -0.721 1.00 1.08 N ATOM 1754 CA SER A 118 14.657 0.001 -0.127 1.00 0.98 C ATOM 1755 C SER A 118 13.327 -0.728 0.081 1.00 0.97 C ATOM 1756 O SER A 118 13.281 -1.665 0.875 1.00 1.06 O ATOM 1757 CB SER A 118 15.478 0.082 1.170 1.00 1.03 C ATOM 1758 OG SER A 118 16.725 0.704 0.932 1.00 1.43 O ATOM 0 H SER A 118 14.988 1.415 -1.612 1.00 1.08 H new ATOM 0 HA SER A 118 15.212 -0.605 -0.844 1.00 0.98 H new ATOM 0 HB2 SER A 118 14.924 0.642 1.923 1.00 1.03 H new ATOM 0 HB3 SER A 118 15.636 -0.920 1.570 1.00 1.03 H new ATOM 0 HG SER A 118 17.233 0.748 1.769 1.00 1.43 H new ATOM 1764 N LYS A 119 12.263 -0.340 -0.633 1.00 0.95 N ATOM 1765 CA LYS A 119 10.945 -0.944 -0.503 1.00 0.97 C ATOM 1766 C LYS A 119 10.724 -1.987 -1.590 1.00 0.82 C ATOM 1767 O LYS A 119 11.251 -1.861 -2.693 1.00 0.84 O ATOM 1768 CB LYS A 119 9.882 0.147 -0.639 1.00 1.42 C ATOM 1769 CG LYS A 119 9.889 1.074 0.575 1.00 1.62 C ATOM 1770 CD LYS A 119 8.967 0.538 1.678 1.00 2.37 C ATOM 1771 CE LYS A 119 9.020 1.442 2.915 1.00 2.68 C ATOM 1772 NZ LYS A 119 8.415 0.767 4.078 1.00 3.74 N ATOM 0 H LYS A 119 12.301 0.411 -1.323 1.00 0.95 H new ATOM 0 HA LYS A 119 10.874 -1.428 0.471 1.00 0.97 H new ATOM 0 HB2 LYS A 119 10.064 0.726 -1.544 1.00 1.42 H new ATOM 0 HB3 LYS A 119 8.898 -0.310 -0.746 1.00 1.42 H new ATOM 0 HG2 LYS A 119 10.905 1.169 0.959 1.00 1.62 H new ATOM 0 HG3 LYS A 119 9.565 2.072 0.278 1.00 1.62 H new ATOM 0 HD2 LYS A 119 7.944 0.480 1.307 1.00 2.37 H new ATOM 0 HD3 LYS A 119 9.266 -0.475 1.948 1.00 2.37 H new ATOM 0 HE2 LYS A 119 10.055 1.703 3.137 1.00 2.68 H new ATOM 0 HE3 LYS A 119 8.492 2.374 2.714 1.00 2.68 H new ATOM 0 HZ1 LYS A 119 8.414 1.413 4.893 1.00 3.74 H new ATOM 0 HZ2 LYS A 119 7.437 0.494 3.851 1.00 3.74 H new ATOM 0 HZ3 LYS A 119 8.966 -0.083 4.311 1.00 3.74 H new ATOM 1786 N ALA A 120 9.912 -2.992 -1.274 1.00 0.78 N ATOM 1787 CA ALA A 120 9.491 -4.069 -2.144 1.00 0.76 C ATOM 1788 C ALA A 120 7.986 -4.246 -1.985 1.00 0.77 C ATOM 1789 O ALA A 120 7.550 -4.797 -0.982 1.00 0.81 O ATOM 1790 CB ALA A 120 10.253 -5.345 -1.766 1.00 0.82 C ATOM 0 H ALA A 120 9.508 -3.074 -0.341 1.00 0.78 H new ATOM 0 HA ALA A 120 9.710 -3.845 -3.188 1.00 0.76 H new ATOM 0 HB1 ALA A 120 9.941 -6.161 -2.417 1.00 0.82 H new ATOM 0 HB2 ALA A 120 11.324 -5.177 -1.882 1.00 0.82 H new ATOM 0 HB3 ALA A 120 10.036 -5.605 -0.730 1.00 0.82 H new ATOM 1796 N LEU A 121 7.208 -3.815 -2.981 1.00 0.81 N ATOM 1797 CA LEU A 121 5.768 -3.926 -3.065 1.00 0.86 C ATOM 1798 C LEU A 121 5.503 -5.234 -3.806 1.00 0.77 C ATOM 1799 O LEU A 121 5.750 -5.304 -5.013 1.00 0.78 O ATOM 1800 CB LEU A 121 5.204 -2.764 -3.902 1.00 1.07 C ATOM 1801 CG LEU A 121 5.471 -1.315 -3.468 1.00 1.28 C ATOM 1802 CD1 LEU A 121 5.063 -1.080 -2.021 1.00 1.62 C ATOM 1803 CD2 LEU A 121 6.903 -0.819 -3.703 1.00 2.04 C ATOM 0 H LEU A 121 7.603 -3.350 -3.799 1.00 0.81 H new ATOM 0 HA LEU A 121 5.305 -3.900 -2.078 1.00 0.86 H new ATOM 0 HB2 LEU A 121 5.588 -2.876 -4.916 1.00 1.07 H new ATOM 0 HB3 LEU A 121 4.123 -2.895 -3.954 1.00 1.07 H new ATOM 0 HG LEU A 121 4.841 -0.719 -4.128 1.00 1.28 H new ATOM 0 HD11 LEU A 121 5.266 -0.044 -1.749 1.00 1.62 H new ATOM 0 HD12 LEU A 121 3.998 -1.283 -1.906 1.00 1.62 H new ATOM 0 HD13 LEU A 121 5.632 -1.744 -1.370 1.00 1.62 H new ATOM 0 HD21 LEU A 121 6.991 0.213 -3.364 1.00 2.04 H new ATOM 0 HD22 LEU A 121 7.601 -1.444 -3.146 1.00 2.04 H new ATOM 0 HD23 LEU A 121 7.137 -0.873 -4.766 1.00 2.04 H new ATOM 1815 N VAL A 122 5.003 -6.254 -3.104 1.00 0.89 N ATOM 1816 CA VAL A 122 4.755 -7.584 -3.649 1.00 0.86 C ATOM 1817 C VAL A 122 3.243 -7.835 -3.644 1.00 0.93 C ATOM 1818 O VAL A 122 2.605 -7.594 -2.622 1.00 1.02 O ATOM 1819 CB VAL A 122 5.571 -8.621 -2.850 1.00 0.92 C ATOM 1820 CG1 VAL A 122 5.158 -8.770 -1.379 1.00 2.19 C ATOM 1821 CG2 VAL A 122 5.507 -9.983 -3.537 1.00 2.16 C ATOM 0 H VAL A 122 4.755 -6.172 -2.118 1.00 0.89 H new ATOM 0 HA VAL A 122 5.087 -7.672 -4.683 1.00 0.86 H new ATOM 0 HB VAL A 122 6.591 -8.236 -2.838 1.00 0.92 H new ATOM 0 HG11 VAL A 122 5.786 -9.520 -0.899 1.00 2.19 H new ATOM 0 HG12 VAL A 122 5.279 -7.815 -0.869 1.00 2.19 H new ATOM 0 HG13 VAL A 122 4.115 -9.081 -1.324 1.00 2.19 H new ATOM 0 HG21 VAL A 122 6.087 -10.707 -2.964 1.00 2.16 H new ATOM 0 HG22 VAL A 122 4.470 -10.313 -3.595 1.00 2.16 H new ATOM 0 HG23 VAL A 122 5.919 -9.903 -4.543 1.00 2.16 H new ATOM 1831 N LYS A 123 2.660 -8.217 -4.793 1.00 0.93 N ATOM 1832 CA LYS A 123 1.223 -8.425 -4.948 1.00 1.02 C ATOM 1833 C LYS A 123 0.936 -9.894 -5.240 1.00 0.99 C ATOM 1834 O LYS A 123 1.204 -10.338 -6.360 1.00 1.05 O ATOM 1835 CB LYS A 123 0.681 -7.540 -6.068 1.00 1.14 C ATOM 1836 CG LYS A 123 0.441 -6.098 -5.601 1.00 1.18 C ATOM 1837 CD LYS A 123 1.595 -5.246 -5.056 1.00 2.07 C ATOM 1838 CE LYS A 123 2.775 -5.302 -6.018 1.00 3.82 C ATOM 1839 NZ LYS A 123 3.347 -3.985 -6.349 1.00 4.86 N ATOM 0 H LYS A 123 3.188 -8.391 -5.649 1.00 0.93 H new ATOM 0 HA LYS A 123 0.723 -8.151 -4.019 1.00 1.02 H new ATOM 0 HB2 LYS A 123 1.385 -7.538 -6.901 1.00 1.14 H new ATOM 0 HB3 LYS A 123 -0.253 -7.960 -6.441 1.00 1.14 H new ATOM 0 HG2 LYS A 123 0.013 -5.556 -6.444 1.00 1.18 H new ATOM 0 HG3 LYS A 123 -0.323 -6.136 -4.825 1.00 1.18 H new ATOM 0 HD2 LYS A 123 1.268 -4.214 -4.926 1.00 2.07 H new ATOM 0 HD3 LYS A 123 1.897 -5.611 -4.074 1.00 2.07 H new ATOM 0 HE2 LYS A 123 3.556 -5.926 -5.582 1.00 3.82 H new ATOM 0 HE3 LYS A 123 2.456 -5.789 -6.939 1.00 3.82 H new ATOM 0 HZ1 LYS A 123 3.101 -3.736 -7.328 1.00 4.86 H new ATOM 0 HZ2 LYS A 123 2.963 -3.267 -5.702 1.00 4.86 H new ATOM 0 HZ3 LYS A 123 4.382 -4.021 -6.251 1.00 4.86 H new ATOM 1853 N PHE A 124 0.415 -10.629 -4.247 1.00 0.99 N ATOM 1854 CA PHE A 124 0.191 -12.078 -4.339 1.00 1.05 C ATOM 1855 C PHE A 124 -1.265 -12.446 -4.059 1.00 1.16 C ATOM 1856 O PHE A 124 -2.084 -11.556 -3.864 1.00 1.26 O ATOM 1857 CB PHE A 124 1.191 -12.835 -3.448 1.00 1.06 C ATOM 1858 CG PHE A 124 1.158 -12.488 -1.970 1.00 1.06 C ATOM 1859 CD1 PHE A 124 0.284 -13.158 -1.093 1.00 1.65 C ATOM 1860 CD2 PHE A 124 2.028 -11.504 -1.465 1.00 1.91 C ATOM 1861 CE1 PHE A 124 0.251 -12.812 0.270 1.00 1.74 C ATOM 1862 CE2 PHE A 124 2.020 -11.187 -0.097 1.00 1.94 C ATOM 1863 CZ PHE A 124 1.132 -11.841 0.772 1.00 1.25 C ATOM 0 H PHE A 124 0.135 -10.231 -3.351 1.00 0.99 H new ATOM 0 HA PHE A 124 0.378 -12.393 -5.365 1.00 1.05 H new ATOM 0 HB2 PHE A 124 1.006 -13.904 -3.555 1.00 1.06 H new ATOM 0 HB3 PHE A 124 2.197 -12.647 -3.823 1.00 1.06 H new ATOM 0 HD1 PHE A 124 -0.362 -13.939 -1.467 1.00 1.65 H new ATOM 0 HD2 PHE A 124 2.705 -10.991 -2.132 1.00 1.91 H new ATOM 0 HE1 PHE A 124 -0.453 -13.294 0.932 1.00 1.74 H new ATOM 0 HE2 PHE A 124 2.698 -10.439 0.287 1.00 1.94 H new ATOM 0 HZ PHE A 124 1.127 -11.598 1.824 1.00 1.25 H new ATOM 1873 N ASP A 125 -1.588 -13.746 -4.059 1.00 1.21 N ATOM 1874 CA ASP A 125 -2.926 -14.243 -3.773 1.00 1.34 C ATOM 1875 C ASP A 125 -2.895 -14.843 -2.361 1.00 1.34 C ATOM 1876 O ASP A 125 -2.270 -15.893 -2.170 1.00 1.28 O ATOM 1877 CB ASP A 125 -3.279 -15.314 -4.811 1.00 1.41 C ATOM 1878 CG ASP A 125 -3.393 -14.791 -6.238 1.00 2.34 C ATOM 1879 OD1 ASP A 125 -3.862 -13.646 -6.403 1.00 2.84 O ATOM 1880 OD2 ASP A 125 -3.003 -15.561 -7.141 1.00 3.56 O ATOM 0 H ASP A 125 -0.914 -14.485 -4.261 1.00 1.21 H new ATOM 0 HA ASP A 125 -3.675 -13.453 -3.822 1.00 1.34 H new ATOM 0 HB2 ASP A 125 -2.519 -16.095 -4.782 1.00 1.41 H new ATOM 0 HB3 ASP A 125 -4.224 -15.778 -4.530 1.00 1.41 H new ATOM 1885 N PRO A 126 -3.489 -14.183 -1.349 1.00 1.45 N ATOM 1886 CA PRO A 126 -3.316 -14.537 0.054 1.00 1.49 C ATOM 1887 C PRO A 126 -4.198 -15.727 0.434 1.00 1.57 C ATOM 1888 O PRO A 126 -5.114 -15.622 1.247 1.00 1.72 O ATOM 1889 CB PRO A 126 -3.679 -13.270 0.825 1.00 1.60 C ATOM 1890 CG PRO A 126 -4.770 -12.657 -0.049 1.00 1.67 C ATOM 1891 CD PRO A 126 -4.276 -12.964 -1.464 1.00 1.56 C ATOM 0 HA PRO A 126 -2.300 -14.858 0.282 1.00 1.49 H new ATOM 0 HB2 PRO A 126 -4.040 -13.494 1.829 1.00 1.60 H new ATOM 0 HB3 PRO A 126 -2.824 -12.603 0.936 1.00 1.60 H new ATOM 0 HG2 PRO A 126 -5.745 -13.104 0.146 1.00 1.67 H new ATOM 0 HG3 PRO A 126 -4.871 -11.585 0.121 1.00 1.67 H new ATOM 0 HD2 PRO A 126 -5.112 -13.101 -2.150 1.00 1.56 H new ATOM 0 HD3 PRO A 126 -3.674 -12.144 -1.855 1.00 1.56 H new ATOM 1899 N GLU A 127 -3.878 -16.872 -0.158 1.00 1.51 N ATOM 1900 CA GLU A 127 -4.580 -18.131 0.008 1.00 1.62 C ATOM 1901 C GLU A 127 -3.664 -19.263 -0.446 1.00 1.55 C ATOM 1902 O GLU A 127 -3.477 -20.245 0.270 1.00 1.62 O ATOM 1903 CB GLU A 127 -5.922 -18.111 -0.745 1.00 1.77 C ATOM 1904 CG GLU A 127 -5.848 -17.663 -2.214 1.00 2.31 C ATOM 1905 CD GLU A 127 -7.228 -17.724 -2.850 1.00 2.57 C ATOM 1906 OE1 GLU A 127 -8.000 -16.769 -2.624 1.00 3.24 O ATOM 1907 OE2 GLU A 127 -7.493 -18.745 -3.521 1.00 3.03 O ATOM 0 H GLU A 127 -3.085 -16.947 -0.795 1.00 1.51 H new ATOM 0 HA GLU A 127 -4.827 -18.292 1.057 1.00 1.62 H new ATOM 0 HB2 GLU A 127 -6.354 -19.111 -0.709 1.00 1.77 H new ATOM 0 HB3 GLU A 127 -6.607 -17.449 -0.215 1.00 1.77 H new ATOM 0 HG2 GLU A 127 -5.457 -16.647 -2.273 1.00 2.31 H new ATOM 0 HG3 GLU A 127 -5.158 -18.303 -2.763 1.00 2.31 H new ATOM 1914 N ILE A 128 -3.063 -19.105 -1.629 1.00 1.45 N ATOM 1915 CA ILE A 128 -2.168 -20.082 -2.212 1.00 1.39 C ATOM 1916 C ILE A 128 -0.739 -19.885 -1.719 1.00 1.33 C ATOM 1917 O ILE A 128 0.007 -20.855 -1.603 1.00 1.35 O ATOM 1918 CB ILE A 128 -2.250 -20.039 -3.746 1.00 1.35 C ATOM 1919 CG1 ILE A 128 -2.261 -18.626 -4.343 1.00 1.33 C ATOM 1920 CG2 ILE A 128 -3.461 -20.856 -4.221 1.00 1.46 C ATOM 1921 CD1 ILE A 128 -2.256 -18.682 -5.863 1.00 1.54 C ATOM 0 H ILE A 128 -3.194 -18.277 -2.210 1.00 1.45 H new ATOM 0 HA ILE A 128 -2.485 -21.073 -1.888 1.00 1.39 H new ATOM 0 HB ILE A 128 -1.329 -20.487 -4.118 1.00 1.35 H new ATOM 0 HG12 ILE A 128 -3.143 -18.087 -3.997 1.00 1.33 H new ATOM 0 HG13 ILE A 128 -1.391 -18.071 -3.992 1.00 1.33 H new ATOM 0 HG21 ILE A 128 -3.517 -20.824 -5.309 1.00 1.46 H new ATOM 0 HG22 ILE A 128 -3.353 -21.890 -3.893 1.00 1.46 H new ATOM 0 HG23 ILE A 128 -4.373 -20.434 -3.798 1.00 1.46 H new ATOM 0 HD11 ILE A 128 -2.264 -17.669 -6.264 1.00 1.54 H new ATOM 0 HD12 ILE A 128 -1.360 -19.201 -6.205 1.00 1.54 H new ATOM 0 HD13 ILE A 128 -3.140 -19.217 -6.210 1.00 1.54 H new ATOM 1933 N ILE A 129 -0.350 -18.637 -1.452 1.00 1.29 N ATOM 1934 CA ILE A 129 0.976 -18.303 -0.953 1.00 1.23 C ATOM 1935 C ILE A 129 0.857 -17.261 0.161 1.00 1.27 C ATOM 1936 O ILE A 129 -0.192 -16.632 0.308 1.00 1.33 O ATOM 1937 CB ILE A 129 1.868 -17.877 -2.140 1.00 1.14 C ATOM 1938 CG1 ILE A 129 3.092 -18.795 -2.293 1.00 1.17 C ATOM 1939 CG2 ILE A 129 2.229 -16.385 -2.160 1.00 1.08 C ATOM 1940 CD1 ILE A 129 4.126 -18.714 -1.167 1.00 1.21 C ATOM 0 H ILE A 129 -0.955 -17.826 -1.579 1.00 1.29 H new ATOM 0 HA ILE A 129 1.464 -19.165 -0.499 1.00 1.23 H new ATOM 0 HB ILE A 129 1.253 -18.011 -3.030 1.00 1.14 H new ATOM 0 HG12 ILE A 129 2.744 -19.825 -2.368 1.00 1.17 H new ATOM 0 HG13 ILE A 129 3.587 -18.556 -3.234 1.00 1.17 H new ATOM 0 HG21 ILE A 129 2.857 -16.174 -3.026 1.00 1.08 H new ATOM 0 HG22 ILE A 129 1.317 -15.791 -2.219 1.00 1.08 H new ATOM 0 HG23 ILE A 129 2.770 -16.129 -1.249 1.00 1.08 H new ATOM 0 HD11 ILE A 129 4.946 -19.401 -1.376 1.00 1.21 H new ATOM 0 HD12 ILE A 129 4.513 -17.697 -1.101 1.00 1.21 H new ATOM 0 HD13 ILE A 129 3.656 -18.986 -0.222 1.00 1.21 H new ATOM 1952 N GLY A 130 1.923 -17.090 0.951 1.00 1.27 N ATOM 1953 CA GLY A 130 1.959 -16.163 2.068 1.00 1.34 C ATOM 1954 C GLY A 130 3.335 -15.502 2.170 1.00 1.26 C ATOM 1955 O GLY A 130 4.290 -15.963 1.545 1.00 1.19 O ATOM 0 H GLY A 130 2.795 -17.604 0.823 1.00 1.27 H new ATOM 0 HA2 GLY A 130 1.191 -15.400 1.940 1.00 1.34 H new ATOM 0 HA3 GLY A 130 1.733 -16.691 2.994 1.00 1.34 H new ATOM 1959 N PRO A 131 3.451 -14.428 2.963 1.00 1.29 N ATOM 1960 CA PRO A 131 4.668 -13.640 3.070 1.00 1.24 C ATOM 1961 C PRO A 131 5.790 -14.444 3.728 1.00 1.25 C ATOM 1962 O PRO A 131 6.947 -14.318 3.337 1.00 1.16 O ATOM 1963 CB PRO A 131 4.283 -12.407 3.893 1.00 1.38 C ATOM 1964 CG PRO A 131 3.111 -12.894 4.747 1.00 1.48 C ATOM 1965 CD PRO A 131 2.410 -13.898 3.830 1.00 1.39 C ATOM 0 HA PRO A 131 5.056 -13.353 2.093 1.00 1.24 H new ATOM 0 HB2 PRO A 131 5.113 -12.062 4.510 1.00 1.38 H new ATOM 0 HB3 PRO A 131 3.994 -11.573 3.254 1.00 1.38 H new ATOM 0 HG2 PRO A 131 3.452 -13.361 5.671 1.00 1.48 H new ATOM 0 HG3 PRO A 131 2.449 -12.075 5.029 1.00 1.48 H new ATOM 0 HD2 PRO A 131 1.938 -14.693 4.407 1.00 1.39 H new ATOM 0 HD3 PRO A 131 1.624 -13.416 3.249 1.00 1.39 H new ATOM 1973 N ARG A 132 5.457 -15.277 4.720 1.00 1.38 N ATOM 1974 CA ARG A 132 6.428 -16.091 5.439 1.00 1.42 C ATOM 1975 C ARG A 132 7.335 -16.865 4.475 1.00 1.32 C ATOM 1976 O ARG A 132 8.521 -17.032 4.736 1.00 1.31 O ATOM 1977 CB ARG A 132 5.711 -17.034 6.425 1.00 1.57 C ATOM 1978 CG ARG A 132 5.066 -18.195 5.665 1.00 2.46 C ATOM 1979 CD ARG A 132 4.329 -19.233 6.497 1.00 2.95 C ATOM 1980 NE ARG A 132 4.115 -20.390 5.615 1.00 4.21 N ATOM 1981 CZ ARG A 132 3.970 -21.658 6.009 1.00 4.82 C ATOM 1982 NH1 ARG A 132 3.676 -21.917 7.290 1.00 4.42 N ATOM 1983 NH2 ARG A 132 4.136 -22.644 5.121 1.00 6.32 N ATOM 0 H ARG A 132 4.498 -15.402 5.044 1.00 1.38 H new ATOM 0 HA ARG A 132 7.072 -15.426 6.014 1.00 1.42 H new ATOM 0 HB2 ARG A 132 6.422 -17.418 7.156 1.00 1.57 H new ATOM 0 HB3 ARG A 132 4.950 -16.484 6.979 1.00 1.57 H new ATOM 0 HG2 ARG A 132 4.365 -17.780 4.941 1.00 2.46 H new ATOM 0 HG3 ARG A 132 5.845 -18.705 5.098 1.00 2.46 H new ATOM 0 HD2 ARG A 132 4.912 -19.515 7.374 1.00 2.95 H new ATOM 0 HD3 ARG A 132 3.379 -18.839 6.859 1.00 2.95 H new ATOM 0 HE ARG A 132 4.074 -20.208 4.612 1.00 4.21 H new ATOM 0 HH11 ARG A 132 3.565 -21.150 7.953 1.00 4.42 H new ATOM 0 HH12 ARG A 132 3.563 -22.881 7.602 1.00 4.42 H new ATOM 0 HH21 ARG A 132 4.371 -22.424 4.153 1.00 6.32 H new ATOM 0 HH22 ARG A 132 4.028 -23.616 5.412 1.00 6.32 H new ATOM 1997 N ASP A 133 6.765 -17.373 3.380 1.00 1.28 N ATOM 1998 CA ASP A 133 7.465 -18.230 2.444 1.00 1.22 C ATOM 1999 C ASP A 133 8.483 -17.378 1.670 1.00 1.05 C ATOM 2000 O ASP A 133 9.625 -17.792 1.466 1.00 1.01 O ATOM 2001 CB ASP A 133 6.416 -18.961 1.587 1.00 1.31 C ATOM 2002 CG ASP A 133 5.642 -20.002 2.408 1.00 2.78 C ATOM 2003 OD1 ASP A 133 4.653 -19.613 3.070 1.00 4.35 O ATOM 2004 OD2 ASP A 133 6.053 -21.181 2.420 1.00 3.26 O ATOM 0 H ASP A 133 5.794 -17.194 3.123 1.00 1.28 H new ATOM 0 HA ASP A 133 8.050 -19.012 2.927 1.00 1.22 H new ATOM 0 HB2 ASP A 133 5.719 -18.236 1.167 1.00 1.31 H new ATOM 0 HB3 ASP A 133 6.909 -19.452 0.748 1.00 1.31 H new ATOM 2009 N ILE A 134 8.100 -16.145 1.317 1.00 1.00 N ATOM 2010 CA ILE A 134 8.997 -15.165 0.718 1.00 0.91 C ATOM 2011 C ILE A 134 10.120 -14.844 1.704 1.00 0.88 C ATOM 2012 O ILE A 134 11.297 -14.856 1.341 1.00 0.84 O ATOM 2013 CB ILE A 134 8.223 -13.896 0.311 1.00 0.92 C ATOM 2014 CG1 ILE A 134 7.083 -14.251 -0.663 1.00 1.03 C ATOM 2015 CG2 ILE A 134 9.193 -12.881 -0.306 1.00 0.87 C ATOM 2016 CD1 ILE A 134 6.249 -13.034 -1.065 1.00 0.95 C ATOM 0 H ILE A 134 7.148 -15.802 1.443 1.00 1.00 H new ATOM 0 HA ILE A 134 9.436 -15.579 -0.190 1.00 0.91 H new ATOM 0 HB ILE A 134 7.770 -13.446 1.195 1.00 0.92 H new ATOM 0 HG12 ILE A 134 7.505 -14.709 -1.558 1.00 1.03 H new ATOM 0 HG13 ILE A 134 6.434 -14.994 -0.200 1.00 1.03 H new ATOM 0 HG21 ILE A 134 8.646 -11.983 -0.594 1.00 0.87 H new ATOM 0 HG22 ILE A 134 9.960 -12.620 0.424 1.00 0.87 H new ATOM 0 HG23 ILE A 134 9.664 -13.317 -1.187 1.00 0.87 H new ATOM 0 HD11 ILE A 134 5.461 -13.344 -1.752 1.00 0.95 H new ATOM 0 HD12 ILE A 134 5.802 -12.590 -0.176 1.00 0.95 H new ATOM 0 HD13 ILE A 134 6.889 -12.300 -1.554 1.00 0.95 H new ATOM 2028 N ILE A 135 9.748 -14.552 2.954 1.00 0.98 N ATOM 2029 CA ILE A 135 10.697 -14.306 4.027 1.00 1.05 C ATOM 2030 C ILE A 135 11.696 -15.463 4.073 1.00 1.08 C ATOM 2031 O ILE A 135 12.894 -15.231 3.976 1.00 1.11 O ATOM 2032 CB ILE A 135 9.970 -14.026 5.355 1.00 1.27 C ATOM 2033 CG1 ILE A 135 9.302 -12.639 5.265 1.00 1.48 C ATOM 2034 CG2 ILE A 135 10.932 -14.083 6.551 1.00 1.81 C ATOM 2035 CD1 ILE A 135 8.304 -12.361 6.392 1.00 1.69 C ATOM 0 H ILE A 135 8.773 -14.481 3.244 1.00 0.98 H new ATOM 0 HA ILE A 135 11.272 -13.399 3.839 1.00 1.05 H new ATOM 0 HB ILE A 135 9.216 -14.797 5.516 1.00 1.27 H new ATOM 0 HG12 ILE A 135 10.076 -11.871 5.280 1.00 1.48 H new ATOM 0 HG13 ILE A 135 8.788 -12.555 4.308 1.00 1.48 H new ATOM 0 HG21 ILE A 135 10.382 -13.880 7.470 1.00 1.81 H new ATOM 0 HG22 ILE A 135 11.383 -15.074 6.609 1.00 1.81 H new ATOM 0 HG23 ILE A 135 11.715 -13.335 6.424 1.00 1.81 H new ATOM 0 HD11 ILE A 135 7.875 -11.367 6.261 1.00 1.69 H new ATOM 0 HD12 ILE A 135 7.509 -13.106 6.366 1.00 1.69 H new ATOM 0 HD13 ILE A 135 8.817 -12.412 7.353 1.00 1.69 H new ATOM 2047 N LYS A 136 11.234 -16.714 4.148 1.00 1.14 N ATOM 2048 CA LYS A 136 12.134 -17.849 4.176 1.00 1.21 C ATOM 2049 C LYS A 136 13.075 -17.860 2.970 1.00 1.12 C ATOM 2050 O LYS A 136 14.280 -18.034 3.139 1.00 1.18 O ATOM 2051 CB LYS A 136 11.355 -19.168 4.246 1.00 1.32 C ATOM 2052 CG LYS A 136 12.028 -20.089 5.269 1.00 2.26 C ATOM 2053 CD LYS A 136 12.027 -21.559 4.816 1.00 1.95 C ATOM 2054 CE LYS A 136 13.453 -21.919 4.353 1.00 3.31 C ATOM 2055 NZ LYS A 136 13.528 -23.150 3.545 1.00 3.64 N ATOM 0 H LYS A 136 10.244 -16.957 4.190 1.00 1.14 H new ATOM 0 HA LYS A 136 12.741 -17.750 5.076 1.00 1.21 H new ATOM 0 HB2 LYS A 136 10.320 -18.980 4.532 1.00 1.32 H new ATOM 0 HB3 LYS A 136 11.333 -19.645 3.266 1.00 1.32 H new ATOM 0 HG2 LYS A 136 13.055 -19.761 5.430 1.00 2.26 H new ATOM 0 HG3 LYS A 136 11.512 -20.005 6.226 1.00 2.26 H new ATOM 0 HD2 LYS A 136 11.717 -22.209 5.634 1.00 1.95 H new ATOM 0 HD3 LYS A 136 11.315 -21.707 4.004 1.00 1.95 H new ATOM 0 HE2 LYS A 136 13.855 -21.090 3.771 1.00 3.31 H new ATOM 0 HE3 LYS A 136 14.091 -22.032 5.230 1.00 3.31 H new ATOM 0 HZ1 LYS A 136 14.320 -23.078 2.875 1.00 3.64 H new ATOM 0 HZ2 LYS A 136 13.677 -23.967 4.171 1.00 3.64 H new ATOM 0 HZ3 LYS A 136 12.640 -23.275 3.019 1.00 3.64 H new ATOM 2069 N ILE A 137 12.529 -17.689 1.759 1.00 1.02 N ATOM 2070 CA ILE A 137 13.343 -17.614 0.550 1.00 1.00 C ATOM 2071 C ILE A 137 14.468 -16.600 0.772 1.00 1.00 C ATOM 2072 O ILE A 137 15.643 -16.946 0.651 1.00 1.20 O ATOM 2073 CB ILE A 137 12.470 -17.306 -0.687 1.00 0.98 C ATOM 2074 CG1 ILE A 137 11.630 -18.545 -1.055 1.00 1.09 C ATOM 2075 CG2 ILE A 137 13.327 -16.888 -1.894 1.00 1.10 C ATOM 2076 CD1 ILE A 137 10.410 -18.208 -1.921 1.00 2.30 C ATOM 0 H ILE A 137 11.526 -17.600 1.596 1.00 1.02 H new ATOM 0 HA ILE A 137 13.805 -18.580 0.344 1.00 1.00 H new ATOM 0 HB ILE A 137 11.813 -16.474 -0.434 1.00 0.98 H new ATOM 0 HG12 ILE A 137 12.259 -19.259 -1.586 1.00 1.09 H new ATOM 0 HG13 ILE A 137 11.295 -19.034 -0.140 1.00 1.09 H new ATOM 0 HG21 ILE A 137 12.679 -16.679 -2.745 1.00 1.10 H new ATOM 0 HG22 ILE A 137 13.897 -15.993 -1.643 1.00 1.10 H new ATOM 0 HG23 ILE A 137 14.013 -17.695 -2.150 1.00 1.10 H new ATOM 0 HD11 ILE A 137 9.860 -19.122 -2.146 1.00 2.30 H new ATOM 0 HD12 ILE A 137 9.761 -17.517 -1.382 1.00 2.30 H new ATOM 0 HD13 ILE A 137 10.741 -17.745 -2.851 1.00 2.30 H new ATOM 2088 N ILE A 138 14.135 -15.356 1.129 1.00 0.88 N ATOM 2089 CA ILE A 138 15.175 -14.347 1.290 1.00 0.90 C ATOM 2090 C ILE A 138 16.106 -14.624 2.474 1.00 1.01 C ATOM 2091 O ILE A 138 17.286 -14.283 2.390 1.00 1.07 O ATOM 2092 CB ILE A 138 14.642 -12.909 1.227 1.00 0.85 C ATOM 2093 CG1 ILE A 138 13.711 -12.495 2.366 1.00 0.91 C ATOM 2094 CG2 ILE A 138 13.941 -12.669 -0.118 1.00 0.83 C ATOM 2095 CD1 ILE A 138 14.437 -12.019 3.628 1.00 1.55 C ATOM 0 H ILE A 138 13.184 -15.034 1.306 1.00 0.88 H new ATOM 0 HA ILE A 138 15.814 -14.437 0.412 1.00 0.90 H new ATOM 0 HB ILE A 138 15.526 -12.282 1.337 1.00 0.85 H new ATOM 0 HG12 ILE A 138 13.057 -11.697 2.014 1.00 0.91 H new ATOM 0 HG13 ILE A 138 13.073 -13.340 2.624 1.00 0.91 H new ATOM 0 HG21 ILE A 138 13.565 -11.646 -0.155 1.00 0.83 H new ATOM 0 HG22 ILE A 138 14.650 -12.825 -0.931 1.00 0.83 H new ATOM 0 HG23 ILE A 138 13.109 -13.365 -0.224 1.00 0.83 H new ATOM 0 HD11 ILE A 138 13.705 -11.744 4.387 1.00 1.55 H new ATOM 0 HD12 ILE A 138 15.070 -12.821 4.008 1.00 1.55 H new ATOM 0 HD13 ILE A 138 15.054 -11.153 3.388 1.00 1.55 H new ATOM 2107 N GLU A 139 15.634 -15.266 3.546 1.00 1.07 N ATOM 2108 CA GLU A 139 16.526 -15.728 4.607 1.00 1.19 C ATOM 2109 C GLU A 139 17.536 -16.729 4.047 1.00 1.26 C ATOM 2110 O GLU A 139 18.700 -16.716 4.437 1.00 1.31 O ATOM 2111 CB GLU A 139 15.763 -16.363 5.779 1.00 1.31 C ATOM 2112 CG GLU A 139 14.872 -15.377 6.547 1.00 1.34 C ATOM 2113 CD GLU A 139 14.788 -15.739 8.023 1.00 1.79 C ATOM 2114 OE1 GLU A 139 14.484 -16.920 8.296 1.00 2.14 O ATOM 2115 OE2 GLU A 139 15.031 -14.832 8.846 1.00 2.61 O ATOM 0 H GLU A 139 14.648 -15.475 3.700 1.00 1.07 H new ATOM 0 HA GLU A 139 17.047 -14.851 4.991 1.00 1.19 H new ATOM 0 HB2 GLU A 139 15.145 -17.177 5.399 1.00 1.31 H new ATOM 0 HB3 GLU A 139 16.481 -16.804 6.471 1.00 1.31 H new ATOM 0 HG2 GLU A 139 15.268 -14.367 6.440 1.00 1.34 H new ATOM 0 HG3 GLU A 139 13.872 -15.374 6.114 1.00 1.34 H new ATOM 2122 N GLU A 140 17.102 -17.585 3.119 1.00 1.29 N ATOM 2123 CA GLU A 140 17.958 -18.593 2.515 1.00 1.43 C ATOM 2124 C GLU A 140 19.000 -17.917 1.616 1.00 1.33 C ATOM 2125 O GLU A 140 20.131 -18.388 1.516 1.00 1.40 O ATOM 2126 CB GLU A 140 17.095 -19.653 1.799 1.00 1.64 C ATOM 2127 CG GLU A 140 17.527 -21.091 2.136 1.00 2.34 C ATOM 2128 CD GLU A 140 16.456 -22.099 1.743 1.00 2.75 C ATOM 2129 OE1 GLU A 140 16.122 -22.159 0.546 1.00 2.57 O ATOM 2130 OE2 GLU A 140 15.939 -22.776 2.663 1.00 3.89 O ATOM 0 H GLU A 140 16.144 -17.594 2.769 1.00 1.29 H new ATOM 0 HA GLU A 140 18.521 -19.131 3.278 1.00 1.43 H new ATOM 0 HB2 GLU A 140 16.051 -19.516 2.079 1.00 1.64 H new ATOM 0 HB3 GLU A 140 17.159 -19.501 0.722 1.00 1.64 H new ATOM 0 HG2 GLU A 140 18.457 -21.324 1.617 1.00 2.34 H new ATOM 0 HG3 GLU A 140 17.730 -21.171 3.204 1.00 2.34 H new ATOM 2137 N ILE A 141 18.651 -16.777 1.004 1.00 1.22 N ATOM 2138 CA ILE A 141 19.644 -15.918 0.362 1.00 1.23 C ATOM 2139 C ILE A 141 20.574 -15.315 1.425 1.00 1.26 C ATOM 2140 O ILE A 141 21.787 -15.254 1.235 1.00 1.38 O ATOM 2141 CB ILE A 141 18.982 -14.798 -0.470 1.00 1.16 C ATOM 2142 CG1 ILE A 141 17.936 -15.354 -1.443 1.00 1.16 C ATOM 2143 CG2 ILE A 141 20.056 -14.049 -1.266 1.00 1.23 C ATOM 2144 CD1 ILE A 141 17.232 -14.250 -2.237 1.00 1.19 C ATOM 0 H ILE A 141 17.693 -16.433 0.942 1.00 1.22 H new ATOM 0 HA ILE A 141 20.226 -16.532 -0.325 1.00 1.23 H new ATOM 0 HB ILE A 141 18.479 -14.124 0.223 1.00 1.16 H new ATOM 0 HG12 ILE A 141 18.418 -16.044 -2.135 1.00 1.16 H new ATOM 0 HG13 ILE A 141 17.194 -15.927 -0.886 1.00 1.16 H new ATOM 0 HG21 ILE A 141 19.589 -13.259 -1.853 1.00 1.23 H new ATOM 0 HG22 ILE A 141 20.779 -13.611 -0.578 1.00 1.23 H new ATOM 0 HG23 ILE A 141 20.565 -14.744 -1.934 1.00 1.23 H new ATOM 0 HD11 ILE A 141 16.501 -14.696 -2.911 1.00 1.19 H new ATOM 0 HD12 ILE A 141 16.725 -13.574 -1.549 1.00 1.19 H new ATOM 0 HD13 ILE A 141 17.968 -13.693 -2.817 1.00 1.19 H new ATOM 2156 N GLY A 142 19.984 -14.827 2.519 1.00 1.18 N ATOM 2157 CA GLY A 142 20.654 -14.124 3.602 1.00 1.20 C ATOM 2158 C GLY A 142 20.357 -12.625 3.560 1.00 1.14 C ATOM 2159 O GLY A 142 21.205 -11.824 3.947 1.00 1.18 O ATOM 0 H GLY A 142 18.980 -14.918 2.676 1.00 1.18 H new ATOM 0 HA2 GLY A 142 20.331 -14.534 4.559 1.00 1.20 H new ATOM 0 HA3 GLY A 142 21.730 -14.286 3.533 1.00 1.20 H new ATOM 2163 N PHE A 143 19.163 -12.235 3.096 1.00 1.05 N ATOM 2164 CA PHE A 143 18.684 -10.857 3.169 1.00 0.94 C ATOM 2165 C PHE A 143 17.728 -10.723 4.353 1.00 0.99 C ATOM 2166 O PHE A 143 17.384 -11.720 4.984 1.00 1.12 O ATOM 2167 CB PHE A 143 18.010 -10.480 1.844 1.00 0.91 C ATOM 2168 CG PHE A 143 18.974 -9.941 0.810 1.00 1.02 C ATOM 2169 CD1 PHE A 143 19.992 -10.766 0.300 1.00 2.08 C ATOM 2170 CD2 PHE A 143 18.901 -8.594 0.413 1.00 2.16 C ATOM 2171 CE1 PHE A 143 20.944 -10.243 -0.591 1.00 2.16 C ATOM 2172 CE2 PHE A 143 19.820 -8.087 -0.518 1.00 2.49 C ATOM 2173 CZ PHE A 143 20.863 -8.900 -0.994 1.00 1.73 C ATOM 0 H PHE A 143 18.501 -12.875 2.657 1.00 1.05 H new ATOM 0 HA PHE A 143 19.515 -10.170 3.326 1.00 0.94 H new ATOM 0 HB2 PHE A 143 17.507 -11.358 1.438 1.00 0.91 H new ATOM 0 HB3 PHE A 143 17.240 -9.733 2.036 1.00 0.91 H new ATOM 0 HD1 PHE A 143 20.042 -11.804 0.594 1.00 2.08 H new ATOM 0 HD2 PHE A 143 18.138 -7.950 0.825 1.00 2.16 H new ATOM 0 HE1 PHE A 143 21.737 -10.873 -0.966 1.00 2.16 H new ATOM 0 HE2 PHE A 143 19.726 -7.070 -0.870 1.00 2.49 H new ATOM 0 HZ PHE A 143 21.601 -8.493 -1.669 1.00 1.73 H new ATOM 2183 N HIS A 144 17.278 -9.497 4.642 1.00 0.98 N ATOM 2184 CA HIS A 144 16.293 -9.235 5.678 1.00 1.09 C ATOM 2185 C HIS A 144 15.169 -8.453 5.021 1.00 0.96 C ATOM 2186 O HIS A 144 15.446 -7.417 4.418 1.00 0.88 O ATOM 2187 CB HIS A 144 16.928 -8.424 6.811 1.00 1.24 C ATOM 2188 CG HIS A 144 18.007 -9.163 7.558 1.00 1.86 C ATOM 2189 ND1 HIS A 144 19.316 -8.759 7.696 1.00 3.25 N ATOM 2190 CD2 HIS A 144 17.850 -10.318 8.278 1.00 2.37 C ATOM 2191 CE1 HIS A 144 19.931 -9.653 8.489 1.00 3.95 C ATOM 2192 NE2 HIS A 144 19.079 -10.617 8.872 1.00 3.48 N ATOM 0 H HIS A 144 17.594 -8.658 4.156 1.00 0.98 H new ATOM 0 HA HIS A 144 15.916 -10.161 6.112 1.00 1.09 H new ATOM 0 HB2 HIS A 144 17.348 -7.507 6.397 1.00 1.24 H new ATOM 0 HB3 HIS A 144 16.149 -8.129 7.514 1.00 1.24 H new ATOM 0 HD2 HIS A 144 16.941 -10.893 8.370 1.00 2.37 H new ATOM 0 HE1 HIS A 144 20.970 -9.603 8.779 1.00 3.95 H new ATOM 0 HE2 HIS A 144 19.288 -11.411 9.477 1.00 3.48 H new ATOM 2200 N ALA A 145 13.941 -8.971 5.105 1.00 1.02 N ATOM 2201 CA ALA A 145 12.735 -8.371 4.556 1.00 0.99 C ATOM 2202 C ALA A 145 11.795 -8.014 5.702 1.00 1.10 C ATOM 2203 O ALA A 145 11.100 -8.882 6.228 1.00 1.23 O ATOM 2204 CB ALA A 145 12.047 -9.353 3.611 1.00 1.02 C ATOM 0 H ALA A 145 13.759 -9.856 5.578 1.00 1.02 H new ATOM 0 HA ALA A 145 12.996 -7.472 3.998 1.00 0.99 H new ATOM 0 HB1 ALA A 145 11.145 -8.896 3.205 1.00 1.02 H new ATOM 0 HB2 ALA A 145 12.724 -9.608 2.795 1.00 1.02 H new ATOM 0 HB3 ALA A 145 11.780 -10.258 4.157 1.00 1.02 H new ATOM 2210 N SER A 146 11.766 -6.742 6.084 1.00 1.11 N ATOM 2211 CA SER A 146 10.959 -6.244 7.177 1.00 1.24 C ATOM 2212 C SER A 146 9.684 -5.634 6.585 1.00 1.15 C ATOM 2213 O SER A 146 9.690 -4.521 6.061 1.00 1.27 O ATOM 2214 CB SER A 146 11.819 -5.268 7.984 1.00 1.52 C ATOM 2215 OG SER A 146 12.514 -4.384 7.129 1.00 3.21 O ATOM 0 H SER A 146 12.318 -6.016 5.627 1.00 1.11 H new ATOM 0 HA SER A 146 10.636 -7.022 7.868 1.00 1.24 H new ATOM 0 HB2 SER A 146 11.188 -4.699 8.667 1.00 1.52 H new ATOM 0 HB3 SER A 146 12.530 -5.823 8.596 1.00 1.52 H new ATOM 0 HG SER A 146 12.203 -3.468 7.283 1.00 3.21 H new ATOM 2221 N LEU A 147 8.600 -6.413 6.620 1.00 1.39 N ATOM 2222 CA LEU A 147 7.260 -6.051 6.184 1.00 1.76 C ATOM 2223 C LEU A 147 6.853 -4.694 6.752 1.00 1.80 C ATOM 2224 O LEU A 147 6.444 -4.613 7.909 1.00 2.29 O ATOM 2225 CB LEU A 147 6.265 -7.161 6.549 1.00 2.64 C ATOM 2226 CG LEU A 147 6.403 -7.657 8.000 1.00 3.24 C ATOM 2227 CD1 LEU A 147 5.052 -7.569 8.718 1.00 3.85 C ATOM 2228 CD2 LEU A 147 6.900 -9.106 8.017 1.00 4.00 C ATOM 0 H LEU A 147 8.643 -7.368 6.975 1.00 1.39 H new ATOM 0 HA LEU A 147 7.253 -5.952 5.099 1.00 1.76 H new ATOM 0 HB2 LEU A 147 5.250 -6.794 6.394 1.00 2.64 H new ATOM 0 HB3 LEU A 147 6.407 -8.002 5.871 1.00 2.64 H new ATOM 0 HG LEU A 147 7.125 -7.025 8.517 1.00 3.24 H new ATOM 0 HD11 LEU A 147 5.161 -7.922 9.743 1.00 3.85 H new ATOM 0 HD12 LEU A 147 4.711 -6.534 8.725 1.00 3.85 H new ATOM 0 HD13 LEU A 147 4.322 -8.188 8.197 1.00 3.85 H new ATOM 0 HD21 LEU A 147 6.994 -9.446 9.048 1.00 4.00 H new ATOM 0 HD22 LEU A 147 6.189 -9.741 7.489 1.00 4.00 H new ATOM 0 HD23 LEU A 147 7.872 -9.163 7.526 1.00 4.00 H new ATOM 2240 N ALA A 148 6.979 -3.634 5.948 1.00 1.70 N ATOM 2241 CA ALA A 148 6.681 -2.272 6.350 1.00 2.25 C ATOM 2242 C ALA A 148 7.327 -1.909 7.690 1.00 2.87 C ATOM 2243 O ALA A 148 6.686 -1.281 8.533 1.00 3.52 O ATOM 2244 CB ALA A 148 5.161 -2.114 6.384 1.00 3.75 C ATOM 0 H ALA A 148 7.298 -3.709 4.982 1.00 1.70 H new ATOM 0 HA ALA A 148 7.108 -1.576 5.628 1.00 2.25 H new ATOM 0 HB1 ALA A 148 4.908 -1.097 6.684 1.00 3.75 H new ATOM 0 HB2 ALA A 148 4.752 -2.313 5.393 1.00 3.75 H new ATOM 0 HB3 ALA A 148 4.738 -2.819 7.099 1.00 3.75 H new ATOM 2250 N GLN A 149 8.587 -2.302 7.899 1.00 3.95 N ATOM 2251 CA GLN A 149 9.267 -2.103 9.167 1.00 5.76 C ATOM 2252 C GLN A 149 10.775 -2.136 8.925 1.00 7.24 C ATOM 2253 O GLN A 149 11.156 -2.215 7.735 1.00 7.93 O ATOM 2254 CB GLN A 149 8.793 -3.190 10.148 1.00 6.11 C ATOM 2255 CG GLN A 149 8.977 -2.791 11.617 1.00 7.16 C ATOM 2256 CD GLN A 149 8.230 -3.737 12.550 1.00 7.20 C ATOM 2257 OE1 GLN A 149 8.823 -4.395 13.398 1.00 8.44 O ATOM 2258 NE2 GLN A 149 6.908 -3.815 12.409 1.00 6.16 N ATOM 2259 OXT GLN A 149 11.524 -2.125 9.922 1.00 8.12 O ATOM 0 H GLN A 149 9.157 -2.765 7.191 1.00 3.95 H new ATOM 0 HA GLN A 149 9.031 -1.135 9.608 1.00 5.76 H new ATOM 0 HB2 GLN A 149 7.740 -3.404 9.964 1.00 6.11 H new ATOM 0 HB3 GLN A 149 9.343 -4.111 9.955 1.00 6.11 H new ATOM 0 HG2 GLN A 149 10.038 -2.795 11.866 1.00 7.16 H new ATOM 0 HG3 GLN A 149 8.618 -1.773 11.766 1.00 7.16 H new ATOM 0 HE21 GLN A 149 6.437 -3.258 11.696 1.00 6.16 H new ATOM 0 HE22 GLN A 149 6.366 -4.432 13.014 1.00 6.16 H new