USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1075 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 133 LYS NZ :NH3+ 160:sc= 1.18 (180deg=0) USER MOD Set 1.2: A 137 THR OG1 : rot 72:sc= 1.15 USER MOD Set 2.1: A 42 HIS : no HD1:sc= -0.0409 X(o=0.11,f=0.15) USER MOD Set 2.2: A 44 TYR OH : rot 8:sc= 0.15 USER MOD Single : A 8 SER OG : rot 130:sc= -0.0265 USER MOD Single : A 9 HIS :FLIP no HE2:sc= 0.0948 F(o=-1.2,f=0.095) USER MOD Single : A 10 ASN : amide:sc= -1.19 K(o=-1.2,f=-4.4!) USER MOD Single : A 14 TYR OH : rot 30:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0.0179 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00781 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0.797 K(o=0.8,f=-5!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -165:sc= -0.0351 (180deg=-0.348) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 CYS SG : rot -140:sc= -4.72! USER MOD Single : A 56 SER OG : rot 180:sc= 0.172 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 168:sc= 0.362 (180deg=-0.226) USER MOD Single : A 63 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot -54:sc= 0.249 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.04) USER MOD Single : A 77 ASN : amide:sc= -2.25! C(o=-2.2!,f=-2.4!) USER MOD Single : A 84 ASN : amide:sc= 1.17 K(o=1.2,f=-0.19) USER MOD Single : A 86 TYR OH : rot 30:sc= -0.0747 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN :FLIP amide:sc= 0 F(o=-1.8,f=0) USER MOD Single : A 99 SER OG : rot -98:sc= 1.24 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 58:sc= 1.11 USER MOD Single : A 107 TYR OH : rot 150:sc= 0.98 USER MOD Single : A 111 ASN : amide:sc= -1.4! X(o=-1.4!,f=-1.1) USER MOD Single : A 112 LYS NZ :NH3+ 165:sc= 1.09 (180deg=0.425) USER MOD Single : A 117 MET CE :methyl -143:sc= -0.184 (180deg=-1.44) USER MOD Single : A 130 HIS : no HD1:sc= -1.59 X(o=-1.6,f=-2.1!) USER MOD Single : A 140 LYS NZ :NH3+ -151:sc= 0.288 (180deg=-0.618!) USER MOD Single : A 141 MET CE :methyl -160:sc= -0.175 (180deg=-0.755) USER MOD Single : A 145 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 ASN : amide:sc= -0.749 K(o=-0.75,f=-6.7!) USER MOD Single : A 149 ASN : amide:sc= -0.0117 X(o=-0.012,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 93 N SER A 8 8.322 -13.612 3.153 1.00 22.01 N ATOM 94 CA SER A 8 9.222 -12.504 2.974 1.00 34.34 C ATOM 95 C SER A 8 8.445 -11.221 3.121 1.00 11.12 C ATOM 96 O SER A 8 7.208 -11.232 3.154 1.00 51.12 O ATOM 97 CB SER A 8 9.872 -12.519 1.579 1.00 61.24 C ATOM 98 OG SER A 8 10.709 -13.652 1.372 1.00 1.12 O ATOM 0 HA SER A 8 10.009 -12.582 3.724 1.00 34.34 H new ATOM 0 HB2 SER A 8 9.091 -12.507 0.819 1.00 61.24 H new ATOM 0 HB3 SER A 8 10.459 -11.610 1.447 1.00 61.24 H new ATOM 0 HG SER A 8 10.473 -14.083 0.524 1.00 1.12 H new ATOM 104 N HIS A 9 9.161 -10.142 3.207 1.00 21.10 N ATOM 105 CA HIS A 9 8.591 -8.826 3.275 1.00 5.21 C ATOM 106 C HIS A 9 8.465 -8.265 1.896 1.00 75.32 C ATOM 107 O HIS A 9 9.288 -8.576 1.016 1.00 72.21 O ATOM 108 CB HIS A 9 9.455 -7.905 4.137 1.00 41.42 C ATOM 109 CG HIS A 9 9.383 -8.200 5.593 1.00 1.04 C ATOM 110 ND1 HIS A 9 8.777 -7.533 6.594 1.00 33.44 N flip ATOM 111 CD2 HIS A 9 9.956 -9.305 6.172 1.00 55.32 C flip ATOM 112 CE1 HIS A 9 8.992 -8.237 7.738 1.00 51.05 C flip ATOM 113 NE2 HIS A 9 9.704 -9.299 7.456 1.00 61.40 N flip ATOM 0 H HIS A 9 10.181 -10.149 3.233 1.00 21.10 H new ATOM 0 HA HIS A 9 7.604 -8.895 3.732 1.00 5.21 H new ATOM 0 HB2 HIS A 9 10.492 -7.985 3.811 1.00 41.42 H new ATOM 0 HB3 HIS A 9 9.147 -6.873 3.970 1.00 41.42 H new ATOM 0 HD1 HIS A 9 8.254 -6.661 6.510 1.00 33.44 H new ATOM 0 HD2 HIS A 9 10.525 -10.060 5.650 1.00 55.32 H new ATOM 0 HE1 HIS A 9 8.634 -7.964 8.720 1.00 51.05 H new ATOM 122 N ASN A 10 7.463 -7.452 1.703 1.00 43.32 N ATOM 123 CA ASN A 10 7.205 -6.837 0.417 1.00 11.34 C ATOM 124 C ASN A 10 7.049 -5.357 0.634 1.00 1.15 C ATOM 125 O ASN A 10 6.194 -4.923 1.419 1.00 65.32 O ATOM 126 CB ASN A 10 5.931 -7.401 -0.238 1.00 30.41 C ATOM 127 CG ASN A 10 5.977 -8.895 -0.543 1.00 21.24 C ATOM 128 OD1 ASN A 10 7.032 -9.474 -0.797 1.00 34.43 O ATOM 129 ND2 ASN A 10 4.831 -9.522 -0.531 1.00 15.41 N ATOM 0 H ASN A 10 6.797 -7.193 2.431 1.00 43.32 H new ATOM 0 HA ASN A 10 8.037 -7.051 -0.253 1.00 11.34 H new ATOM 0 HB2 ASN A 10 5.084 -7.204 0.419 1.00 30.41 H new ATOM 0 HB3 ASN A 10 5.747 -6.860 -1.166 1.00 30.41 H new ATOM 0 HD21 ASN A 10 4.794 -10.520 -0.736 1.00 15.41 H new ATOM 0 HD22 ASN A 10 3.973 -9.013 -0.316 1.00 15.41 H new ATOM 136 N VAL A 11 7.854 -4.575 -0.033 1.00 75.14 N ATOM 137 CA VAL A 11 7.854 -3.143 0.202 1.00 11.24 C ATOM 138 C VAL A 11 7.450 -2.374 -1.049 1.00 52.53 C ATOM 139 O VAL A 11 8.100 -2.485 -2.077 1.00 74.14 O ATOM 140 CB VAL A 11 9.270 -2.657 0.627 1.00 63.23 C ATOM 141 CG1 VAL A 11 9.261 -1.183 1.028 1.00 71.43 C ATOM 142 CG2 VAL A 11 9.850 -3.522 1.732 1.00 75.34 C ATOM 0 H VAL A 11 8.516 -4.895 -0.740 1.00 75.14 H new ATOM 0 HA VAL A 11 7.133 -2.953 0.997 1.00 11.24 H new ATOM 0 HB VAL A 11 9.918 -2.758 -0.244 1.00 63.23 H new ATOM 0 HG11 VAL A 11 10.267 -0.879 1.319 1.00 71.43 H new ATOM 0 HG12 VAL A 11 8.929 -0.578 0.184 1.00 71.43 H new ATOM 0 HG13 VAL A 11 8.581 -1.039 1.868 1.00 71.43 H new ATOM 0 HG21 VAL A 11 10.839 -3.152 2.002 1.00 75.34 H new ATOM 0 HG22 VAL A 11 9.197 -3.484 2.604 1.00 75.34 H new ATOM 0 HG23 VAL A 11 9.930 -4.552 1.384 1.00 75.34 H new ATOM 152 N PHE A 12 6.384 -1.611 -0.955 1.00 11.22 N ATOM 153 CA PHE A 12 5.990 -0.711 -2.027 1.00 22.00 C ATOM 154 C PHE A 12 6.785 0.562 -1.865 1.00 34.34 C ATOM 155 O PHE A 12 6.587 1.305 -0.894 1.00 11.11 O ATOM 156 CB PHE A 12 4.468 -0.387 -1.972 1.00 25.35 C ATOM 157 CG PHE A 12 3.979 0.585 -3.045 1.00 52.34 C ATOM 158 CD1 PHE A 12 4.034 1.957 -2.829 1.00 70.13 C ATOM 159 CD2 PHE A 12 3.476 0.130 -4.261 1.00 45.43 C ATOM 160 CE1 PHE A 12 3.605 2.844 -3.787 1.00 10.33 C ATOM 161 CE2 PHE A 12 3.047 1.020 -5.219 1.00 45.03 C ATOM 162 CZ PHE A 12 3.111 2.375 -4.981 1.00 2.35 C ATOM 0 H PHE A 12 5.767 -1.593 -0.143 1.00 11.22 H new ATOM 0 HA PHE A 12 6.187 -1.184 -2.989 1.00 22.00 H new ATOM 0 HB2 PHE A 12 3.909 -1.318 -2.064 1.00 25.35 H new ATOM 0 HB3 PHE A 12 4.235 0.029 -0.992 1.00 25.35 H new ATOM 0 HD1 PHE A 12 4.420 2.332 -1.893 1.00 70.13 H new ATOM 0 HD2 PHE A 12 3.422 -0.931 -4.454 1.00 45.43 H new ATOM 0 HE1 PHE A 12 3.656 3.907 -3.602 1.00 10.33 H new ATOM 0 HE2 PHE A 12 2.660 0.655 -6.159 1.00 45.03 H new ATOM 0 HZ PHE A 12 2.772 3.071 -5.734 1.00 2.35 H new ATOM 172 N VAL A 13 7.689 0.811 -2.759 1.00 2.03 N ATOM 173 CA VAL A 13 8.474 2.007 -2.678 1.00 20.02 C ATOM 174 C VAL A 13 8.592 2.653 -4.062 1.00 44.24 C ATOM 175 O VAL A 13 8.400 1.990 -5.082 1.00 64.41 O ATOM 176 CB VAL A 13 9.847 1.743 -1.976 1.00 70.03 C ATOM 177 CG1 VAL A 13 10.660 0.718 -2.700 1.00 45.41 C ATOM 178 CG2 VAL A 13 10.646 3.024 -1.732 1.00 30.31 C ATOM 0 H VAL A 13 7.903 0.206 -3.552 1.00 2.03 H new ATOM 0 HA VAL A 13 7.967 2.732 -2.041 1.00 20.02 H new ATOM 0 HB VAL A 13 9.608 1.336 -0.994 1.00 70.03 H new ATOM 0 HG11 VAL A 13 11.604 0.567 -2.177 1.00 45.41 H new ATOM 0 HG12 VAL A 13 10.111 -0.223 -2.736 1.00 45.41 H new ATOM 0 HG13 VAL A 13 10.858 1.062 -3.715 1.00 45.41 H new ATOM 0 HG21 VAL A 13 11.588 2.777 -1.243 1.00 30.31 H new ATOM 0 HG22 VAL A 13 10.849 3.513 -2.685 1.00 30.31 H new ATOM 0 HG23 VAL A 13 10.071 3.696 -1.094 1.00 30.31 H new ATOM 188 N TYR A 14 8.879 3.935 -4.088 1.00 5.23 N ATOM 189 CA TYR A 14 8.832 4.716 -5.308 1.00 44.22 C ATOM 190 C TYR A 14 10.173 5.472 -5.538 1.00 14.41 C ATOM 191 O TYR A 14 10.238 6.426 -6.305 1.00 52.31 O ATOM 192 CB TYR A 14 7.634 5.691 -5.120 1.00 21.44 C ATOM 193 CG TYR A 14 7.293 6.616 -6.265 1.00 42.15 C ATOM 194 CD1 TYR A 14 6.722 6.134 -7.427 1.00 3.02 C ATOM 195 CD2 TYR A 14 7.511 7.984 -6.159 1.00 33.24 C ATOM 196 CE1 TYR A 14 6.384 6.984 -8.456 1.00 33.50 C ATOM 197 CE2 TYR A 14 7.179 8.840 -7.183 1.00 53.54 C ATOM 198 CZ TYR A 14 6.616 8.333 -8.329 1.00 72.22 C ATOM 199 OH TYR A 14 6.273 9.179 -9.352 1.00 4.55 O ATOM 0 H TYR A 14 9.152 4.469 -3.263 1.00 5.23 H new ATOM 0 HA TYR A 14 8.697 4.093 -6.193 1.00 44.22 H new ATOM 0 HB2 TYR A 14 6.749 5.095 -4.896 1.00 21.44 H new ATOM 0 HB3 TYR A 14 7.836 6.305 -4.242 1.00 21.44 H new ATOM 0 HD1 TYR A 14 6.538 5.075 -7.530 1.00 3.02 H new ATOM 0 HD2 TYR A 14 7.949 8.383 -5.256 1.00 33.24 H new ATOM 0 HE1 TYR A 14 5.939 6.593 -9.359 1.00 33.50 H new ATOM 0 HE2 TYR A 14 7.359 9.901 -7.087 1.00 53.54 H new ATOM 0 HH TYR A 14 5.503 8.812 -9.835 1.00 4.55 H new ATOM 209 N GLY A 15 11.258 4.997 -4.932 1.00 32.15 N ATOM 210 CA GLY A 15 12.485 5.763 -5.028 1.00 43.02 C ATOM 211 C GLY A 15 13.766 4.988 -5.312 1.00 14.32 C ATOM 212 O GLY A 15 13.807 4.102 -6.157 1.00 61.02 O ATOM 0 H GLY A 15 11.311 4.130 -4.397 1.00 32.15 H new ATOM 0 HA2 GLY A 15 12.359 6.507 -5.814 1.00 43.02 H new ATOM 0 HA3 GLY A 15 12.619 6.307 -4.093 1.00 43.02 H new ATOM 216 N SER A 16 14.784 5.327 -4.536 1.00 54.12 N ATOM 217 CA SER A 16 16.187 4.921 -4.699 1.00 71.22 C ATOM 218 C SER A 16 16.445 3.455 -5.121 1.00 22.14 C ATOM 219 O SER A 16 17.217 3.205 -6.046 1.00 42.51 O ATOM 220 CB SER A 16 16.924 5.224 -3.402 1.00 1.33 C ATOM 221 OG SER A 16 16.754 6.590 -3.042 1.00 5.25 O ATOM 0 H SER A 16 14.653 5.930 -3.724 1.00 54.12 H new ATOM 0 HA SER A 16 16.559 5.500 -5.545 1.00 71.22 H new ATOM 0 HB2 SER A 16 16.549 4.582 -2.605 1.00 1.33 H new ATOM 0 HB3 SER A 16 17.985 5.001 -3.518 1.00 1.33 H new ATOM 0 HG SER A 16 17.232 6.770 -2.205 1.00 5.25 H new ATOM 227 N ILE A 17 15.816 2.510 -4.485 1.00 4.23 N ATOM 228 CA ILE A 17 16.168 1.124 -4.739 1.00 62.30 C ATOM 229 C ILE A 17 15.460 0.494 -5.961 1.00 1.10 C ATOM 230 O ILE A 17 15.676 -0.674 -6.259 1.00 23.34 O ATOM 231 CB ILE A 17 16.055 0.245 -3.448 1.00 74.42 C ATOM 232 CG1 ILE A 17 14.673 0.253 -2.851 1.00 14.44 C ATOM 233 CG2 ILE A 17 17.034 0.674 -2.415 1.00 73.40 C ATOM 234 CD1 ILE A 17 13.726 -0.549 -3.607 1.00 22.41 C ATOM 0 H ILE A 17 15.073 2.656 -3.801 1.00 4.23 H new ATOM 0 HA ILE A 17 17.220 1.144 -5.024 1.00 62.30 H new ATOM 0 HB ILE A 17 16.278 -0.773 -3.766 1.00 74.42 H new ATOM 0 HG12 ILE A 17 14.722 -0.120 -1.828 1.00 14.44 H new ATOM 0 HG13 ILE A 17 14.311 1.280 -2.798 1.00 14.44 H new ATOM 0 HG21 ILE A 17 16.930 0.044 -1.531 1.00 73.40 H new ATOM 0 HG22 ILE A 17 18.045 0.580 -2.811 1.00 73.40 H new ATOM 0 HG23 ILE A 17 16.846 1.713 -2.144 1.00 73.40 H new ATOM 0 HD11 ILE A 17 12.748 -0.504 -3.128 1.00 22.41 H new ATOM 0 HD12 ILE A 17 13.651 -0.162 -4.623 1.00 22.41 H new ATOM 0 HD13 ILE A 17 14.068 -1.583 -3.638 1.00 22.41 H new ATOM 246 N LEU A 18 14.632 1.281 -6.670 1.00 2.14 N ATOM 247 CA LEU A 18 13.938 0.775 -7.871 1.00 34.04 C ATOM 248 C LEU A 18 14.888 0.505 -9.019 1.00 54.12 C ATOM 249 O LEU A 18 14.509 -0.108 -10.016 1.00 64.11 O ATOM 250 CB LEU A 18 12.734 1.641 -8.306 1.00 21.41 C ATOM 251 CG LEU A 18 11.427 1.470 -7.489 1.00 23.34 C ATOM 252 CD1 LEU A 18 11.601 1.823 -6.036 1.00 1.52 C ATOM 253 CD2 LEU A 18 10.281 2.261 -8.103 1.00 42.15 C ATOM 0 H LEU A 18 14.428 2.253 -6.439 1.00 2.14 H new ATOM 0 HA LEU A 18 13.516 -0.185 -7.572 1.00 34.04 H new ATOM 0 HB2 LEU A 18 13.032 2.688 -8.257 1.00 21.41 H new ATOM 0 HB3 LEU A 18 12.515 1.420 -9.351 1.00 21.41 H new ATOM 0 HG LEU A 18 11.175 0.410 -7.532 1.00 23.34 H new ATOM 0 HD11 LEU A 18 10.655 1.685 -5.512 1.00 1.52 H new ATOM 0 HD12 LEU A 18 12.359 1.177 -5.593 1.00 1.52 H new ATOM 0 HD13 LEU A 18 11.915 2.863 -5.949 1.00 1.52 H new ATOM 0 HD21 LEU A 18 9.380 2.119 -7.506 1.00 42.15 H new ATOM 0 HD22 LEU A 18 10.540 3.320 -8.124 1.00 42.15 H new ATOM 0 HD23 LEU A 18 10.101 1.911 -9.120 1.00 42.15 H new ATOM 265 N GLU A 19 16.119 0.962 -8.878 1.00 13.42 N ATOM 266 CA GLU A 19 17.156 0.597 -9.806 1.00 52.41 C ATOM 267 C GLU A 19 17.642 -0.798 -9.412 1.00 10.32 C ATOM 268 O GLU A 19 18.113 -0.985 -8.284 1.00 23.32 O ATOM 269 CB GLU A 19 18.329 1.588 -9.768 1.00 22.34 C ATOM 270 CG GLU A 19 18.007 2.990 -10.259 1.00 22.02 C ATOM 271 CD GLU A 19 19.219 3.908 -10.228 1.00 34.20 C ATOM 272 OE1 GLU A 19 20.088 3.801 -11.110 1.00 21.20 O ATOM 273 OE2 GLU A 19 19.317 4.752 -9.321 1.00 1.14 O ATOM 0 H GLU A 19 16.418 1.586 -8.128 1.00 13.42 H new ATOM 0 HA GLU A 19 16.761 0.612 -10.822 1.00 52.41 H new ATOM 0 HB2 GLU A 19 18.695 1.654 -8.743 1.00 22.34 H new ATOM 0 HB3 GLU A 19 19.143 1.187 -10.372 1.00 22.34 H new ATOM 0 HG2 GLU A 19 17.622 2.936 -11.277 1.00 22.02 H new ATOM 0 HG3 GLU A 19 17.216 3.416 -9.641 1.00 22.02 H new ATOM 280 N PRO A 20 17.510 -1.796 -10.317 1.00 74.34 N ATOM 281 CA PRO A 20 17.881 -3.207 -10.048 1.00 73.53 C ATOM 282 C PRO A 20 19.264 -3.378 -9.403 1.00 13.33 C ATOM 283 O PRO A 20 19.455 -4.244 -8.532 1.00 73.13 O ATOM 284 CB PRO A 20 17.865 -3.836 -11.440 1.00 13.14 C ATOM 285 CG PRO A 20 16.842 -3.054 -12.179 1.00 13.33 C ATOM 286 CD PRO A 20 16.966 -1.639 -11.686 1.00 15.24 C ATOM 0 HA PRO A 20 17.199 -3.663 -9.331 1.00 73.53 H new ATOM 0 HB2 PRO A 20 18.842 -3.768 -11.919 1.00 13.14 H new ATOM 0 HB3 PRO A 20 17.604 -4.893 -11.397 1.00 13.14 H new ATOM 0 HG2 PRO A 20 17.011 -3.109 -13.254 1.00 13.33 H new ATOM 0 HG3 PRO A 20 15.842 -3.446 -11.993 1.00 13.33 H new ATOM 0 HD2 PRO A 20 17.632 -1.051 -12.317 1.00 15.24 H new ATOM 0 HD3 PRO A 20 16.002 -1.131 -11.679 1.00 15.24 H new ATOM 294 N ALA A 21 20.213 -2.554 -9.818 1.00 33.21 N ATOM 295 CA ALA A 21 21.565 -2.611 -9.289 1.00 44.30 C ATOM 296 C ALA A 21 21.603 -2.199 -7.809 1.00 62.35 C ATOM 297 O ALA A 21 22.359 -2.758 -7.020 1.00 60.20 O ATOM 298 CB ALA A 21 22.491 -1.734 -10.118 1.00 32.00 C ATOM 0 H ALA A 21 20.069 -1.833 -10.525 1.00 33.21 H new ATOM 0 HA ALA A 21 21.912 -3.642 -9.352 1.00 44.30 H new ATOM 0 HB1 ALA A 21 23.501 -1.785 -9.712 1.00 32.00 H new ATOM 0 HB2 ALA A 21 22.497 -2.085 -11.150 1.00 32.00 H new ATOM 0 HB3 ALA A 21 22.139 -0.703 -10.087 1.00 32.00 H new ATOM 304 N VAL A 22 20.759 -1.255 -7.445 1.00 63.04 N ATOM 305 CA VAL A 22 20.704 -0.732 -6.089 1.00 42.43 C ATOM 306 C VAL A 22 19.979 -1.718 -5.171 1.00 61.15 C ATOM 307 O VAL A 22 20.394 -1.947 -4.035 1.00 71.05 O ATOM 308 CB VAL A 22 19.998 0.644 -6.038 1.00 33.25 C ATOM 309 CG1 VAL A 22 20.030 1.215 -4.631 1.00 1.51 C ATOM 310 CG2 VAL A 22 20.648 1.606 -7.011 1.00 45.41 C ATOM 0 H VAL A 22 20.088 -0.825 -8.082 1.00 63.04 H new ATOM 0 HA VAL A 22 21.730 -0.600 -5.745 1.00 42.43 H new ATOM 0 HB VAL A 22 18.956 0.504 -6.327 1.00 33.25 H new ATOM 0 HG11 VAL A 22 19.528 2.182 -4.619 1.00 1.51 H new ATOM 0 HG12 VAL A 22 19.520 0.533 -3.950 1.00 1.51 H new ATOM 0 HG13 VAL A 22 21.065 1.339 -4.312 1.00 1.51 H new ATOM 0 HG21 VAL A 22 20.141 2.570 -6.964 1.00 45.41 H new ATOM 0 HG22 VAL A 22 21.698 1.736 -6.748 1.00 45.41 H new ATOM 0 HG23 VAL A 22 20.574 1.206 -8.022 1.00 45.41 H new ATOM 320 N ALA A 23 18.906 -2.314 -5.671 1.00 25.22 N ATOM 321 CA ALA A 23 18.181 -3.339 -4.917 1.00 62.45 C ATOM 322 C ALA A 23 19.124 -4.495 -4.586 1.00 70.51 C ATOM 323 O ALA A 23 19.058 -5.094 -3.507 1.00 71.40 O ATOM 324 CB ALA A 23 17.007 -3.847 -5.724 1.00 2.10 C ATOM 0 H ALA A 23 18.516 -2.110 -6.591 1.00 25.22 H new ATOM 0 HA ALA A 23 17.807 -2.902 -3.991 1.00 62.45 H new ATOM 0 HB1 ALA A 23 16.476 -4.609 -5.153 1.00 2.10 H new ATOM 0 HB2 ALA A 23 16.331 -3.020 -5.943 1.00 2.10 H new ATOM 0 HB3 ALA A 23 17.367 -4.279 -6.658 1.00 2.10 H new ATOM 330 N ALA A 24 20.047 -4.755 -5.498 1.00 22.05 N ATOM 331 CA ALA A 24 21.005 -5.826 -5.336 1.00 41.33 C ATOM 332 C ALA A 24 22.123 -5.467 -4.354 1.00 72.21 C ATOM 333 O ALA A 24 22.895 -6.328 -3.960 1.00 11.01 O ATOM 334 CB ALA A 24 21.582 -6.251 -6.673 1.00 75.11 C ATOM 0 H ALA A 24 20.149 -4.230 -6.366 1.00 22.05 H new ATOM 0 HA ALA A 24 20.461 -6.669 -4.909 1.00 41.33 H new ATOM 0 HB1 ALA A 24 22.299 -7.058 -6.520 1.00 75.11 H new ATOM 0 HB2 ALA A 24 20.778 -6.598 -7.322 1.00 75.11 H new ATOM 0 HB3 ALA A 24 22.084 -5.403 -7.139 1.00 75.11 H new ATOM 340 N VAL A 25 22.225 -4.202 -3.963 1.00 74.34 N ATOM 341 CA VAL A 25 23.247 -3.821 -2.990 1.00 41.01 C ATOM 342 C VAL A 25 22.634 -3.646 -1.609 1.00 41.11 C ATOM 343 O VAL A 25 23.302 -3.826 -0.597 1.00 64.35 O ATOM 344 CB VAL A 25 24.074 -2.551 -3.389 1.00 24.40 C ATOM 345 CG1 VAL A 25 24.695 -2.711 -4.759 1.00 40.03 C ATOM 346 CG2 VAL A 25 23.259 -1.275 -3.308 1.00 73.44 C ATOM 0 H VAL A 25 21.632 -3.440 -4.292 1.00 74.34 H new ATOM 0 HA VAL A 25 23.960 -4.646 -2.975 1.00 41.01 H new ATOM 0 HB VAL A 25 24.876 -2.460 -2.657 1.00 24.40 H new ATOM 0 HG11 VAL A 25 25.262 -1.814 -5.008 1.00 40.03 H new ATOM 0 HG12 VAL A 25 25.362 -3.573 -4.758 1.00 40.03 H new ATOM 0 HG13 VAL A 25 23.909 -2.861 -5.499 1.00 40.03 H new ATOM 0 HG21 VAL A 25 23.881 -0.427 -3.595 1.00 73.44 H new ATOM 0 HG22 VAL A 25 22.406 -1.344 -3.983 1.00 73.44 H new ATOM 0 HG23 VAL A 25 22.903 -1.135 -2.287 1.00 73.44 H new ATOM 356 N ILE A 26 21.346 -3.308 -1.569 1.00 71.20 N ATOM 357 CA ILE A 26 20.658 -3.148 -0.302 1.00 10.33 C ATOM 358 C ILE A 26 20.319 -4.509 0.301 1.00 75.02 C ATOM 359 O ILE A 26 20.386 -4.706 1.511 1.00 10.32 O ATOM 360 CB ILE A 26 19.393 -2.244 -0.420 1.00 35.34 C ATOM 361 CG1 ILE A 26 18.777 -2.046 0.953 1.00 52.41 C ATOM 362 CG2 ILE A 26 18.393 -2.851 -1.371 1.00 12.52 C ATOM 363 CD1 ILE A 26 17.993 -0.803 1.078 1.00 21.41 C ATOM 0 H ILE A 26 20.768 -3.143 -2.393 1.00 71.20 H new ATOM 0 HA ILE A 26 21.340 -2.633 0.374 1.00 10.33 H new ATOM 0 HB ILE A 26 19.687 -1.273 -0.818 1.00 35.34 H new ATOM 0 HG12 ILE A 26 18.132 -2.896 1.178 1.00 52.41 H new ATOM 0 HG13 ILE A 26 19.571 -2.041 1.700 1.00 52.41 H new ATOM 0 HG21 ILE A 26 17.518 -2.205 -1.439 1.00 12.52 H new ATOM 0 HG22 ILE A 26 18.845 -2.955 -2.357 1.00 12.52 H new ATOM 0 HG23 ILE A 26 18.092 -3.833 -1.005 1.00 12.52 H new ATOM 0 HD11 ILE A 26 17.584 -0.731 2.086 1.00 21.41 H new ATOM 0 HD12 ILE A 26 18.638 0.055 0.885 1.00 21.41 H new ATOM 0 HD13 ILE A 26 17.177 -0.813 0.355 1.00 21.41 H new ATOM 375 N LEU A 27 19.977 -5.447 -0.550 1.00 31.22 N ATOM 376 CA LEU A 27 19.688 -6.790 -0.113 1.00 1.04 C ATOM 377 C LEU A 27 20.908 -7.658 -0.257 1.00 22.22 C ATOM 378 O LEU A 27 20.954 -8.765 0.272 1.00 55.11 O ATOM 379 CB LEU A 27 18.542 -7.386 -0.929 1.00 34.03 C ATOM 380 CG LEU A 27 17.179 -6.733 -0.767 1.00 41.10 C ATOM 381 CD1 LEU A 27 16.170 -7.406 -1.662 1.00 25.43 C ATOM 382 CD2 LEU A 27 16.729 -6.809 0.673 1.00 71.53 C ATOM 0 H LEU A 27 19.892 -5.302 -1.556 1.00 31.22 H new ATOM 0 HA LEU A 27 19.394 -6.750 0.936 1.00 1.04 H new ATOM 0 HB2 LEU A 27 18.817 -7.344 -1.983 1.00 34.03 H new ATOM 0 HB3 LEU A 27 18.448 -8.440 -0.666 1.00 34.03 H new ATOM 0 HG LEU A 27 17.259 -5.684 -1.053 1.00 41.10 H new ATOM 0 HD11 LEU A 27 15.198 -6.929 -1.537 1.00 25.43 H new ATOM 0 HD12 LEU A 27 16.488 -7.316 -2.701 1.00 25.43 H new ATOM 0 HD13 LEU A 27 16.094 -8.460 -1.396 1.00 25.43 H new ATOM 0 HD21 LEU A 27 15.751 -6.337 0.774 1.00 71.53 H new ATOM 0 HD22 LEU A 27 16.662 -7.853 0.979 1.00 71.53 H new ATOM 0 HD23 LEU A 27 17.449 -6.291 1.307 1.00 71.53 H new ATOM 394 N ASP A 28 21.899 -7.151 -1.022 1.00 63.00 N ATOM 395 CA ASP A 28 23.157 -7.885 -1.348 1.00 74.04 C ATOM 396 C ASP A 28 22.845 -9.076 -2.278 1.00 43.54 C ATOM 397 O ASP A 28 23.730 -9.787 -2.764 1.00 13.43 O ATOM 398 CB ASP A 28 23.889 -8.329 -0.057 1.00 73.42 C ATOM 399 CG ASP A 28 25.199 -9.051 -0.289 1.00 1.01 C ATOM 400 OD1 ASP A 28 26.234 -8.381 -0.531 1.00 32.04 O ATOM 401 OD2 ASP A 28 25.225 -10.291 -0.212 1.00 41.01 O ATOM 0 H ASP A 28 21.856 -6.219 -1.435 1.00 63.00 H new ATOM 0 HA ASP A 28 23.834 -7.215 -1.879 1.00 74.04 H new ATOM 0 HB2 ASP A 28 24.079 -7.449 0.558 1.00 73.42 H new ATOM 0 HB3 ASP A 28 23.227 -8.980 0.514 1.00 73.42 H new ATOM 406 N ARG A 29 21.575 -9.218 -2.567 1.00 22.21 N ATOM 407 CA ARG A 29 21.028 -10.282 -3.357 1.00 30.54 C ATOM 408 C ARG A 29 20.088 -9.642 -4.342 1.00 10.41 C ATOM 409 O ARG A 29 19.875 -8.430 -4.282 1.00 21.14 O ATOM 410 CB ARG A 29 20.228 -11.246 -2.456 1.00 31.41 C ATOM 411 CG ARG A 29 21.016 -11.843 -1.297 1.00 14.44 C ATOM 412 CD ARG A 29 20.122 -12.691 -0.407 1.00 31.12 C ATOM 413 NE ARG A 29 20.833 -13.197 0.778 1.00 22.42 N ATOM 414 CZ ARG A 29 20.239 -13.625 1.909 1.00 51.21 C ATOM 415 NH1 ARG A 29 18.911 -13.678 1.996 1.00 64.11 N ATOM 416 NH2 ARG A 29 20.978 -14.006 2.942 1.00 31.00 N ATOM 0 H ARG A 29 20.866 -8.562 -2.240 1.00 22.21 H new ATOM 0 HA ARG A 29 21.818 -10.845 -3.855 1.00 30.54 H new ATOM 0 HB2 ARG A 29 19.366 -10.713 -2.054 1.00 31.41 H new ATOM 0 HB3 ARG A 29 19.842 -12.059 -3.071 1.00 31.41 H new ATOM 0 HG2 ARG A 29 21.832 -12.453 -1.684 1.00 14.44 H new ATOM 0 HG3 ARG A 29 21.466 -11.043 -0.709 1.00 14.44 H new ATOM 0 HD2 ARG A 29 19.264 -12.099 -0.088 1.00 31.12 H new ATOM 0 HD3 ARG A 29 19.733 -13.532 -0.982 1.00 31.12 H new ATOM 0 HE ARG A 29 21.852 -13.226 0.740 1.00 22.42 H new ATOM 0 HH11 ARG A 29 18.336 -13.393 1.203 1.00 64.11 H new ATOM 0 HH12 ARG A 29 18.469 -14.003 2.856 1.00 64.11 H new ATOM 0 HH21 ARG A 29 21.996 -13.975 2.880 1.00 31.00 H new ATOM 0 HH22 ARG A 29 20.529 -14.330 3.798 1.00 31.00 H new ATOM 430 N THR A 30 19.521 -10.416 -5.208 1.00 51.10 N ATOM 431 CA THR A 30 18.599 -9.895 -6.173 1.00 50.10 C ATOM 432 C THR A 30 17.237 -9.620 -5.544 1.00 74.23 C ATOM 433 O THR A 30 16.794 -10.340 -4.631 1.00 24.53 O ATOM 434 CB THR A 30 18.471 -10.838 -7.383 1.00 53.44 C ATOM 435 OG1 THR A 30 18.203 -12.182 -6.934 1.00 21.14 O ATOM 436 CG2 THR A 30 19.746 -10.816 -8.208 1.00 11.35 C ATOM 0 H THR A 30 19.680 -11.422 -5.270 1.00 51.10 H new ATOM 0 HA THR A 30 18.996 -8.945 -6.531 1.00 50.10 H new ATOM 0 HB THR A 30 17.644 -10.496 -8.005 1.00 53.44 H new ATOM 0 HG1 THR A 30 18.121 -12.776 -7.709 1.00 21.14 H new ATOM 0 HG21 THR A 30 19.640 -11.488 -9.060 1.00 11.35 H new ATOM 0 HG22 THR A 30 19.931 -9.803 -8.566 1.00 11.35 H new ATOM 0 HG23 THR A 30 20.584 -11.141 -7.592 1.00 11.35 H new ATOM 444 N ALA A 31 16.601 -8.571 -5.995 1.00 71.23 N ATOM 445 CA ALA A 31 15.305 -8.203 -5.508 1.00 55.31 C ATOM 446 C ALA A 31 14.323 -8.299 -6.621 1.00 34.15 C ATOM 447 O ALA A 31 14.608 -7.847 -7.740 1.00 11.40 O ATOM 448 CB ALA A 31 15.325 -6.783 -5.010 1.00 72.34 C ATOM 0 H ALA A 31 16.972 -7.948 -6.713 1.00 71.23 H new ATOM 0 HA ALA A 31 15.028 -8.872 -4.693 1.00 55.31 H new ATOM 0 HB1 ALA A 31 14.335 -6.513 -4.642 1.00 72.34 H new ATOM 0 HB2 ALA A 31 16.050 -6.691 -4.202 1.00 72.34 H new ATOM 0 HB3 ALA A 31 15.604 -6.115 -5.825 1.00 72.34 H new ATOM 454 N ASP A 32 13.193 -8.871 -6.376 1.00 63.02 N ATOM 455 CA ASP A 32 12.230 -8.913 -7.418 1.00 51.32 C ATOM 456 C ASP A 32 11.226 -7.820 -7.205 1.00 33.14 C ATOM 457 O ASP A 32 10.453 -7.847 -6.255 1.00 32.12 O ATOM 458 CB ASP A 32 11.556 -10.283 -7.533 1.00 14.21 C ATOM 459 CG ASP A 32 10.646 -10.380 -8.751 1.00 41.52 C ATOM 460 OD1 ASP A 32 11.132 -10.141 -9.885 1.00 74.24 O ATOM 461 OD2 ASP A 32 9.466 -10.704 -8.608 1.00 20.22 O ATOM 0 H ASP A 32 12.920 -9.303 -5.493 1.00 63.02 H new ATOM 0 HA ASP A 32 12.741 -8.752 -8.367 1.00 51.32 H new ATOM 0 HB2 ASP A 32 12.321 -11.058 -7.591 1.00 14.21 H new ATOM 0 HB3 ASP A 32 10.974 -10.476 -6.632 1.00 14.21 H new ATOM 466 N THR A 33 11.272 -6.834 -8.048 1.00 42.14 N ATOM 467 CA THR A 33 10.315 -5.787 -7.978 1.00 42.21 C ATOM 468 C THR A 33 9.332 -5.920 -9.095 1.00 70.13 C ATOM 469 O THR A 33 9.699 -6.271 -10.231 1.00 34.42 O ATOM 470 CB THR A 33 10.966 -4.375 -8.023 1.00 51.31 C ATOM 471 OG1 THR A 33 12.060 -4.319 -8.964 1.00 13.20 O ATOM 472 CG2 THR A 33 11.384 -3.867 -6.652 1.00 75.44 C ATOM 0 H THR A 33 11.965 -6.738 -8.791 1.00 42.14 H new ATOM 0 HA THR A 33 9.810 -5.882 -7.017 1.00 42.21 H new ATOM 0 HB THR A 33 10.189 -3.698 -8.376 1.00 51.31 H new ATOM 0 HG1 THR A 33 12.443 -3.417 -8.967 1.00 13.20 H new ATOM 0 HG21 THR A 33 11.831 -2.878 -6.751 1.00 75.44 H new ATOM 0 HG22 THR A 33 10.509 -3.807 -6.004 1.00 75.44 H new ATOM 0 HG23 THR A 33 12.112 -4.552 -6.216 1.00 75.44 H new ATOM 480 N VAL A 34 8.115 -5.630 -8.807 1.00 54.22 N ATOM 481 CA VAL A 34 7.086 -5.680 -9.794 1.00 12.04 C ATOM 482 C VAL A 34 6.326 -4.382 -9.767 1.00 61.21 C ATOM 483 O VAL A 34 6.108 -3.817 -8.682 1.00 11.54 O ATOM 484 CB VAL A 34 6.105 -6.893 -9.598 1.00 73.42 C ATOM 485 CG1 VAL A 34 6.833 -8.218 -9.733 1.00 11.21 C ATOM 486 CG2 VAL A 34 5.403 -6.830 -8.258 1.00 2.12 C ATOM 0 H VAL A 34 7.798 -5.350 -7.879 1.00 54.22 H new ATOM 0 HA VAL A 34 7.560 -5.827 -10.764 1.00 12.04 H new ATOM 0 HB VAL A 34 5.355 -6.823 -10.385 1.00 73.42 H new ATOM 0 HG11 VAL A 34 6.127 -9.037 -9.592 1.00 11.21 H new ATOM 0 HG12 VAL A 34 7.278 -8.289 -10.725 1.00 11.21 H new ATOM 0 HG13 VAL A 34 7.617 -8.281 -8.978 1.00 11.21 H new ATOM 0 HG21 VAL A 34 4.733 -7.684 -8.158 1.00 2.12 H new ATOM 0 HG22 VAL A 34 6.143 -6.853 -7.458 1.00 2.12 H new ATOM 0 HG23 VAL A 34 4.827 -5.907 -8.192 1.00 2.12 H new ATOM 496 N PRO A 35 6.001 -3.834 -10.945 1.00 12.31 N ATOM 497 CA PRO A 35 5.185 -2.638 -11.044 1.00 52.54 C ATOM 498 C PRO A 35 3.864 -2.867 -10.362 1.00 10.20 C ATOM 499 O PRO A 35 3.114 -3.738 -10.748 1.00 60.42 O ATOM 500 CB PRO A 35 4.957 -2.447 -12.548 1.00 73.21 C ATOM 501 CG PRO A 35 5.476 -3.674 -13.207 1.00 33.44 C ATOM 502 CD PRO A 35 6.417 -4.335 -12.258 1.00 60.11 C ATOM 0 HA PRO A 35 5.657 -1.773 -10.578 1.00 52.54 H new ATOM 0 HB2 PRO A 35 3.898 -2.307 -12.766 1.00 73.21 H new ATOM 0 HB3 PRO A 35 5.478 -1.561 -12.911 1.00 73.21 H new ATOM 0 HG2 PRO A 35 4.657 -4.346 -13.464 1.00 33.44 H new ATOM 0 HG3 PRO A 35 5.985 -3.422 -14.137 1.00 33.44 H new ATOM 0 HD2 PRO A 35 6.343 -5.421 -12.313 1.00 60.11 H new ATOM 0 HD3 PRO A 35 7.453 -4.074 -12.475 1.00 60.11 H new ATOM 510 N ALA A 36 3.603 -2.118 -9.355 1.00 4.33 N ATOM 511 CA ALA A 36 2.402 -2.269 -8.610 1.00 13.24 C ATOM 512 C ALA A 36 1.828 -0.927 -8.343 1.00 63.53 C ATOM 513 O ALA A 36 2.549 0.072 -8.321 1.00 43.52 O ATOM 514 CB ALA A 36 2.664 -2.995 -7.307 1.00 42.25 C ATOM 0 H ALA A 36 4.219 -1.377 -9.020 1.00 4.33 H new ATOM 0 HA ALA A 36 1.695 -2.864 -9.188 1.00 13.24 H new ATOM 0 HB1 ALA A 36 1.730 -3.099 -6.754 1.00 42.25 H new ATOM 0 HB2 ALA A 36 3.073 -3.983 -7.517 1.00 42.25 H new ATOM 0 HB3 ALA A 36 3.377 -2.426 -6.711 1.00 42.25 H new ATOM 520 N VAL A 37 0.564 -0.876 -8.137 1.00 71.14 N ATOM 521 CA VAL A 37 -0.062 0.374 -7.918 1.00 50.45 C ATOM 522 C VAL A 37 -0.865 0.383 -6.621 1.00 21.42 C ATOM 523 O VAL A 37 -1.700 -0.502 -6.362 1.00 22.25 O ATOM 524 CB VAL A 37 -0.907 0.805 -9.136 1.00 42.45 C ATOM 525 CG1 VAL A 37 -2.037 -0.174 -9.401 1.00 55.52 C ATOM 526 CG2 VAL A 37 -1.415 2.219 -8.974 1.00 71.24 C ATOM 0 H VAL A 37 -0.057 -1.685 -8.115 1.00 71.14 H new ATOM 0 HA VAL A 37 0.725 1.119 -7.801 1.00 50.45 H new ATOM 0 HB VAL A 37 -0.259 0.791 -10.013 1.00 42.45 H new ATOM 0 HG11 VAL A 37 -2.612 0.159 -10.265 1.00 55.52 H new ATOM 0 HG12 VAL A 37 -1.623 -1.162 -9.600 1.00 55.52 H new ATOM 0 HG13 VAL A 37 -2.688 -0.223 -8.528 1.00 55.52 H new ATOM 0 HG21 VAL A 37 -2.007 2.495 -9.847 1.00 71.24 H new ATOM 0 HG22 VAL A 37 -2.035 2.283 -8.080 1.00 71.24 H new ATOM 0 HG23 VAL A 37 -0.570 2.901 -8.878 1.00 71.24 H new ATOM 536 N LEU A 38 -0.594 1.364 -5.814 1.00 10.21 N ATOM 537 CA LEU A 38 -1.222 1.524 -4.546 1.00 74.21 C ATOM 538 C LEU A 38 -2.500 2.299 -4.636 1.00 30.22 C ATOM 539 O LEU A 38 -2.496 3.514 -4.686 1.00 33.10 O ATOM 540 CB LEU A 38 -0.273 2.172 -3.540 1.00 2.14 C ATOM 541 CG LEU A 38 -0.884 2.590 -2.198 1.00 33.24 C ATOM 542 CD1 LEU A 38 -1.632 1.449 -1.544 1.00 33.51 C ATOM 543 CD2 LEU A 38 0.202 3.080 -1.288 1.00 65.23 C ATOM 0 H LEU A 38 0.088 2.091 -6.029 1.00 10.21 H new ATOM 0 HA LEU A 38 -1.474 0.524 -4.194 1.00 74.21 H new ATOM 0 HB2 LEU A 38 0.542 1.476 -3.342 1.00 2.14 H new ATOM 0 HB3 LEU A 38 0.167 3.054 -4.005 1.00 2.14 H new ATOM 0 HG LEU A 38 -1.602 3.389 -2.385 1.00 33.24 H new ATOM 0 HD11 LEU A 38 -2.050 1.785 -0.595 1.00 33.51 H new ATOM 0 HD12 LEU A 38 -2.438 1.119 -2.200 1.00 33.51 H new ATOM 0 HD13 LEU A 38 -0.947 0.620 -1.365 1.00 33.51 H new ATOM 0 HD21 LEU A 38 -0.230 3.378 -0.333 1.00 65.23 H new ATOM 0 HD22 LEU A 38 0.927 2.283 -1.125 1.00 65.23 H new ATOM 0 HD23 LEU A 38 0.700 3.936 -1.744 1.00 65.23 H new ATOM 555 N HIS A 39 -3.576 1.586 -4.709 1.00 41.40 N ATOM 556 CA HIS A 39 -4.886 2.181 -4.661 1.00 62.33 C ATOM 557 C HIS A 39 -5.197 2.661 -3.246 1.00 11.32 C ATOM 558 O HIS A 39 -5.062 1.901 -2.283 1.00 11.22 O ATOM 559 CB HIS A 39 -5.978 1.200 -5.182 1.00 44.30 C ATOM 560 CG HIS A 39 -6.085 -0.148 -4.468 1.00 20.20 C ATOM 561 ND1 HIS A 39 -5.620 -1.320 -5.019 1.00 45.41 N ATOM 562 CD2 HIS A 39 -6.633 -0.501 -3.273 1.00 25.44 C ATOM 563 CE1 HIS A 39 -5.869 -2.326 -4.202 1.00 34.11 C ATOM 564 NE2 HIS A 39 -6.480 -1.863 -3.144 1.00 12.24 N ATOM 0 H HIS A 39 -3.579 0.570 -4.804 1.00 41.40 H new ATOM 0 HA HIS A 39 -4.892 3.046 -5.325 1.00 62.33 H new ATOM 0 HB2 HIS A 39 -6.945 1.699 -5.114 1.00 44.30 H new ATOM 0 HB3 HIS A 39 -5.790 1.012 -6.239 1.00 44.30 H new ATOM 0 HD2 HIS A 39 -7.100 0.163 -2.560 1.00 25.44 H new ATOM 0 HE1 HIS A 39 -5.611 -3.360 -4.379 1.00 34.11 H new ATOM 0 HE2 HIS A 39 -6.793 -2.421 -2.350 1.00 12.24 H new ATOM 573 N GLY A 40 -5.562 3.909 -3.118 1.00 3.44 N ATOM 574 CA GLY A 40 -5.934 4.411 -1.825 1.00 62.23 C ATOM 575 C GLY A 40 -5.024 5.500 -1.330 1.00 70.53 C ATOM 576 O GLY A 40 -5.284 6.097 -0.285 1.00 2.40 O ATOM 0 H GLY A 40 -5.609 4.586 -3.880 1.00 3.44 H new ATOM 0 HA2 GLY A 40 -6.955 4.791 -1.870 1.00 62.23 H new ATOM 0 HA3 GLY A 40 -5.931 3.590 -1.108 1.00 62.23 H new ATOM 580 N TYR A 41 -3.939 5.745 -2.035 1.00 3.44 N ATOM 581 CA TYR A 41 -3.056 6.813 -1.684 1.00 21.13 C ATOM 582 C TYR A 41 -2.790 7.739 -2.827 1.00 44.41 C ATOM 583 O TYR A 41 -2.743 7.329 -3.978 1.00 35.32 O ATOM 584 CB TYR A 41 -1.760 6.295 -1.084 1.00 13.22 C ATOM 585 CG TYR A 41 -1.872 5.970 0.376 1.00 20.43 C ATOM 586 CD1 TYR A 41 -2.362 4.750 0.827 1.00 61.53 C ATOM 587 CD2 TYR A 41 -1.502 6.912 1.311 1.00 2.41 C ATOM 588 CE1 TYR A 41 -2.480 4.492 2.177 1.00 32.35 C ATOM 589 CE2 TYR A 41 -1.610 6.664 2.658 1.00 52.34 C ATOM 590 CZ TYR A 41 -2.102 5.454 3.088 1.00 74.32 C ATOM 591 OH TYR A 41 -2.223 5.209 4.441 1.00 32.11 O ATOM 0 H TYR A 41 -3.656 5.211 -2.856 1.00 3.44 H new ATOM 0 HA TYR A 41 -3.570 7.396 -0.919 1.00 21.13 H new ATOM 0 HB2 TYR A 41 -1.448 5.402 -1.625 1.00 13.22 H new ATOM 0 HB3 TYR A 41 -0.978 7.042 -1.224 1.00 13.22 H new ATOM 0 HD1 TYR A 41 -2.654 3.995 0.112 1.00 61.53 H new ATOM 0 HD2 TYR A 41 -1.119 7.865 0.978 1.00 2.41 H new ATOM 0 HE1 TYR A 41 -2.866 3.543 2.517 1.00 32.35 H new ATOM 0 HE2 TYR A 41 -1.310 7.414 3.375 1.00 52.34 H new ATOM 0 HH TYR A 41 -1.911 5.990 4.944 1.00 32.11 H new ATOM 601 N HIS A 42 -2.644 8.992 -2.507 1.00 60.22 N ATOM 602 CA HIS A 42 -2.327 10.001 -3.473 1.00 13.50 C ATOM 603 C HIS A 42 -0.880 10.392 -3.309 1.00 31.54 C ATOM 604 O HIS A 42 -0.454 10.726 -2.210 1.00 61.11 O ATOM 605 CB HIS A 42 -3.243 11.230 -3.263 1.00 15.11 C ATOM 606 CG HIS A 42 -3.026 12.378 -4.208 1.00 1.23 C ATOM 607 ND1 HIS A 42 -3.470 13.656 -3.953 1.00 0.21 N ATOM 608 CD2 HIS A 42 -2.453 12.424 -5.427 1.00 64.31 C ATOM 609 CE1 HIS A 42 -3.185 14.431 -4.971 1.00 31.21 C ATOM 610 NE2 HIS A 42 -2.568 13.713 -5.886 1.00 45.34 N ATOM 0 H HIS A 42 -2.743 9.345 -1.555 1.00 60.22 H new ATOM 0 HA HIS A 42 -2.487 9.618 -4.481 1.00 13.50 H new ATOM 0 HB2 HIS A 42 -4.280 10.905 -3.348 1.00 15.11 H new ATOM 0 HB3 HIS A 42 -3.105 11.592 -2.244 1.00 15.11 H new ATOM 0 HD2 HIS A 42 -1.989 11.599 -5.947 1.00 64.31 H new ATOM 0 HE1 HIS A 42 -3.418 15.483 -5.047 1.00 31.21 H new ATOM 0 HE2 HIS A 42 -2.232 14.057 -6.785 1.00 45.34 H new ATOM 619 N ARG A 43 -0.126 10.346 -4.390 1.00 54.31 N ATOM 620 CA ARG A 43 1.247 10.787 -4.340 1.00 20.31 C ATOM 621 C ARG A 43 1.301 12.258 -4.614 1.00 31.12 C ATOM 622 O ARG A 43 0.603 12.769 -5.484 1.00 2.12 O ATOM 623 CB ARG A 43 2.161 10.076 -5.353 1.00 2.35 C ATOM 624 CG ARG A 43 1.760 10.280 -6.810 1.00 34.34 C ATOM 625 CD ARG A 43 2.958 10.157 -7.731 1.00 51.30 C ATOM 626 NE ARG A 43 3.960 11.198 -7.410 1.00 60.12 N ATOM 627 CZ ARG A 43 4.698 11.881 -8.299 1.00 51.20 C ATOM 628 NH1 ARG A 43 4.550 11.676 -9.609 1.00 71.33 N ATOM 629 NH2 ARG A 43 5.573 12.781 -7.869 1.00 31.11 N ATOM 0 H ARG A 43 -0.439 10.011 -5.301 1.00 54.31 H new ATOM 0 HA ARG A 43 1.613 10.543 -3.343 1.00 20.31 H new ATOM 0 HB2 ARG A 43 3.182 10.432 -5.216 1.00 2.35 H new ATOM 0 HB3 ARG A 43 2.164 9.008 -5.135 1.00 2.35 H new ATOM 0 HG2 ARG A 43 1.006 9.544 -7.089 1.00 34.34 H new ATOM 0 HG3 ARG A 43 1.305 11.263 -6.930 1.00 34.34 H new ATOM 0 HD2 ARG A 43 3.405 9.168 -7.628 1.00 51.30 H new ATOM 0 HD3 ARG A 43 2.640 10.256 -8.769 1.00 51.30 H new ATOM 0 HE ARG A 43 4.103 11.416 -6.424 1.00 60.12 H new ATOM 0 HH11 ARG A 43 3.870 10.994 -9.945 1.00 71.33 H new ATOM 0 HH12 ARG A 43 5.117 12.201 -10.275 1.00 71.33 H new ATOM 0 HH21 ARG A 43 5.681 12.950 -6.869 1.00 31.11 H new ATOM 0 HH22 ARG A 43 6.137 13.304 -8.539 1.00 31.11 H new ATOM 643 N TYR A 44 2.087 12.930 -3.877 1.00 53.45 N ATOM 644 CA TYR A 44 2.267 14.322 -4.066 1.00 72.53 C ATOM 645 C TYR A 44 3.518 14.573 -4.853 1.00 63.05 C ATOM 646 O TYR A 44 4.210 13.623 -5.249 1.00 71.54 O ATOM 647 CB TYR A 44 2.211 15.074 -2.720 1.00 74.45 C ATOM 648 CG TYR A 44 0.812 15.010 -2.132 1.00 13.11 C ATOM 649 CD1 TYR A 44 0.296 13.817 -1.653 1.00 22.10 C ATOM 650 CD2 TYR A 44 -0.011 16.121 -2.120 1.00 43.41 C ATOM 651 CE1 TYR A 44 -0.978 13.730 -1.174 1.00 31.24 C ATOM 652 CE2 TYR A 44 -1.305 16.037 -1.647 1.00 11.01 C ATOM 653 CZ TYR A 44 -1.779 14.833 -1.173 1.00 63.22 C ATOM 654 OH TYR A 44 -3.069 14.729 -0.720 1.00 52.32 O ATOM 0 H TYR A 44 2.634 12.532 -3.114 1.00 53.45 H new ATOM 0 HA TYR A 44 1.444 14.724 -4.656 1.00 72.53 H new ATOM 0 HB2 TYR A 44 2.925 14.637 -2.022 1.00 74.45 H new ATOM 0 HB3 TYR A 44 2.503 16.114 -2.865 1.00 74.45 H new ATOM 0 HD1 TYR A 44 0.918 12.934 -1.659 1.00 22.10 H new ATOM 0 HD2 TYR A 44 0.363 17.066 -2.485 1.00 43.41 H new ATOM 0 HE1 TYR A 44 -1.351 12.790 -0.796 1.00 31.24 H new ATOM 0 HE2 TYR A 44 -1.942 16.909 -1.648 1.00 11.01 H new ATOM 0 HH TYR A 44 -3.207 13.842 -0.327 1.00 52.32 H new ATOM 664 N LYS A 45 3.781 15.801 -5.133 1.00 5.24 N ATOM 665 CA LYS A 45 4.926 16.136 -5.915 1.00 20.20 C ATOM 666 C LYS A 45 5.947 16.979 -5.182 1.00 52.21 C ATOM 667 O LYS A 45 7.142 16.876 -5.474 1.00 12.21 O ATOM 668 CB LYS A 45 4.534 16.684 -7.315 1.00 2.14 C ATOM 669 CG LYS A 45 3.378 17.708 -7.351 1.00 43.20 C ATOM 670 CD LYS A 45 3.671 18.995 -6.599 1.00 55.11 C ATOM 671 CE LYS A 45 2.499 19.961 -6.688 1.00 50.13 C ATOM 672 NZ LYS A 45 2.203 20.340 -8.081 1.00 50.55 N ATOM 0 H LYS A 45 3.218 16.596 -4.832 1.00 5.24 H new ATOM 0 HA LYS A 45 5.454 15.200 -6.097 1.00 20.20 H new ATOM 0 HB2 LYS A 45 5.415 17.147 -7.760 1.00 2.14 H new ATOM 0 HB3 LYS A 45 4.263 15.840 -7.949 1.00 2.14 H new ATOM 0 HG2 LYS A 45 3.152 17.949 -8.390 1.00 43.20 H new ATOM 0 HG3 LYS A 45 2.485 17.248 -6.929 1.00 43.20 H new ATOM 0 HD2 LYS A 45 3.881 18.769 -5.554 1.00 55.11 H new ATOM 0 HD3 LYS A 45 4.565 19.464 -7.010 1.00 55.11 H new ATOM 0 HE2 LYS A 45 1.617 19.503 -6.241 1.00 50.13 H new ATOM 0 HE3 LYS A 45 2.722 20.856 -6.108 1.00 50.13 H new ATOM 0 HZ1 LYS A 45 1.584 21.175 -8.089 1.00 50.55 H new ATOM 0 HZ2 LYS A 45 3.090 20.562 -8.576 1.00 50.55 H new ATOM 0 HZ3 LYS A 45 1.726 19.551 -8.562 1.00 50.55 H new ATOM 686 N LEU A 46 5.485 17.790 -4.204 1.00 52.54 N ATOM 687 CA LEU A 46 6.374 18.676 -3.431 1.00 34.24 C ATOM 688 C LEU A 46 7.139 19.646 -4.345 1.00 51.42 C ATOM 689 O LEU A 46 6.806 19.783 -5.524 1.00 34.11 O ATOM 690 CB LEU A 46 7.295 17.867 -2.471 1.00 71.21 C ATOM 691 CG LEU A 46 6.655 17.362 -1.137 1.00 55.13 C ATOM 692 CD1 LEU A 46 6.298 18.531 -0.240 1.00 63.32 C ATOM 693 CD2 LEU A 46 5.411 16.526 -1.383 1.00 12.24 C ATOM 0 H LEU A 46 4.503 17.847 -3.934 1.00 52.54 H new ATOM 0 HA LEU A 46 5.753 19.301 -2.789 1.00 34.24 H new ATOM 0 HB2 LEU A 46 7.675 17.002 -3.014 1.00 71.21 H new ATOM 0 HB3 LEU A 46 8.155 18.489 -2.221 1.00 71.21 H new ATOM 0 HG LEU A 46 7.400 16.734 -0.648 1.00 55.13 H new ATOM 0 HD11 LEU A 46 5.854 18.159 0.683 1.00 63.32 H new ATOM 0 HD12 LEU A 46 7.199 19.099 -0.006 1.00 63.32 H new ATOM 0 HD13 LEU A 46 5.584 19.177 -0.751 1.00 63.32 H new ATOM 0 HD21 LEU A 46 5.000 16.196 -0.429 1.00 12.24 H new ATOM 0 HD22 LEU A 46 4.669 17.125 -1.911 1.00 12.24 H new ATOM 0 HD23 LEU A 46 5.671 15.656 -1.986 1.00 12.24 H new ATOM 705 N LYS A 47 8.109 20.350 -3.816 1.00 51.24 N ATOM 706 CA LYS A 47 8.823 21.322 -4.631 1.00 34.24 C ATOM 707 C LYS A 47 10.336 21.178 -4.535 1.00 63.45 C ATOM 708 O LYS A 47 11.077 22.103 -4.847 1.00 53.31 O ATOM 709 CB LYS A 47 8.313 22.757 -4.328 1.00 4.41 C ATOM 710 CG LYS A 47 8.367 23.193 -2.861 1.00 61.55 C ATOM 711 CD LYS A 47 9.776 23.521 -2.360 1.00 14.31 C ATOM 712 CE LYS A 47 10.362 24.731 -3.089 1.00 32.04 C ATOM 713 NZ LYS A 47 11.702 25.089 -2.595 1.00 62.54 N ATOM 0 H LYS A 47 8.423 20.278 -2.848 1.00 51.24 H new ATOM 0 HA LYS A 47 8.600 21.115 -5.678 1.00 34.24 H new ATOM 0 HB2 LYS A 47 8.899 23.462 -4.918 1.00 4.41 H new ATOM 0 HB3 LYS A 47 7.282 22.835 -4.672 1.00 4.41 H new ATOM 0 HG2 LYS A 47 7.733 24.070 -2.730 1.00 61.55 H new ATOM 0 HG3 LYS A 47 7.948 22.400 -2.241 1.00 61.55 H new ATOM 0 HD2 LYS A 47 9.745 23.720 -1.289 1.00 14.31 H new ATOM 0 HD3 LYS A 47 10.425 22.658 -2.505 1.00 14.31 H new ATOM 0 HE2 LYS A 47 10.416 24.517 -4.156 1.00 32.04 H new ATOM 0 HE3 LYS A 47 9.693 25.583 -2.968 1.00 32.04 H new ATOM 0 HZ1 LYS A 47 12.056 25.914 -3.120 1.00 62.54 H new ATOM 0 HZ2 LYS A 47 11.649 25.319 -1.582 1.00 62.54 H new ATOM 0 HZ3 LYS A 47 12.349 24.287 -2.734 1.00 62.54 H new ATOM 727 N GLY A 48 10.779 20.002 -4.172 1.00 2.32 N ATOM 728 CA GLY A 48 12.201 19.766 -4.042 1.00 70.13 C ATOM 729 C GLY A 48 12.532 18.646 -3.078 1.00 13.13 C ATOM 730 O GLY A 48 13.701 18.417 -2.767 1.00 54.12 O ATOM 0 H GLY A 48 10.187 19.198 -3.962 1.00 2.32 H new ATOM 0 HA2 GLY A 48 12.615 19.528 -5.022 1.00 70.13 H new ATOM 0 HA3 GLY A 48 12.686 20.682 -3.705 1.00 70.13 H new ATOM 734 N LEU A 49 11.524 17.944 -2.603 1.00 23.13 N ATOM 735 CA LEU A 49 11.754 16.863 -1.654 1.00 41.33 C ATOM 736 C LEU A 49 11.955 15.517 -2.404 1.00 52.31 C ATOM 737 O LEU A 49 11.577 15.408 -3.571 1.00 60.11 O ATOM 738 CB LEU A 49 10.631 16.792 -0.585 1.00 54.34 C ATOM 739 CG LEU A 49 10.553 17.935 0.465 1.00 71.43 C ATOM 740 CD1 LEU A 49 10.199 19.284 -0.152 1.00 20.21 C ATOM 741 CD2 LEU A 49 9.575 17.573 1.575 1.00 34.54 C ATOM 0 H LEU A 49 10.547 18.096 -2.852 1.00 23.13 H new ATOM 0 HA LEU A 49 12.675 17.071 -1.109 1.00 41.33 H new ATOM 0 HB2 LEU A 49 9.675 16.751 -1.107 1.00 54.34 H new ATOM 0 HB3 LEU A 49 10.741 15.850 -0.047 1.00 54.34 H new ATOM 0 HG LEU A 49 11.551 18.042 0.890 1.00 71.43 H new ATOM 0 HD11 LEU A 49 10.159 20.042 0.630 1.00 20.21 H new ATOM 0 HD12 LEU A 49 10.957 19.559 -0.886 1.00 20.21 H new ATOM 0 HD13 LEU A 49 9.228 19.216 -0.642 1.00 20.21 H new ATOM 0 HD21 LEU A 49 9.533 18.384 2.302 1.00 34.54 H new ATOM 0 HD22 LEU A 49 8.584 17.415 1.150 1.00 34.54 H new ATOM 0 HD23 LEU A 49 9.907 16.660 2.069 1.00 34.54 H new ATOM 753 N PRO A 50 12.554 14.483 -1.757 1.00 2.30 N ATOM 754 CA PRO A 50 12.882 13.199 -2.415 1.00 1.52 C ATOM 755 C PRO A 50 11.669 12.285 -2.679 1.00 72.23 C ATOM 756 O PRO A 50 11.212 11.575 -1.781 1.00 64.20 O ATOM 757 CB PRO A 50 13.867 12.517 -1.441 1.00 32.31 C ATOM 758 CG PRO A 50 14.134 13.529 -0.366 1.00 65.32 C ATOM 759 CD PRO A 50 12.958 14.457 -0.352 1.00 62.35 C ATOM 0 HA PRO A 50 13.289 13.382 -3.409 1.00 1.52 H new ATOM 0 HB2 PRO A 50 13.439 11.606 -1.024 1.00 32.31 H new ATOM 0 HB3 PRO A 50 14.788 12.233 -1.950 1.00 32.31 H new ATOM 0 HG2 PRO A 50 14.256 13.043 0.602 1.00 65.32 H new ATOM 0 HG3 PRO A 50 15.056 14.074 -0.567 1.00 65.32 H new ATOM 0 HD2 PRO A 50 12.159 14.089 0.292 1.00 62.35 H new ATOM 0 HD3 PRO A 50 13.229 15.449 0.010 1.00 62.35 H new ATOM 767 N TYR A 51 11.135 12.367 -3.921 1.00 71.11 N ATOM 768 CA TYR A 51 9.970 11.550 -4.442 1.00 50.54 C ATOM 769 C TYR A 51 8.720 11.390 -3.466 1.00 22.43 C ATOM 770 O TYR A 51 8.028 10.372 -3.527 1.00 13.50 O ATOM 771 CB TYR A 51 10.462 10.154 -4.959 1.00 2.44 C ATOM 772 CG TYR A 51 11.143 9.247 -3.928 1.00 34.41 C ATOM 773 CD1 TYR A 51 10.402 8.363 -3.147 1.00 42.13 C ATOM 774 CD2 TYR A 51 12.523 9.274 -3.747 1.00 21.35 C ATOM 775 CE1 TYR A 51 11.013 7.541 -2.222 1.00 41.03 C ATOM 776 CE2 TYR A 51 13.138 8.453 -2.822 1.00 53.11 C ATOM 777 CZ TYR A 51 12.379 7.592 -2.062 1.00 61.41 C ATOM 778 OH TYR A 51 12.994 6.764 -1.148 1.00 50.32 O ATOM 0 H TYR A 51 11.499 13.014 -4.620 1.00 71.11 H new ATOM 0 HA TYR A 51 9.577 12.145 -5.267 1.00 50.54 H new ATOM 0 HB2 TYR A 51 9.605 9.621 -5.370 1.00 2.44 H new ATOM 0 HB3 TYR A 51 11.158 10.320 -5.781 1.00 2.44 H new ATOM 0 HD1 TYR A 51 9.330 8.320 -3.268 1.00 42.13 H new ATOM 0 HD2 TYR A 51 13.123 9.948 -4.340 1.00 21.35 H new ATOM 0 HE1 TYR A 51 10.422 6.861 -1.626 1.00 41.03 H new ATOM 0 HE2 TYR A 51 14.210 8.486 -2.696 1.00 53.11 H new ATOM 0 HH TYR A 51 13.961 6.925 -1.160 1.00 50.32 H new ATOM 788 N PRO A 52 8.354 12.413 -2.641 1.00 74.13 N ATOM 789 CA PRO A 52 7.312 12.294 -1.641 1.00 52.22 C ATOM 790 C PRO A 52 6.032 13.068 -1.994 1.00 51.23 C ATOM 791 O PRO A 52 6.022 13.875 -2.925 1.00 50.43 O ATOM 792 CB PRO A 52 7.978 12.985 -0.485 1.00 63.33 C ATOM 793 CG PRO A 52 8.924 13.983 -1.092 1.00 5.03 C ATOM 794 CD PRO A 52 8.898 13.753 -2.583 1.00 21.54 C ATOM 0 HA PRO A 52 6.987 11.264 -1.493 1.00 52.22 H new ATOM 0 HB2 PRO A 52 7.243 13.479 0.150 1.00 63.33 H new ATOM 0 HB3 PRO A 52 8.512 12.271 0.142 1.00 63.33 H new ATOM 0 HG2 PRO A 52 8.619 15.001 -0.852 1.00 5.03 H new ATOM 0 HG3 PRO A 52 9.931 13.851 -0.697 1.00 5.03 H new ATOM 0 HD2 PRO A 52 8.270 14.477 -3.102 1.00 21.54 H new ATOM 0 HD3 PRO A 52 9.891 13.816 -3.028 1.00 21.54 H new ATOM 802 N CYS A 53 4.926 12.828 -1.296 1.00 2.52 N ATOM 803 CA CYS A 53 4.726 11.819 -0.250 1.00 45.03 C ATOM 804 C CYS A 53 3.381 11.179 -0.607 1.00 61.10 C ATOM 805 O CYS A 53 2.782 11.584 -1.605 1.00 42.55 O ATOM 806 CB CYS A 53 4.569 12.503 1.152 1.00 43.42 C ATOM 807 SG CYS A 53 5.824 13.708 1.619 1.00 32.33 S ATOM 0 H CYS A 53 4.079 13.373 -1.456 1.00 2.52 H new ATOM 0 HA CYS A 53 5.560 11.119 -0.199 1.00 45.03 H new ATOM 0 HB2 CYS A 53 3.598 12.997 1.181 1.00 43.42 H new ATOM 0 HB3 CYS A 53 4.552 11.721 1.911 1.00 43.42 H new ATOM 0 HG CYS A 53 6.110 13.570 2.880 1.00 32.33 H new ATOM 813 N ILE A 54 2.892 10.226 0.156 1.00 5.30 N ATOM 814 CA ILE A 54 1.556 9.700 -0.123 1.00 52.44 C ATOM 815 C ILE A 54 0.642 9.802 1.074 1.00 63.32 C ATOM 816 O ILE A 54 0.942 9.262 2.138 1.00 75.40 O ATOM 817 CB ILE A 54 1.521 8.262 -0.685 1.00 21.40 C ATOM 818 CG1 ILE A 54 2.231 7.246 0.215 1.00 62.42 C ATOM 819 CG2 ILE A 54 2.033 8.220 -2.098 1.00 3.32 C ATOM 820 CD1 ILE A 54 2.035 5.803 -0.228 1.00 63.02 C ATOM 0 H ILE A 54 3.373 9.805 0.951 1.00 5.30 H new ATOM 0 HA ILE A 54 1.189 10.348 -0.919 1.00 52.44 H new ATOM 0 HB ILE A 54 0.474 7.958 -0.700 1.00 21.40 H new ATOM 0 HG12 ILE A 54 3.297 7.471 0.233 1.00 62.42 H new ATOM 0 HG13 ILE A 54 1.865 7.358 1.235 1.00 62.42 H new ATOM 0 HG21 ILE A 54 1.997 7.195 -2.468 1.00 3.32 H new ATOM 0 HG22 ILE A 54 1.412 8.856 -2.729 1.00 3.32 H new ATOM 0 HG23 ILE A 54 3.062 8.579 -2.123 1.00 3.32 H new ATOM 0 HD11 ILE A 54 2.565 5.138 0.454 1.00 63.02 H new ATOM 0 HD12 ILE A 54 0.972 5.561 -0.219 1.00 63.02 H new ATOM 0 HD13 ILE A 54 2.427 5.676 -1.237 1.00 63.02 H new ATOM 832 N VAL A 55 -0.469 10.517 0.895 1.00 62.43 N ATOM 833 CA VAL A 55 -1.467 10.730 1.953 1.00 65.22 C ATOM 834 C VAL A 55 -2.863 10.999 1.364 1.00 52.23 C ATOM 835 O VAL A 55 -3.009 11.793 0.419 1.00 73.35 O ATOM 836 CB VAL A 55 -1.104 11.916 2.937 1.00 40.23 C ATOM 837 CG1 VAL A 55 0.118 11.609 3.774 1.00 22.35 C ATOM 838 CG2 VAL A 55 -0.885 13.213 2.178 1.00 34.43 C ATOM 0 H VAL A 55 -0.706 10.968 0.011 1.00 62.43 H new ATOM 0 HA VAL A 55 -1.468 9.803 2.526 1.00 65.22 H new ATOM 0 HB VAL A 55 -1.956 12.032 3.607 1.00 40.23 H new ATOM 0 HG11 VAL A 55 0.328 12.451 4.433 1.00 22.35 H new ATOM 0 HG12 VAL A 55 -0.066 10.717 4.372 1.00 22.35 H new ATOM 0 HG13 VAL A 55 0.973 11.438 3.120 1.00 22.35 H new ATOM 0 HG21 VAL A 55 -0.637 14.009 2.881 1.00 34.43 H new ATOM 0 HG22 VAL A 55 -0.066 13.086 1.470 1.00 34.43 H new ATOM 0 HG23 VAL A 55 -1.794 13.476 1.638 1.00 34.43 H new ATOM 848 N SER A 56 -3.858 10.309 1.915 1.00 20.32 N ATOM 849 CA SER A 56 -5.282 10.512 1.609 1.00 3.53 C ATOM 850 C SER A 56 -5.656 10.165 0.130 1.00 20.32 C ATOM 851 O SER A 56 -4.826 9.661 -0.640 1.00 24.34 O ATOM 852 CB SER A 56 -5.682 11.973 1.978 1.00 75.52 C ATOM 853 OG SER A 56 -7.097 12.203 1.910 1.00 72.54 O ATOM 0 H SER A 56 -3.699 9.574 2.604 1.00 20.32 H new ATOM 0 HA SER A 56 -5.855 9.812 2.216 1.00 3.53 H new ATOM 0 HB2 SER A 56 -5.332 12.196 2.986 1.00 75.52 H new ATOM 0 HB3 SER A 56 -5.175 12.664 1.304 1.00 75.52 H new ATOM 0 HG SER A 56 -7.289 13.133 2.152 1.00 72.54 H new ATOM 859 N SER A 57 -6.939 10.423 -0.201 1.00 25.44 N ATOM 860 CA SER A 57 -7.553 10.250 -1.522 1.00 25.33 C ATOM 861 C SER A 57 -7.908 8.788 -1.830 1.00 72.24 C ATOM 862 O SER A 57 -7.042 7.943 -1.974 1.00 53.30 O ATOM 863 CB SER A 57 -6.698 10.870 -2.636 1.00 65.20 C ATOM 864 OG SER A 57 -7.374 10.879 -3.892 1.00 71.33 O ATOM 0 H SER A 57 -7.604 10.776 0.487 1.00 25.44 H new ATOM 0 HA SER A 57 -8.496 10.795 -1.489 1.00 25.33 H new ATOM 0 HB2 SER A 57 -6.431 11.891 -2.362 1.00 65.20 H new ATOM 0 HB3 SER A 57 -5.767 10.312 -2.730 1.00 65.20 H new ATOM 0 HG SER A 57 -6.795 11.283 -4.572 1.00 71.33 H new ATOM 870 N ASP A 58 -9.197 8.505 -1.911 1.00 33.44 N ATOM 871 CA ASP A 58 -9.690 7.169 -2.270 1.00 10.14 C ATOM 872 C ASP A 58 -9.675 7.000 -3.775 1.00 13.24 C ATOM 873 O ASP A 58 -9.537 5.898 -4.293 1.00 53.33 O ATOM 874 CB ASP A 58 -11.111 6.935 -1.725 1.00 13.41 C ATOM 875 CG ASP A 58 -11.723 5.613 -2.193 1.00 71.24 C ATOM 876 OD1 ASP A 58 -11.255 4.537 -1.761 1.00 75.34 O ATOM 877 OD2 ASP A 58 -12.675 5.643 -3.019 1.00 31.44 O ATOM 0 H ASP A 58 -9.935 9.186 -1.732 1.00 33.44 H new ATOM 0 HA ASP A 58 -9.029 6.429 -1.818 1.00 10.14 H new ATOM 0 HB2 ASP A 58 -11.083 6.950 -0.635 1.00 13.41 H new ATOM 0 HB3 ASP A 58 -11.754 7.757 -2.039 1.00 13.41 H new ATOM 882 N SER A 59 -9.793 8.102 -4.473 1.00 54.23 N ATOM 883 CA SER A 59 -9.790 8.084 -5.914 1.00 24.44 C ATOM 884 C SER A 59 -8.354 8.055 -6.445 1.00 22.23 C ATOM 885 O SER A 59 -8.121 7.843 -7.641 1.00 65.02 O ATOM 886 CB SER A 59 -10.545 9.302 -6.445 1.00 60.21 C ATOM 887 OG SER A 59 -11.879 9.334 -5.929 1.00 13.20 O ATOM 0 H SER A 59 -9.893 9.030 -4.062 1.00 54.23 H new ATOM 0 HA SER A 59 -10.294 7.182 -6.263 1.00 24.44 H new ATOM 0 HB2 SER A 59 -10.019 10.214 -6.163 1.00 60.21 H new ATOM 0 HB3 SER A 59 -10.572 9.273 -7.534 1.00 60.21 H new ATOM 0 HG SER A 59 -12.346 10.121 -6.279 1.00 13.20 H new ATOM 893 N GLY A 60 -7.409 8.241 -5.548 1.00 55.04 N ATOM 894 CA GLY A 60 -6.034 8.263 -5.918 1.00 55.41 C ATOM 895 C GLY A 60 -5.387 6.917 -5.788 1.00 3.33 C ATOM 896 O GLY A 60 -5.830 6.065 -4.994 1.00 61.34 O ATOM 0 H GLY A 60 -7.583 8.379 -4.553 1.00 55.04 H new ATOM 0 HA2 GLY A 60 -5.943 8.609 -6.947 1.00 55.41 H new ATOM 0 HA3 GLY A 60 -5.503 8.980 -5.292 1.00 55.41 H new ATOM 900 N LYS A 61 -4.362 6.710 -6.567 1.00 1.23 N ATOM 901 CA LYS A 61 -3.596 5.508 -6.530 1.00 10.42 C ATOM 902 C LYS A 61 -2.184 5.822 -7.034 1.00 14.43 C ATOM 903 O LYS A 61 -2.003 6.694 -7.893 1.00 32.34 O ATOM 904 CB LYS A 61 -4.291 4.387 -7.332 1.00 55.31 C ATOM 905 CG LYS A 61 -4.407 4.662 -8.800 1.00 32.13 C ATOM 906 CD LYS A 61 -5.275 3.644 -9.522 1.00 34.53 C ATOM 907 CE LYS A 61 -4.761 2.238 -9.366 1.00 54.22 C ATOM 908 NZ LYS A 61 -5.464 1.311 -10.245 1.00 12.52 N ATOM 0 H LYS A 61 -4.034 7.388 -7.256 1.00 1.23 H new ATOM 0 HA LYS A 61 -3.519 5.132 -5.510 1.00 10.42 H new ATOM 0 HB2 LYS A 61 -3.738 3.458 -7.191 1.00 55.31 H new ATOM 0 HB3 LYS A 61 -5.289 4.229 -6.924 1.00 55.31 H new ATOM 0 HG2 LYS A 61 -4.824 5.658 -8.947 1.00 32.13 H new ATOM 0 HG3 LYS A 61 -3.412 4.665 -9.244 1.00 32.13 H new ATOM 0 HD2 LYS A 61 -6.293 3.701 -9.137 1.00 34.53 H new ATOM 0 HD3 LYS A 61 -5.321 3.896 -10.582 1.00 34.53 H new ATOM 0 HE2 LYS A 61 -3.694 2.213 -9.588 1.00 54.22 H new ATOM 0 HE3 LYS A 61 -4.879 1.919 -8.330 1.00 54.22 H new ATOM 0 HZ1 LYS A 61 -4.959 0.402 -10.266 1.00 12.52 H new ATOM 0 HZ2 LYS A 61 -6.431 1.162 -9.891 1.00 12.52 H new ATOM 0 HZ3 LYS A 61 -5.504 1.707 -11.206 1.00 12.52 H new ATOM 922 N VAL A 62 -1.206 5.160 -6.481 1.00 13.54 N ATOM 923 CA VAL A 62 0.192 5.462 -6.760 1.00 64.45 C ATOM 924 C VAL A 62 0.890 4.319 -7.486 1.00 12.41 C ATOM 925 O VAL A 62 0.913 3.204 -7.003 1.00 12.15 O ATOM 926 CB VAL A 62 0.925 5.747 -5.435 1.00 43.54 C ATOM 927 CG1 VAL A 62 2.389 6.107 -5.662 1.00 43.12 C ATOM 928 CG2 VAL A 62 0.212 6.847 -4.691 1.00 50.43 C ATOM 0 H VAL A 62 -1.344 4.393 -5.822 1.00 13.54 H new ATOM 0 HA VAL A 62 0.221 6.336 -7.410 1.00 64.45 H new ATOM 0 HB VAL A 62 0.912 4.837 -4.835 1.00 43.54 H new ATOM 0 HG11 VAL A 62 2.869 6.300 -4.703 1.00 43.12 H new ATOM 0 HG12 VAL A 62 2.894 5.280 -6.160 1.00 43.12 H new ATOM 0 HG13 VAL A 62 2.452 6.999 -6.285 1.00 43.12 H new ATOM 0 HG21 VAL A 62 0.731 7.048 -3.754 1.00 50.43 H new ATOM 0 HG22 VAL A 62 0.201 7.751 -5.301 1.00 50.43 H new ATOM 0 HG23 VAL A 62 -0.812 6.539 -4.480 1.00 50.43 H new ATOM 938 N ASN A 63 1.459 4.613 -8.635 1.00 74.24 N ATOM 939 CA ASN A 63 2.176 3.607 -9.426 1.00 23.34 C ATOM 940 C ASN A 63 3.632 3.539 -8.995 1.00 5.03 C ATOM 941 O ASN A 63 4.350 4.538 -9.073 1.00 25.51 O ATOM 942 CB ASN A 63 2.111 3.925 -10.939 1.00 43.14 C ATOM 943 CG ASN A 63 0.712 3.864 -11.529 1.00 72.45 C ATOM 944 OD1 ASN A 63 0.264 2.816 -11.971 1.00 34.22 O ATOM 945 ND2 ASN A 63 0.027 4.988 -11.577 1.00 34.31 N ATOM 0 H ASN A 63 1.445 5.543 -9.054 1.00 74.24 H new ATOM 0 HA ASN A 63 1.691 2.647 -9.250 1.00 23.34 H new ATOM 0 HB2 ASN A 63 2.521 4.921 -11.107 1.00 43.14 H new ATOM 0 HB3 ASN A 63 2.750 3.222 -11.474 1.00 43.14 H new ATOM 0 HD21 ASN A 63 -0.905 5.000 -11.992 1.00 34.31 H new ATOM 0 HD22 ASN A 63 0.428 5.846 -11.200 1.00 34.31 H new ATOM 952 N GLY A 64 4.059 2.382 -8.551 1.00 75.44 N ATOM 953 CA GLY A 64 5.428 2.183 -8.129 1.00 1.44 C ATOM 954 C GLY A 64 5.830 0.735 -8.290 1.00 23.42 C ATOM 955 O GLY A 64 5.355 0.060 -9.204 1.00 72.32 O ATOM 0 H GLY A 64 3.471 1.553 -8.471 1.00 75.44 H new ATOM 0 HA2 GLY A 64 6.091 2.818 -8.717 1.00 1.44 H new ATOM 0 HA3 GLY A 64 5.540 2.483 -7.087 1.00 1.44 H new ATOM 959 N LYS A 65 6.684 0.245 -7.425 1.00 63.33 N ATOM 960 CA LYS A 65 7.096 -1.149 -7.470 1.00 31.22 C ATOM 961 C LYS A 65 7.165 -1.714 -6.076 1.00 73.45 C ATOM 962 O LYS A 65 7.533 -1.005 -5.131 1.00 3.25 O ATOM 963 CB LYS A 65 8.471 -1.347 -8.162 1.00 74.15 C ATOM 964 CG LYS A 65 8.542 -1.009 -9.592 1.00 23.25 C ATOM 965 CD LYS A 65 9.929 -1.330 -10.090 1.00 21.41 C ATOM 966 CE LYS A 65 10.042 -0.917 -11.477 1.00 15.11 C ATOM 967 NZ LYS A 65 11.347 -1.273 -12.102 1.00 10.02 N ATOM 0 H LYS A 65 7.113 0.788 -6.676 1.00 63.33 H new ATOM 0 HA LYS A 65 6.346 -1.676 -8.061 1.00 31.22 H new ATOM 0 HB2 LYS A 65 9.209 -0.745 -7.632 1.00 74.15 H new ATOM 0 HB3 LYS A 65 8.766 -2.390 -8.043 1.00 74.15 H new ATOM 0 HG2 LYS A 65 7.798 -1.575 -10.153 1.00 23.25 H new ATOM 0 HG3 LYS A 65 8.320 0.047 -9.743 1.00 23.25 H new ATOM 0 HD2 LYS A 65 10.675 -0.817 -9.483 1.00 21.41 H new ATOM 0 HD3 LYS A 65 10.124 -2.399 -9.999 1.00 21.41 H new ATOM 0 HE2 LYS A 65 9.237 -1.376 -12.051 1.00 15.11 H new ATOM 0 HE3 LYS A 65 9.902 0.162 -11.538 1.00 15.11 H new ATOM 0 HZ1 LYS A 65 11.359 -0.949 -13.090 1.00 10.02 H new ATOM 0 HZ2 LYS A 65 12.119 -0.814 -11.578 1.00 10.02 H new ATOM 0 HZ3 LYS A 65 11.475 -2.305 -12.075 1.00 10.02 H new ATOM 981 N VAL A 66 6.794 -2.962 -5.933 1.00 22.14 N ATOM 982 CA VAL A 66 6.938 -3.625 -4.665 1.00 11.34 C ATOM 983 C VAL A 66 8.108 -4.571 -4.727 1.00 13.14 C ATOM 984 O VAL A 66 8.288 -5.284 -5.721 1.00 75.31 O ATOM 985 CB VAL A 66 5.656 -4.372 -4.158 1.00 72.33 C ATOM 986 CG1 VAL A 66 4.498 -3.427 -4.010 1.00 64.41 C ATOM 987 CG2 VAL A 66 5.271 -5.543 -5.037 1.00 1.23 C ATOM 0 H VAL A 66 6.393 -3.535 -6.675 1.00 22.14 H new ATOM 0 HA VAL A 66 7.110 -2.837 -3.931 1.00 11.34 H new ATOM 0 HB VAL A 66 5.909 -4.776 -3.178 1.00 72.33 H new ATOM 0 HG11 VAL A 66 3.624 -3.975 -3.657 1.00 64.41 H new ATOM 0 HG12 VAL A 66 4.753 -2.649 -3.291 1.00 64.41 H new ATOM 0 HG13 VAL A 66 4.275 -2.971 -4.975 1.00 64.41 H new ATOM 0 HG21 VAL A 66 4.377 -6.020 -4.636 1.00 1.23 H new ATOM 0 HG22 VAL A 66 5.071 -5.189 -6.048 1.00 1.23 H new ATOM 0 HG23 VAL A 66 6.088 -6.264 -5.061 1.00 1.23 H new ATOM 997 N ILE A 67 8.925 -4.525 -3.718 1.00 2.33 N ATOM 998 CA ILE A 67 10.072 -5.388 -3.627 1.00 51.01 C ATOM 999 C ILE A 67 9.616 -6.624 -2.928 1.00 74.34 C ATOM 1000 O ILE A 67 9.182 -6.533 -1.780 1.00 43.54 O ATOM 1001 CB ILE A 67 11.147 -4.809 -2.700 1.00 71.24 C ATOM 1002 CG1 ILE A 67 11.254 -3.301 -2.812 1.00 50.35 C ATOM 1003 CG2 ILE A 67 12.492 -5.438 -3.037 1.00 62.21 C ATOM 1004 CD1 ILE A 67 12.167 -2.730 -1.762 1.00 33.23 C ATOM 0 H ILE A 67 8.817 -3.887 -2.930 1.00 2.33 H new ATOM 0 HA ILE A 67 10.471 -5.536 -4.630 1.00 51.01 H new ATOM 0 HB ILE A 67 10.859 -5.041 -1.675 1.00 71.24 H new ATOM 0 HG12 ILE A 67 11.626 -3.035 -3.802 1.00 50.35 H new ATOM 0 HG13 ILE A 67 10.263 -2.857 -2.714 1.00 50.35 H new ATOM 0 HG21 ILE A 67 13.260 -5.029 -2.380 1.00 62.21 H new ATOM 0 HG22 ILE A 67 12.434 -6.518 -2.899 1.00 62.21 H new ATOM 0 HG23 ILE A 67 12.747 -5.218 -4.074 1.00 62.21 H new ATOM 0 HD11 ILE A 67 12.218 -1.647 -1.874 1.00 33.23 H new ATOM 0 HD12 ILE A 67 11.781 -2.974 -0.772 1.00 33.23 H new ATOM 0 HD13 ILE A 67 13.164 -3.154 -1.877 1.00 33.23 H new ATOM 1016 N THR A 68 9.672 -7.739 -3.558 1.00 41.21 N ATOM 1017 CA THR A 68 9.304 -8.926 -2.885 1.00 24.32 C ATOM 1018 C THR A 68 10.560 -9.703 -2.516 1.00 53.31 C ATOM 1019 O THR A 68 11.643 -9.458 -3.083 1.00 41.35 O ATOM 1020 CB THR A 68 8.357 -9.800 -3.749 1.00 0.03 C ATOM 1021 OG1 THR A 68 9.013 -10.192 -4.960 1.00 62.12 O ATOM 1022 CG2 THR A 68 7.085 -9.029 -4.100 1.00 60.54 C ATOM 0 H THR A 68 9.966 -7.854 -4.528 1.00 41.21 H new ATOM 0 HA THR A 68 8.760 -8.658 -1.979 1.00 24.32 H new ATOM 0 HB THR A 68 8.094 -10.686 -3.171 1.00 0.03 H new ATOM 0 HG1 THR A 68 9.342 -9.395 -5.426 1.00 62.12 H new ATOM 0 HG21 THR A 68 6.434 -9.659 -4.706 1.00 60.54 H new ATOM 0 HG22 THR A 68 6.566 -8.746 -3.184 1.00 60.54 H new ATOM 0 HG23 THR A 68 7.347 -8.132 -4.661 1.00 60.54 H new ATOM 1030 N GLY A 69 10.438 -10.601 -1.564 1.00 50.24 N ATOM 1031 CA GLY A 69 11.566 -11.431 -1.196 1.00 53.24 C ATOM 1032 C GLY A 69 12.556 -10.740 -0.265 1.00 3.24 C ATOM 1033 O GLY A 69 13.749 -11.038 -0.294 1.00 52.53 O ATOM 0 H GLY A 69 9.583 -10.775 -1.036 1.00 50.24 H new ATOM 0 HA2 GLY A 69 11.198 -12.336 -0.713 1.00 53.24 H new ATOM 0 HA3 GLY A 69 12.088 -11.742 -2.101 1.00 53.24 H new ATOM 1037 N VAL A 70 12.076 -9.827 0.559 1.00 31.11 N ATOM 1038 CA VAL A 70 12.945 -9.146 1.506 1.00 75.03 C ATOM 1039 C VAL A 70 12.905 -9.860 2.862 1.00 2.00 C ATOM 1040 O VAL A 70 11.828 -10.044 3.432 1.00 33.21 O ATOM 1041 CB VAL A 70 12.523 -7.663 1.695 1.00 61.11 C ATOM 1042 CG1 VAL A 70 13.449 -6.956 2.658 1.00 60.55 C ATOM 1043 CG2 VAL A 70 12.484 -6.936 0.357 1.00 33.13 C ATOM 0 H VAL A 70 11.098 -9.540 0.594 1.00 31.11 H new ATOM 0 HA VAL A 70 13.958 -9.169 1.104 1.00 75.03 H new ATOM 0 HB VAL A 70 11.519 -7.652 2.119 1.00 61.11 H new ATOM 0 HG11 VAL A 70 13.132 -5.919 2.773 1.00 60.55 H new ATOM 0 HG12 VAL A 70 13.417 -7.455 3.627 1.00 60.55 H new ATOM 0 HG13 VAL A 70 14.467 -6.983 2.270 1.00 60.55 H new ATOM 0 HG21 VAL A 70 12.186 -5.899 0.515 1.00 33.13 H new ATOM 0 HG22 VAL A 70 13.473 -6.964 -0.101 1.00 33.13 H new ATOM 0 HG23 VAL A 70 11.765 -7.424 -0.301 1.00 33.13 H new ATOM 1053 N SER A 71 14.052 -10.269 3.380 1.00 44.21 N ATOM 1054 CA SER A 71 14.071 -10.919 4.674 1.00 55.52 C ATOM 1055 C SER A 71 13.879 -9.856 5.764 1.00 14.24 C ATOM 1056 O SER A 71 14.136 -8.674 5.522 1.00 70.34 O ATOM 1057 CB SER A 71 15.377 -11.682 4.863 1.00 64.23 C ATOM 1058 OG SER A 71 15.595 -12.608 3.807 1.00 50.24 O ATOM 0 H SER A 71 14.963 -10.164 2.933 1.00 44.21 H new ATOM 0 HA SER A 71 13.259 -11.643 4.741 1.00 55.52 H new ATOM 0 HB2 SER A 71 16.208 -10.978 4.909 1.00 64.23 H new ATOM 0 HB3 SER A 71 15.356 -12.212 5.815 1.00 64.23 H new ATOM 0 HG SER A 71 16.441 -13.080 3.956 1.00 50.24 H new ATOM 1064 N ASP A 72 13.432 -10.265 6.947 1.00 73.13 N ATOM 1065 CA ASP A 72 13.129 -9.304 8.035 1.00 74.02 C ATOM 1066 C ASP A 72 14.340 -8.461 8.407 1.00 1.10 C ATOM 1067 O ASP A 72 14.222 -7.262 8.618 1.00 71.50 O ATOM 1068 CB ASP A 72 12.544 -9.990 9.301 1.00 63.40 C ATOM 1069 CG ASP A 72 13.529 -10.840 10.070 1.00 22.53 C ATOM 1070 OD1 ASP A 72 13.653 -12.043 9.782 1.00 64.51 O ATOM 1071 OD2 ASP A 72 14.186 -10.318 10.984 1.00 64.11 O ATOM 0 H ASP A 72 13.268 -11.242 7.189 1.00 73.13 H new ATOM 0 HA ASP A 72 12.360 -8.644 7.634 1.00 74.02 H new ATOM 0 HB2 ASP A 72 12.152 -9.221 9.966 1.00 63.40 H new ATOM 0 HB3 ASP A 72 11.701 -10.614 9.003 1.00 63.40 H new ATOM 1076 N ALA A 73 15.498 -9.076 8.436 1.00 2.13 N ATOM 1077 CA ALA A 73 16.721 -8.368 8.816 1.00 15.23 C ATOM 1078 C ALA A 73 17.165 -7.435 7.711 1.00 51.20 C ATOM 1079 O ALA A 73 17.700 -6.354 7.967 1.00 13.35 O ATOM 1080 CB ALA A 73 17.835 -9.335 9.182 1.00 24.00 C ATOM 0 H ALA A 73 15.631 -10.060 8.204 1.00 2.13 H new ATOM 0 HA ALA A 73 16.496 -7.773 9.701 1.00 15.23 H new ATOM 0 HB1 ALA A 73 18.728 -8.774 9.459 1.00 24.00 H new ATOM 0 HB2 ALA A 73 17.519 -9.952 10.023 1.00 24.00 H new ATOM 0 HB3 ALA A 73 18.058 -9.973 8.327 1.00 24.00 H new ATOM 1086 N GLU A 74 16.905 -7.840 6.488 1.00 74.21 N ATOM 1087 CA GLU A 74 17.279 -7.068 5.320 1.00 60.23 C ATOM 1088 C GLU A 74 16.369 -5.856 5.173 1.00 23.12 C ATOM 1089 O GLU A 74 16.782 -4.801 4.695 1.00 34.13 O ATOM 1090 CB GLU A 74 17.191 -7.934 4.071 1.00 3.44 C ATOM 1091 CG GLU A 74 18.013 -9.210 4.141 1.00 62.52 C ATOM 1092 CD GLU A 74 19.453 -8.964 4.452 1.00 24.21 C ATOM 1093 OE1 GLU A 74 20.127 -8.277 3.680 1.00 23.01 O ATOM 1094 OE2 GLU A 74 19.932 -9.448 5.499 1.00 13.13 O ATOM 0 H GLU A 74 16.427 -8.715 6.273 1.00 74.21 H new ATOM 0 HA GLU A 74 18.306 -6.724 5.445 1.00 60.23 H new ATOM 0 HB2 GLU A 74 16.147 -8.196 3.897 1.00 3.44 H new ATOM 0 HB3 GLU A 74 17.521 -7.349 3.212 1.00 3.44 H new ATOM 0 HG2 GLU A 74 17.590 -9.866 4.902 1.00 62.52 H new ATOM 0 HG3 GLU A 74 17.938 -9.736 3.189 1.00 62.52 H new ATOM 1101 N LEU A 75 15.138 -6.024 5.621 1.00 5.34 N ATOM 1102 CA LEU A 75 14.100 -5.007 5.559 1.00 75.10 C ATOM 1103 C LEU A 75 14.533 -3.717 6.291 1.00 3.21 C ATOM 1104 O LEU A 75 14.267 -2.611 5.816 1.00 31.30 O ATOM 1105 CB LEU A 75 12.765 -5.633 6.093 1.00 52.41 C ATOM 1106 CG LEU A 75 11.469 -4.792 6.113 1.00 71.34 C ATOM 1107 CD1 LEU A 75 11.471 -3.797 7.248 1.00 34.12 C ATOM 1108 CD2 LEU A 75 11.297 -4.062 4.801 1.00 34.32 C ATOM 0 H LEU A 75 14.823 -6.894 6.050 1.00 5.34 H new ATOM 0 HA LEU A 75 13.929 -4.691 4.530 1.00 75.10 H new ATOM 0 HB2 LEU A 75 12.564 -6.523 5.497 1.00 52.41 H new ATOM 0 HB3 LEU A 75 12.950 -5.967 7.114 1.00 52.41 H new ATOM 0 HG LEU A 75 10.635 -5.478 6.261 1.00 71.34 H new ATOM 0 HD11 LEU A 75 10.544 -3.223 7.231 1.00 34.12 H new ATOM 0 HD12 LEU A 75 11.552 -4.327 8.197 1.00 34.12 H new ATOM 0 HD13 LEU A 75 12.319 -3.121 7.137 1.00 34.12 H new ATOM 0 HD21 LEU A 75 10.380 -3.474 4.830 1.00 34.32 H new ATOM 0 HD22 LEU A 75 12.148 -3.400 4.639 1.00 34.32 H new ATOM 0 HD23 LEU A 75 11.239 -4.785 3.987 1.00 34.32 H new ATOM 1120 N ASN A 76 15.249 -3.883 7.401 1.00 74.02 N ATOM 1121 CA ASN A 76 15.769 -2.749 8.217 1.00 14.32 C ATOM 1122 C ASN A 76 16.650 -1.822 7.393 1.00 32.03 C ATOM 1123 O ASN A 76 16.758 -0.645 7.687 1.00 73.43 O ATOM 1124 CB ASN A 76 16.585 -3.243 9.430 1.00 65.21 C ATOM 1125 CG ASN A 76 15.810 -4.113 10.397 1.00 3.31 C ATOM 1126 OD1 ASN A 76 15.178 -3.624 11.323 1.00 20.24 O ATOM 1127 ND2 ASN A 76 15.892 -5.401 10.221 1.00 52.25 N ATOM 0 H ASN A 76 15.494 -4.800 7.774 1.00 74.02 H new ATOM 0 HA ASN A 76 14.892 -2.204 8.567 1.00 14.32 H new ATOM 0 HB2 ASN A 76 17.447 -3.803 9.068 1.00 65.21 H new ATOM 0 HB3 ASN A 76 16.971 -2.378 9.969 1.00 65.21 H new ATOM 0 HD21 ASN A 76 15.421 -6.035 10.866 1.00 52.25 H new ATOM 0 HD22 ASN A 76 16.428 -5.776 9.438 1.00 52.25 H new ATOM 1134 N ASN A 77 17.285 -2.355 6.360 1.00 11.14 N ATOM 1135 CA ASN A 77 18.207 -1.561 5.553 1.00 62.41 C ATOM 1136 C ASN A 77 17.411 -0.513 4.758 1.00 62.35 C ATOM 1137 O ASN A 77 17.874 0.604 4.537 1.00 0.11 O ATOM 1138 CB ASN A 77 19.035 -2.474 4.621 1.00 60.51 C ATOM 1139 CG ASN A 77 20.251 -1.793 3.961 1.00 54.03 C ATOM 1140 OD1 ASN A 77 20.270 -0.598 3.696 1.00 0.34 O ATOM 1141 ND2 ASN A 77 21.275 -2.575 3.691 1.00 43.54 N ATOM 0 H ASN A 77 17.182 -3.325 6.060 1.00 11.14 H new ATOM 0 HA ASN A 77 18.910 -1.041 6.204 1.00 62.41 H new ATOM 0 HB2 ASN A 77 19.384 -3.333 5.194 1.00 60.51 H new ATOM 0 HB3 ASN A 77 18.382 -2.858 3.837 1.00 60.51 H new ATOM 0 HD21 ASN A 77 22.110 -2.188 3.251 1.00 43.54 H new ATOM 0 HD22 ASN A 77 21.234 -3.568 3.922 1.00 43.54 H new ATOM 1148 N PHE A 78 16.171 -0.855 4.385 1.00 5.51 N ATOM 1149 CA PHE A 78 15.329 0.093 3.659 1.00 71.02 C ATOM 1150 C PHE A 78 14.891 1.218 4.596 1.00 52.25 C ATOM 1151 O PHE A 78 14.662 2.345 4.156 1.00 74.22 O ATOM 1152 CB PHE A 78 14.111 -0.579 2.994 1.00 44.45 C ATOM 1153 CG PHE A 78 14.458 -1.626 1.985 1.00 40.20 C ATOM 1154 CD1 PHE A 78 14.805 -1.289 0.678 1.00 10.53 C ATOM 1155 CD2 PHE A 78 14.459 -2.947 2.344 1.00 21.14 C ATOM 1156 CE1 PHE A 78 15.146 -2.267 -0.224 1.00 24.04 C ATOM 1157 CE2 PHE A 78 14.790 -3.919 1.446 1.00 51.41 C ATOM 1158 CZ PHE A 78 15.137 -3.584 0.158 1.00 2.33 C ATOM 0 H PHE A 78 15.740 -1.761 4.570 1.00 5.51 H new ATOM 0 HA PHE A 78 15.927 0.509 2.848 1.00 71.02 H new ATOM 0 HB2 PHE A 78 13.492 -1.030 3.769 1.00 44.45 H new ATOM 0 HB3 PHE A 78 13.507 0.189 2.510 1.00 44.45 H new ATOM 0 HD1 PHE A 78 14.806 -0.253 0.373 1.00 10.53 H new ATOM 0 HD2 PHE A 78 14.194 -3.224 3.354 1.00 21.14 H new ATOM 0 HE1 PHE A 78 15.421 -1.999 -1.233 1.00 24.04 H new ATOM 0 HE2 PHE A 78 14.780 -4.956 1.748 1.00 51.41 H new ATOM 0 HZ PHE A 78 15.401 -4.355 -0.550 1.00 2.33 H new ATOM 1168 N ASP A 79 14.781 0.890 5.894 1.00 72.13 N ATOM 1169 CA ASP A 79 14.486 1.881 6.948 1.00 20.32 C ATOM 1170 C ASP A 79 15.582 2.917 6.984 1.00 74.25 C ATOM 1171 O ASP A 79 15.333 4.115 7.126 1.00 42.50 O ATOM 1172 CB ASP A 79 14.416 1.218 8.340 1.00 1.42 C ATOM 1173 CG ASP A 79 13.215 0.368 8.553 1.00 34.13 C ATOM 1174 OD1 ASP A 79 13.178 -0.761 8.058 1.00 40.03 O ATOM 1175 OD2 ASP A 79 12.273 0.810 9.229 1.00 70.30 O ATOM 0 H ASP A 79 14.893 -0.062 6.243 1.00 72.13 H new ATOM 0 HA ASP A 79 13.522 2.334 6.716 1.00 20.32 H new ATOM 0 HB2 ASP A 79 15.308 0.609 8.485 1.00 1.42 H new ATOM 0 HB3 ASP A 79 14.435 1.997 9.102 1.00 1.42 H new ATOM 1180 N VAL A 80 16.809 2.439 6.845 1.00 23.10 N ATOM 1181 CA VAL A 80 17.995 3.283 6.866 1.00 13.52 C ATOM 1182 C VAL A 80 17.997 4.233 5.660 1.00 74.35 C ATOM 1183 O VAL A 80 18.439 5.381 5.764 1.00 44.34 O ATOM 1184 CB VAL A 80 19.297 2.431 6.852 1.00 33.44 C ATOM 1185 CG1 VAL A 80 20.529 3.312 6.977 1.00 60.53 C ATOM 1186 CG2 VAL A 80 19.277 1.389 7.956 1.00 24.14 C ATOM 0 H VAL A 80 17.012 1.448 6.714 1.00 23.10 H new ATOM 0 HA VAL A 80 17.968 3.863 7.789 1.00 13.52 H new ATOM 0 HB VAL A 80 19.343 1.914 5.893 1.00 33.44 H new ATOM 0 HG11 VAL A 80 21.424 2.690 6.964 1.00 60.53 H new ATOM 0 HG12 VAL A 80 20.562 4.012 6.142 1.00 60.53 H new ATOM 0 HG13 VAL A 80 20.486 3.867 7.914 1.00 60.53 H new ATOM 0 HG21 VAL A 80 20.198 0.807 7.924 1.00 24.14 H new ATOM 0 HG22 VAL A 80 19.195 1.885 8.923 1.00 24.14 H new ATOM 0 HG23 VAL A 80 18.424 0.725 7.815 1.00 24.14 H new ATOM 1196 N ILE A 81 17.481 3.755 4.537 1.00 44.21 N ATOM 1197 CA ILE A 81 17.422 4.548 3.312 1.00 5.22 C ATOM 1198 C ILE A 81 16.560 5.790 3.502 1.00 11.43 C ATOM 1199 O ILE A 81 17.000 6.910 3.200 1.00 11.32 O ATOM 1200 CB ILE A 81 16.914 3.718 2.099 1.00 64.11 C ATOM 1201 CG1 ILE A 81 17.852 2.536 1.828 1.00 53.02 C ATOM 1202 CG2 ILE A 81 16.763 4.585 0.842 1.00 20.11 C ATOM 1203 CD1 ILE A 81 19.293 2.923 1.526 1.00 22.42 C ATOM 0 H ILE A 81 17.094 2.816 4.446 1.00 44.21 H new ATOM 0 HA ILE A 81 18.443 4.861 3.092 1.00 5.22 H new ATOM 0 HB ILE A 81 15.926 3.333 2.353 1.00 64.11 H new ATOM 0 HG12 ILE A 81 17.842 1.876 2.695 1.00 53.02 H new ATOM 0 HG13 ILE A 81 17.460 1.964 0.987 1.00 53.02 H new ATOM 0 HG21 ILE A 81 16.406 3.970 0.016 1.00 20.11 H new ATOM 0 HG22 ILE A 81 16.047 5.384 1.035 1.00 20.11 H new ATOM 0 HG23 ILE A 81 17.728 5.018 0.581 1.00 20.11 H new ATOM 0 HD11 ILE A 81 19.882 2.023 1.348 1.00 22.42 H new ATOM 0 HD12 ILE A 81 19.321 3.557 0.640 1.00 22.42 H new ATOM 0 HD13 ILE A 81 19.709 3.467 2.374 1.00 22.42 H new ATOM 1215 N GLU A 82 15.357 5.610 4.014 1.00 23.11 N ATOM 1216 CA GLU A 82 14.487 6.728 4.267 1.00 42.25 C ATOM 1217 C GLU A 82 13.413 6.354 5.269 1.00 73.05 C ATOM 1218 O GLU A 82 12.890 5.242 5.249 1.00 5.43 O ATOM 1219 CB GLU A 82 13.867 7.274 2.965 1.00 64.44 C ATOM 1220 CG GLU A 82 13.045 8.546 3.161 1.00 33.31 C ATOM 1221 CD GLU A 82 13.838 9.636 3.868 1.00 33.31 C ATOM 1222 OE1 GLU A 82 14.614 10.349 3.206 1.00 70.42 O ATOM 1223 OE2 GLU A 82 13.714 9.766 5.122 1.00 61.33 O ATOM 0 H GLU A 82 14.967 4.700 4.260 1.00 23.11 H new ATOM 0 HA GLU A 82 15.091 7.527 4.696 1.00 42.25 H new ATOM 0 HB2 GLU A 82 14.665 7.474 2.250 1.00 64.44 H new ATOM 0 HB3 GLU A 82 13.231 6.505 2.526 1.00 64.44 H new ATOM 0 HG2 GLU A 82 12.709 8.913 2.191 1.00 33.31 H new ATOM 0 HG3 GLU A 82 12.152 8.314 3.741 1.00 33.31 H new ATOM 1230 N GLY A 83 13.100 7.290 6.128 1.00 44.42 N ATOM 1231 CA GLY A 83 12.115 7.090 7.144 1.00 34.01 C ATOM 1232 C GLY A 83 12.222 8.142 8.223 1.00 75.01 C ATOM 1233 O GLY A 83 11.873 7.896 9.380 1.00 3.31 O ATOM 0 H GLY A 83 13.528 8.216 6.137 1.00 44.42 H new ATOM 0 HA2 GLY A 83 11.120 7.120 6.700 1.00 34.01 H new ATOM 0 HA3 GLY A 83 12.238 6.100 7.584 1.00 34.01 H new ATOM 1237 N ASN A 84 12.701 9.338 7.862 1.00 50.44 N ATOM 1238 CA ASN A 84 12.882 10.396 8.867 1.00 22.53 C ATOM 1239 C ASN A 84 11.551 11.016 9.231 1.00 35.43 C ATOM 1240 O ASN A 84 11.254 11.244 10.400 1.00 30.15 O ATOM 1241 CB ASN A 84 13.856 11.485 8.378 1.00 42.14 C ATOM 1242 CG ASN A 84 14.181 12.515 9.460 1.00 35.12 C ATOM 1243 OD1 ASN A 84 15.129 12.340 10.230 1.00 42.35 O ATOM 1244 ND2 ASN A 84 13.438 13.589 9.519 1.00 51.41 N ATOM 0 H ASN A 84 12.964 9.595 6.911 1.00 50.44 H new ATOM 0 HA ASN A 84 13.314 9.933 9.754 1.00 22.53 H new ATOM 0 HB2 ASN A 84 14.780 11.015 8.040 1.00 42.14 H new ATOM 0 HB3 ASN A 84 13.423 11.993 7.516 1.00 42.14 H new ATOM 0 HD21 ASN A 84 13.636 14.309 10.214 1.00 51.41 H new ATOM 0 HD22 ASN A 84 12.660 13.707 8.870 1.00 51.41 H new ATOM 1251 N ASP A 85 10.743 11.263 8.231 1.00 5.52 N ATOM 1252 CA ASP A 85 9.411 11.838 8.431 1.00 61.25 C ATOM 1253 C ASP A 85 8.405 10.949 7.770 1.00 12.44 C ATOM 1254 O ASP A 85 7.238 11.299 7.595 1.00 35.41 O ATOM 1255 CB ASP A 85 9.313 13.238 7.828 1.00 41.10 C ATOM 1256 CG ASP A 85 10.260 14.237 8.428 1.00 55.01 C ATOM 1257 OD1 ASP A 85 11.410 14.334 7.957 1.00 2.11 O ATOM 1258 OD2 ASP A 85 9.875 14.950 9.370 1.00 52.10 O ATOM 0 H ASP A 85 10.976 11.077 7.256 1.00 5.52 H new ATOM 0 HA ASP A 85 9.221 11.915 9.501 1.00 61.25 H new ATOM 0 HB2 ASP A 85 9.502 13.173 6.757 1.00 41.10 H new ATOM 0 HB3 ASP A 85 8.293 13.603 7.950 1.00 41.10 H new ATOM 1263 N TYR A 86 8.852 9.790 7.424 1.00 21.20 N ATOM 1264 CA TYR A 86 8.042 8.839 6.745 1.00 1.21 C ATOM 1265 C TYR A 86 7.885 7.637 7.666 1.00 2.41 C ATOM 1266 O TYR A 86 8.781 7.366 8.470 1.00 23.23 O ATOM 1267 CB TYR A 86 8.720 8.413 5.430 1.00 24.30 C ATOM 1268 CG TYR A 86 9.082 9.545 4.492 1.00 32.44 C ATOM 1269 CD1 TYR A 86 10.246 10.281 4.695 1.00 52.42 C ATOM 1270 CD2 TYR A 86 8.281 9.875 3.411 1.00 44.35 C ATOM 1271 CE1 TYR A 86 10.600 11.308 3.857 1.00 53.54 C ATOM 1272 CE2 TYR A 86 8.631 10.907 2.561 1.00 72.30 C ATOM 1273 CZ TYR A 86 9.798 11.621 2.793 1.00 51.41 C ATOM 1274 OH TYR A 86 10.151 12.659 1.963 1.00 1.20 O ATOM 0 H TYR A 86 9.804 9.473 7.608 1.00 21.20 H new ATOM 0 HA TYR A 86 7.069 9.265 6.500 1.00 1.21 H new ATOM 0 HB2 TYR A 86 9.627 7.859 5.671 1.00 24.30 H new ATOM 0 HB3 TYR A 86 8.057 7.726 4.905 1.00 24.30 H new ATOM 0 HD1 TYR A 86 10.885 10.038 5.531 1.00 52.42 H new ATOM 0 HD2 TYR A 86 7.373 9.319 3.230 1.00 44.35 H new ATOM 0 HE1 TYR A 86 11.507 11.867 4.036 1.00 53.54 H new ATOM 0 HE2 TYR A 86 8.000 11.156 1.721 1.00 72.30 H new ATOM 0 HH TYR A 86 11.127 12.744 1.942 1.00 1.20 H new ATOM 1284 N GLU A 87 6.779 6.949 7.581 1.00 51.11 N ATOM 1285 CA GLU A 87 6.538 5.784 8.433 1.00 64.43 C ATOM 1286 C GLU A 87 6.079 4.613 7.608 1.00 53.12 C ATOM 1287 O GLU A 87 5.529 4.789 6.528 1.00 4.41 O ATOM 1288 CB GLU A 87 5.479 6.094 9.483 1.00 4.40 C ATOM 1289 CG GLU A 87 4.130 6.468 8.892 1.00 50.43 C ATOM 1290 CD GLU A 87 3.093 6.795 9.923 1.00 3.31 C ATOM 1291 OE1 GLU A 87 2.745 5.906 10.728 1.00 74.10 O ATOM 1292 OE2 GLU A 87 2.619 7.941 9.956 1.00 3.04 O ATOM 0 H GLU A 87 6.021 7.164 6.934 1.00 51.11 H new ATOM 0 HA GLU A 87 7.476 5.536 8.929 1.00 64.43 H new ATOM 0 HB2 GLU A 87 5.355 5.225 10.130 1.00 4.40 H new ATOM 0 HB3 GLU A 87 5.831 6.912 10.112 1.00 4.40 H new ATOM 0 HG2 GLU A 87 4.257 7.326 8.232 1.00 50.43 H new ATOM 0 HG3 GLU A 87 3.771 5.643 8.277 1.00 50.43 H new ATOM 1299 N ARG A 88 6.289 3.433 8.111 1.00 1.34 N ATOM 1300 CA ARG A 88 5.872 2.254 7.440 1.00 53.34 C ATOM 1301 C ARG A 88 4.483 1.841 7.859 1.00 5.41 C ATOM 1302 O ARG A 88 4.191 1.724 9.049 1.00 63.23 O ATOM 1303 CB ARG A 88 6.827 1.145 7.698 1.00 71.24 C ATOM 1304 CG ARG A 88 6.458 -0.103 6.955 1.00 12.30 C ATOM 1305 CD ARG A 88 7.487 -1.118 7.156 1.00 11.32 C ATOM 1306 NE ARG A 88 8.759 -0.726 6.549 1.00 1.04 N ATOM 1307 CZ ARG A 88 9.937 -0.756 7.167 1.00 32.10 C ATOM 1308 NH1 ARG A 88 10.017 -1.088 8.450 1.00 61.43 N ATOM 1309 NH2 ARG A 88 11.035 -0.432 6.517 1.00 24.14 N ATOM 0 H ARG A 88 6.757 3.268 9.002 1.00 1.34 H new ATOM 0 HA ARG A 88 5.854 2.473 6.372 1.00 53.34 H new ATOM 0 HB2 ARG A 88 7.830 1.456 7.407 1.00 71.24 H new ATOM 0 HB3 ARG A 88 6.857 0.934 8.767 1.00 71.24 H new ATOM 0 HG2 ARG A 88 5.494 -0.474 7.304 1.00 12.30 H new ATOM 0 HG3 ARG A 88 6.350 0.114 5.892 1.00 12.30 H new ATOM 0 HD2 ARG A 88 7.629 -1.285 8.224 1.00 11.32 H new ATOM 0 HD3 ARG A 88 7.155 -2.063 6.727 1.00 11.32 H new ATOM 0 HE ARG A 88 8.742 -0.406 5.581 1.00 1.04 H new ATOM 0 HH11 ARG A 88 9.171 -1.323 8.970 1.00 61.43 H new ATOM 0 HH12 ARG A 88 10.924 -1.108 8.916 1.00 61.43 H new ATOM 0 HH21 ARG A 88 10.985 -0.157 5.536 1.00 24.14 H new ATOM 0 HH22 ARG A 88 11.936 -0.456 6.994 1.00 24.14 H new ATOM 1323 N VAL A 89 3.636 1.661 6.887 1.00 63.44 N ATOM 1324 CA VAL A 89 2.279 1.186 7.085 1.00 71.40 C ATOM 1325 C VAL A 89 1.995 0.109 6.062 1.00 52.25 C ATOM 1326 O VAL A 89 2.691 0.035 5.034 1.00 54.21 O ATOM 1327 CB VAL A 89 1.221 2.315 6.936 1.00 4.03 C ATOM 1328 CG1 VAL A 89 1.356 3.350 8.039 1.00 31.41 C ATOM 1329 CG2 VAL A 89 1.345 2.982 5.583 1.00 50.41 C ATOM 0 H VAL A 89 3.866 1.842 5.910 1.00 63.44 H new ATOM 0 HA VAL A 89 2.204 0.803 8.103 1.00 71.40 H new ATOM 0 HB VAL A 89 0.235 1.857 7.019 1.00 4.03 H new ATOM 0 HG11 VAL A 89 0.601 4.125 7.905 1.00 31.41 H new ATOM 0 HG12 VAL A 89 1.215 2.870 9.007 1.00 31.41 H new ATOM 0 HG13 VAL A 89 2.348 3.799 7.997 1.00 31.41 H new ATOM 0 HG21 VAL A 89 0.597 3.770 5.496 1.00 50.41 H new ATOM 0 HG22 VAL A 89 2.340 3.414 5.480 1.00 50.41 H new ATOM 0 HG23 VAL A 89 1.187 2.243 4.797 1.00 50.41 H new ATOM 1339 N THR A 90 1.022 -0.715 6.320 1.00 33.34 N ATOM 1340 CA THR A 90 0.668 -1.747 5.391 1.00 52.20 C ATOM 1341 C THR A 90 -0.496 -1.264 4.520 1.00 41.22 C ATOM 1342 O THR A 90 -1.557 -0.880 5.025 1.00 31.24 O ATOM 1343 CB THR A 90 0.301 -3.050 6.127 1.00 11.40 C ATOM 1344 OG1 THR A 90 1.362 -3.386 7.054 1.00 30.42 O ATOM 1345 CG2 THR A 90 0.128 -4.201 5.135 1.00 45.34 C ATOM 0 H THR A 90 0.458 -0.692 7.169 1.00 33.34 H new ATOM 0 HA THR A 90 1.526 -1.964 4.754 1.00 52.20 H new ATOM 0 HB THR A 90 -0.638 -2.898 6.659 1.00 11.40 H new ATOM 0 HG1 THR A 90 1.133 -4.213 7.527 1.00 30.42 H new ATOM 0 HG21 THR A 90 -0.131 -5.111 5.676 1.00 45.34 H new ATOM 0 HG22 THR A 90 -0.668 -3.958 4.431 1.00 45.34 H new ATOM 0 HG23 THR A 90 1.059 -4.355 4.590 1.00 45.34 H new ATOM 1353 N VAL A 91 -0.280 -1.278 3.233 1.00 31.33 N ATOM 1354 CA VAL A 91 -1.216 -0.768 2.253 1.00 10.04 C ATOM 1355 C VAL A 91 -1.510 -1.839 1.220 1.00 22.33 C ATOM 1356 O VAL A 91 -0.717 -2.765 1.037 1.00 31.42 O ATOM 1357 CB VAL A 91 -0.623 0.469 1.546 1.00 71.11 C ATOM 1358 CG1 VAL A 91 -0.414 1.590 2.538 1.00 51.22 C ATOM 1359 CG2 VAL A 91 0.693 0.100 0.857 1.00 63.31 C ATOM 0 H VAL A 91 0.574 -1.654 2.820 1.00 31.33 H new ATOM 0 HA VAL A 91 -2.137 -0.485 2.762 1.00 10.04 H new ATOM 0 HB VAL A 91 -1.325 0.813 0.786 1.00 71.11 H new ATOM 0 HG11 VAL A 91 0.005 2.456 2.025 1.00 51.22 H new ATOM 0 HG12 VAL A 91 -1.369 1.861 2.987 1.00 51.22 H new ATOM 0 HG13 VAL A 91 0.274 1.262 3.318 1.00 51.22 H new ATOM 0 HG21 VAL A 91 1.103 0.980 0.361 1.00 63.31 H new ATOM 0 HG22 VAL A 91 1.404 -0.262 1.600 1.00 63.31 H new ATOM 0 HG23 VAL A 91 0.511 -0.681 0.119 1.00 63.31 H new ATOM 1369 N GLU A 92 -2.617 -1.732 0.552 1.00 55.15 N ATOM 1370 CA GLU A 92 -2.985 -2.738 -0.399 1.00 23.24 C ATOM 1371 C GLU A 92 -2.765 -2.210 -1.808 1.00 61.40 C ATOM 1372 O GLU A 92 -3.306 -1.167 -2.190 1.00 53.22 O ATOM 1373 CB GLU A 92 -4.431 -3.127 -0.194 1.00 13.03 C ATOM 1374 CG GLU A 92 -4.824 -4.389 -0.889 1.00 21.32 C ATOM 1375 CD GLU A 92 -6.296 -4.625 -0.791 1.00 25.31 C ATOM 1376 OE1 GLU A 92 -7.046 -4.068 -1.622 1.00 11.21 O ATOM 1377 OE2 GLU A 92 -6.735 -5.335 0.122 1.00 41.22 O ATOM 0 H GLU A 92 -3.280 -0.962 0.646 1.00 55.15 H new ATOM 0 HA GLU A 92 -2.365 -3.623 -0.257 1.00 23.24 H new ATOM 0 HB2 GLU A 92 -4.619 -3.239 0.874 1.00 13.03 H new ATOM 0 HB3 GLU A 92 -5.068 -2.316 -0.547 1.00 13.03 H new ATOM 0 HG2 GLU A 92 -4.531 -4.336 -1.937 1.00 21.32 H new ATOM 0 HG3 GLU A 92 -4.288 -5.231 -0.450 1.00 21.32 H new ATOM 1384 N VAL A 93 -2.009 -2.930 -2.581 1.00 45.11 N ATOM 1385 CA VAL A 93 -1.651 -2.498 -3.899 1.00 63.33 C ATOM 1386 C VAL A 93 -2.019 -3.585 -4.891 1.00 1.44 C ATOM 1387 O VAL A 93 -2.369 -4.687 -4.511 1.00 1.43 O ATOM 1388 CB VAL A 93 -0.105 -2.211 -4.026 1.00 55.24 C ATOM 1389 CG1 VAL A 93 0.371 -1.239 -2.976 1.00 3.41 C ATOM 1390 CG2 VAL A 93 0.716 -3.478 -3.973 1.00 12.14 C ATOM 0 H VAL A 93 -1.622 -3.836 -2.315 1.00 45.11 H new ATOM 0 HA VAL A 93 -2.190 -1.573 -4.104 1.00 63.33 H new ATOM 0 HB VAL A 93 0.041 -1.757 -5.006 1.00 55.24 H new ATOM 0 HG11 VAL A 93 1.441 -1.067 -3.097 1.00 3.41 H new ATOM 0 HG12 VAL A 93 -0.163 -0.295 -3.086 1.00 3.41 H new ATOM 0 HG13 VAL A 93 0.180 -1.651 -1.985 1.00 3.41 H new ATOM 0 HG21 VAL A 93 1.774 -3.230 -4.064 1.00 12.14 H new ATOM 0 HG22 VAL A 93 0.543 -3.985 -3.024 1.00 12.14 H new ATOM 0 HG23 VAL A 93 0.425 -4.135 -4.793 1.00 12.14 H new ATOM 1400 N VAL A 94 -1.977 -3.270 -6.129 1.00 73.51 N ATOM 1401 CA VAL A 94 -2.216 -4.243 -7.157 1.00 31.11 C ATOM 1402 C VAL A 94 -0.907 -4.613 -7.766 1.00 72.51 C ATOM 1403 O VAL A 94 -0.170 -3.741 -8.172 1.00 60.44 O ATOM 1404 CB VAL A 94 -3.201 -3.709 -8.212 1.00 63.54 C ATOM 1405 CG1 VAL A 94 -3.303 -4.647 -9.407 1.00 54.42 C ATOM 1406 CG2 VAL A 94 -4.562 -3.542 -7.576 1.00 43.54 C ATOM 0 H VAL A 94 -1.776 -2.331 -6.473 1.00 73.51 H new ATOM 0 HA VAL A 94 -2.679 -5.130 -6.725 1.00 31.11 H new ATOM 0 HB VAL A 94 -2.832 -2.749 -8.574 1.00 63.54 H new ATOM 0 HG11 VAL A 94 -4.007 -4.238 -10.131 1.00 54.42 H new ATOM 0 HG12 VAL A 94 -2.323 -4.751 -9.873 1.00 54.42 H new ATOM 0 HG13 VAL A 94 -3.652 -5.624 -9.074 1.00 54.42 H new ATOM 0 HG21 VAL A 94 -5.266 -3.164 -8.317 1.00 43.54 H new ATOM 0 HG22 VAL A 94 -4.910 -4.505 -7.203 1.00 43.54 H new ATOM 0 HG23 VAL A 94 -4.493 -2.836 -6.748 1.00 43.54 H new ATOM 1416 N ARG A 95 -0.629 -5.916 -7.836 1.00 51.41 N ATOM 1417 CA ARG A 95 0.664 -6.429 -8.291 1.00 71.21 C ATOM 1418 C ARG A 95 0.848 -6.150 -9.793 1.00 62.55 C ATOM 1419 O ARG A 95 1.938 -6.264 -10.332 1.00 40.53 O ATOM 1420 CB ARG A 95 0.780 -7.934 -7.992 1.00 44.43 C ATOM 1421 CG ARG A 95 2.220 -8.398 -7.796 1.00 3.31 C ATOM 1422 CD ARG A 95 2.333 -9.894 -7.536 1.00 61.42 C ATOM 1423 NE ARG A 95 2.135 -10.684 -8.750 1.00 14.11 N ATOM 1424 CZ ARG A 95 2.083 -12.016 -8.814 1.00 24.40 C ATOM 1425 NH1 ARG A 95 1.942 -12.742 -7.700 1.00 73.43 N ATOM 1426 NH2 ARG A 95 2.142 -12.611 -9.997 1.00 65.31 N ATOM 0 H ARG A 95 -1.294 -6.645 -7.579 1.00 51.41 H new ATOM 0 HA ARG A 95 1.457 -5.915 -7.748 1.00 71.21 H new ATOM 0 HB2 ARG A 95 0.205 -8.165 -7.095 1.00 44.43 H new ATOM 0 HB3 ARG A 95 0.332 -8.496 -8.811 1.00 44.43 H new ATOM 0 HG2 ARG A 95 2.802 -8.144 -8.682 1.00 3.31 H new ATOM 0 HG3 ARG A 95 2.660 -7.855 -6.959 1.00 3.31 H new ATOM 0 HD2 ARG A 95 3.315 -10.115 -7.118 1.00 61.42 H new ATOM 0 HD3 ARG A 95 1.595 -10.188 -6.790 1.00 61.42 H new ATOM 0 HE ARG A 95 2.027 -10.172 -9.626 1.00 14.11 H new ATOM 0 HH11 ARG A 95 1.873 -12.278 -6.794 1.00 73.43 H new ATOM 0 HH12 ARG A 95 1.903 -13.760 -7.756 1.00 73.43 H new ATOM 0 HH21 ARG A 95 2.226 -12.051 -10.846 1.00 65.31 H new ATOM 0 HH22 ARG A 95 2.103 -13.628 -10.059 1.00 65.31 H new ATOM 1440 N MET A 96 -0.279 -5.817 -10.439 1.00 73.12 N ATOM 1441 CA MET A 96 -0.377 -5.356 -11.842 1.00 64.21 C ATOM 1442 C MET A 96 -0.098 -6.444 -12.869 1.00 35.52 C ATOM 1443 O MET A 96 -0.936 -6.699 -13.733 1.00 4.50 O ATOM 1444 CB MET A 96 0.454 -4.061 -12.080 1.00 14.44 C ATOM 1445 CG MET A 96 0.345 -3.411 -13.472 1.00 72.31 C ATOM 1446 SD MET A 96 1.112 -4.349 -14.820 1.00 40.14 S ATOM 1447 CE MET A 96 0.746 -3.275 -16.206 1.00 43.54 C ATOM 0 H MET A 96 -1.190 -5.862 -9.983 1.00 73.12 H new ATOM 0 HA MET A 96 -1.423 -5.096 -12.003 1.00 64.21 H new ATOM 0 HB2 MET A 96 0.153 -3.323 -11.336 1.00 14.44 H new ATOM 0 HB3 MET A 96 1.503 -4.292 -11.894 1.00 14.44 H new ATOM 0 HG2 MET A 96 -0.709 -3.265 -13.706 1.00 72.31 H new ATOM 0 HG3 MET A 96 0.803 -2.423 -13.431 1.00 72.31 H new ATOM 0 HE1 MET A 96 1.152 -3.709 -17.120 1.00 43.54 H new ATOM 0 HE2 MET A 96 -0.334 -3.164 -16.305 1.00 43.54 H new ATOM 0 HE3 MET A 96 1.197 -2.297 -16.038 1.00 43.54 H new ATOM 1457 N ASP A 97 1.052 -7.085 -12.759 1.00 12.13 N ATOM 1458 CA ASP A 97 1.501 -8.147 -13.690 1.00 1.22 C ATOM 1459 C ASP A 97 0.390 -9.203 -13.923 1.00 43.44 C ATOM 1460 O ASP A 97 0.124 -9.596 -15.052 1.00 70.43 O ATOM 1461 CB ASP A 97 2.772 -8.843 -13.140 1.00 54.11 C ATOM 1462 CG ASP A 97 2.498 -9.742 -11.945 1.00 21.34 C ATOM 1463 OD1 ASP A 97 1.923 -9.276 -10.959 1.00 42.13 O ATOM 1464 OD2 ASP A 97 2.789 -10.948 -12.020 1.00 62.25 O ATOM 0 H ASP A 97 1.722 -6.892 -12.015 1.00 12.13 H new ATOM 0 HA ASP A 97 1.730 -7.673 -14.645 1.00 1.22 H new ATOM 0 HB2 ASP A 97 3.226 -9.435 -13.935 1.00 54.11 H new ATOM 0 HB3 ASP A 97 3.499 -8.083 -12.854 1.00 54.11 H new ATOM 1469 N ASN A 98 -0.240 -9.636 -12.845 1.00 64.24 N ATOM 1470 CA ASN A 98 -1.338 -10.619 -12.888 1.00 11.01 C ATOM 1471 C ASN A 98 -2.623 -9.993 -12.427 1.00 2.23 C ATOM 1472 O ASN A 98 -3.612 -10.682 -12.199 1.00 24.45 O ATOM 1473 CB ASN A 98 -1.029 -11.859 -12.025 1.00 5.31 C ATOM 1474 CG ASN A 98 -0.077 -12.882 -12.659 1.00 51.43 C ATOM 1475 OD1 ASN A 98 0.794 -12.458 -13.535 1.00 15.22 O flip ATOM 1476 ND2 ASN A 98 -0.150 -14.071 -12.344 1.00 32.34 N flip ATOM 0 H ASN A 98 -0.011 -9.320 -11.902 1.00 64.24 H new ATOM 0 HA ASN A 98 -1.442 -10.942 -13.924 1.00 11.01 H new ATOM 0 HB2 ASN A 98 -0.600 -11.525 -11.080 1.00 5.31 H new ATOM 0 HB3 ASN A 98 -1.968 -12.360 -11.789 1.00 5.31 H new ATOM 0 HD21 ASN A 98 -0.840 -14.375 -11.657 1.00 32.34 H new ATOM 0 HD22 ASN A 98 0.479 -14.751 -12.770 1.00 32.34 H new ATOM 1483 N SER A 99 -2.594 -8.674 -12.274 1.00 72.42 N ATOM 1484 CA SER A 99 -3.755 -7.867 -11.869 1.00 51.10 C ATOM 1485 C SER A 99 -4.289 -8.206 -10.460 1.00 11.14 C ATOM 1486 O SER A 99 -5.345 -7.719 -10.067 1.00 74.54 O ATOM 1487 CB SER A 99 -4.865 -8.015 -12.906 1.00 5.50 C ATOM 1488 OG SER A 99 -4.382 -7.662 -14.188 1.00 2.13 O ATOM 0 H SER A 99 -1.752 -8.119 -12.429 1.00 72.42 H new ATOM 0 HA SER A 99 -3.416 -6.832 -11.818 1.00 51.10 H new ATOM 0 HB2 SER A 99 -5.229 -9.042 -12.916 1.00 5.50 H new ATOM 0 HB3 SER A 99 -5.710 -7.380 -12.639 1.00 5.50 H new ATOM 0 HG SER A 99 -4.641 -6.739 -14.392 1.00 2.13 H new ATOM 1494 N GLU A 100 -3.556 -9.004 -9.703 1.00 44.00 N ATOM 1495 CA GLU A 100 -4.004 -9.379 -8.381 1.00 11.40 C ATOM 1496 C GLU A 100 -3.654 -8.312 -7.390 1.00 32.22 C ATOM 1497 O GLU A 100 -2.784 -7.477 -7.640 1.00 14.33 O ATOM 1498 CB GLU A 100 -3.429 -10.717 -7.939 1.00 21.45 C ATOM 1499 CG GLU A 100 -1.926 -10.719 -7.728 1.00 43.52 C ATOM 1500 CD GLU A 100 -1.426 -12.077 -7.277 1.00 4.03 C ATOM 1501 OE1 GLU A 100 -1.240 -12.964 -8.127 1.00 11.52 O ATOM 1502 OE2 GLU A 100 -1.250 -12.284 -6.048 1.00 42.15 O ATOM 0 H GLU A 100 -2.658 -9.399 -9.981 1.00 44.00 H new ATOM 0 HA GLU A 100 -5.088 -9.488 -8.425 1.00 11.40 H new ATOM 0 HB2 GLU A 100 -3.914 -11.017 -7.010 1.00 21.45 H new ATOM 0 HB3 GLU A 100 -3.679 -11.470 -8.686 1.00 21.45 H new ATOM 0 HG2 GLU A 100 -1.428 -10.437 -8.656 1.00 43.52 H new ATOM 0 HG3 GLU A 100 -1.662 -9.968 -6.983 1.00 43.52 H new ATOM 1509 N LYS A 101 -4.308 -8.340 -6.289 1.00 51.14 N ATOM 1510 CA LYS A 101 -4.104 -7.363 -5.261 1.00 41.35 C ATOM 1511 C LYS A 101 -3.242 -7.976 -4.173 1.00 15.13 C ATOM 1512 O LYS A 101 -3.471 -9.118 -3.759 1.00 43.30 O ATOM 1513 CB LYS A 101 -5.439 -6.921 -4.661 1.00 41.54 C ATOM 1514 CG LYS A 101 -6.481 -6.478 -5.674 1.00 74.11 C ATOM 1515 CD LYS A 101 -7.781 -6.111 -4.984 1.00 12.45 C ATOM 1516 CE LYS A 101 -8.826 -5.662 -5.983 1.00 61.32 C ATOM 1517 NZ LYS A 101 -10.103 -5.312 -5.331 1.00 62.34 N ATOM 0 H LYS A 101 -5.010 -9.045 -6.064 1.00 51.14 H new ATOM 0 HA LYS A 101 -3.613 -6.490 -5.691 1.00 41.35 H new ATOM 0 HB2 LYS A 101 -5.849 -7.745 -4.077 1.00 41.54 H new ATOM 0 HB3 LYS A 101 -5.255 -6.100 -3.968 1.00 41.54 H new ATOM 0 HG2 LYS A 101 -6.108 -5.622 -6.236 1.00 74.11 H new ATOM 0 HG3 LYS A 101 -6.659 -7.278 -6.393 1.00 74.11 H new ATOM 0 HD2 LYS A 101 -8.154 -6.970 -4.426 1.00 12.45 H new ATOM 0 HD3 LYS A 101 -7.600 -5.315 -4.262 1.00 12.45 H new ATOM 0 HE2 LYS A 101 -8.453 -4.799 -6.534 1.00 61.32 H new ATOM 0 HE3 LYS A 101 -8.996 -6.456 -6.710 1.00 61.32 H new ATOM 0 HZ1 LYS A 101 -10.789 -5.010 -6.052 1.00 62.34 H new ATOM 0 HZ2 LYS A 101 -10.474 -6.142 -4.826 1.00 62.34 H new ATOM 0 HZ3 LYS A 101 -9.947 -4.537 -4.656 1.00 62.34 H new ATOM 1531 N VAL A 102 -2.262 -7.255 -3.732 1.00 32.03 N ATOM 1532 CA VAL A 102 -1.374 -7.707 -2.694 1.00 15.21 C ATOM 1533 C VAL A 102 -1.233 -6.605 -1.659 1.00 71.32 C ATOM 1534 O VAL A 102 -1.166 -5.430 -2.002 1.00 15.02 O ATOM 1535 CB VAL A 102 0.043 -8.108 -3.242 1.00 11.33 C ATOM 1536 CG1 VAL A 102 -0.050 -9.268 -4.219 1.00 33.40 C ATOM 1537 CG2 VAL A 102 0.733 -6.930 -3.908 1.00 43.00 C ATOM 0 H VAL A 102 -2.048 -6.322 -4.083 1.00 32.03 H new ATOM 0 HA VAL A 102 -1.806 -8.604 -2.250 1.00 15.21 H new ATOM 0 HB VAL A 102 0.639 -8.421 -2.384 1.00 11.33 H new ATOM 0 HG11 VAL A 102 0.947 -9.521 -4.580 1.00 33.40 H new ATOM 0 HG12 VAL A 102 -0.484 -10.133 -3.717 1.00 33.40 H new ATOM 0 HG13 VAL A 102 -0.680 -8.984 -5.062 1.00 33.40 H new ATOM 0 HG21 VAL A 102 1.711 -7.241 -4.276 1.00 43.00 H new ATOM 0 HG22 VAL A 102 0.127 -6.577 -4.742 1.00 43.00 H new ATOM 0 HG23 VAL A 102 0.858 -6.125 -3.184 1.00 43.00 H new ATOM 1547 N LYS A 103 -1.225 -6.955 -0.419 1.00 63.13 N ATOM 1548 CA LYS A 103 -1.098 -5.959 0.597 1.00 74.25 C ATOM 1549 C LYS A 103 0.288 -6.017 1.236 1.00 44.11 C ATOM 1550 O LYS A 103 0.674 -7.006 1.868 1.00 22.41 O ATOM 1551 CB LYS A 103 -2.302 -6.026 1.550 1.00 2.41 C ATOM 1552 CG LYS A 103 -2.299 -5.017 2.662 1.00 21.03 C ATOM 1553 CD LYS A 103 -3.701 -4.722 3.200 1.00 72.14 C ATOM 1554 CE LYS A 103 -4.493 -5.972 3.516 1.00 55.32 C ATOM 1555 NZ LYS A 103 -5.840 -5.654 4.044 1.00 3.21 N ATOM 0 H LYS A 103 -1.304 -7.915 -0.082 1.00 63.13 H new ATOM 0 HA LYS A 103 -1.143 -4.955 0.175 1.00 74.25 H new ATOM 0 HB2 LYS A 103 -3.213 -5.896 0.967 1.00 2.41 H new ATOM 0 HB3 LYS A 103 -2.343 -7.024 1.987 1.00 2.41 H new ATOM 0 HG2 LYS A 103 -1.672 -5.382 3.476 1.00 21.03 H new ATOM 0 HG3 LYS A 103 -1.850 -4.090 2.304 1.00 21.03 H new ATOM 0 HD2 LYS A 103 -3.617 -4.115 4.102 1.00 72.14 H new ATOM 0 HD3 LYS A 103 -4.247 -4.129 2.466 1.00 72.14 H new ATOM 0 HE2 LYS A 103 -4.590 -6.578 2.615 1.00 55.32 H new ATOM 0 HE3 LYS A 103 -3.949 -6.571 4.246 1.00 55.32 H new ATOM 0 HZ1 LYS A 103 -6.350 -6.537 4.248 1.00 3.21 H new ATOM 0 HZ2 LYS A 103 -5.748 -5.098 4.918 1.00 3.21 H new ATOM 0 HZ3 LYS A 103 -6.369 -5.104 3.337 1.00 3.21 H new ATOM 1569 N VAL A 104 1.010 -4.925 1.054 1.00 52.23 N ATOM 1570 CA VAL A 104 2.441 -4.803 1.339 1.00 73.10 C ATOM 1571 C VAL A 104 2.711 -3.601 2.240 1.00 31.32 C ATOM 1572 O VAL A 104 1.800 -2.854 2.563 1.00 73.31 O ATOM 1573 CB VAL A 104 3.231 -4.594 0.011 1.00 32.41 C ATOM 1574 CG1 VAL A 104 3.012 -5.751 -0.946 1.00 52.11 C ATOM 1575 CG2 VAL A 104 2.827 -3.289 -0.659 1.00 45.00 C ATOM 0 H VAL A 104 0.606 -4.062 0.690 1.00 52.23 H new ATOM 0 HA VAL A 104 2.762 -5.718 1.837 1.00 73.10 H new ATOM 0 HB VAL A 104 4.290 -4.549 0.265 1.00 32.41 H new ATOM 0 HG11 VAL A 104 3.575 -5.577 -1.863 1.00 52.11 H new ATOM 0 HG12 VAL A 104 3.352 -6.677 -0.482 1.00 52.11 H new ATOM 0 HG13 VAL A 104 1.951 -5.832 -1.182 1.00 52.11 H new ATOM 0 HG21 VAL A 104 3.391 -3.165 -1.583 1.00 45.00 H new ATOM 0 HG22 VAL A 104 1.761 -3.311 -0.885 1.00 45.00 H new ATOM 0 HG23 VAL A 104 3.039 -2.455 0.010 1.00 45.00 H new ATOM 1585 N GLU A 105 3.949 -3.410 2.621 1.00 71.22 N ATOM 1586 CA GLU A 105 4.307 -2.298 3.480 1.00 15.33 C ATOM 1587 C GLU A 105 4.884 -1.160 2.640 1.00 31.00 C ATOM 1588 O GLU A 105 5.558 -1.403 1.643 1.00 32.14 O ATOM 1589 CB GLU A 105 5.329 -2.752 4.515 1.00 44.42 C ATOM 1590 CG GLU A 105 4.860 -3.929 5.343 1.00 60.12 C ATOM 1591 CD GLU A 105 5.866 -4.354 6.377 1.00 22.30 C ATOM 1592 OE1 GLU A 105 6.787 -5.100 6.041 1.00 53.31 O ATOM 1593 OE2 GLU A 105 5.722 -3.959 7.559 1.00 11.34 O ATOM 0 H GLU A 105 4.730 -4.008 2.352 1.00 71.22 H new ATOM 0 HA GLU A 105 3.415 -1.942 3.995 1.00 15.33 H new ATOM 0 HB2 GLU A 105 6.256 -3.020 4.007 1.00 44.42 H new ATOM 0 HB3 GLU A 105 5.559 -1.918 5.179 1.00 44.42 H new ATOM 0 HG2 GLU A 105 3.925 -3.669 5.839 1.00 60.12 H new ATOM 0 HG3 GLU A 105 4.648 -4.770 4.683 1.00 60.12 H new ATOM 1600 N THR A 106 4.597 0.067 3.023 1.00 12.45 N ATOM 1601 CA THR A 106 5.073 1.232 2.301 1.00 20.02 C ATOM 1602 C THR A 106 5.379 2.353 3.298 1.00 10.03 C ATOM 1603 O THR A 106 5.132 2.197 4.502 1.00 44.11 O ATOM 1604 CB THR A 106 4.022 1.735 1.271 1.00 63.01 C ATOM 1605 OG1 THR A 106 4.625 2.687 0.386 1.00 73.34 O ATOM 1606 CG2 THR A 106 2.865 2.414 1.990 1.00 50.12 C ATOM 0 H THR A 106 4.029 0.286 3.841 1.00 12.45 H new ATOM 0 HA THR A 106 5.974 0.949 1.756 1.00 20.02 H new ATOM 0 HB THR A 106 3.655 0.877 0.707 1.00 63.01 H new ATOM 0 HG1 THR A 106 5.390 2.274 -0.066 1.00 73.34 H new ATOM 0 HG21 THR A 106 2.136 2.762 1.258 1.00 50.12 H new ATOM 0 HG22 THR A 106 2.390 1.704 2.666 1.00 50.12 H new ATOM 0 HG23 THR A 106 3.240 3.264 2.561 1.00 50.12 H new ATOM 1614 N TYR A 107 5.917 3.455 2.805 1.00 12.54 N ATOM 1615 CA TYR A 107 6.250 4.583 3.639 1.00 71.24 C ATOM 1616 C TYR A 107 5.315 5.752 3.345 1.00 74.11 C ATOM 1617 O TYR A 107 5.261 6.243 2.220 1.00 63.20 O ATOM 1618 CB TYR A 107 7.701 5.024 3.407 1.00 74.14 C ATOM 1619 CG TYR A 107 8.715 3.935 3.624 1.00 52.51 C ATOM 1620 CD1 TYR A 107 9.084 3.547 4.904 1.00 34.52 C ATOM 1621 CD2 TYR A 107 9.307 3.293 2.547 1.00 12.45 C ATOM 1622 CE1 TYR A 107 10.011 2.548 5.101 1.00 53.33 C ATOM 1623 CE2 TYR A 107 10.234 2.296 2.736 1.00 33.10 C ATOM 1624 CZ TYR A 107 10.580 1.926 4.011 1.00 22.44 C ATOM 1625 OH TYR A 107 11.504 0.931 4.200 1.00 12.51 O ATOM 0 H TYR A 107 6.133 3.587 1.817 1.00 12.54 H new ATOM 0 HA TYR A 107 6.135 4.277 4.679 1.00 71.24 H new ATOM 0 HB2 TYR A 107 7.797 5.398 2.388 1.00 74.14 H new ATOM 0 HB3 TYR A 107 7.928 5.855 4.074 1.00 74.14 H new ATOM 0 HD1 TYR A 107 8.638 4.035 5.758 1.00 34.52 H new ATOM 0 HD2 TYR A 107 9.035 3.581 1.542 1.00 12.45 H new ATOM 0 HE1 TYR A 107 10.290 2.254 6.102 1.00 53.33 H new ATOM 0 HE2 TYR A 107 10.687 1.807 1.886 1.00 33.10 H new ATOM 0 HH TYR A 107 11.459 0.297 3.454 1.00 12.51 H new ATOM 1635 N VAL A 108 4.584 6.179 4.345 1.00 40.40 N ATOM 1636 CA VAL A 108 3.713 7.320 4.228 1.00 55.13 C ATOM 1637 C VAL A 108 4.290 8.468 5.047 1.00 2.33 C ATOM 1638 O VAL A 108 5.383 8.346 5.577 1.00 32.32 O ATOM 1639 CB VAL A 108 2.258 7.004 4.665 1.00 5.12 C ATOM 1640 CG1 VAL A 108 1.657 5.926 3.786 1.00 60.44 C ATOM 1641 CG2 VAL A 108 2.186 6.594 6.123 1.00 33.23 C ATOM 0 H VAL A 108 4.577 5.742 5.267 1.00 40.40 H new ATOM 0 HA VAL A 108 3.660 7.603 3.177 1.00 55.13 H new ATOM 0 HB VAL A 108 1.678 7.919 4.548 1.00 5.12 H new ATOM 0 HG11 VAL A 108 0.637 5.720 4.109 1.00 60.44 H new ATOM 0 HG12 VAL A 108 1.648 6.265 2.750 1.00 60.44 H new ATOM 0 HG13 VAL A 108 2.254 5.017 3.865 1.00 60.44 H new ATOM 0 HG21 VAL A 108 1.151 6.381 6.390 1.00 33.23 H new ATOM 0 HG22 VAL A 108 2.792 5.702 6.280 1.00 33.23 H new ATOM 0 HG23 VAL A 108 2.563 7.404 6.748 1.00 33.23 H new ATOM 1651 N TRP A 109 3.572 9.551 5.172 1.00 60.21 N ATOM 1652 CA TRP A 109 4.101 10.724 5.828 1.00 73.41 C ATOM 1653 C TRP A 109 3.587 10.764 7.269 1.00 44.12 C ATOM 1654 O TRP A 109 2.394 10.751 7.483 1.00 72.14 O ATOM 1655 CB TRP A 109 3.629 11.942 5.018 1.00 42.22 C ATOM 1656 CG TRP A 109 4.234 13.257 5.381 1.00 2.44 C ATOM 1657 CD1 TRP A 109 3.599 14.339 5.892 1.00 74.41 C ATOM 1658 CD2 TRP A 109 5.596 13.625 5.238 1.00 31.54 C ATOM 1659 NE1 TRP A 109 4.471 15.368 6.072 1.00 51.32 N ATOM 1660 CE2 TRP A 109 5.717 14.959 5.681 1.00 65.42 C ATOM 1661 CE3 TRP A 109 6.727 12.959 4.778 1.00 12.31 C ATOM 1662 CZ2 TRP A 109 6.929 15.637 5.673 1.00 74.13 C ATOM 1663 CZ3 TRP A 109 7.925 13.630 4.771 1.00 32.21 C ATOM 1664 CH2 TRP A 109 8.023 14.957 5.215 1.00 32.54 C ATOM 0 H TRP A 109 2.617 9.649 4.829 1.00 60.21 H new ATOM 0 HA TRP A 109 5.190 10.717 5.871 1.00 73.41 H new ATOM 0 HB2 TRP A 109 3.834 11.751 3.964 1.00 42.22 H new ATOM 0 HB3 TRP A 109 2.547 12.023 5.123 1.00 42.22 H new ATOM 0 HD1 TRP A 109 2.545 14.379 6.125 1.00 74.41 H new ATOM 0 HE1 TRP A 109 4.235 16.291 6.438 1.00 51.32 H new ATOM 0 HE3 TRP A 109 6.664 11.937 4.434 1.00 12.31 H new ATOM 0 HZ2 TRP A 109 7.004 16.659 6.014 1.00 74.13 H new ATOM 0 HZ3 TRP A 109 8.811 13.125 4.416 1.00 32.21 H new ATOM 0 HH2 TRP A 109 8.983 15.452 5.195 1.00 32.54 H new ATOM 1675 N VAL A 110 4.486 10.800 8.257 1.00 3.43 N ATOM 1676 CA VAL A 110 4.068 10.793 9.663 1.00 2.40 C ATOM 1677 C VAL A 110 3.311 12.050 10.019 1.00 41.32 C ATOM 1678 O VAL A 110 2.328 12.015 10.725 1.00 33.13 O ATOM 1679 CB VAL A 110 5.261 10.624 10.650 1.00 21.54 C ATOM 1680 CG1 VAL A 110 5.935 9.306 10.472 1.00 74.44 C ATOM 1681 CG2 VAL A 110 6.270 11.749 10.538 1.00 73.42 C ATOM 0 H VAL A 110 5.495 10.834 8.113 1.00 3.43 H new ATOM 0 HA VAL A 110 3.415 9.927 9.769 1.00 2.40 H new ATOM 0 HB VAL A 110 4.834 10.664 11.652 1.00 21.54 H new ATOM 0 HG11 VAL A 110 6.762 9.222 11.177 1.00 74.44 H new ATOM 0 HG12 VAL A 110 5.220 8.504 10.655 1.00 74.44 H new ATOM 0 HG13 VAL A 110 6.316 9.227 9.454 1.00 74.44 H new ATOM 0 HG21 VAL A 110 7.081 11.583 11.247 1.00 73.42 H new ATOM 0 HG22 VAL A 110 6.673 11.777 9.526 1.00 73.42 H new ATOM 0 HG23 VAL A 110 5.783 12.698 10.760 1.00 73.42 H new ATOM 1691 N ASN A 111 3.736 13.122 9.431 1.00 71.22 N ATOM 1692 CA ASN A 111 3.269 14.460 9.710 1.00 1.55 C ATOM 1693 C ASN A 111 2.045 14.772 8.828 1.00 2.13 C ATOM 1694 O ASN A 111 1.638 15.892 8.706 1.00 15.04 O ATOM 1695 CB ASN A 111 4.434 15.438 9.459 1.00 33.52 C ATOM 1696 CG ASN A 111 4.253 16.806 10.090 1.00 43.30 C ATOM 1697 OD1 ASN A 111 4.644 17.020 11.240 1.00 34.30 O ATOM 1698 ND2 ASN A 111 3.703 17.730 9.375 1.00 42.44 N ATOM 0 H ASN A 111 4.453 13.097 8.706 1.00 71.22 H new ATOM 0 HA ASN A 111 2.951 14.560 10.748 1.00 1.55 H new ATOM 0 HB2 ASN A 111 5.353 14.994 9.841 1.00 33.52 H new ATOM 0 HB3 ASN A 111 4.563 15.562 8.384 1.00 33.52 H new ATOM 0 HD21 ASN A 111 3.582 18.667 9.758 1.00 42.44 H new ATOM 0 HD22 ASN A 111 3.390 17.522 8.427 1.00 42.44 H new ATOM 1705 N LYS A 112 1.460 13.698 8.255 1.00 14.13 N ATOM 1706 CA LYS A 112 0.372 13.710 7.224 1.00 63.04 C ATOM 1707 C LYS A 112 -0.803 14.640 7.533 1.00 63.30 C ATOM 1708 O LYS A 112 -1.612 14.936 6.646 1.00 72.35 O ATOM 1709 CB LYS A 112 -0.172 12.292 7.094 1.00 51.44 C ATOM 1710 CG LYS A 112 -0.836 11.776 8.347 1.00 55.13 C ATOM 1711 CD LYS A 112 -1.291 10.351 8.196 1.00 62.05 C ATOM 1712 CE LYS A 112 -0.132 9.367 8.324 1.00 41.31 C ATOM 1713 NZ LYS A 112 0.501 9.437 9.671 1.00 34.01 N ATOM 0 H LYS A 112 1.739 12.749 8.503 1.00 14.13 H new ATOM 0 HA LYS A 112 0.827 14.086 6.308 1.00 63.04 H new ATOM 0 HB2 LYS A 112 -0.891 12.262 6.275 1.00 51.44 H new ATOM 0 HB3 LYS A 112 0.645 11.623 6.825 1.00 51.44 H new ATOM 0 HG2 LYS A 112 -0.140 11.848 9.182 1.00 55.13 H new ATOM 0 HG3 LYS A 112 -1.692 12.406 8.590 1.00 55.13 H new ATOM 0 HD2 LYS A 112 -2.042 10.128 8.954 1.00 62.05 H new ATOM 0 HD3 LYS A 112 -1.770 10.224 7.225 1.00 62.05 H new ATOM 0 HE2 LYS A 112 -0.492 8.354 8.143 1.00 41.31 H new ATOM 0 HE3 LYS A 112 0.614 9.582 7.559 1.00 41.31 H new ATOM 0 HZ1 LYS A 112 1.103 8.601 9.816 1.00 34.01 H new ATOM 0 HZ2 LYS A 112 1.082 10.297 9.737 1.00 34.01 H new ATOM 0 HZ3 LYS A 112 -0.239 9.462 10.401 1.00 34.01 H new ATOM 1727 N ASP A 113 -0.900 15.087 8.753 1.00 14.52 N ATOM 1728 CA ASP A 113 -1.982 15.945 9.155 1.00 72.23 C ATOM 1729 C ASP A 113 -1.633 17.434 8.966 1.00 11.11 C ATOM 1730 O ASP A 113 -2.407 18.326 9.361 1.00 23.24 O ATOM 1731 CB ASP A 113 -2.437 15.629 10.585 1.00 25.01 C ATOM 1732 CG ASP A 113 -2.939 14.196 10.720 1.00 30.40 C ATOM 1733 OD1 ASP A 113 -3.995 13.864 10.141 1.00 42.44 O ATOM 1734 OD2 ASP A 113 -2.266 13.367 11.380 1.00 44.52 O ATOM 0 H ASP A 113 -0.235 14.869 9.495 1.00 14.52 H new ATOM 0 HA ASP A 113 -2.827 15.742 8.498 1.00 72.23 H new ATOM 0 HB2 ASP A 113 -1.607 15.789 11.273 1.00 25.01 H new ATOM 0 HB3 ASP A 113 -3.229 16.320 10.875 1.00 25.01 H new ATOM 1739 N ASP A 114 -0.481 17.708 8.346 1.00 2.22 N ATOM 1740 CA ASP A 114 -0.103 19.087 7.997 1.00 73.15 C ATOM 1741 C ASP A 114 -0.729 19.417 6.654 1.00 23.23 C ATOM 1742 O ASP A 114 -1.144 18.495 5.934 1.00 73.21 O ATOM 1743 CB ASP A 114 1.450 19.297 7.915 1.00 32.44 C ATOM 1744 CG ASP A 114 2.166 18.667 6.695 1.00 25.13 C ATOM 1745 OD1 ASP A 114 2.256 19.325 5.628 1.00 75.10 O ATOM 1746 OD2 ASP A 114 2.701 17.549 6.812 1.00 53.54 O ATOM 0 H ASP A 114 0.203 17.001 8.076 1.00 2.22 H new ATOM 0 HA ASP A 114 -0.464 19.747 8.786 1.00 73.15 H new ATOM 0 HB2 ASP A 114 1.650 20.368 7.913 1.00 32.44 H new ATOM 0 HB3 ASP A 114 1.898 18.891 8.822 1.00 32.44 H new ATOM 1751 N PRO A 115 -0.879 20.713 6.305 1.00 60.34 N ATOM 1752 CA PRO A 115 -1.396 21.109 4.997 1.00 11.12 C ATOM 1753 C PRO A 115 -0.500 20.585 3.878 1.00 42.11 C ATOM 1754 O PRO A 115 0.565 21.150 3.589 1.00 63.21 O ATOM 1755 CB PRO A 115 -1.377 22.645 5.032 1.00 33.54 C ATOM 1756 CG PRO A 115 -0.442 22.988 6.143 1.00 60.32 C ATOM 1757 CD PRO A 115 -0.585 21.886 7.147 1.00 4.31 C ATOM 0 HA PRO A 115 -2.391 20.707 4.804 1.00 11.12 H new ATOM 0 HB2 PRO A 115 -1.033 23.058 4.084 1.00 33.54 H new ATOM 0 HB3 PRO A 115 -2.373 23.049 5.214 1.00 33.54 H new ATOM 0 HG2 PRO A 115 0.584 23.059 5.783 1.00 60.32 H new ATOM 0 HG3 PRO A 115 -0.693 23.953 6.582 1.00 60.32 H new ATOM 0 HD2 PRO A 115 0.326 21.748 7.729 1.00 4.31 H new ATOM 0 HD3 PRO A 115 -1.388 22.087 7.856 1.00 4.31 H new ATOM 1765 N ARG A 116 -0.915 19.493 3.283 1.00 31.01 N ATOM 1766 CA ARG A 116 -0.133 18.857 2.268 1.00 61.22 C ATOM 1767 C ARG A 116 -0.223 19.603 0.954 1.00 74.03 C ATOM 1768 O ARG A 116 -1.309 20.037 0.528 1.00 44.32 O ATOM 1769 CB ARG A 116 -0.428 17.338 2.098 1.00 43.00 C ATOM 1770 CG ARG A 116 -1.853 16.941 1.687 1.00 12.13 C ATOM 1771 CD ARG A 116 -2.883 17.077 2.802 1.00 52.44 C ATOM 1772 NE ARG A 116 -4.211 16.699 2.316 1.00 12.31 N ATOM 1773 CZ ARG A 116 -5.305 16.526 3.060 1.00 73.11 C ATOM 1774 NH1 ARG A 116 -5.260 16.648 4.380 1.00 45.10 N ATOM 1775 NH2 ARG A 116 -6.445 16.224 2.471 1.00 1.51 N ATOM 0 H ARG A 116 -1.799 19.028 3.491 1.00 31.01 H new ATOM 0 HA ARG A 116 0.899 18.907 2.615 1.00 61.22 H new ATOM 0 HB2 ARG A 116 0.261 16.942 1.352 1.00 43.00 H new ATOM 0 HB3 ARG A 116 -0.198 16.842 3.041 1.00 43.00 H new ATOM 0 HG2 ARG A 116 -2.162 17.559 0.844 1.00 12.13 H new ATOM 0 HG3 ARG A 116 -1.845 15.908 1.339 1.00 12.13 H new ATOM 0 HD2 ARG A 116 -2.603 16.444 3.644 1.00 52.44 H new ATOM 0 HD3 ARG A 116 -2.901 18.104 3.167 1.00 52.44 H new ATOM 0 HE ARG A 116 -4.310 16.554 1.311 1.00 12.31 H new ATOM 0 HH11 ARG A 116 -4.380 16.877 4.841 1.00 45.10 H new ATOM 0 HH12 ARG A 116 -6.106 16.512 4.934 1.00 45.10 H new ATOM 0 HH21 ARG A 116 -6.484 16.125 1.457 1.00 1.51 H new ATOM 0 HH22 ARG A 116 -7.288 16.089 3.030 1.00 1.51 H new ATOM 1789 N MET A 117 0.916 19.747 0.335 1.00 31.43 N ATOM 1790 CA MET A 117 1.083 20.516 -0.873 1.00 4.44 C ATOM 1791 C MET A 117 0.490 19.817 -2.063 1.00 42.14 C ATOM 1792 O MET A 117 1.102 18.904 -2.632 1.00 11.13 O ATOM 1793 CB MET A 117 2.566 20.741 -1.128 1.00 44.01 C ATOM 1794 CG MET A 117 2.885 21.582 -2.358 1.00 63.34 C ATOM 1795 SD MET A 117 4.664 21.750 -2.635 1.00 74.42 S ATOM 1796 CE MET A 117 5.163 22.551 -1.107 1.00 45.12 C ATOM 0 H MET A 117 1.782 19.320 0.665 1.00 31.43 H new ATOM 0 HA MET A 117 0.565 21.465 -0.737 1.00 4.44 H new ATOM 0 HB2 MET A 117 3.001 21.224 -0.253 1.00 44.01 H new ATOM 0 HB3 MET A 117 3.053 19.771 -1.232 1.00 44.01 H new ATOM 0 HG2 MET A 117 2.425 21.127 -3.235 1.00 63.34 H new ATOM 0 HG3 MET A 117 2.443 22.572 -2.243 1.00 63.34 H new ATOM 0 HE1 MET A 117 5.950 23.276 -1.316 1.00 45.12 H new ATOM 0 HE2 MET A 117 4.306 23.062 -0.668 1.00 45.12 H new ATOM 0 HE3 MET A 117 5.536 21.802 -0.408 1.00 45.12 H new ATOM 1920 N GLU A 125 -0.982 13.333 -15.901 1.00 22.11 N ATOM 1921 CA GLU A 125 -0.427 12.198 -15.205 1.00 41.23 C ATOM 1922 C GLU A 125 -1.598 11.388 -14.662 1.00 30.54 C ATOM 1923 O GLU A 125 -1.600 10.168 -14.689 1.00 11.01 O ATOM 1924 CB GLU A 125 0.457 12.686 -14.057 1.00 5.03 C ATOM 1925 CG GLU A 125 1.331 11.621 -13.436 1.00 64.03 C ATOM 1926 CD GLU A 125 2.367 11.112 -14.407 1.00 10.22 C ATOM 1927 OE1 GLU A 125 3.446 11.741 -14.521 1.00 1.22 O ATOM 1928 OE2 GLU A 125 2.137 10.082 -15.057 1.00 12.23 O ATOM 0 HA GLU A 125 0.184 11.587 -15.869 1.00 41.23 H new ATOM 0 HB2 GLU A 125 1.094 13.491 -14.424 1.00 5.03 H new ATOM 0 HB3 GLU A 125 -0.180 13.112 -13.282 1.00 5.03 H new ATOM 0 HG2 GLU A 125 1.827 12.026 -12.554 1.00 64.03 H new ATOM 0 HG3 GLU A 125 0.710 10.791 -13.099 1.00 64.03 H new ATOM 1935 N TRP A 126 -2.624 12.113 -14.219 1.00 32.23 N ATOM 1936 CA TRP A 126 -3.853 11.532 -13.705 1.00 15.34 C ATOM 1937 C TRP A 126 -4.520 10.621 -14.747 1.00 34.11 C ATOM 1938 O TRP A 126 -5.186 9.647 -14.391 1.00 74.45 O ATOM 1939 CB TRP A 126 -4.790 12.654 -13.212 1.00 2.21 C ATOM 1940 CG TRP A 126 -6.138 12.216 -12.718 1.00 71.05 C ATOM 1941 CD1 TRP A 126 -6.439 11.117 -11.955 1.00 1.14 C ATOM 1942 CD2 TRP A 126 -7.373 12.910 -12.920 1.00 74.12 C ATOM 1943 NE1 TRP A 126 -7.781 11.079 -11.706 1.00 51.20 N ATOM 1944 CE2 TRP A 126 -8.378 12.168 -12.280 1.00 52.23 C ATOM 1945 CE3 TRP A 126 -7.725 14.086 -13.593 1.00 11.03 C ATOM 1946 CZ2 TRP A 126 -9.713 12.561 -12.289 1.00 15.13 C ATOM 1947 CZ3 TRP A 126 -9.049 14.478 -13.597 1.00 15.22 C ATOM 1948 CH2 TRP A 126 -10.028 13.715 -12.950 1.00 12.51 C ATOM 0 H TRP A 126 -2.620 13.133 -14.209 1.00 32.23 H new ATOM 0 HA TRP A 126 -3.619 10.893 -12.853 1.00 15.34 H new ATOM 0 HB2 TRP A 126 -4.288 13.192 -12.408 1.00 2.21 H new ATOM 0 HB3 TRP A 126 -4.936 13.362 -14.027 1.00 2.21 H new ATOM 0 HD1 TRP A 126 -5.722 10.390 -11.604 1.00 1.14 H new ATOM 0 HE1 TRP A 126 -8.263 10.353 -11.176 1.00 51.20 H new ATOM 0 HE3 TRP A 126 -6.975 14.676 -14.100 1.00 11.03 H new ATOM 0 HZ2 TRP A 126 -10.472 11.976 -11.792 1.00 15.13 H new ATOM 0 HZ3 TRP A 126 -9.333 15.387 -14.107 1.00 15.22 H new ATOM 0 HH2 TRP A 126 -11.056 14.046 -12.974 1.00 12.51 H new ATOM 1959 N ARG A 127 -4.306 10.915 -16.031 1.00 64.32 N ATOM 1960 CA ARG A 127 -4.832 10.066 -17.098 1.00 33.02 C ATOM 1961 C ARG A 127 -4.344 8.636 -16.986 1.00 23.22 C ATOM 1962 O ARG A 127 -5.151 7.722 -16.968 1.00 71.10 O ATOM 1963 CB ARG A 127 -4.567 10.629 -18.504 1.00 3.43 C ATOM 1964 CG ARG A 127 -5.651 11.563 -19.043 1.00 62.03 C ATOM 1965 CD ARG A 127 -5.909 12.747 -18.147 1.00 73.31 C ATOM 1966 NE ARG A 127 -6.970 13.599 -18.666 1.00 12.51 N ATOM 1967 CZ ARG A 127 -7.518 14.627 -18.012 1.00 5.25 C ATOM 1968 NH1 ARG A 127 -7.075 14.968 -16.802 1.00 1.13 N ATOM 1969 NH2 ARG A 127 -8.492 15.323 -18.577 1.00 52.14 N ATOM 0 H ARG A 127 -3.778 11.726 -16.354 1.00 64.32 H new ATOM 0 HA ARG A 127 -5.913 10.062 -16.958 1.00 33.02 H new ATOM 0 HB2 ARG A 127 -3.619 11.167 -18.490 1.00 3.43 H new ATOM 0 HB3 ARG A 127 -4.450 9.795 -19.196 1.00 3.43 H new ATOM 0 HG2 ARG A 127 -5.357 11.919 -20.030 1.00 62.03 H new ATOM 0 HG3 ARG A 127 -6.577 11.001 -19.169 1.00 62.03 H new ATOM 0 HD2 ARG A 127 -6.179 12.397 -17.151 1.00 73.31 H new ATOM 0 HD3 ARG A 127 -4.994 13.330 -18.043 1.00 73.31 H new ATOM 0 HE ARG A 127 -7.322 13.395 -19.601 1.00 12.51 H new ATOM 0 HH11 ARG A 127 -6.314 14.443 -16.371 1.00 1.13 H new ATOM 0 HH12 ARG A 127 -7.497 15.754 -16.307 1.00 1.13 H new ATOM 0 HH21 ARG A 127 -8.822 15.074 -19.509 1.00 52.14 H new ATOM 0 HH22 ARG A 127 -8.912 16.108 -18.080 1.00 52.14 H new ATOM 1983 N VAL A 128 -3.039 8.442 -16.815 1.00 64.42 N ATOM 1984 CA VAL A 128 -2.497 7.083 -16.737 1.00 35.51 C ATOM 1985 C VAL A 128 -2.879 6.439 -15.411 1.00 73.52 C ATOM 1986 O VAL A 128 -3.055 5.230 -15.321 1.00 21.34 O ATOM 1987 CB VAL A 128 -0.950 7.018 -16.949 1.00 61.00 C ATOM 1988 CG1 VAL A 128 -0.562 7.656 -18.270 1.00 54.31 C ATOM 1989 CG2 VAL A 128 -0.189 7.650 -15.802 1.00 34.00 C ATOM 0 H VAL A 128 -2.348 9.188 -16.729 1.00 64.42 H new ATOM 0 HA VAL A 128 -2.942 6.524 -17.560 1.00 35.51 H new ATOM 0 HB VAL A 128 -0.672 5.964 -16.976 1.00 61.00 H new ATOM 0 HG11 VAL A 128 0.519 7.600 -18.397 1.00 54.31 H new ATOM 0 HG12 VAL A 128 -1.052 7.127 -19.087 1.00 54.31 H new ATOM 0 HG13 VAL A 128 -0.874 8.700 -18.275 1.00 54.31 H new ATOM 0 HG21 VAL A 128 0.882 7.581 -15.994 1.00 34.00 H new ATOM 0 HG22 VAL A 128 -0.474 8.698 -15.710 1.00 34.00 H new ATOM 0 HG23 VAL A 128 -0.426 7.126 -14.876 1.00 34.00 H new ATOM 1999 N VAL A 129 -3.072 7.285 -14.405 1.00 10.31 N ATOM 2000 CA VAL A 129 -3.435 6.854 -13.070 1.00 54.31 C ATOM 2001 C VAL A 129 -4.857 6.278 -13.047 1.00 23.21 C ATOM 2002 O VAL A 129 -5.176 5.439 -12.225 1.00 51.35 O ATOM 2003 CB VAL A 129 -3.285 8.026 -12.043 1.00 23.20 C ATOM 2004 CG1 VAL A 129 -3.724 7.623 -10.645 1.00 3.52 C ATOM 2005 CG2 VAL A 129 -1.845 8.499 -12.002 1.00 23.21 C ATOM 0 H VAL A 129 -2.979 8.296 -14.499 1.00 10.31 H new ATOM 0 HA VAL A 129 -2.749 6.061 -12.774 1.00 54.31 H new ATOM 0 HB VAL A 129 -3.935 8.834 -12.378 1.00 23.20 H new ATOM 0 HG11 VAL A 129 -3.602 8.468 -9.968 1.00 3.52 H new ATOM 0 HG12 VAL A 129 -4.772 7.322 -10.665 1.00 3.52 H new ATOM 0 HG13 VAL A 129 -3.114 6.789 -10.298 1.00 3.52 H new ATOM 0 HG21 VAL A 129 -1.750 9.314 -11.285 1.00 23.21 H new ATOM 0 HG22 VAL A 129 -1.199 7.674 -11.701 1.00 23.21 H new ATOM 0 HG23 VAL A 129 -1.549 8.849 -12.991 1.00 23.21 H new ATOM 2015 N HIS A 130 -5.713 6.732 -13.938 1.00 23.42 N ATOM 2016 CA HIS A 130 -7.045 6.142 -13.999 1.00 24.44 C ATOM 2017 C HIS A 130 -7.133 5.121 -15.120 1.00 22.35 C ATOM 2018 O HIS A 130 -7.905 4.166 -15.048 1.00 13.23 O ATOM 2019 CB HIS A 130 -8.197 7.186 -14.095 1.00 14.04 C ATOM 2020 CG HIS A 130 -8.288 7.995 -15.372 1.00 23.45 C ATOM 2021 ND1 HIS A 130 -8.829 7.506 -16.549 1.00 73.23 N ATOM 2022 CD2 HIS A 130 -7.942 9.270 -15.631 1.00 63.41 C ATOM 2023 CE1 HIS A 130 -8.805 8.449 -17.462 1.00 25.42 C ATOM 2024 NE2 HIS A 130 -8.274 9.529 -16.932 1.00 51.14 N ATOM 0 H HIS A 130 -5.528 7.478 -14.608 1.00 23.42 H new ATOM 0 HA HIS A 130 -7.191 5.635 -13.045 1.00 24.44 H new ATOM 0 HB2 HIS A 130 -9.142 6.661 -13.959 1.00 14.04 H new ATOM 0 HB3 HIS A 130 -8.095 7.880 -13.261 1.00 14.04 H new ATOM 0 HD2 HIS A 130 -7.486 9.962 -14.938 1.00 63.41 H new ATOM 0 HE1 HIS A 130 -9.161 8.354 -18.477 1.00 25.42 H new ATOM 0 HE2 HIS A 130 -8.133 10.417 -17.414 1.00 51.14 H new ATOM 2033 N ALA A 131 -6.332 5.329 -16.152 1.00 20.11 N ATOM 2034 CA ALA A 131 -6.315 4.472 -17.332 1.00 65.31 C ATOM 2035 C ALA A 131 -6.013 3.035 -16.991 1.00 0.11 C ATOM 2036 O ALA A 131 -6.728 2.124 -17.438 1.00 34.11 O ATOM 2037 CB ALA A 131 -5.316 4.974 -18.350 1.00 71.42 C ATOM 0 H ALA A 131 -5.669 6.103 -16.197 1.00 20.11 H new ATOM 0 HA ALA A 131 -7.317 4.512 -17.759 1.00 65.31 H new ATOM 0 HB1 ALA A 131 -5.322 4.318 -19.220 1.00 71.42 H new ATOM 0 HB2 ALA A 131 -5.585 5.985 -18.656 1.00 71.42 H new ATOM 0 HB3 ALA A 131 -4.319 4.981 -17.909 1.00 71.42 H new ATOM 2043 N GLU A 132 -4.985 2.827 -16.185 1.00 44.03 N ATOM 2044 CA GLU A 132 -4.569 1.488 -15.844 1.00 20.31 C ATOM 2045 C GLU A 132 -5.591 0.741 -15.014 1.00 60.40 C ATOM 2046 O GLU A 132 -5.624 -0.469 -15.015 1.00 34.45 O ATOM 2047 CB GLU A 132 -3.150 1.443 -15.232 1.00 22.44 C ATOM 2048 CG GLU A 132 -2.897 2.337 -14.021 1.00 62.32 C ATOM 2049 CD GLU A 132 -3.670 1.941 -12.793 1.00 62.42 C ATOM 2050 OE1 GLU A 132 -3.264 1.005 -12.098 1.00 15.34 O ATOM 2051 OE2 GLU A 132 -4.702 2.554 -12.509 1.00 30.01 O ATOM 0 H GLU A 132 -4.429 3.568 -15.759 1.00 44.03 H new ATOM 0 HA GLU A 132 -4.508 0.947 -16.788 1.00 20.31 H new ATOM 0 HB2 GLU A 132 -2.936 0.413 -14.946 1.00 22.44 H new ATOM 0 HB3 GLU A 132 -2.435 1.713 -16.010 1.00 22.44 H new ATOM 0 HG2 GLU A 132 -1.832 2.322 -13.788 1.00 62.32 H new ATOM 0 HG3 GLU A 132 -3.151 3.364 -14.282 1.00 62.32 H new ATOM 2058 N LYS A 133 -6.425 1.466 -14.321 1.00 34.41 N ATOM 2059 CA LYS A 133 -7.407 0.860 -13.484 1.00 11.15 C ATOM 2060 C LYS A 133 -8.536 0.322 -14.334 1.00 62.41 C ATOM 2061 O LYS A 133 -8.864 -0.862 -14.276 1.00 54.40 O ATOM 2062 CB LYS A 133 -7.930 1.880 -12.441 1.00 3.13 C ATOM 2063 CG LYS A 133 -8.681 1.254 -11.264 1.00 23.55 C ATOM 2064 CD LYS A 133 -9.995 0.599 -11.648 1.00 64.12 C ATOM 2065 CE LYS A 133 -10.460 -0.325 -10.563 1.00 5.13 C ATOM 2066 NZ LYS A 133 -11.764 -0.948 -10.877 1.00 33.23 N ATOM 0 H LYS A 133 -6.439 2.486 -14.324 1.00 34.41 H new ATOM 0 HA LYS A 133 -6.956 0.030 -12.940 1.00 11.15 H new ATOM 0 HB2 LYS A 133 -7.086 2.451 -12.055 1.00 3.13 H new ATOM 0 HB3 LYS A 133 -8.591 2.587 -12.942 1.00 3.13 H new ATOM 0 HG2 LYS A 133 -8.040 0.509 -10.792 1.00 23.55 H new ATOM 0 HG3 LYS A 133 -8.876 2.025 -10.519 1.00 23.55 H new ATOM 0 HD2 LYS A 133 -10.750 1.364 -11.830 1.00 64.12 H new ATOM 0 HD3 LYS A 133 -9.873 0.044 -12.578 1.00 64.12 H new ATOM 0 HE2 LYS A 133 -9.715 -1.105 -10.409 1.00 5.13 H new ATOM 0 HE3 LYS A 133 -10.540 0.228 -9.627 1.00 5.13 H new ATOM 0 HZ1 LYS A 133 -11.888 -1.804 -10.299 1.00 33.23 H new ATOM 0 HZ2 LYS A 133 -12.529 -0.276 -10.668 1.00 33.23 H new ATOM 0 HZ3 LYS A 133 -11.793 -1.203 -11.885 1.00 33.23 H new ATOM 2080 N PHE A 134 -9.118 1.186 -15.126 1.00 15.34 N ATOM 2081 CA PHE A 134 -10.258 0.812 -15.920 1.00 34.23 C ATOM 2082 C PHE A 134 -9.935 -0.252 -16.947 1.00 34.50 C ATOM 2083 O PHE A 134 -10.773 -1.105 -17.232 1.00 13.24 O ATOM 2084 CB PHE A 134 -10.965 2.029 -16.518 1.00 44.55 C ATOM 2085 CG PHE A 134 -11.628 2.886 -15.465 1.00 12.35 C ATOM 2086 CD1 PHE A 134 -10.942 3.918 -14.841 1.00 14.22 C ATOM 2087 CD2 PHE A 134 -12.943 2.649 -15.097 1.00 30.13 C ATOM 2088 CE1 PHE A 134 -11.553 4.694 -13.877 1.00 60.05 C ATOM 2089 CE2 PHE A 134 -13.558 3.422 -14.130 1.00 3.12 C ATOM 2090 CZ PHE A 134 -12.862 4.446 -13.520 1.00 44.34 C ATOM 0 H PHE A 134 -8.820 2.155 -15.238 1.00 15.34 H new ATOM 0 HA PHE A 134 -10.972 0.348 -15.240 1.00 34.23 H new ATOM 0 HB2 PHE A 134 -10.243 2.630 -17.070 1.00 44.55 H new ATOM 0 HB3 PHE A 134 -11.715 1.694 -17.235 1.00 44.55 H new ATOM 0 HD1 PHE A 134 -9.916 4.117 -15.113 1.00 14.22 H new ATOM 0 HD2 PHE A 134 -13.494 1.851 -15.572 1.00 30.13 H new ATOM 0 HE1 PHE A 134 -11.006 5.495 -13.402 1.00 60.05 H new ATOM 0 HE2 PHE A 134 -14.583 3.225 -13.852 1.00 3.12 H new ATOM 0 HZ PHE A 134 -13.341 5.052 -12.765 1.00 44.34 H new ATOM 2100 N VAL A 135 -8.706 -0.251 -17.469 1.00 74.43 N ATOM 2101 CA VAL A 135 -8.325 -1.279 -18.418 1.00 4.01 C ATOM 2102 C VAL A 135 -8.307 -2.662 -17.729 1.00 54.13 C ATOM 2103 O VAL A 135 -8.738 -3.659 -18.318 1.00 13.55 O ATOM 2104 CB VAL A 135 -6.976 -0.981 -19.149 1.00 41.35 C ATOM 2105 CG1 VAL A 135 -5.800 -0.954 -18.202 1.00 73.21 C ATOM 2106 CG2 VAL A 135 -6.739 -1.964 -20.274 1.00 44.44 C ATOM 0 H VAL A 135 -7.981 0.433 -17.254 1.00 74.43 H new ATOM 0 HA VAL A 135 -9.083 -1.285 -19.201 1.00 4.01 H new ATOM 0 HB VAL A 135 -7.064 0.018 -19.575 1.00 41.35 H new ATOM 0 HG11 VAL A 135 -4.888 -0.743 -18.760 1.00 73.21 H new ATOM 0 HG12 VAL A 135 -5.954 -0.178 -17.452 1.00 73.21 H new ATOM 0 HG13 VAL A 135 -5.708 -1.922 -17.709 1.00 73.21 H new ATOM 0 HG21 VAL A 135 -5.794 -1.734 -20.765 1.00 44.44 H new ATOM 0 HG22 VAL A 135 -6.701 -2.976 -19.871 1.00 44.44 H new ATOM 0 HG23 VAL A 135 -7.551 -1.892 -20.997 1.00 44.44 H new ATOM 2116 N GLU A 136 -7.862 -2.695 -16.457 1.00 71.32 N ATOM 2117 CA GLU A 136 -7.860 -3.929 -15.672 1.00 50.43 C ATOM 2118 C GLU A 136 -9.268 -4.418 -15.487 1.00 63.33 C ATOM 2119 O GLU A 136 -9.535 -5.604 -15.562 1.00 31.02 O ATOM 2120 CB GLU A 136 -7.241 -3.719 -14.300 1.00 21.32 C ATOM 2121 CG GLU A 136 -5.797 -3.316 -14.319 1.00 55.23 C ATOM 2122 CD GLU A 136 -4.888 -4.353 -14.940 1.00 35.03 C ATOM 2123 OE1 GLU A 136 -4.827 -4.457 -16.186 1.00 21.53 O ATOM 2124 OE2 GLU A 136 -4.231 -5.097 -14.199 1.00 65.42 O ATOM 0 H GLU A 136 -7.502 -1.880 -15.960 1.00 71.32 H new ATOM 0 HA GLU A 136 -7.266 -4.662 -16.218 1.00 50.43 H new ATOM 0 HB2 GLU A 136 -7.811 -2.954 -13.773 1.00 21.32 H new ATOM 0 HB3 GLU A 136 -7.339 -4.641 -13.727 1.00 21.32 H new ATOM 0 HG2 GLU A 136 -5.697 -2.380 -14.869 1.00 55.23 H new ATOM 0 HG3 GLU A 136 -5.469 -3.122 -13.298 1.00 55.23 H new ATOM 2131 N THR A 137 -10.168 -3.483 -15.259 1.00 23.33 N ATOM 2132 CA THR A 137 -11.557 -3.793 -15.066 1.00 73.53 C ATOM 2133 C THR A 137 -12.148 -4.449 -16.326 1.00 32.35 C ATOM 2134 O THR A 137 -12.844 -5.461 -16.237 1.00 44.22 O ATOM 2135 CB THR A 137 -12.346 -2.524 -14.702 1.00 51.24 C ATOM 2136 OG1 THR A 137 -11.750 -1.922 -13.529 1.00 33.31 O ATOM 2137 CG2 THR A 137 -13.809 -2.864 -14.421 1.00 45.15 C ATOM 0 H THR A 137 -9.950 -2.488 -15.204 1.00 23.33 H new ATOM 0 HA THR A 137 -11.638 -4.501 -14.241 1.00 73.53 H new ATOM 0 HB THR A 137 -12.310 -1.827 -15.539 1.00 51.24 H new ATOM 0 HG1 THR A 137 -10.888 -1.521 -13.769 1.00 33.31 H new ATOM 0 HG21 THR A 137 -14.351 -1.954 -14.165 1.00 45.15 H new ATOM 0 HG22 THR A 137 -14.255 -3.315 -15.308 1.00 45.15 H new ATOM 0 HG23 THR A 137 -13.866 -3.566 -13.589 1.00 45.15 H new ATOM 2145 N PHE A 138 -11.834 -3.895 -17.498 1.00 50.12 N ATOM 2146 CA PHE A 138 -12.358 -4.445 -18.743 1.00 0.25 C ATOM 2147 C PHE A 138 -11.748 -5.821 -18.994 1.00 1.31 C ATOM 2148 O PHE A 138 -12.419 -6.730 -19.498 1.00 45.34 O ATOM 2149 CB PHE A 138 -12.093 -3.527 -19.949 1.00 44.24 C ATOM 2150 CG PHE A 138 -12.570 -2.110 -19.784 1.00 32.14 C ATOM 2151 CD1 PHE A 138 -13.841 -1.834 -19.306 1.00 43.54 C ATOM 2152 CD2 PHE A 138 -11.743 -1.050 -20.122 1.00 63.32 C ATOM 2153 CE1 PHE A 138 -14.270 -0.532 -19.159 1.00 12.32 C ATOM 2154 CE2 PHE A 138 -12.168 0.253 -19.977 1.00 53.31 C ATOM 2155 CZ PHE A 138 -13.433 0.512 -19.493 1.00 0.32 C ATOM 0 H PHE A 138 -11.230 -3.080 -17.609 1.00 50.12 H new ATOM 0 HA PHE A 138 -13.439 -4.529 -18.633 1.00 0.25 H new ATOM 0 HB2 PHE A 138 -11.021 -3.513 -20.148 1.00 44.24 H new ATOM 0 HB3 PHE A 138 -12.575 -3.957 -20.827 1.00 44.24 H new ATOM 0 HD1 PHE A 138 -14.502 -2.647 -19.046 1.00 43.54 H new ATOM 0 HD2 PHE A 138 -10.752 -1.248 -20.504 1.00 63.32 H new ATOM 0 HE1 PHE A 138 -15.262 -0.330 -18.782 1.00 12.32 H new ATOM 0 HE2 PHE A 138 -11.512 1.069 -20.242 1.00 53.31 H new ATOM 0 HZ PHE A 138 -13.768 1.532 -19.376 1.00 0.32 H new ATOM 2165 N ARG A 139 -10.483 -5.967 -18.639 1.00 44.31 N ATOM 2166 CA ARG A 139 -9.802 -7.239 -18.745 1.00 14.33 C ATOM 2167 C ARG A 139 -10.421 -8.262 -17.819 1.00 40.04 C ATOM 2168 O ARG A 139 -10.777 -9.351 -18.255 1.00 34.11 O ATOM 2169 CB ARG A 139 -8.321 -7.105 -18.445 1.00 2.34 C ATOM 2170 CG ARG A 139 -7.539 -6.331 -19.474 1.00 33.10 C ATOM 2171 CD ARG A 139 -6.091 -6.210 -19.063 1.00 73.40 C ATOM 2172 NE ARG A 139 -5.277 -5.601 -20.099 1.00 54.34 N ATOM 2173 CZ ARG A 139 -4.063 -5.095 -19.906 1.00 25.44 C ATOM 2174 NH1 ARG A 139 -3.571 -4.974 -18.671 1.00 31.03 N ATOM 2175 NH2 ARG A 139 -3.367 -4.661 -20.941 1.00 71.13 N ATOM 0 H ARG A 139 -9.905 -5.211 -18.272 1.00 44.31 H new ATOM 0 HA ARG A 139 -9.914 -7.578 -19.775 1.00 14.33 H new ATOM 0 HB2 ARG A 139 -8.203 -6.619 -17.477 1.00 2.34 H new ATOM 0 HB3 ARG A 139 -7.890 -8.102 -18.355 1.00 2.34 H new ATOM 0 HG2 ARG A 139 -7.607 -6.830 -20.441 1.00 33.10 H new ATOM 0 HG3 ARG A 139 -7.972 -5.338 -19.596 1.00 33.10 H new ATOM 0 HD2 ARG A 139 -6.022 -5.615 -18.152 1.00 73.40 H new ATOM 0 HD3 ARG A 139 -5.698 -7.199 -18.828 1.00 73.40 H new ATOM 0 HE ARG A 139 -5.664 -5.558 -21.042 1.00 54.34 H new ATOM 0 HH11 ARG A 139 -4.127 -5.271 -17.869 1.00 31.03 H new ATOM 0 HH12 ARG A 139 -2.639 -4.585 -18.529 1.00 31.03 H new ATOM 0 HH21 ARG A 139 -3.762 -4.715 -21.880 1.00 71.13 H new ATOM 0 HH22 ARG A 139 -2.435 -4.271 -20.801 1.00 71.13 H new ATOM 2189 N LYS A 140 -10.563 -7.897 -16.551 1.00 5.30 N ATOM 2190 CA LYS A 140 -11.132 -8.779 -15.541 1.00 15.41 C ATOM 2191 C LYS A 140 -12.572 -9.131 -15.821 1.00 73.04 C ATOM 2192 O LYS A 140 -12.994 -10.225 -15.533 1.00 54.43 O ATOM 2193 CB LYS A 140 -10.981 -8.215 -14.118 1.00 65.00 C ATOM 2194 CG LYS A 140 -9.539 -8.179 -13.589 1.00 1.20 C ATOM 2195 CD LYS A 140 -8.919 -9.588 -13.492 1.00 24.02 C ATOM 2196 CE LYS A 140 -9.679 -10.493 -12.512 1.00 72.24 C ATOM 2197 NZ LYS A 140 -9.125 -11.871 -12.471 1.00 63.30 N ATOM 0 H LYS A 140 -10.287 -6.982 -16.194 1.00 5.30 H new ATOM 0 HA LYS A 140 -10.552 -9.700 -15.599 1.00 15.41 H new ATOM 0 HB2 LYS A 140 -11.386 -7.203 -14.099 1.00 65.00 H new ATOM 0 HB3 LYS A 140 -11.588 -8.814 -13.439 1.00 65.00 H new ATOM 0 HG2 LYS A 140 -8.928 -7.560 -14.246 1.00 1.20 H new ATOM 0 HG3 LYS A 140 -9.526 -7.710 -12.605 1.00 1.20 H new ATOM 0 HD2 LYS A 140 -8.914 -10.049 -14.480 1.00 24.02 H new ATOM 0 HD3 LYS A 140 -7.880 -9.504 -13.174 1.00 24.02 H new ATOM 0 HE2 LYS A 140 -9.639 -10.058 -11.513 1.00 72.24 H new ATOM 0 HE3 LYS A 140 -10.730 -10.535 -12.800 1.00 72.24 H new ATOM 0 HZ1 LYS A 140 -9.881 -12.542 -12.228 1.00 63.30 H new ATOM 0 HZ2 LYS A 140 -8.731 -12.115 -13.402 1.00 63.30 H new ATOM 0 HZ3 LYS A 140 -8.374 -11.922 -11.754 1.00 63.30 H new ATOM 2211 N MET A 141 -13.330 -8.220 -16.379 1.00 4.35 N ATOM 2212 CA MET A 141 -14.712 -8.531 -16.686 1.00 73.20 C ATOM 2213 C MET A 141 -14.772 -9.534 -17.854 1.00 42.01 C ATOM 2214 O MET A 141 -15.661 -10.376 -17.924 1.00 3.42 O ATOM 2215 CB MET A 141 -15.548 -7.258 -16.970 1.00 21.51 C ATOM 2216 CG MET A 141 -15.241 -6.554 -18.270 1.00 44.13 C ATOM 2217 SD MET A 141 -16.187 -5.023 -18.476 1.00 24.10 S ATOM 2218 CE MET A 141 -17.871 -5.639 -18.363 1.00 11.30 C ATOM 0 H MET A 141 -13.028 -7.278 -16.627 1.00 4.35 H new ATOM 0 HA MET A 141 -15.163 -8.994 -15.808 1.00 73.20 H new ATOM 0 HB2 MET A 141 -16.604 -7.529 -16.965 1.00 21.51 H new ATOM 0 HB3 MET A 141 -15.396 -6.555 -16.151 1.00 21.51 H new ATOM 0 HG2 MET A 141 -14.176 -6.327 -18.313 1.00 44.13 H new ATOM 0 HG3 MET A 141 -15.457 -7.225 -19.102 1.00 44.13 H new ATOM 0 HE1 MET A 141 -18.553 -4.917 -18.812 1.00 11.30 H new ATOM 0 HE2 MET A 141 -17.947 -6.589 -18.893 1.00 11.30 H new ATOM 0 HE3 MET A 141 -18.135 -5.786 -17.316 1.00 11.30 H new ATOM 2228 N LEU A 142 -13.788 -9.448 -18.741 1.00 31.53 N ATOM 2229 CA LEU A 142 -13.697 -10.325 -19.895 1.00 74.35 C ATOM 2230 C LEU A 142 -13.176 -11.700 -19.503 1.00 2.31 C ATOM 2231 O LEU A 142 -13.780 -12.710 -19.844 1.00 65.30 O ATOM 2232 CB LEU A 142 -12.798 -9.703 -20.970 1.00 12.32 C ATOM 2233 CG LEU A 142 -12.560 -10.536 -22.238 1.00 64.02 C ATOM 2234 CD1 LEU A 142 -13.863 -10.814 -22.964 1.00 3.35 C ATOM 2235 CD2 LEU A 142 -11.579 -9.829 -23.155 1.00 24.51 C ATOM 0 H LEU A 142 -13.032 -8.767 -18.678 1.00 31.53 H new ATOM 0 HA LEU A 142 -14.701 -10.448 -20.302 1.00 74.35 H new ATOM 0 HB2 LEU A 142 -13.233 -8.749 -21.267 1.00 12.32 H new ATOM 0 HB3 LEU A 142 -11.830 -9.485 -20.519 1.00 12.32 H new ATOM 0 HG LEU A 142 -12.134 -11.494 -21.940 1.00 64.02 H new ATOM 0 HD11 LEU A 142 -13.663 -11.405 -23.857 1.00 3.35 H new ATOM 0 HD12 LEU A 142 -14.535 -11.366 -22.307 1.00 3.35 H new ATOM 0 HD13 LEU A 142 -14.329 -9.871 -23.250 1.00 3.35 H new ATOM 0 HD21 LEU A 142 -11.419 -10.430 -24.050 1.00 24.51 H new ATOM 0 HD22 LEU A 142 -11.982 -8.857 -23.438 1.00 24.51 H new ATOM 0 HD23 LEU A 142 -10.630 -9.692 -22.636 1.00 24.51 H new ATOM 2247 N GLU A 143 -12.076 -11.737 -18.776 1.00 14.04 N ATOM 2248 CA GLU A 143 -11.474 -12.999 -18.379 1.00 60.11 C ATOM 2249 C GLU A 143 -12.332 -13.757 -17.376 1.00 21.11 C ATOM 2250 O GLU A 143 -12.209 -14.970 -17.229 1.00 62.54 O ATOM 2251 CB GLU A 143 -9.975 -12.860 -17.996 1.00 11.33 C ATOM 2252 CG GLU A 143 -9.641 -11.924 -16.838 1.00 14.13 C ATOM 2253 CD GLU A 143 -9.958 -12.488 -15.478 1.00 3.04 C ATOM 2254 OE1 GLU A 143 -9.137 -13.255 -14.939 1.00 44.55 O ATOM 2255 OE2 GLU A 143 -10.988 -12.175 -14.917 1.00 4.31 O ATOM 0 H GLU A 143 -11.580 -10.909 -18.447 1.00 14.04 H new ATOM 0 HA GLU A 143 -11.456 -13.640 -19.261 1.00 60.11 H new ATOM 0 HB2 GLU A 143 -9.594 -13.852 -17.751 1.00 11.33 H new ATOM 0 HB3 GLU A 143 -9.431 -12.518 -18.876 1.00 11.33 H new ATOM 0 HG2 GLU A 143 -8.580 -11.678 -16.879 1.00 14.13 H new ATOM 0 HG3 GLU A 143 -10.190 -10.991 -16.969 1.00 14.13 H new ATOM 2262 N TRP A 144 -13.154 -13.023 -16.654 1.00 70.23 N ATOM 2263 CA TRP A 144 -14.132 -13.607 -15.770 1.00 64.11 C ATOM 2264 C TRP A 144 -15.309 -14.173 -16.561 1.00 44.12 C ATOM 2265 O TRP A 144 -15.772 -15.272 -16.288 1.00 22.12 O ATOM 2266 CB TRP A 144 -14.598 -12.576 -14.749 1.00 15.24 C ATOM 2267 CG TRP A 144 -15.751 -13.003 -13.920 1.00 52.10 C ATOM 2268 CD1 TRP A 144 -15.741 -13.855 -12.861 1.00 74.34 C ATOM 2269 CD2 TRP A 144 -17.098 -12.575 -14.089 1.00 74.33 C ATOM 2270 NE1 TRP A 144 -17.013 -13.984 -12.363 1.00 21.32 N ATOM 2271 CE2 TRP A 144 -17.861 -13.207 -13.106 1.00 62.44 C ATOM 2272 CE3 TRP A 144 -17.728 -11.711 -14.990 1.00 34.14 C ATOM 2273 CZ2 TRP A 144 -19.224 -13.009 -12.992 1.00 41.12 C ATOM 2274 CZ3 TRP A 144 -19.080 -11.515 -14.877 1.00 71.41 C ATOM 2275 CH2 TRP A 144 -19.814 -12.159 -13.885 1.00 23.54 C ATOM 0 H TRP A 144 -13.160 -12.003 -16.666 1.00 70.23 H new ATOM 0 HA TRP A 144 -13.668 -14.435 -15.233 1.00 64.11 H new ATOM 0 HB2 TRP A 144 -13.764 -12.334 -14.090 1.00 15.24 H new ATOM 0 HB3 TRP A 144 -14.865 -11.659 -15.274 1.00 15.24 H new ATOM 0 HD1 TRP A 144 -14.866 -14.354 -12.471 1.00 74.34 H new ATOM 0 HE1 TRP A 144 -17.283 -14.564 -11.569 1.00 21.32 H new ATOM 0 HE3 TRP A 144 -17.161 -11.208 -15.759 1.00 34.14 H new ATOM 0 HZ2 TRP A 144 -19.801 -13.507 -12.227 1.00 41.12 H new ATOM 0 HZ3 TRP A 144 -19.582 -10.852 -15.566 1.00 71.41 H new ATOM 0 HH2 TRP A 144 -20.877 -11.982 -13.819 1.00 23.54 H new ATOM 2286 N ASN A 145 -15.788 -13.435 -17.542 1.00 63.15 N ATOM 2287 CA ASN A 145 -16.917 -13.910 -18.341 1.00 12.13 C ATOM 2288 C ASN A 145 -16.485 -15.096 -19.204 1.00 74.33 C ATOM 2289 O ASN A 145 -17.239 -16.039 -19.422 1.00 12.20 O ATOM 2290 CB ASN A 145 -17.489 -12.790 -19.216 1.00 61.55 C ATOM 2291 CG ASN A 145 -18.750 -13.207 -19.960 1.00 52.12 C ATOM 2292 OD1 ASN A 145 -19.539 -14.036 -19.480 1.00 24.00 O ATOM 2293 ND2 ASN A 145 -18.954 -12.651 -21.129 1.00 11.24 N ATOM 0 H ASN A 145 -15.426 -12.519 -17.808 1.00 63.15 H new ATOM 0 HA ASN A 145 -17.704 -14.234 -17.660 1.00 12.13 H new ATOM 0 HB2 ASN A 145 -17.711 -11.925 -18.591 1.00 61.55 H new ATOM 0 HB3 ASN A 145 -16.734 -12.477 -19.937 1.00 61.55 H new ATOM 0 HD21 ASN A 145 -19.781 -12.896 -21.673 1.00 11.24 H new ATOM 0 HD22 ASN A 145 -18.286 -11.973 -21.495 1.00 11.24 H new ATOM 2300 N LYS A 146 -15.250 -15.045 -19.661 1.00 64.03 N ATOM 2301 CA LYS A 146 -14.673 -16.099 -20.485 1.00 71.13 C ATOM 2302 C LYS A 146 -13.926 -17.146 -19.594 1.00 72.14 C ATOM 2303 O LYS A 146 -13.250 -18.043 -20.101 1.00 1.43 O ATOM 2304 CB LYS A 146 -13.706 -15.475 -21.527 1.00 60.45 C ATOM 2305 CG LYS A 146 -13.186 -16.462 -22.573 1.00 44.34 C ATOM 2306 CD LYS A 146 -12.154 -15.851 -23.509 1.00 70.22 C ATOM 2307 CE LYS A 146 -12.717 -14.704 -24.333 1.00 0.43 C ATOM 2308 NZ LYS A 146 -11.725 -14.203 -25.305 1.00 11.24 N ATOM 0 H LYS A 146 -14.613 -14.271 -19.473 1.00 64.03 H new ATOM 0 HA LYS A 146 -15.474 -16.618 -21.012 1.00 71.13 H new ATOM 0 HB2 LYS A 146 -14.218 -14.659 -22.037 1.00 60.45 H new ATOM 0 HB3 LYS A 146 -12.856 -15.039 -21.001 1.00 60.45 H new ATOM 0 HG2 LYS A 146 -12.745 -17.320 -22.066 1.00 44.34 H new ATOM 0 HG3 LYS A 146 -14.025 -16.835 -23.161 1.00 44.34 H new ATOM 0 HD2 LYS A 146 -11.307 -15.492 -22.925 1.00 70.22 H new ATOM 0 HD3 LYS A 146 -11.775 -16.623 -24.179 1.00 70.22 H new ATOM 0 HE2 LYS A 146 -13.610 -15.037 -24.861 1.00 0.43 H new ATOM 0 HE3 LYS A 146 -13.022 -13.893 -23.671 1.00 0.43 H new ATOM 0 HZ1 LYS A 146 -12.139 -13.421 -25.852 1.00 11.24 H new ATOM 0 HZ2 LYS A 146 -10.883 -13.863 -24.798 1.00 11.24 H new ATOM 0 HZ3 LYS A 146 -11.453 -14.971 -25.951 1.00 11.24 H new ATOM 2322 N ASN A 147 -14.075 -17.016 -18.270 1.00 65.34 N ATOM 2323 CA ASN A 147 -13.383 -17.880 -17.267 1.00 4.32 C ATOM 2324 C ASN A 147 -13.465 -19.375 -17.608 1.00 32.15 C ATOM 2325 O ASN A 147 -14.553 -19.945 -17.668 1.00 73.40 O ATOM 2326 CB ASN A 147 -13.931 -17.618 -15.849 1.00 71.25 C ATOM 2327 CG ASN A 147 -13.316 -18.507 -14.782 1.00 73.51 C ATOM 2328 OD1 ASN A 147 -13.838 -19.574 -14.482 1.00 0.40 O ATOM 2329 ND2 ASN A 147 -12.210 -18.080 -14.211 1.00 35.12 N ATOM 0 H ASN A 147 -14.678 -16.310 -17.848 1.00 65.34 H new ATOM 0 HA ASN A 147 -12.328 -17.607 -17.298 1.00 4.32 H new ATOM 0 HB2 ASN A 147 -13.753 -16.575 -15.587 1.00 71.25 H new ATOM 0 HB3 ASN A 147 -15.011 -17.765 -15.854 1.00 71.25 H new ATOM 0 HD21 ASN A 147 -11.757 -18.644 -13.491 1.00 35.12 H new ATOM 0 HD22 ASN A 147 -11.806 -17.186 -14.488 1.00 35.12 H new ATOM 2336 N PRO A 148 -12.289 -20.028 -17.827 1.00 12.44 N ATOM 2337 CA PRO A 148 -12.207 -21.450 -18.229 1.00 20.43 C ATOM 2338 C PRO A 148 -12.767 -22.413 -17.185 1.00 22.21 C ATOM 2339 O PRO A 148 -13.183 -23.529 -17.517 1.00 14.14 O ATOM 2340 CB PRO A 148 -10.706 -21.707 -18.409 1.00 32.24 C ATOM 2341 CG PRO A 148 -10.064 -20.364 -18.472 1.00 74.10 C ATOM 2342 CD PRO A 148 -10.945 -19.423 -17.710 1.00 22.11 C ATOM 0 HA PRO A 148 -12.802 -21.624 -19.125 1.00 20.43 H new ATOM 0 HB2 PRO A 148 -10.308 -22.291 -17.579 1.00 32.24 H new ATOM 0 HB3 PRO A 148 -10.514 -22.274 -19.320 1.00 32.24 H new ATOM 0 HG2 PRO A 148 -9.064 -20.393 -18.038 1.00 74.10 H new ATOM 0 HG3 PRO A 148 -9.953 -20.037 -19.506 1.00 74.10 H new ATOM 0 HD2 PRO A 148 -10.634 -19.338 -16.669 1.00 22.11 H new ATOM 0 HD3 PRO A 148 -10.920 -18.419 -18.134 1.00 22.11 H new ATOM 2350 N ASN A 149 -12.782 -21.986 -15.940 1.00 10.52 N ATOM 2351 CA ASN A 149 -13.271 -22.824 -14.845 1.00 23.20 C ATOM 2352 C ASN A 149 -14.807 -22.811 -14.813 1.00 41.43 C ATOM 2353 O ASN A 149 -15.443 -23.636 -14.157 1.00 10.31 O ATOM 2354 CB ASN A 149 -12.668 -22.354 -13.503 1.00 70.31 C ATOM 2355 CG ASN A 149 -13.053 -23.222 -12.315 1.00 63.02 C ATOM 2356 OD1 ASN A 149 -14.043 -22.972 -11.642 1.00 31.30 O ATOM 2357 ND2 ASN A 149 -12.270 -24.235 -12.051 1.00 23.02 N ATOM 0 H ASN A 149 -12.462 -21.061 -15.652 1.00 10.52 H new ATOM 0 HA ASN A 149 -12.951 -23.853 -15.009 1.00 23.20 H new ATOM 0 HB2 ASN A 149 -11.582 -22.337 -13.591 1.00 70.31 H new ATOM 0 HB3 ASN A 149 -12.989 -21.330 -13.311 1.00 70.31 H new ATOM 0 HD21 ASN A 149 -12.477 -24.847 -11.262 1.00 23.02 H new ATOM 0 HD22 ASN A 149 -11.452 -24.413 -12.634 1.00 23.02 H new ATOM 2364 N GLY A 150 -15.391 -21.871 -15.542 1.00 22.24 N ATOM 2365 CA GLY A 150 -16.827 -21.800 -15.658 1.00 52.12 C ATOM 2366 C GLY A 150 -17.492 -21.104 -14.498 1.00 50.22 C ATOM 2367 O GLY A 150 -18.662 -21.340 -14.222 1.00 41.43 O ATOM 0 H GLY A 150 -14.887 -21.151 -16.059 1.00 22.24 H new ATOM 0 HA2 GLY A 150 -17.083 -21.278 -16.580 1.00 52.12 H new ATOM 0 HA3 GLY A 150 -17.227 -22.810 -15.742 1.00 52.12 H new