USER MOD reduce.3.24.130724 H: found=0, std=0, add=897, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 897 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 119 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 122 GLN : amide:sc= 1.07 K(o=1.1,f=-0.58) USER MOD Set 2.1: A 90 MET CE :methyl -114:sc= -0.445 (180deg=-0.00746) USER MOD Set 2.2: A 93 GLN : amide:sc= -2.55! C(o=-3!,f=-11!) USER MOD Set 3.1: A 87 GLN : amide:sc= 0.00219 X(o=-4,f=-4.4) USER MOD Set 3.2: A 88 ASN : amide:sc= -3.96! C(o=-4!,f=-4.4!) USER MOD Set 4.1: A 71 THR OG1 : rot 147:sc= 1.27 USER MOD Set 4.2: A 77 THR OG1 : rot 180:sc= 1.01 USER MOD Set 5.1: A 26 TYR OH : rot 167:sc= 0.167 USER MOD Set 5.2: A 118 THR OG1 : rot -30:sc= 1.05 USER MOD Single : A 10 GLN : amide:sc= -0.392 X(o=-0.39,f=-0.00027) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.829 X(o=-0.83,f=-1.2) USER MOD Single : A 16 CYS SG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0718 X(o=-0.072,f=-0.23) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -162:sc= -1.8! (180deg=-1.93!) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -54:sc= 1.13 USER MOD Single : A 45 GLN : amide:sc= -1.54 K(o=-1.5,f=-3.6!) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.303 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.347 X(o=-0.35,f=-0.5) USER MOD Single : A 70 MET CE :methyl -176:sc= -4.05 (180deg=-4.61) USER MOD Single : A 73 MET CE :methyl -178:sc= -1.79 (180deg=-1.8) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.913 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.152) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.169 F(o=-2.8!,f=-0.17) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0.673 K(o=0.67,f=-2.1!) USER MOD Single : A 96 MET CE :methyl -117:sc= -0.611 (180deg=-2.66!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 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 105 HIS : no HE2:sc= -1.61 K(o=-1.6,f=-2.8!) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 140:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.0367 X(o=-0.037,f=0) USER MOD Single : A 121 THR OG1 : rot -94:sc= -0.567 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 109 N LEU A 8 -3.683 10.516 5.025 1.00 13.22 N ATOM 110 CA LEU A 8 -4.917 10.213 5.742 1.00 12.51 C ATOM 111 C LEU A 8 -5.597 11.492 6.221 1.00 42.54 C ATOM 112 O LEU A 8 -6.815 11.534 6.391 1.00 74.53 O ATOM 113 CB LEU A 8 -4.627 9.300 6.934 1.00 3.12 C ATOM 114 CG LEU A 8 -3.864 8.012 6.623 1.00 43.14 C ATOM 115 CD1 LEU A 8 -3.933 7.053 7.801 1.00 65.34 C ATOM 116 CD2 LEU A 8 -4.415 7.356 5.365 1.00 15.22 C ATOM 0 HA LEU A 8 -5.590 9.700 5.055 1.00 12.51 H new ATOM 0 HB2 LEU A 8 -4.058 9.867 7.670 1.00 3.12 H new ATOM 0 HB3 LEU A 8 -5.575 9.033 7.401 1.00 3.12 H new ATOM 0 HG LEU A 8 -2.818 8.265 6.448 1.00 43.14 H new ATOM 0 HD11 LEU A 8 -3.384 6.142 7.561 1.00 65.34 H new ATOM 0 HD12 LEU A 8 -3.490 7.523 8.679 1.00 65.34 H new ATOM 0 HD13 LEU A 8 -4.974 6.806 8.008 1.00 65.34 H new ATOM 0 HD21 LEU A 8 -3.860 6.441 5.159 1.00 15.22 H new ATOM 0 HD22 LEU A 8 -5.468 7.117 5.511 1.00 15.22 H new ATOM 0 HD23 LEU A 8 -4.312 8.040 4.523 1.00 15.22 H new ATOM 128 N ASP A 9 -4.801 12.535 6.434 1.00 72.32 N ATOM 129 CA ASP A 9 -5.326 13.817 6.889 1.00 30.34 C ATOM 130 C ASP A 9 -6.480 14.277 6.004 1.00 1.11 C ATOM 131 O ASP A 9 -7.405 14.942 6.470 1.00 24.14 O ATOM 132 CB ASP A 9 -4.219 14.872 6.896 1.00 50.15 C ATOM 133 CG ASP A 9 -4.092 15.571 8.235 1.00 34.41 C ATOM 134 OD1 ASP A 9 -4.359 14.924 9.270 1.00 73.54 O ATOM 135 OD2 ASP A 9 -3.725 16.764 8.249 1.00 35.01 O ATOM 0 H ASP A 9 -3.790 12.517 6.299 1.00 72.32 H new ATOM 0 HA ASP A 9 -5.701 13.689 7.905 1.00 30.34 H new ATOM 0 HB2 ASP A 9 -3.269 14.399 6.645 1.00 50.15 H new ATOM 0 HB3 ASP A 9 -4.421 15.612 6.121 1.00 50.15 H new ATOM 140 N GLN A 10 -6.417 13.920 4.726 1.00 72.45 N ATOM 141 CA GLN A 10 -7.456 14.298 3.775 1.00 13.02 C ATOM 142 C GLN A 10 -8.763 13.574 4.081 1.00 54.11 C ATOM 143 O GLN A 10 -9.844 14.159 3.993 1.00 65.53 O ATOM 144 CB GLN A 10 -7.008 13.985 2.346 1.00 15.43 C ATOM 145 CG GLN A 10 -5.621 14.510 2.015 1.00 24.23 C ATOM 146 CD GLN A 10 -5.525 16.019 2.126 1.00 21.45 C ATOM 147 OE1 GLN A 10 -5.658 16.736 1.134 1.00 34.53 O ATOM 148 NE2 GLN A 10 -5.293 16.510 3.338 1.00 23.42 N ATOM 0 H GLN A 10 -5.658 13.370 4.325 1.00 72.45 H new ATOM 0 HA GLN A 10 -7.626 15.371 3.868 1.00 13.02 H new ATOM 0 HB2 GLN A 10 -7.024 12.905 2.197 1.00 15.43 H new ATOM 0 HB3 GLN A 10 -7.726 14.414 1.647 1.00 15.43 H new ATOM 0 HG2 GLN A 10 -4.894 14.053 2.687 1.00 24.23 H new ATOM 0 HG3 GLN A 10 -5.354 14.206 1.003 1.00 24.23 H new ATOM 0 HE21 GLN A 10 -5.189 15.879 4.133 1.00 23.42 H new ATOM 0 HE22 GLN A 10 -5.219 17.518 3.474 1.00 23.42 H new ATOM 157 N TYR A 11 -8.658 12.300 4.440 1.00 61.41 N ATOM 158 CA TYR A 11 -9.832 11.495 4.756 1.00 70.10 C ATOM 159 C TYR A 11 -10.742 12.223 5.740 1.00 34.24 C ATOM 160 O TYR A 11 -11.941 11.949 5.815 1.00 65.23 O ATOM 161 CB TYR A 11 -9.409 10.145 5.338 1.00 74.25 C ATOM 162 CG TYR A 11 -8.953 9.152 4.293 1.00 61.32 C ATOM 163 CD1 TYR A 11 -9.675 8.967 3.120 1.00 64.22 C ATOM 164 CD2 TYR A 11 -7.801 8.398 4.479 1.00 60.42 C ATOM 165 CE1 TYR A 11 -9.262 8.060 2.163 1.00 41.14 C ATOM 166 CE2 TYR A 11 -7.380 7.490 3.526 1.00 20.25 C ATOM 167 CZ TYR A 11 -8.114 7.324 2.370 1.00 2.43 C ATOM 168 OH TYR A 11 -7.699 6.420 1.420 1.00 45.11 O ATOM 0 H TYR A 11 -7.771 11.802 4.520 1.00 61.41 H new ATOM 0 HA TYR A 11 -10.386 11.327 3.832 1.00 70.10 H new ATOM 0 HB2 TYR A 11 -8.602 10.304 6.053 1.00 74.25 H new ATOM 0 HB3 TYR A 11 -10.246 9.719 5.891 1.00 74.25 H new ATOM 0 HD1 TYR A 11 -10.574 9.542 2.954 1.00 64.22 H new ATOM 0 HD2 TYR A 11 -7.225 8.524 5.384 1.00 60.42 H new ATOM 0 HE1 TYR A 11 -9.835 7.928 1.257 1.00 41.14 H new ATOM 0 HE2 TYR A 11 -6.481 6.913 3.686 1.00 20.25 H new ATOM 0 HH TYR A 11 -6.873 5.986 1.720 1.00 45.11 H new ATOM 178 N TYR A 12 -10.165 13.152 6.494 1.00 60.12 N ATOM 179 CA TYR A 12 -10.922 13.919 7.475 1.00 13.25 C ATOM 180 C TYR A 12 -12.081 14.659 6.813 1.00 24.20 C ATOM 181 O TYR A 12 -13.158 14.792 7.392 1.00 20.03 O ATOM 182 CB TYR A 12 -10.008 14.916 8.190 1.00 32.12 C ATOM 183 CG TYR A 12 -9.213 14.305 9.322 1.00 70.44 C ATOM 184 CD1 TYR A 12 -9.827 13.500 10.274 1.00 51.43 C ATOM 185 CD2 TYR A 12 -7.847 14.531 9.438 1.00 61.52 C ATOM 186 CE1 TYR A 12 -9.104 12.941 11.309 1.00 35.43 C ATOM 187 CE2 TYR A 12 -7.116 13.974 10.469 1.00 21.43 C ATOM 188 CZ TYR A 12 -7.749 13.180 11.403 1.00 73.12 C ATOM 189 OH TYR A 12 -7.026 12.623 12.432 1.00 23.12 O ATOM 0 H TYR A 12 -9.175 13.392 6.444 1.00 60.12 H new ATOM 0 HA TYR A 12 -11.331 13.221 8.206 1.00 13.25 H new ATOM 0 HB2 TYR A 12 -9.318 15.348 7.465 1.00 32.12 H new ATOM 0 HB3 TYR A 12 -10.613 15.734 8.582 1.00 32.12 H new ATOM 0 HD1 TYR A 12 -10.888 13.308 10.203 1.00 51.43 H new ATOM 0 HD2 TYR A 12 -7.348 15.153 8.709 1.00 61.52 H new ATOM 0 HE1 TYR A 12 -9.597 12.319 12.042 1.00 35.43 H new ATOM 0 HE2 TYR A 12 -6.055 14.159 10.544 1.00 21.43 H new ATOM 0 HH TYR A 12 -6.086 12.889 12.353 1.00 23.12 H new ATOM 199 N GLU A 13 -11.849 15.137 5.594 1.00 10.35 N ATOM 200 CA GLU A 13 -12.873 15.864 4.853 1.00 62.34 C ATOM 201 C GLU A 13 -14.095 14.984 4.609 1.00 74.23 C ATOM 202 O GLU A 13 -15.233 15.428 4.764 1.00 35.41 O ATOM 203 CB GLU A 13 -12.312 16.358 3.517 1.00 12.35 C ATOM 204 CG GLU A 13 -12.283 15.291 2.437 1.00 71.33 C ATOM 205 CD GLU A 13 -11.918 15.849 1.075 1.00 61.11 C ATOM 206 OE1 GLU A 13 -11.073 16.766 1.016 1.00 0.43 O ATOM 207 OE2 GLU A 13 -12.478 15.367 0.068 1.00 45.34 O ATOM 0 H GLU A 13 -10.963 15.034 5.100 1.00 10.35 H new ATOM 0 HA GLU A 13 -13.178 16.723 5.451 1.00 62.34 H new ATOM 0 HB2 GLU A 13 -12.912 17.199 3.169 1.00 12.35 H new ATOM 0 HB3 GLU A 13 -11.300 16.732 3.674 1.00 12.35 H new ATOM 0 HG2 GLU A 13 -11.565 14.519 2.713 1.00 71.33 H new ATOM 0 HG3 GLU A 13 -13.260 14.811 2.379 1.00 71.33 H new ATOM 214 N ILE A 14 -13.851 13.735 4.225 1.00 13.24 N ATOM 215 CA ILE A 14 -14.931 12.793 3.961 1.00 74.05 C ATOM 216 C ILE A 14 -15.669 12.427 5.244 1.00 22.02 C ATOM 217 O ILE A 14 -16.898 12.369 5.270 1.00 62.22 O ATOM 218 CB ILE A 14 -14.406 11.505 3.299 1.00 43.41 C ATOM 219 CG1 ILE A 14 -14.049 11.768 1.834 1.00 25.24 C ATOM 220 CG2 ILE A 14 -15.439 10.394 3.407 1.00 54.42 C ATOM 221 CD1 ILE A 14 -12.597 12.137 1.623 1.00 1.04 C ATOM 0 H ILE A 14 -12.915 13.353 4.090 1.00 13.24 H new ATOM 0 HA ILE A 14 -15.620 13.289 3.277 1.00 74.05 H new ATOM 0 HB ILE A 14 -13.504 11.187 3.822 1.00 43.41 H new ATOM 0 HG12 ILE A 14 -14.278 10.879 1.247 1.00 25.24 H new ATOM 0 HG13 ILE A 14 -14.679 12.572 1.454 1.00 25.24 H new ATOM 0 HG21 ILE A 14 -15.053 9.491 2.934 1.00 54.42 H new ATOM 0 HG22 ILE A 14 -15.648 10.193 4.458 1.00 54.42 H new ATOM 0 HG23 ILE A 14 -16.357 10.701 2.906 1.00 54.42 H new ATOM 0 HD11 ILE A 14 -12.416 12.309 0.562 1.00 1.04 H new ATOM 0 HD12 ILE A 14 -12.367 13.044 2.182 1.00 1.04 H new ATOM 0 HD13 ILE A 14 -11.961 11.324 1.973 1.00 1.04 H new ATOM 233 N GLN A 15 -14.909 12.183 6.307 1.00 34.03 N ATOM 234 CA GLN A 15 -15.492 11.824 7.595 1.00 24.20 C ATOM 235 C GLN A 15 -16.350 12.960 8.140 1.00 14.21 C ATOM 236 O GLN A 15 -17.467 12.737 8.609 1.00 54.34 O ATOM 237 CB GLN A 15 -14.390 11.476 8.597 1.00 23.53 C ATOM 238 CG GLN A 15 -14.029 9.999 8.616 1.00 30.11 C ATOM 239 CD GLN A 15 -12.591 9.755 9.027 1.00 25.35 C ATOM 240 OE1 GLN A 15 -11.909 10.659 9.510 1.00 44.42 O ATOM 241 NE2 GLN A 15 -12.121 8.527 8.839 1.00 42.12 N ATOM 0 H GLN A 15 -13.890 12.227 6.302 1.00 34.03 H new ATOM 0 HA GLN A 15 -16.129 10.952 7.447 1.00 24.20 H new ATOM 0 HB2 GLN A 15 -13.498 12.056 8.360 1.00 23.53 H new ATOM 0 HB3 GLN A 15 -14.710 11.776 9.595 1.00 23.53 H new ATOM 0 HG2 GLN A 15 -14.693 9.475 9.304 1.00 30.11 H new ATOM 0 HG3 GLN A 15 -14.197 9.575 7.626 1.00 30.11 H new ATOM 0 HE21 GLN A 15 -12.721 7.808 8.435 1.00 42.12 H new ATOM 0 HE22 GLN A 15 -11.160 8.303 9.098 1.00 42.12 H new ATOM 250 N CYS A 16 -15.822 14.177 8.076 1.00 12.32 N ATOM 251 CA CYS A 16 -16.540 15.349 8.565 1.00 53.13 C ATOM 252 C CYS A 16 -17.871 15.514 7.837 1.00 22.45 C ATOM 253 O CYS A 16 -18.889 15.834 8.450 1.00 64.22 O ATOM 254 CB CYS A 16 -15.688 16.607 8.385 1.00 34.54 C ATOM 255 SG CYS A 16 -16.309 18.052 9.277 1.00 52.03 S ATOM 0 H CYS A 16 -14.899 14.378 7.690 1.00 12.32 H new ATOM 0 HA CYS A 16 -16.742 15.204 9.626 1.00 53.13 H new ATOM 0 HB2 CYS A 16 -14.672 16.396 8.719 1.00 34.54 H new ATOM 0 HB3 CYS A 16 -15.631 16.846 7.323 1.00 34.54 H new ATOM 0 HG CYS A 16 -15.522 19.064 9.065 1.00 52.03 H new ATOM 261 N ASN A 17 -17.854 15.294 6.527 1.00 70.22 N ATOM 262 CA ASN A 17 -19.059 15.420 5.715 1.00 31.01 C ATOM 263 C ASN A 17 -20.110 14.399 6.140 1.00 73.04 C ATOM 264 O ASN A 17 -21.309 14.670 6.087 1.00 13.33 O ATOM 265 CB ASN A 17 -18.723 15.237 4.234 1.00 61.42 C ATOM 266 CG ASN A 17 -18.644 16.557 3.491 1.00 33.51 C ATOM 267 OD1 ASN A 17 -19.485 17.437 3.676 1.00 21.32 O ATOM 268 ND2 ASN A 17 -17.631 16.700 2.645 1.00 70.53 N ATOM 0 H ASN A 17 -17.019 15.028 6.005 1.00 70.22 H new ATOM 0 HA ASN A 17 -19.467 16.419 5.867 1.00 31.01 H new ATOM 0 HB2 ASN A 17 -17.771 14.714 4.142 1.00 61.42 H new ATOM 0 HB3 ASN A 17 -19.480 14.606 3.768 1.00 61.42 H new ATOM 0 HD21 ASN A 17 -17.526 17.566 2.117 1.00 70.53 H new ATOM 0 HD22 ASN A 17 -16.957 15.944 2.523 1.00 70.53 H new ATOM 275 N GLU A 18 -19.651 13.225 6.560 1.00 22.53 N ATOM 276 CA GLU A 18 -20.552 12.163 6.994 1.00 40.24 C ATOM 277 C GLU A 18 -21.289 12.562 8.268 1.00 14.45 C ATOM 278 O GLU A 18 -22.475 12.270 8.431 1.00 1.20 O ATOM 279 CB GLU A 18 -19.774 10.866 7.226 1.00 1.42 C ATOM 280 CG GLU A 18 -19.686 9.980 5.995 1.00 44.40 C ATOM 281 CD GLU A 18 -18.953 10.648 4.847 1.00 24.44 C ATOM 282 OE1 GLU A 18 -19.313 11.791 4.497 1.00 30.50 O ATOM 283 OE2 GLU A 18 -18.018 10.026 4.300 1.00 61.10 O ATOM 0 H GLU A 18 -18.661 12.985 6.609 1.00 22.53 H new ATOM 0 HA GLU A 18 -21.287 12.001 6.206 1.00 40.24 H new ATOM 0 HB2 GLU A 18 -18.766 11.112 7.559 1.00 1.42 H new ATOM 0 HB3 GLU A 18 -20.249 10.307 8.032 1.00 1.42 H new ATOM 0 HG2 GLU A 18 -19.177 9.052 6.255 1.00 44.40 H new ATOM 0 HG3 GLU A 18 -20.692 9.712 5.672 1.00 44.40 H new ATOM 290 N LEU A 19 -20.580 13.231 9.170 1.00 3.34 N ATOM 291 CA LEU A 19 -21.165 13.671 10.432 1.00 14.01 C ATOM 292 C LEU A 19 -22.329 14.626 10.188 1.00 14.25 C ATOM 293 O LEU A 19 -23.424 14.432 10.716 1.00 51.32 O ATOM 294 CB LEU A 19 -20.105 14.352 11.299 1.00 31.25 C ATOM 295 CG LEU A 19 -18.727 13.689 11.319 1.00 51.34 C ATOM 296 CD1 LEU A 19 -17.892 14.228 12.470 1.00 61.13 C ATOM 297 CD2 LEU A 19 -18.864 12.177 11.418 1.00 23.03 C ATOM 0 H LEU A 19 -19.598 13.481 9.051 1.00 3.34 H new ATOM 0 HA LEU A 19 -21.543 12.792 10.955 1.00 14.01 H new ATOM 0 HB2 LEU A 19 -19.987 15.379 10.954 1.00 31.25 H new ATOM 0 HB3 LEU A 19 -20.478 14.401 12.322 1.00 31.25 H new ATOM 0 HG LEU A 19 -18.217 13.927 10.385 1.00 51.34 H new ATOM 0 HD11 LEU A 19 -16.915 13.745 12.468 1.00 61.13 H new ATOM 0 HD12 LEU A 19 -17.765 15.304 12.354 1.00 61.13 H new ATOM 0 HD13 LEU A 19 -18.397 14.022 13.414 1.00 61.13 H new ATOM 0 HD21 LEU A 19 -17.874 11.722 11.431 1.00 23.03 H new ATOM 0 HD22 LEU A 19 -19.394 11.919 12.335 1.00 23.03 H new ATOM 0 HD23 LEU A 19 -19.423 11.805 10.559 1.00 23.03 H new ATOM 309 N GLU A 20 -22.085 15.656 9.385 1.00 43.34 N ATOM 310 CA GLU A 20 -23.114 16.641 9.070 1.00 22.53 C ATOM 311 C GLU A 20 -24.209 16.025 8.204 1.00 31.24 C ATOM 312 O GLU A 20 -25.390 16.327 8.371 1.00 33.14 O ATOM 313 CB GLU A 20 -22.498 17.844 8.354 1.00 40.03 C ATOM 314 CG GLU A 20 -21.488 17.464 7.284 1.00 4.13 C ATOM 315 CD GLU A 20 -21.083 18.642 6.419 1.00 30.12 C ATOM 316 OE1 GLU A 20 -20.380 19.539 6.929 1.00 52.42 O ATOM 317 OE2 GLU A 20 -21.470 18.665 5.232 1.00 45.52 O ATOM 0 H GLU A 20 -21.184 15.831 8.940 1.00 43.34 H new ATOM 0 HA GLU A 20 -23.560 16.975 10.007 1.00 22.53 H new ATOM 0 HB2 GLU A 20 -23.295 18.431 7.897 1.00 40.03 H new ATOM 0 HB3 GLU A 20 -22.012 18.484 9.090 1.00 40.03 H new ATOM 0 HG2 GLU A 20 -20.601 17.045 7.759 1.00 4.13 H new ATOM 0 HG3 GLU A 20 -21.910 16.682 6.652 1.00 4.13 H new ATOM 324 N ALA A 21 -23.807 15.160 7.279 1.00 54.24 N ATOM 325 CA ALA A 21 -24.754 14.501 6.387 1.00 24.33 C ATOM 326 C ALA A 21 -25.788 13.705 7.176 1.00 1.02 C ATOM 327 O ALA A 21 -26.991 13.843 6.955 1.00 13.12 O ATOM 328 CB ALA A 21 -24.017 13.593 5.414 1.00 62.13 C ATOM 0 H ALA A 21 -22.833 14.899 7.127 1.00 54.24 H new ATOM 0 HA ALA A 21 -25.280 15.271 5.822 1.00 24.33 H new ATOM 0 HB1 ALA A 21 -24.736 13.107 4.754 1.00 62.13 H new ATOM 0 HB2 ALA A 21 -23.321 14.185 4.820 1.00 62.13 H new ATOM 0 HB3 ALA A 21 -23.465 12.835 5.970 1.00 62.13 H new ATOM 334 N ILE A 22 -25.311 12.872 8.096 1.00 54.44 N ATOM 335 CA ILE A 22 -26.196 12.055 8.917 1.00 3.21 C ATOM 336 C ILE A 22 -26.869 12.892 10.000 1.00 24.41 C ATOM 337 O ILE A 22 -28.028 12.663 10.345 1.00 71.33 O ATOM 338 CB ILE A 22 -25.433 10.893 9.581 1.00 53.40 C ATOM 339 CG1 ILE A 22 -25.362 9.694 8.634 1.00 74.21 C ATOM 340 CG2 ILE A 22 -26.100 10.502 10.891 1.00 15.11 C ATOM 341 CD1 ILE A 22 -25.221 10.081 7.178 1.00 23.34 C ATOM 0 H ILE A 22 -24.318 12.746 8.291 1.00 54.44 H new ATOM 0 HA ILE A 22 -26.957 11.646 8.252 1.00 3.21 H new ATOM 0 HB ILE A 22 -24.416 11.221 9.797 1.00 53.40 H new ATOM 0 HG12 ILE A 22 -24.517 9.066 8.918 1.00 74.21 H new ATOM 0 HG13 ILE A 22 -26.262 9.091 8.756 1.00 74.21 H new ATOM 0 HG21 ILE A 22 -25.550 9.680 11.348 1.00 15.11 H new ATOM 0 HG22 ILE A 22 -26.103 11.357 11.567 1.00 15.11 H new ATOM 0 HG23 ILE A 22 -27.126 10.189 10.698 1.00 15.11 H new ATOM 0 HD11 ILE A 22 -25.177 9.181 6.565 1.00 23.34 H new ATOM 0 HD12 ILE A 22 -26.078 10.683 6.877 1.00 23.34 H new ATOM 0 HD13 ILE A 22 -24.306 10.658 7.042 1.00 23.34 H new ATOM 353 N ARG A 23 -26.134 13.863 10.532 1.00 62.01 N ATOM 354 CA ARG A 23 -26.660 14.735 11.576 1.00 64.44 C ATOM 355 C ARG A 23 -27.988 15.353 11.150 1.00 71.44 C ATOM 356 O ARG A 23 -28.875 15.572 11.975 1.00 72.45 O ATOM 357 CB ARG A 23 -25.653 15.839 11.903 1.00 62.14 C ATOM 358 CG ARG A 23 -24.672 15.463 13.001 1.00 10.14 C ATOM 359 CD ARG A 23 -23.401 16.294 12.921 1.00 22.25 C ATOM 360 NE ARG A 23 -23.305 17.254 14.018 1.00 43.14 N ATOM 361 CZ ARG A 23 -22.342 18.164 14.115 1.00 52.41 C ATOM 362 NH1 ARG A 23 -21.399 18.238 13.186 1.00 4.14 N ATOM 363 NH2 ARG A 23 -22.323 19.004 15.142 1.00 24.34 N ATOM 0 H ARG A 23 -25.173 14.066 10.258 1.00 62.01 H new ATOM 0 HA ARG A 23 -26.829 14.131 12.468 1.00 64.44 H new ATOM 0 HB2 ARG A 23 -25.096 16.090 11.000 1.00 62.14 H new ATOM 0 HB3 ARG A 23 -26.195 16.736 12.203 1.00 62.14 H new ATOM 0 HG2 ARG A 23 -25.141 15.606 13.974 1.00 10.14 H new ATOM 0 HG3 ARG A 23 -24.422 14.405 12.920 1.00 10.14 H new ATOM 0 HD2 ARG A 23 -22.534 15.633 12.940 1.00 22.25 H new ATOM 0 HD3 ARG A 23 -23.375 16.826 11.970 1.00 22.25 H new ATOM 0 HE ARG A 23 -24.016 17.224 14.749 1.00 43.14 H new ATOM 0 HH11 ARG A 23 -21.412 17.595 12.394 1.00 4.14 H new ATOM 0 HH12 ARG A 23 -20.661 18.938 13.263 1.00 4.14 H new ATOM 0 HH21 ARG A 23 -23.048 18.951 15.858 1.00 24.34 H new ATOM 0 HH22 ARG A 23 -21.583 19.702 15.216 1.00 24.34 H new ATOM 377 N SER A 24 -28.117 15.632 9.857 1.00 74.05 N ATOM 378 CA SER A 24 -29.336 16.229 9.321 1.00 25.25 C ATOM 379 C SER A 24 -30.510 15.262 9.437 1.00 52.10 C ATOM 380 O SER A 24 -31.649 15.676 9.659 1.00 63.43 O ATOM 381 CB SER A 24 -29.132 16.630 7.859 1.00 34.02 C ATOM 382 OG SER A 24 -29.171 18.038 7.707 1.00 40.34 O ATOM 0 H SER A 24 -27.393 15.455 9.161 1.00 74.05 H new ATOM 0 HA SER A 24 -29.563 17.120 9.906 1.00 25.25 H new ATOM 0 HB2 SER A 24 -28.174 16.249 7.504 1.00 34.02 H new ATOM 0 HB3 SER A 24 -29.905 16.173 7.242 1.00 34.02 H new ATOM 0 HG SER A 24 -29.036 18.269 6.764 1.00 40.34 H new ATOM 388 N ILE A 25 -30.225 13.973 9.285 1.00 43.41 N ATOM 389 CA ILE A 25 -31.256 12.947 9.373 1.00 14.41 C ATOM 390 C ILE A 25 -31.587 12.624 10.826 1.00 31.21 C ATOM 391 O ILE A 25 -32.756 12.524 11.200 1.00 21.51 O ATOM 392 CB ILE A 25 -30.827 11.654 8.656 1.00 43.02 C ATOM 393 CG1 ILE A 25 -30.525 11.938 7.183 1.00 61.11 C ATOM 394 CG2 ILE A 25 -31.909 10.592 8.785 1.00 5.23 C ATOM 395 CD1 ILE A 25 -29.174 11.427 6.734 1.00 43.43 C ATOM 0 H ILE A 25 -29.288 13.615 9.100 1.00 43.41 H new ATOM 0 HA ILE A 25 -32.142 13.348 8.881 1.00 14.41 H new ATOM 0 HB ILE A 25 -29.919 11.279 9.128 1.00 43.02 H new ATOM 0 HG12 ILE A 25 -31.300 11.482 6.567 1.00 61.11 H new ATOM 0 HG13 ILE A 25 -30.573 13.013 7.011 1.00 61.11 H new ATOM 0 HG21 ILE A 25 -31.591 9.684 8.273 1.00 5.23 H new ATOM 0 HG22 ILE A 25 -32.080 10.373 9.839 1.00 5.23 H new ATOM 0 HG23 ILE A 25 -32.833 10.957 8.336 1.00 5.23 H new ATOM 0 HD11 ILE A 25 -29.028 11.663 5.680 1.00 43.43 H new ATOM 0 HD12 ILE A 25 -28.391 11.902 7.325 1.00 43.43 H new ATOM 0 HD13 ILE A 25 -29.129 10.347 6.873 1.00 43.43 H new ATOM 407 N TYR A 26 -30.551 12.463 11.641 1.00 3.32 N ATOM 408 CA TYR A 26 -30.731 12.151 13.054 1.00 63.41 C ATOM 409 C TYR A 26 -30.342 13.338 13.929 1.00 43.43 C ATOM 410 O TYR A 26 -29.645 13.183 14.931 1.00 14.24 O ATOM 411 CB TYR A 26 -29.897 10.926 13.437 1.00 55.30 C ATOM 412 CG TYR A 26 -30.240 9.688 12.641 1.00 61.54 C ATOM 413 CD1 TYR A 26 -31.544 9.211 12.587 1.00 31.11 C ATOM 414 CD2 TYR A 26 -29.260 8.993 11.943 1.00 43.13 C ATOM 415 CE1 TYR A 26 -31.862 8.079 11.861 1.00 3.14 C ATOM 416 CE2 TYR A 26 -29.568 7.861 11.213 1.00 14.42 C ATOM 417 CZ TYR A 26 -30.871 7.408 11.176 1.00 44.22 C ATOM 418 OH TYR A 26 -31.182 6.280 10.452 1.00 41.35 O ATOM 0 H TYR A 26 -29.577 12.543 11.348 1.00 3.32 H new ATOM 0 HA TYR A 26 -31.786 11.932 13.220 1.00 63.41 H new ATOM 0 HB2 TYR A 26 -28.841 11.157 13.296 1.00 55.30 H new ATOM 0 HB3 TYR A 26 -30.039 10.717 14.497 1.00 55.30 H new ATOM 0 HD1 TYR A 26 -32.323 9.734 13.122 1.00 31.11 H new ATOM 0 HD2 TYR A 26 -28.239 9.344 11.972 1.00 43.13 H new ATOM 0 HE1 TYR A 26 -32.881 7.722 11.830 1.00 3.14 H new ATOM 0 HE2 TYR A 26 -28.794 7.334 10.675 1.00 14.42 H new ATOM 0 HH TYR A 26 -30.430 6.048 9.868 1.00 41.35 H new ATOM 428 N MET A 27 -30.798 14.525 13.541 1.00 61.11 N ATOM 429 CA MET A 27 -30.500 15.740 14.290 1.00 22.02 C ATOM 430 C MET A 27 -30.559 15.481 15.792 1.00 23.42 C ATOM 431 O MET A 27 -29.596 15.739 16.514 1.00 24.44 O ATOM 432 CB MET A 27 -31.482 16.851 13.914 1.00 72.32 C ATOM 433 CG MET A 27 -31.598 17.078 12.415 1.00 25.12 C ATOM 434 SD MET A 27 -33.306 17.065 11.840 1.00 14.23 S ATOM 435 CE MET A 27 -33.846 15.458 12.418 1.00 11.01 C ATOM 0 H MET A 27 -31.375 14.671 12.713 1.00 61.11 H new ATOM 0 HA MET A 27 -29.489 16.056 14.033 1.00 22.02 H new ATOM 0 HB2 MET A 27 -32.466 16.605 14.313 1.00 72.32 H new ATOM 0 HB3 MET A 27 -31.167 17.779 14.391 1.00 72.32 H new ATOM 0 HG2 MET A 27 -31.140 18.034 12.160 1.00 25.12 H new ATOM 0 HG3 MET A 27 -31.036 16.305 11.890 1.00 25.12 H new ATOM 0 HE1 MET A 27 -34.749 15.163 11.883 1.00 11.01 H new ATOM 0 HE2 MET A 27 -33.061 14.724 12.237 1.00 11.01 H new ATOM 0 HE3 MET A 27 -34.057 15.508 13.486 1.00 11.01 H new ATOM 445 N ASP A 28 -31.694 14.970 16.256 1.00 60.33 N ATOM 446 CA ASP A 28 -31.878 14.675 17.672 1.00 22.20 C ATOM 447 C ASP A 28 -31.563 13.212 17.968 1.00 72.32 C ATOM 448 O ASP A 28 -31.397 12.824 19.124 1.00 32.33 O ATOM 449 CB ASP A 28 -33.310 14.998 18.101 1.00 40.25 C ATOM 450 CG ASP A 28 -33.365 15.751 19.415 1.00 1.41 C ATOM 451 OD1 ASP A 28 -32.499 16.624 19.636 1.00 24.32 O ATOM 452 OD2 ASP A 28 -34.275 15.469 20.222 1.00 4.44 O ATOM 0 H ASP A 28 -32.501 14.751 15.672 1.00 60.33 H new ATOM 0 HA ASP A 28 -31.188 15.299 18.240 1.00 22.20 H new ATOM 0 HB2 ASP A 28 -33.793 15.592 17.325 1.00 40.25 H new ATOM 0 HB3 ASP A 28 -33.876 14.071 18.193 1.00 40.25 H new ATOM 457 N ASP A 29 -31.484 12.405 16.916 1.00 61.34 N ATOM 458 CA ASP A 29 -31.189 10.984 17.062 1.00 34.01 C ATOM 459 C ASP A 29 -29.691 10.724 16.940 1.00 52.23 C ATOM 460 O ASP A 29 -29.270 9.665 16.475 1.00 72.41 O ATOM 461 CB ASP A 29 -31.948 10.173 16.010 1.00 21.03 C ATOM 462 CG ASP A 29 -33.259 9.623 16.538 1.00 44.13 C ATOM 463 OD1 ASP A 29 -33.349 9.371 17.758 1.00 64.23 O ATOM 464 OD2 ASP A 29 -34.195 9.446 15.731 1.00 63.24 O ATOM 0 H ASP A 29 -31.620 12.710 15.952 1.00 61.34 H new ATOM 0 HA ASP A 29 -31.514 10.671 18.054 1.00 34.01 H new ATOM 0 HB2 ASP A 29 -32.145 10.803 15.142 1.00 21.03 H new ATOM 0 HB3 ASP A 29 -31.322 9.348 15.670 1.00 21.03 H new ATOM 469 N PHE A 30 -28.891 11.699 17.359 1.00 63.43 N ATOM 470 CA PHE A 30 -27.439 11.576 17.294 1.00 0.41 C ATOM 471 C PHE A 30 -26.821 11.697 18.684 1.00 43.21 C ATOM 472 O PHE A 30 -27.274 12.488 19.512 1.00 73.10 O ATOM 473 CB PHE A 30 -26.856 12.647 16.370 1.00 54.35 C ATOM 474 CG PHE A 30 -25.356 12.708 16.393 1.00 22.12 C ATOM 475 CD1 PHE A 30 -24.684 13.128 17.530 1.00 12.10 C ATOM 476 CD2 PHE A 30 -24.617 12.344 15.279 1.00 1.31 C ATOM 477 CE1 PHE A 30 -23.304 13.186 17.554 1.00 24.51 C ATOM 478 CE2 PHE A 30 -23.236 12.399 15.297 1.00 1.34 C ATOM 479 CZ PHE A 30 -22.578 12.820 16.437 1.00 74.51 C ATOM 0 H PHE A 30 -29.223 12.582 17.747 1.00 63.43 H new ATOM 0 HA PHE A 30 -27.200 10.591 16.893 1.00 0.41 H new ATOM 0 HB2 PHE A 30 -27.188 12.455 15.350 1.00 54.35 H new ATOM 0 HB3 PHE A 30 -27.255 13.620 16.657 1.00 54.35 H new ATOM 0 HD1 PHE A 30 -25.246 13.413 18.407 1.00 12.10 H new ATOM 0 HD2 PHE A 30 -25.126 12.013 14.386 1.00 1.31 H new ATOM 0 HE1 PHE A 30 -22.793 13.517 18.446 1.00 24.51 H new ATOM 0 HE2 PHE A 30 -22.672 12.113 14.421 1.00 1.34 H new ATOM 0 HZ PHE A 30 -21.499 12.863 16.455 1.00 74.51 H new ATOM 489 N THR A 31 -25.781 10.907 18.934 1.00 74.44 N ATOM 490 CA THR A 31 -25.101 10.923 20.222 1.00 31.54 C ATOM 491 C THR A 31 -23.639 11.325 20.067 1.00 21.33 C ATOM 492 O THR A 31 -22.916 10.766 19.243 1.00 63.15 O ATOM 493 CB THR A 31 -25.173 9.547 20.913 1.00 51.43 C ATOM 494 OG1 THR A 31 -26.509 9.293 21.361 1.00 53.45 O ATOM 495 CG2 THR A 31 -24.216 9.484 22.094 1.00 73.03 C ATOM 0 H THR A 31 -25.392 10.248 18.260 1.00 74.44 H new ATOM 0 HA THR A 31 -25.614 11.659 20.841 1.00 31.54 H new ATOM 0 HB THR A 31 -24.882 8.786 20.189 1.00 51.43 H new ATOM 0 HG1 THR A 31 -26.547 8.416 21.797 1.00 53.45 H new ATOM 0 HG21 THR A 31 -24.284 8.504 22.566 1.00 73.03 H new ATOM 0 HG22 THR A 31 -23.196 9.649 21.745 1.00 73.03 H new ATOM 0 HG23 THR A 31 -24.481 10.254 22.818 1.00 73.03 H new ATOM 503 N ASP A 32 -23.210 12.296 20.865 1.00 3.03 N ATOM 504 CA ASP A 32 -21.832 12.772 20.818 1.00 70.12 C ATOM 505 C ASP A 32 -20.947 11.970 21.767 1.00 60.44 C ATOM 506 O ASP A 32 -21.109 12.032 22.986 1.00 0.11 O ATOM 507 CB ASP A 32 -21.770 14.257 21.177 1.00 54.43 C ATOM 508 CG ASP A 32 -20.600 14.963 20.521 1.00 3.22 C ATOM 509 OD1 ASP A 32 -20.154 14.502 19.450 1.00 42.31 O ATOM 510 OD2 ASP A 32 -20.129 15.976 21.080 1.00 3.20 O ATOM 0 H ASP A 32 -23.796 12.769 21.552 1.00 3.03 H new ATOM 0 HA ASP A 32 -21.462 12.636 19.802 1.00 70.12 H new ATOM 0 HB2 ASP A 32 -22.699 14.740 20.873 1.00 54.43 H new ATOM 0 HB3 ASP A 32 -21.694 14.363 22.259 1.00 54.43 H new ATOM 515 N LEU A 33 -20.012 11.215 21.199 1.00 1.55 N ATOM 516 CA LEU A 33 -19.101 10.399 21.995 1.00 40.24 C ATOM 517 C LEU A 33 -17.651 10.804 21.748 1.00 31.11 C ATOM 518 O LEU A 33 -16.798 10.665 22.625 1.00 20.43 O ATOM 519 CB LEU A 33 -19.292 8.918 21.664 1.00 31.25 C ATOM 520 CG LEU A 33 -18.270 8.306 20.706 1.00 44.40 C ATOM 521 CD1 LEU A 33 -18.520 6.816 20.539 1.00 63.34 C ATOM 522 CD2 LEU A 33 -18.314 9.011 19.358 1.00 52.20 C ATOM 0 H LEU A 33 -19.865 11.151 20.192 1.00 1.55 H new ATOM 0 HA LEU A 33 -19.330 10.563 23.048 1.00 40.24 H new ATOM 0 HB2 LEU A 33 -19.270 8.353 22.596 1.00 31.25 H new ATOM 0 HB3 LEU A 33 -20.285 8.788 21.235 1.00 31.25 H new ATOM 0 HG LEU A 33 -17.276 8.441 21.132 1.00 44.40 H new ATOM 0 HD11 LEU A 33 -17.783 6.398 19.854 1.00 63.34 H new ATOM 0 HD12 LEU A 33 -18.436 6.322 21.507 1.00 63.34 H new ATOM 0 HD13 LEU A 33 -19.520 6.658 20.136 1.00 63.34 H new ATOM 0 HD21 LEU A 33 -17.580 8.562 18.689 1.00 52.20 H new ATOM 0 HD22 LEU A 33 -19.309 8.908 18.926 1.00 52.20 H new ATOM 0 HD23 LEU A 33 -18.084 10.068 19.493 1.00 52.20 H new ATOM 534 N THR A 34 -17.378 11.308 20.549 1.00 55.24 N ATOM 535 CA THR A 34 -16.033 11.734 20.187 1.00 44.44 C ATOM 536 C THR A 34 -15.353 12.454 21.346 1.00 32.22 C ATOM 537 O THR A 34 -15.979 13.246 22.051 1.00 45.41 O ATOM 538 CB THR A 34 -16.049 12.665 18.959 1.00 31.21 C ATOM 539 OG1 THR A 34 -16.947 12.152 17.968 1.00 45.31 O ATOM 540 CG2 THR A 34 -14.655 12.803 18.366 1.00 72.53 C ATOM 0 H THR A 34 -18.072 11.431 19.812 1.00 55.24 H new ATOM 0 HA THR A 34 -15.472 10.832 19.943 1.00 44.44 H new ATOM 0 HB THR A 34 -16.388 13.650 19.281 1.00 31.21 H new ATOM 0 HG1 THR A 34 -16.709 11.225 17.759 1.00 45.31 H new ATOM 0 HG21 THR A 34 -14.692 13.465 17.501 1.00 72.53 H new ATOM 0 HG22 THR A 34 -13.981 13.221 19.114 1.00 72.53 H new ATOM 0 HG23 THR A 34 -14.292 11.823 18.058 1.00 72.53 H new ATOM 727 N GLN A 45 -11.495 10.524 16.856 1.00 15.50 N ATOM 728 CA GLN A 45 -11.370 9.877 15.555 1.00 10.25 C ATOM 729 C GLN A 45 -12.567 10.202 14.668 1.00 31.11 C ATOM 730 O GLN A 45 -12.758 9.588 13.617 1.00 5.55 O ATOM 731 CB GLN A 45 -11.243 8.362 15.726 1.00 3.53 C ATOM 732 CG GLN A 45 -11.349 7.592 14.420 1.00 31.12 C ATOM 733 CD GLN A 45 -10.715 6.217 14.500 1.00 5.52 C ATOM 734 OE1 GLN A 45 -9.960 5.817 13.614 1.00 62.15 O ATOM 735 NE2 GLN A 45 -11.018 5.486 15.566 1.00 3.34 N ATOM 0 HA GLN A 45 -10.470 10.258 15.073 1.00 10.25 H new ATOM 0 HB2 GLN A 45 -10.285 8.137 16.194 1.00 3.53 H new ATOM 0 HB3 GLN A 45 -12.020 8.015 16.407 1.00 3.53 H new ATOM 0 HG2 GLN A 45 -12.399 7.488 14.148 1.00 31.12 H new ATOM 0 HG3 GLN A 45 -10.869 8.164 13.626 1.00 31.12 H new ATOM 0 HE21 GLN A 45 -11.649 5.857 16.277 1.00 3.34 H new ATOM 0 HE22 GLN A 45 -10.620 4.553 15.675 1.00 3.34 H new ATOM 744 N ILE A 46 -13.371 11.169 15.098 1.00 43.03 N ATOM 745 CA ILE A 46 -14.549 11.575 14.341 1.00 3.03 C ATOM 746 C ILE A 46 -15.730 10.653 14.626 1.00 4.34 C ATOM 747 O ILE A 46 -16.887 11.064 14.536 1.00 43.44 O ATOM 748 CB ILE A 46 -14.271 11.581 12.827 1.00 44.15 C ATOM 749 CG1 ILE A 46 -14.739 12.899 12.205 1.00 22.42 C ATOM 750 CG2 ILE A 46 -14.957 10.400 12.157 1.00 15.02 C ATOM 751 CD1 ILE A 46 -13.605 13.833 11.845 1.00 72.05 C ATOM 0 H ILE A 46 -13.228 11.685 15.966 1.00 43.03 H new ATOM 0 HA ILE A 46 -14.796 12.587 14.661 1.00 3.03 H new ATOM 0 HB ILE A 46 -13.196 11.488 12.670 1.00 44.15 H new ATOM 0 HG12 ILE A 46 -15.319 12.682 11.308 1.00 22.42 H new ATOM 0 HG13 ILE A 46 -15.407 13.404 12.903 1.00 22.42 H new ATOM 0 HG21 ILE A 46 -14.751 10.419 11.087 1.00 15.02 H new ATOM 0 HG22 ILE A 46 -14.580 9.470 12.583 1.00 15.02 H new ATOM 0 HG23 ILE A 46 -16.033 10.464 12.320 1.00 15.02 H new ATOM 0 HD11 ILE A 46 -14.010 14.746 11.409 1.00 72.05 H new ATOM 0 HD12 ILE A 46 -13.038 14.080 12.743 1.00 72.05 H new ATOM 0 HD13 ILE A 46 -12.949 13.347 11.123 1.00 72.05 H new ATOM 763 N ILE A 47 -15.429 9.406 14.973 1.00 54.21 N ATOM 764 CA ILE A 47 -16.466 8.427 15.274 1.00 12.14 C ATOM 765 C ILE A 47 -17.626 9.069 16.028 1.00 52.02 C ATOM 766 O ILE A 47 -17.441 10.037 16.766 1.00 34.10 O ATOM 767 CB ILE A 47 -15.911 7.258 16.109 1.00 1.02 C ATOM 768 CG1 ILE A 47 -15.680 7.700 17.556 1.00 50.13 C ATOM 769 CG2 ILE A 47 -14.620 6.736 15.497 1.00 42.13 C ATOM 770 CD1 ILE A 47 -14.457 8.572 17.733 1.00 24.22 C ATOM 0 H ILE A 47 -14.476 9.050 15.053 1.00 54.21 H new ATOM 0 HA ILE A 47 -16.824 8.043 14.319 1.00 12.14 H new ATOM 0 HB ILE A 47 -16.643 6.451 16.108 1.00 1.02 H new ATOM 0 HG12 ILE A 47 -16.558 8.244 17.906 1.00 50.13 H new ATOM 0 HG13 ILE A 47 -15.580 6.816 18.186 1.00 50.13 H new ATOM 0 HG21 ILE A 47 -14.240 5.910 16.098 1.00 42.13 H new ATOM 0 HG22 ILE A 47 -14.813 6.387 14.483 1.00 42.13 H new ATOM 0 HG23 ILE A 47 -13.880 7.536 15.471 1.00 42.13 H new ATOM 0 HD11 ILE A 47 -14.355 8.848 18.783 1.00 24.22 H new ATOM 0 HD12 ILE A 47 -13.570 8.024 17.414 1.00 24.22 H new ATOM 0 HD13 ILE A 47 -14.563 9.474 17.130 1.00 24.22 H new ATOM 782 N PHE A 48 -18.823 8.523 15.838 1.00 64.42 N ATOM 783 CA PHE A 48 -20.014 9.041 16.500 1.00 2.21 C ATOM 784 C PHE A 48 -21.053 7.940 16.691 1.00 50.24 C ATOM 785 O PHE A 48 -21.039 6.931 15.987 1.00 43.14 O ATOM 786 CB PHE A 48 -20.615 10.191 15.688 1.00 21.55 C ATOM 787 CG PHE A 48 -20.963 9.810 14.278 1.00 52.22 C ATOM 788 CD1 PHE A 48 -19.976 9.414 13.389 1.00 15.23 C ATOM 789 CD2 PHE A 48 -22.277 9.848 13.840 1.00 13.24 C ATOM 790 CE1 PHE A 48 -20.294 9.064 12.091 1.00 53.54 C ATOM 791 CE2 PHE A 48 -22.601 9.499 12.543 1.00 53.23 C ATOM 792 CZ PHE A 48 -21.608 9.106 11.667 1.00 34.21 C ATOM 0 H PHE A 48 -18.993 7.722 15.231 1.00 64.42 H new ATOM 0 HA PHE A 48 -19.721 9.413 17.482 1.00 2.21 H new ATOM 0 HB2 PHE A 48 -21.513 10.550 16.191 1.00 21.55 H new ATOM 0 HB3 PHE A 48 -19.907 11.020 15.668 1.00 21.55 H new ATOM 0 HD1 PHE A 48 -18.947 9.379 13.715 1.00 15.23 H new ATOM 0 HD2 PHE A 48 -23.058 10.154 14.521 1.00 13.24 H new ATOM 0 HE1 PHE A 48 -19.516 8.758 11.408 1.00 53.54 H new ATOM 0 HE2 PHE A 48 -23.629 9.533 12.215 1.00 53.23 H new ATOM 0 HZ PHE A 48 -21.858 8.832 10.653 1.00 34.21 H new ATOM 802 N GLU A 49 -21.953 8.143 17.648 1.00 3.00 N ATOM 803 CA GLU A 49 -22.998 7.167 17.932 1.00 12.01 C ATOM 804 C GLU A 49 -24.361 7.682 17.479 1.00 52.21 C ATOM 805 O GLU A 49 -24.625 8.884 17.516 1.00 55.44 O ATOM 806 CB GLU A 49 -23.034 6.845 19.428 1.00 42.44 C ATOM 807 CG GLU A 49 -21.761 6.193 19.940 1.00 30.33 C ATOM 808 CD GLU A 49 -22.034 5.105 20.960 1.00 24.55 C ATOM 809 OE1 GLU A 49 -23.168 4.583 20.984 1.00 10.43 O ATOM 810 OE2 GLU A 49 -21.111 4.774 21.735 1.00 13.01 O ATOM 0 H GLU A 49 -21.979 8.974 18.239 1.00 3.00 H new ATOM 0 HA GLU A 49 -22.770 6.257 17.377 1.00 12.01 H new ATOM 0 HB2 GLU A 49 -23.211 7.765 19.985 1.00 42.44 H new ATOM 0 HB3 GLU A 49 -23.877 6.184 19.629 1.00 42.44 H new ATOM 0 HG2 GLU A 49 -21.211 5.769 19.100 1.00 30.33 H new ATOM 0 HG3 GLU A 49 -21.122 6.954 20.388 1.00 30.33 H new ATOM 817 N ILE A 50 -25.222 6.764 17.051 1.00 3.55 N ATOM 818 CA ILE A 50 -26.557 7.125 16.592 1.00 40.43 C ATOM 819 C ILE A 50 -27.622 6.276 17.277 1.00 54.32 C ATOM 820 O ILE A 50 -27.480 5.059 17.398 1.00 2.10 O ATOM 821 CB ILE A 50 -26.690 6.963 15.066 1.00 50.10 C ATOM 822 CG1 ILE A 50 -25.797 7.974 14.344 1.00 53.41 C ATOM 823 CG2 ILE A 50 -28.141 7.130 14.640 1.00 0.21 C ATOM 824 CD1 ILE A 50 -26.378 9.371 14.301 1.00 71.52 C ATOM 0 H ILE A 50 -25.018 5.765 17.013 1.00 3.55 H new ATOM 0 HA ILE A 50 -26.708 8.173 16.853 1.00 40.43 H new ATOM 0 HB ILE A 50 -26.365 5.959 14.792 1.00 50.10 H new ATOM 0 HG12 ILE A 50 -24.826 8.008 14.839 1.00 53.41 H new ATOM 0 HG13 ILE A 50 -25.623 7.630 13.324 1.00 53.41 H new ATOM 0 HG21 ILE A 50 -28.219 7.013 13.559 1.00 0.21 H new ATOM 0 HG22 ILE A 50 -28.754 6.375 15.132 1.00 0.21 H new ATOM 0 HG23 ILE A 50 -28.491 8.122 14.923 1.00 0.21 H new ATOM 0 HD11 ILE A 50 -25.692 10.034 13.775 1.00 71.52 H new ATOM 0 HD12 ILE A 50 -27.335 9.351 13.780 1.00 71.52 H new ATOM 0 HD13 ILE A 50 -26.526 9.735 15.318 1.00 71.52 H new ATOM 836 N THR A 51 -28.693 6.926 17.723 1.00 51.34 N ATOM 837 CA THR A 51 -29.784 6.232 18.395 1.00 62.21 C ATOM 838 C THR A 51 -30.767 5.647 17.387 1.00 21.25 C ATOM 839 O THR A 51 -31.196 6.328 16.455 1.00 4.22 O ATOM 840 CB THR A 51 -30.544 7.171 19.350 1.00 4.25 C ATOM 841 OG1 THR A 51 -29.658 7.660 20.364 1.00 43.44 O ATOM 842 CG2 THR A 51 -31.716 6.451 19.999 1.00 24.54 C ATOM 0 H THR A 51 -28.828 7.933 17.631 1.00 51.34 H new ATOM 0 HA THR A 51 -29.336 5.424 18.973 1.00 62.21 H new ATOM 0 HB THR A 51 -30.930 8.009 18.769 1.00 4.25 H new ATOM 0 HG1 THR A 51 -30.148 8.258 20.966 1.00 43.44 H new ATOM 0 HG21 THR A 51 -32.237 7.135 20.669 1.00 24.54 H new ATOM 0 HG22 THR A 51 -32.403 6.105 19.227 1.00 24.54 H new ATOM 0 HG23 THR A 51 -31.349 5.596 20.567 1.00 24.54 H new ATOM 850 N LEU A 52 -31.122 4.381 17.581 1.00 44.25 N ATOM 851 CA LEU A 52 -32.056 3.704 16.688 1.00 31.13 C ATOM 852 C LEU A 52 -33.125 2.960 17.482 1.00 21.24 C ATOM 853 O LEU A 52 -32.921 2.617 18.647 1.00 63.41 O ATOM 854 CB LEU A 52 -31.307 2.727 15.779 1.00 15.55 C ATOM 855 CG LEU A 52 -30.554 3.349 14.603 1.00 61.20 C ATOM 856 CD1 LEU A 52 -29.975 2.264 13.707 1.00 11.54 C ATOM 857 CD2 LEU A 52 -31.470 4.267 13.808 1.00 54.03 C ATOM 0 H LEU A 52 -30.777 3.803 18.348 1.00 44.25 H new ATOM 0 HA LEU A 52 -32.545 4.460 16.073 1.00 31.13 H new ATOM 0 HB2 LEU A 52 -30.595 2.169 16.387 1.00 15.55 H new ATOM 0 HB3 LEU A 52 -32.023 2.006 15.386 1.00 15.55 H new ATOM 0 HG LEU A 52 -29.731 3.944 14.998 1.00 61.20 H new ATOM 0 HD11 LEU A 52 -29.442 2.725 12.875 1.00 11.54 H new ATOM 0 HD12 LEU A 52 -29.285 1.647 14.282 1.00 11.54 H new ATOM 0 HD13 LEU A 52 -30.782 1.642 13.321 1.00 11.54 H new ATOM 0 HD21 LEU A 52 -30.917 4.701 12.975 1.00 54.03 H new ATOM 0 HD22 LEU A 52 -32.314 3.695 13.424 1.00 54.03 H new ATOM 0 HD23 LEU A 52 -31.836 5.064 14.455 1.00 54.03 H new ATOM 869 N ARG A 53 -34.264 2.712 16.844 1.00 41.11 N ATOM 870 CA ARG A 53 -35.364 2.008 17.490 1.00 35.43 C ATOM 871 C ARG A 53 -36.535 1.827 16.528 1.00 43.42 C ATOM 872 O ARG A 53 -36.587 2.460 15.473 1.00 21.10 O ATOM 873 CB ARG A 53 -35.826 2.770 18.734 1.00 62.12 C ATOM 874 CG ARG A 53 -36.477 4.107 18.421 1.00 15.15 C ATOM 875 CD ARG A 53 -35.495 5.257 18.583 1.00 33.23 C ATOM 876 NE ARG A 53 -34.802 5.208 19.868 1.00 35.00 N ATOM 877 CZ ARG A 53 -35.370 5.539 21.022 1.00 14.13 C ATOM 878 NH1 ARG A 53 -36.634 5.940 21.052 1.00 3.44 N ATOM 879 NH2 ARG A 53 -34.674 5.469 22.150 1.00 74.51 N ATOM 0 H ARG A 53 -34.449 2.989 15.880 1.00 41.11 H new ATOM 0 HA ARG A 53 -35.005 1.023 17.788 1.00 35.43 H new ATOM 0 HB2 ARG A 53 -36.533 2.152 19.287 1.00 62.12 H new ATOM 0 HB3 ARG A 53 -34.969 2.936 19.387 1.00 62.12 H new ATOM 0 HG2 ARG A 53 -36.861 4.096 17.401 1.00 15.15 H new ATOM 0 HG3 ARG A 53 -37.331 4.261 19.081 1.00 15.15 H new ATOM 0 HD2 ARG A 53 -34.764 5.226 17.775 1.00 33.23 H new ATOM 0 HD3 ARG A 53 -36.028 6.204 18.494 1.00 33.23 H new ATOM 0 HE ARG A 53 -33.829 4.903 19.880 1.00 35.00 H new ATOM 0 HH11 ARG A 53 -37.172 5.995 20.187 1.00 3.44 H new ATOM 0 HH12 ARG A 53 -37.068 6.194 21.940 1.00 3.44 H new ATOM 0 HH21 ARG A 53 -33.702 5.161 22.131 1.00 74.51 H new ATOM 0 HH22 ARG A 53 -35.111 5.723 23.036 1.00 74.51 H new ATOM 893 N SER A 54 -37.471 0.960 16.899 1.00 51.04 N ATOM 894 CA SER A 54 -38.638 0.693 16.066 1.00 15.14 C ATOM 895 C SER A 54 -39.483 1.952 15.895 1.00 43.31 C ATOM 896 O SER A 54 -39.119 3.028 16.371 1.00 24.41 O ATOM 897 CB SER A 54 -39.485 -0.423 16.682 1.00 53.44 C ATOM 898 OG SER A 54 -40.090 -1.217 15.676 1.00 33.12 O ATOM 0 H SER A 54 -37.444 0.431 17.770 1.00 51.04 H new ATOM 0 HA SER A 54 -38.288 0.375 15.084 1.00 15.14 H new ATOM 0 HB2 SER A 54 -38.860 -1.050 17.318 1.00 53.44 H new ATOM 0 HB3 SER A 54 -40.255 0.010 17.320 1.00 53.44 H new ATOM 0 HG SER A 54 -40.624 -1.924 16.094 1.00 33.12 H new ATOM 904 N VAL A 55 -40.614 1.810 15.211 1.00 44.32 N ATOM 905 CA VAL A 55 -41.512 2.935 14.976 1.00 24.23 C ATOM 906 C VAL A 55 -42.672 2.927 15.965 1.00 3.14 C ATOM 907 O VAL A 55 -43.274 3.965 16.240 1.00 41.33 O ATOM 908 CB VAL A 55 -42.074 2.915 13.542 1.00 24.34 C ATOM 909 CG1 VAL A 55 -40.971 3.194 12.533 1.00 61.45 C ATOM 910 CG2 VAL A 55 -42.748 1.582 13.254 1.00 42.04 C ATOM 0 H VAL A 55 -40.930 0.927 14.810 1.00 44.32 H new ATOM 0 HA VAL A 55 -40.925 3.843 15.115 1.00 24.23 H new ATOM 0 HB VAL A 55 -42.823 3.702 13.452 1.00 24.34 H new ATOM 0 HG11 VAL A 55 -41.386 3.176 11.525 1.00 61.45 H new ATOM 0 HG12 VAL A 55 -40.538 4.175 12.729 1.00 61.45 H new ATOM 0 HG13 VAL A 55 -40.197 2.432 12.620 1.00 61.45 H new ATOM 0 HG21 VAL A 55 -43.140 1.585 12.237 1.00 42.04 H new ATOM 0 HG22 VAL A 55 -42.022 0.776 13.361 1.00 42.04 H new ATOM 0 HG23 VAL A 55 -43.566 1.429 13.957 1.00 42.04 H new ATOM 920 N ASP A 56 -42.980 1.750 16.498 1.00 23.12 N ATOM 921 CA ASP A 56 -44.067 1.606 17.459 1.00 54.51 C ATOM 922 C ASP A 56 -43.530 1.234 18.837 1.00 5.31 C ATOM 923 O ASP A 56 -42.321 1.254 19.070 1.00 3.11 O ATOM 924 CB ASP A 56 -45.061 0.546 16.982 1.00 11.01 C ATOM 925 CG ASP A 56 -46.501 0.945 17.239 1.00 20.55 C ATOM 926 OD1 ASP A 56 -47.006 0.663 18.347 1.00 50.23 O ATOM 927 OD2 ASP A 56 -47.123 1.538 16.334 1.00 4.50 O ATOM 0 H ASP A 56 -42.492 0.881 16.281 1.00 23.12 H new ATOM 0 HA ASP A 56 -44.579 2.565 17.536 1.00 54.51 H new ATOM 0 HB2 ASP A 56 -44.920 0.374 15.915 1.00 11.01 H new ATOM 0 HB3 ASP A 56 -44.853 -0.397 17.488 1.00 11.01 H new ATOM 932 N LYS A 57 -44.435 0.896 19.748 1.00 33.05 N ATOM 933 CA LYS A 57 -44.053 0.519 21.104 1.00 34.12 C ATOM 934 C LYS A 57 -44.496 -0.907 21.417 1.00 24.03 C ATOM 935 O LYS A 57 -43.986 -1.534 22.345 1.00 31.22 O ATOM 936 CB LYS A 57 -44.667 1.488 22.117 1.00 3.41 C ATOM 937 CG LYS A 57 -44.421 2.950 21.786 1.00 51.13 C ATOM 938 CD LYS A 57 -42.940 3.289 21.822 1.00 73.12 C ATOM 939 CE LYS A 57 -42.632 4.328 22.889 1.00 71.00 C ATOM 940 NZ LYS A 57 -42.822 5.716 22.383 1.00 35.34 N ATOM 0 H LYS A 57 -45.440 0.875 19.572 1.00 33.05 H new ATOM 0 HA LYS A 57 -42.966 0.568 21.175 1.00 34.12 H new ATOM 0 HB2 LYS A 57 -45.741 1.312 22.171 1.00 3.41 H new ATOM 0 HB3 LYS A 57 -44.259 1.274 23.105 1.00 3.41 H new ATOM 0 HG2 LYS A 57 -44.822 3.172 20.797 1.00 51.13 H new ATOM 0 HG3 LYS A 57 -44.957 3.580 22.496 1.00 51.13 H new ATOM 0 HD2 LYS A 57 -42.363 2.385 22.016 1.00 73.12 H new ATOM 0 HD3 LYS A 57 -42.628 3.663 20.847 1.00 73.12 H new ATOM 0 HE2 LYS A 57 -43.277 4.165 23.752 1.00 71.00 H new ATOM 0 HE3 LYS A 57 -41.605 4.204 23.231 1.00 71.00 H new ATOM 0 HZ1 LYS A 57 -42.602 6.395 23.140 1.00 35.34 H new ATOM 0 HZ2 LYS A 57 -42.188 5.881 21.575 1.00 35.34 H new ATOM 0 HZ3 LYS A 57 -43.809 5.843 22.080 1.00 35.34 H new ATOM 954 N GLU A 58 -45.445 -1.412 20.636 1.00 31.51 N ATOM 955 CA GLU A 58 -45.954 -2.765 20.831 1.00 12.12 C ATOM 956 C GLU A 58 -45.637 -3.645 19.625 1.00 14.32 C ATOM 957 O GLU A 58 -45.666 -3.201 18.477 1.00 73.41 O ATOM 958 CB GLU A 58 -47.465 -2.735 21.072 1.00 61.31 C ATOM 959 CG GLU A 58 -48.246 -2.062 19.956 1.00 40.10 C ATOM 960 CD GLU A 58 -49.743 -2.267 20.086 1.00 42.13 C ATOM 961 OE1 GLU A 58 -50.174 -3.432 20.206 1.00 35.30 O ATOM 962 OE2 GLU A 58 -50.483 -1.261 20.067 1.00 45.30 O ATOM 0 H GLU A 58 -45.877 -0.906 19.863 1.00 31.51 H new ATOM 0 HA GLU A 58 -45.462 -3.188 21.707 1.00 12.12 H new ATOM 0 HB2 GLU A 58 -47.826 -3.757 21.192 1.00 61.31 H new ATOM 0 HB3 GLU A 58 -47.665 -2.215 22.009 1.00 61.31 H new ATOM 0 HG2 GLU A 58 -48.028 -0.994 19.958 1.00 40.10 H new ATOM 0 HG3 GLU A 58 -47.911 -2.454 18.996 1.00 40.10 H new ATOM 969 N PRO A 59 -45.327 -4.922 19.891 1.00 63.24 N ATOM 970 CA PRO A 59 -45.288 -5.461 21.253 1.00 14.25 C ATOM 971 C PRO A 59 -44.122 -4.906 22.063 1.00 25.34 C ATOM 972 O PRO A 59 -44.034 -5.121 23.273 1.00 54.15 O ATOM 973 CB PRO A 59 -45.120 -6.967 21.035 1.00 12.51 C ATOM 974 CG PRO A 59 -44.466 -7.085 19.702 1.00 22.21 C ATOM 975 CD PRO A 59 -44.988 -5.939 18.881 1.00 73.12 C ATOM 0 HA PRO A 59 -46.180 -5.196 21.821 1.00 14.25 H new ATOM 0 HB2 PRO A 59 -44.507 -7.415 21.818 1.00 12.51 H new ATOM 0 HB3 PRO A 59 -46.082 -7.479 21.051 1.00 12.51 H new ATOM 0 HG2 PRO A 59 -43.381 -7.036 19.794 1.00 22.21 H new ATOM 0 HG3 PRO A 59 -44.704 -8.040 19.234 1.00 22.21 H new ATOM 0 HD2 PRO A 59 -44.239 -5.574 18.179 1.00 73.12 H new ATOM 0 HD3 PRO A 59 -45.860 -6.229 18.295 1.00 73.12 H new ATOM 983 N VAL A 60 -43.226 -4.192 21.389 1.00 10.55 N ATOM 984 CA VAL A 60 -42.065 -3.605 22.047 1.00 3.42 C ATOM 985 C VAL A 60 -41.597 -2.349 21.319 1.00 21.43 C ATOM 986 O VAL A 60 -42.220 -1.913 20.352 1.00 22.00 O ATOM 987 CB VAL A 60 -40.897 -4.606 22.123 1.00 21.02 C ATOM 988 CG1 VAL A 60 -41.356 -5.915 22.748 1.00 45.11 C ATOM 989 CG2 VAL A 60 -40.308 -4.843 20.741 1.00 51.03 C ATOM 0 H VAL A 60 -43.282 -4.006 20.388 1.00 10.55 H new ATOM 0 HA VAL A 60 -42.374 -3.341 23.058 1.00 3.42 H new ATOM 0 HB VAL A 60 -40.118 -4.182 22.757 1.00 21.02 H new ATOM 0 HG11 VAL A 60 -40.518 -6.610 22.794 1.00 45.11 H new ATOM 0 HG12 VAL A 60 -41.727 -5.727 23.756 1.00 45.11 H new ATOM 0 HG13 VAL A 60 -42.153 -6.347 22.143 1.00 45.11 H new ATOM 0 HG21 VAL A 60 -39.484 -5.553 20.814 1.00 51.03 H new ATOM 0 HG22 VAL A 60 -41.077 -5.246 20.082 1.00 51.03 H new ATOM 0 HG23 VAL A 60 -39.940 -3.900 20.336 1.00 51.03 H new ATOM 999 N GLU A 61 -40.495 -1.774 21.791 1.00 14.04 N ATOM 1000 CA GLU A 61 -39.944 -0.568 21.185 1.00 53.13 C ATOM 1001 C GLU A 61 -38.594 -0.854 20.534 1.00 72.43 C ATOM 1002 O GLU A 61 -38.067 -0.032 19.784 1.00 34.14 O ATOM 1003 CB GLU A 61 -39.793 0.535 22.235 1.00 62.51 C ATOM 1004 CG GLU A 61 -38.799 1.616 21.844 1.00 74.44 C ATOM 1005 CD GLU A 61 -39.032 2.918 22.585 1.00 23.43 C ATOM 1006 OE1 GLU A 61 -39.307 2.865 23.802 1.00 4.25 O ATOM 1007 OE2 GLU A 61 -38.939 3.988 21.949 1.00 11.13 O ATOM 0 H GLU A 61 -39.967 -2.124 22.590 1.00 14.04 H new ATOM 0 HA GLU A 61 -40.636 -0.232 20.413 1.00 53.13 H new ATOM 0 HB2 GLU A 61 -40.766 0.994 22.410 1.00 62.51 H new ATOM 0 HB3 GLU A 61 -39.478 0.087 23.177 1.00 62.51 H new ATOM 0 HG2 GLU A 61 -37.787 1.264 22.045 1.00 74.44 H new ATOM 0 HG3 GLU A 61 -38.867 1.796 20.771 1.00 74.44 H new ATOM 1014 N SER A 62 -38.040 -2.027 20.826 1.00 2.51 N ATOM 1015 CA SER A 62 -36.749 -2.421 20.273 1.00 12.34 C ATOM 1016 C SER A 62 -35.842 -1.207 20.093 1.00 70.40 C ATOM 1017 O SER A 62 -35.851 -0.563 19.044 1.00 4.44 O ATOM 1018 CB SER A 62 -36.941 -3.132 18.933 1.00 63.52 C ATOM 1019 OG SER A 62 -36.239 -4.363 18.904 1.00 33.52 O ATOM 0 H SER A 62 -38.465 -2.720 21.442 1.00 2.51 H new ATOM 0 HA SER A 62 -36.274 -3.106 20.975 1.00 12.34 H new ATOM 0 HB2 SER A 62 -38.002 -3.311 18.761 1.00 63.52 H new ATOM 0 HB3 SER A 62 -36.591 -2.491 18.124 1.00 63.52 H new ATOM 0 HG SER A 62 -36.379 -4.799 18.038 1.00 33.52 H new ATOM 1025 N SER A 63 -35.060 -0.903 21.124 1.00 51.53 N ATOM 1026 CA SER A 63 -34.149 0.235 21.082 1.00 52.42 C ATOM 1027 C SER A 63 -32.699 -0.232 21.010 1.00 63.25 C ATOM 1028 O SER A 63 -32.240 -1.001 21.855 1.00 13.02 O ATOM 1029 CB SER A 63 -34.350 1.122 22.312 1.00 14.21 C ATOM 1030 OG SER A 63 -33.543 2.285 22.240 1.00 30.34 O ATOM 0 H SER A 63 -35.039 -1.428 21.998 1.00 51.53 H new ATOM 0 HA SER A 63 -34.371 0.813 20.185 1.00 52.42 H new ATOM 0 HB2 SER A 63 -35.399 1.408 22.391 1.00 14.21 H new ATOM 0 HB3 SER A 63 -34.104 0.560 23.213 1.00 14.21 H new ATOM 0 HG SER A 63 -33.691 2.836 23.037 1.00 30.34 H new ATOM 1036 N ILE A 64 -31.982 0.238 19.994 1.00 73.51 N ATOM 1037 CA ILE A 64 -30.584 -0.131 19.811 1.00 0.01 C ATOM 1038 C ILE A 64 -29.753 1.068 19.366 1.00 31.23 C ATOM 1039 O ILE A 64 -30.258 1.977 18.707 1.00 44.41 O ATOM 1040 CB ILE A 64 -30.430 -1.261 18.776 1.00 52.55 C ATOM 1041 CG1 ILE A 64 -31.410 -2.396 19.078 1.00 23.42 C ATOM 1042 CG2 ILE A 64 -28.999 -1.777 18.764 1.00 52.14 C ATOM 1043 CD1 ILE A 64 -31.234 -3.601 18.180 1.00 31.03 C ATOM 0 H ILE A 64 -32.347 0.875 19.286 1.00 73.51 H new ATOM 0 HA ILE A 64 -30.222 -0.483 20.777 1.00 0.01 H new ATOM 0 HB ILE A 64 -30.659 -0.862 17.788 1.00 52.55 H new ATOM 0 HG12 ILE A 64 -31.287 -2.705 20.116 1.00 23.42 H new ATOM 0 HG13 ILE A 64 -32.429 -2.022 18.976 1.00 23.42 H new ATOM 0 HG21 ILE A 64 -28.906 -2.575 18.028 1.00 52.14 H new ATOM 0 HG22 ILE A 64 -28.321 -0.964 18.505 1.00 52.14 H new ATOM 0 HG23 ILE A 64 -28.743 -2.162 19.751 1.00 52.14 H new ATOM 0 HD11 ILE A 64 -31.962 -4.366 18.451 1.00 31.03 H new ATOM 0 HD12 ILE A 64 -31.387 -3.306 17.142 1.00 31.03 H new ATOM 0 HD13 ILE A 64 -30.227 -4.000 18.300 1.00 31.03 H new ATOM 1055 N THR A 65 -28.474 1.063 19.730 1.00 34.51 N ATOM 1056 CA THR A 65 -27.572 2.149 19.368 1.00 34.44 C ATOM 1057 C THR A 65 -26.395 1.635 18.548 1.00 4.10 C ATOM 1058 O THR A 65 -25.566 0.870 19.044 1.00 51.04 O ATOM 1059 CB THR A 65 -27.036 2.873 20.618 1.00 52.15 C ATOM 1060 OG1 THR A 65 -28.126 3.378 21.397 1.00 53.24 O ATOM 1061 CG2 THR A 65 -26.114 4.017 20.225 1.00 4.32 C ATOM 0 H THR A 65 -28.040 0.318 20.275 1.00 34.51 H new ATOM 0 HA THR A 65 -28.149 2.853 18.768 1.00 34.44 H new ATOM 0 HB THR A 65 -26.468 2.156 21.211 1.00 52.15 H new ATOM 0 HG1 THR A 65 -27.777 3.835 22.190 1.00 53.24 H new ATOM 0 HG21 THR A 65 -25.747 4.514 21.123 1.00 4.32 H new ATOM 0 HG22 THR A 65 -25.270 3.625 19.657 1.00 4.32 H new ATOM 0 HG23 THR A 65 -26.663 4.733 19.613 1.00 4.32 H new ATOM 1069 N LEU A 66 -26.325 2.060 17.291 1.00 1.35 N ATOM 1070 CA LEU A 66 -25.247 1.644 16.401 1.00 23.35 C ATOM 1071 C LEU A 66 -24.105 2.655 16.419 1.00 22.20 C ATOM 1072 O LEU A 66 -24.276 3.808 16.022 1.00 72.35 O ATOM 1073 CB LEU A 66 -25.773 1.476 14.975 1.00 64.21 C ATOM 1074 CG LEU A 66 -26.442 0.138 14.659 1.00 33.15 C ATOM 1075 CD1 LEU A 66 -27.256 0.237 13.378 1.00 25.02 C ATOM 1076 CD2 LEU A 66 -25.401 -0.967 14.549 1.00 54.44 C ATOM 0 H LEU A 66 -27.002 2.693 16.865 1.00 1.35 H new ATOM 0 HA LEU A 66 -24.865 0.687 16.756 1.00 23.35 H new ATOM 0 HB2 LEU A 66 -26.490 2.273 14.777 1.00 64.21 H new ATOM 0 HB3 LEU A 66 -24.942 1.616 14.284 1.00 64.21 H new ATOM 0 HG LEU A 66 -27.119 -0.109 15.477 1.00 33.15 H new ATOM 0 HD11 LEU A 66 -27.725 -0.725 13.169 1.00 25.02 H new ATOM 0 HD12 LEU A 66 -28.027 0.999 13.495 1.00 25.02 H new ATOM 0 HD13 LEU A 66 -26.601 0.508 12.550 1.00 25.02 H new ATOM 0 HD21 LEU A 66 -25.896 -1.912 14.324 1.00 54.44 H new ATOM 0 HD22 LEU A 66 -24.698 -0.726 13.752 1.00 54.44 H new ATOM 0 HD23 LEU A 66 -24.863 -1.055 15.493 1.00 54.44 H new ATOM 1088 N HIS A 67 -22.938 2.215 16.880 1.00 34.45 N ATOM 1089 CA HIS A 67 -21.767 3.081 16.947 1.00 64.40 C ATOM 1090 C HIS A 67 -20.787 2.756 15.823 1.00 0.52 C ATOM 1091 O HIS A 67 -20.224 1.663 15.773 1.00 73.54 O ATOM 1092 CB HIS A 67 -21.074 2.933 18.302 1.00 45.12 C ATOM 1093 CG HIS A 67 -19.600 3.197 18.253 1.00 51.42 C ATOM 1094 ND1 HIS A 67 -19.067 4.459 18.098 1.00 4.52 N ATOM 1095 CD2 HIS A 67 -18.546 2.353 18.341 1.00 42.12 C ATOM 1096 CE1 HIS A 67 -17.748 4.380 18.091 1.00 20.14 C ATOM 1097 NE2 HIS A 67 -17.406 3.112 18.237 1.00 13.45 N ATOM 0 H HIS A 67 -22.779 1.264 17.212 1.00 34.45 H new ATOM 0 HA HIS A 67 -22.100 4.112 16.829 1.00 64.40 H new ATOM 0 HB2 HIS A 67 -21.534 3.619 19.013 1.00 45.12 H new ATOM 0 HB3 HIS A 67 -21.242 1.924 18.678 1.00 45.12 H new ATOM 0 HD2 HIS A 67 -18.593 1.282 18.469 1.00 42.12 H new ATOM 0 HE1 HIS A 67 -17.066 5.210 17.984 1.00 20.14 H new ATOM 0 HE2 HIS A 67 -16.451 2.755 18.267 1.00 13.45 H new ATOM 1105 N PHE A 68 -20.588 3.714 14.923 1.00 35.13 N ATOM 1106 CA PHE A 68 -19.678 3.530 13.799 1.00 72.40 C ATOM 1107 C PHE A 68 -18.368 4.276 14.032 1.00 23.53 C ATOM 1108 O PHE A 68 -18.361 5.396 14.540 1.00 11.41 O ATOM 1109 CB PHE A 68 -20.330 4.015 12.503 1.00 74.44 C ATOM 1110 CG PHE A 68 -21.780 4.374 12.659 1.00 12.40 C ATOM 1111 CD1 PHE A 68 -22.152 5.644 13.072 1.00 20.31 C ATOM 1112 CD2 PHE A 68 -22.771 3.444 12.393 1.00 73.45 C ATOM 1113 CE1 PHE A 68 -23.485 5.977 13.218 1.00 73.14 C ATOM 1114 CE2 PHE A 68 -24.107 3.771 12.536 1.00 45.32 C ATOM 1115 CZ PHE A 68 -24.464 5.040 12.948 1.00 42.01 C ATOM 0 H PHE A 68 -21.045 4.625 14.951 1.00 35.13 H new ATOM 0 HA PHE A 68 -19.459 2.466 13.712 1.00 72.40 H new ATOM 0 HB2 PHE A 68 -19.786 4.885 12.136 1.00 74.44 H new ATOM 0 HB3 PHE A 68 -20.236 3.237 11.745 1.00 74.44 H new ATOM 0 HD1 PHE A 68 -21.391 6.381 13.282 1.00 20.31 H new ATOM 0 HD2 PHE A 68 -22.497 2.451 12.070 1.00 73.45 H new ATOM 0 HE1 PHE A 68 -23.762 6.969 13.543 1.00 73.14 H new ATOM 0 HE2 PHE A 68 -24.870 3.036 12.326 1.00 45.32 H new ATOM 0 HZ PHE A 68 -25.506 5.299 13.059 1.00 42.01 H new ATOM 1125 N ALA A 69 -17.260 3.644 13.658 1.00 42.22 N ATOM 1126 CA ALA A 69 -15.943 4.248 13.824 1.00 34.55 C ATOM 1127 C ALA A 69 -15.232 4.392 12.483 1.00 23.55 C ATOM 1128 O ALA A 69 -14.904 3.399 11.835 1.00 62.44 O ATOM 1129 CB ALA A 69 -15.101 3.420 14.785 1.00 55.52 C ATOM 0 H ALA A 69 -17.248 2.714 13.238 1.00 42.22 H new ATOM 0 HA ALA A 69 -16.077 5.246 14.242 1.00 34.55 H new ATOM 0 HB1 ALA A 69 -14.120 3.882 14.900 1.00 55.52 H new ATOM 0 HB2 ALA A 69 -15.596 3.373 15.755 1.00 55.52 H new ATOM 0 HB3 ALA A 69 -14.983 2.411 14.389 1.00 55.52 H new ATOM 1135 N MET A 70 -14.997 5.634 12.074 1.00 63.21 N ATOM 1136 CA MET A 70 -14.323 5.907 10.810 1.00 72.34 C ATOM 1137 C MET A 70 -12.810 5.786 10.962 1.00 33.14 C ATOM 1138 O MET A 70 -12.139 6.733 11.373 1.00 53.41 O ATOM 1139 CB MET A 70 -14.687 7.304 10.305 1.00 45.51 C ATOM 1140 CG MET A 70 -16.174 7.608 10.374 1.00 34.13 C ATOM 1141 SD MET A 70 -16.960 7.608 8.751 1.00 22.53 S ATOM 1142 CE MET A 70 -18.633 8.078 9.185 1.00 43.44 C ATOM 0 H MET A 70 -15.263 6.467 12.599 1.00 63.21 H new ATOM 0 HA MET A 70 -14.657 5.167 10.082 1.00 72.34 H new ATOM 0 HB2 MET A 70 -14.146 8.046 10.892 1.00 45.51 H new ATOM 0 HB3 MET A 70 -14.351 7.407 9.273 1.00 45.51 H new ATOM 0 HG2 MET A 70 -16.663 6.870 11.010 1.00 34.13 H new ATOM 0 HG3 MET A 70 -16.321 8.580 10.844 1.00 34.13 H new ATOM 0 HE1 MET A 70 -19.261 8.053 8.294 1.00 43.44 H new ATOM 0 HE2 MET A 70 -19.026 7.382 9.926 1.00 43.44 H new ATOM 0 HE3 MET A 70 -18.632 9.086 9.599 1.00 43.44 H new ATOM 1152 N THR A 71 -12.278 4.614 10.630 1.00 61.11 N ATOM 1153 CA THR A 71 -10.845 4.369 10.732 1.00 61.14 C ATOM 1154 C THR A 71 -10.049 5.461 10.026 1.00 0.25 C ATOM 1155 O THR A 71 -10.570 6.203 9.193 1.00 61.51 O ATOM 1156 CB THR A 71 -10.464 3.003 10.130 1.00 33.23 C ATOM 1157 OG1 THR A 71 -11.393 2.645 9.101 1.00 61.03 O ATOM 1158 CG2 THR A 71 -10.449 1.925 11.203 1.00 20.44 C ATOM 0 H THR A 71 -12.818 3.819 10.288 1.00 61.11 H new ATOM 0 HA THR A 71 -10.599 4.372 11.794 1.00 61.14 H new ATOM 0 HB THR A 71 -9.464 3.084 9.704 1.00 33.23 H new ATOM 0 HG1 THR A 71 -10.929 2.134 8.405 1.00 61.03 H new ATOM 0 HG21 THR A 71 -10.177 0.969 10.755 1.00 20.44 H new ATOM 0 HG22 THR A 71 -9.720 2.186 11.971 1.00 20.44 H new ATOM 0 HG23 THR A 71 -11.438 1.846 11.654 1.00 20.44 H new ATOM 1166 N PRO A 72 -8.756 5.565 10.366 1.00 25.11 N ATOM 1167 CA PRO A 72 -7.860 6.564 9.776 1.00 63.35 C ATOM 1168 C PRO A 72 -7.553 6.273 8.310 1.00 1.14 C ATOM 1169 O PRO A 72 -7.054 7.136 7.588 1.00 24.44 O ATOM 1170 CB PRO A 72 -6.589 6.445 10.621 1.00 15.15 C ATOM 1171 CG PRO A 72 -6.616 5.053 11.153 1.00 55.55 C ATOM 1172 CD PRO A 72 -8.068 4.715 11.352 1.00 22.42 C ATOM 0 HA PRO A 72 -8.301 7.561 9.783 1.00 63.35 H new ATOM 0 HB2 PRO A 72 -5.697 6.622 10.021 1.00 15.15 H new ATOM 0 HB3 PRO A 72 -6.580 7.177 11.428 1.00 15.15 H new ATOM 0 HG2 PRO A 72 -6.146 4.359 10.456 1.00 55.55 H new ATOM 0 HG3 PRO A 72 -6.067 4.983 12.092 1.00 55.55 H new ATOM 0 HD2 PRO A 72 -8.262 3.657 11.175 1.00 22.42 H new ATOM 0 HD3 PRO A 72 -8.395 4.933 12.368 1.00 22.42 H new ATOM 1180 N MET A 73 -7.855 5.053 7.878 1.00 54.41 N ATOM 1181 CA MET A 73 -7.613 4.651 6.497 1.00 31.44 C ATOM 1182 C MET A 73 -8.904 4.687 5.686 1.00 50.53 C ATOM 1183 O MET A 73 -8.874 4.758 4.457 1.00 71.22 O ATOM 1184 CB MET A 73 -7.008 3.246 6.452 1.00 34.02 C ATOM 1185 CG MET A 73 -5.489 3.236 6.509 1.00 14.11 C ATOM 1186 SD MET A 73 -4.738 2.807 4.927 1.00 1.02 S ATOM 1187 CE MET A 73 -5.362 4.125 3.887 1.00 30.03 C ATOM 0 H MET A 73 -8.267 4.326 8.463 1.00 54.41 H new ATOM 0 HA MET A 73 -6.909 5.357 6.057 1.00 31.44 H new ATOM 0 HB2 MET A 73 -7.399 2.664 7.287 1.00 34.02 H new ATOM 0 HB3 MET A 73 -7.332 2.749 5.538 1.00 34.02 H new ATOM 0 HG2 MET A 73 -5.134 4.218 6.821 1.00 14.11 H new ATOM 0 HG3 MET A 73 -5.162 2.524 7.267 1.00 14.11 H new ATOM 0 HE1 MET A 73 -5.013 3.978 2.865 1.00 30.03 H new ATOM 0 HE2 MET A 73 -6.452 4.116 3.903 1.00 30.03 H new ATOM 0 HE3 MET A 73 -5.001 5.084 4.259 1.00 30.03 H new ATOM 1197 N TYR A 74 -10.035 4.639 6.380 1.00 55.21 N ATOM 1198 CA TYR A 74 -11.337 4.664 5.723 1.00 41.41 C ATOM 1199 C TYR A 74 -11.426 5.823 4.734 1.00 21.03 C ATOM 1200 O TYR A 74 -10.769 6.853 4.885 1.00 42.21 O ATOM 1201 CB TYR A 74 -12.454 4.779 6.762 1.00 61.24 C ATOM 1202 CG TYR A 74 -13.618 5.631 6.308 1.00 62.51 C ATOM 1203 CD1 TYR A 74 -13.452 6.985 6.047 1.00 14.45 C ATOM 1204 CD2 TYR A 74 -14.883 5.081 6.141 1.00 41.15 C ATOM 1205 CE1 TYR A 74 -14.513 7.768 5.633 1.00 30.13 C ATOM 1206 CE2 TYR A 74 -15.949 5.856 5.725 1.00 22.54 C ATOM 1207 CZ TYR A 74 -15.759 7.198 5.473 1.00 0.23 C ATOM 1208 OH TYR A 74 -16.819 7.973 5.061 1.00 44.40 O ATOM 0 H TYR A 74 -10.077 4.583 7.398 1.00 55.21 H new ATOM 0 HA TYR A 74 -11.456 3.730 5.173 1.00 41.41 H new ATOM 0 HB2 TYR A 74 -12.818 3.780 7.004 1.00 61.24 H new ATOM 0 HB3 TYR A 74 -12.043 5.199 7.680 1.00 61.24 H new ATOM 0 HD1 TYR A 74 -12.477 7.434 6.170 1.00 14.45 H new ATOM 0 HD2 TYR A 74 -15.036 4.030 6.340 1.00 41.15 H new ATOM 0 HE1 TYR A 74 -14.367 8.820 5.436 1.00 30.13 H new ATOM 0 HE2 TYR A 74 -16.926 5.413 5.598 1.00 22.54 H new ATOM 0 HH TYR A 74 -17.624 7.418 4.997 1.00 44.40 H new ATOM 1218 N PRO A 75 -12.259 5.652 3.697 1.00 33.24 N ATOM 1219 CA PRO A 75 -13.046 4.430 3.507 1.00 20.54 C ATOM 1220 C PRO A 75 -12.177 3.233 3.133 1.00 15.41 C ATOM 1221 O PRO A 75 -12.640 2.092 3.139 1.00 3.20 O ATOM 1222 CB PRO A 75 -13.987 4.789 2.355 1.00 62.23 C ATOM 1223 CG PRO A 75 -13.274 5.860 1.604 1.00 13.52 C ATOM 1224 CD PRO A 75 -12.497 6.638 2.630 1.00 13.11 C ATOM 0 HA PRO A 75 -13.562 4.132 4.419 1.00 20.54 H new ATOM 0 HB2 PRO A 75 -14.184 3.925 1.721 1.00 62.23 H new ATOM 0 HB3 PRO A 75 -14.951 5.139 2.725 1.00 62.23 H new ATOM 0 HG2 PRO A 75 -12.610 5.434 0.852 1.00 13.52 H new ATOM 0 HG3 PRO A 75 -13.979 6.504 1.078 1.00 13.52 H new ATOM 0 HD2 PRO A 75 -11.562 7.021 2.221 1.00 13.11 H new ATOM 0 HD3 PRO A 75 -13.061 7.497 2.995 1.00 13.11 H new ATOM 1232 N TYR A 76 -10.918 3.502 2.808 1.00 23.34 N ATOM 1233 CA TYR A 76 -9.985 2.447 2.429 1.00 0.03 C ATOM 1234 C TYR A 76 -10.271 1.163 3.202 1.00 11.00 C ATOM 1235 O TYR A 76 -10.506 0.108 2.612 1.00 33.33 O ATOM 1236 CB TYR A 76 -8.545 2.896 2.681 1.00 43.53 C ATOM 1237 CG TYR A 76 -7.523 2.140 1.862 1.00 3.24 C ATOM 1238 CD1 TYR A 76 -7.348 0.772 2.025 1.00 22.45 C ATOM 1239 CD2 TYR A 76 -6.733 2.794 0.925 1.00 4.40 C ATOM 1240 CE1 TYR A 76 -6.415 0.077 1.280 1.00 23.04 C ATOM 1241 CE2 TYR A 76 -5.798 2.108 0.174 1.00 31.44 C ATOM 1242 CZ TYR A 76 -5.642 0.749 0.356 1.00 15.22 C ATOM 1243 OH TYR A 76 -4.713 0.061 -0.389 1.00 61.50 O ATOM 0 H TYR A 76 -10.520 4.441 2.799 1.00 23.34 H new ATOM 0 HA TYR A 76 -10.116 2.247 1.366 1.00 0.03 H new ATOM 0 HB2 TYR A 76 -8.461 3.960 2.459 1.00 43.53 H new ATOM 0 HB3 TYR A 76 -8.314 2.772 3.739 1.00 43.53 H new ATOM 0 HD1 TYR A 76 -7.952 0.242 2.747 1.00 22.45 H new ATOM 0 HD2 TYR A 76 -6.852 3.858 0.781 1.00 4.40 H new ATOM 0 HE1 TYR A 76 -6.291 -0.987 1.420 1.00 23.04 H new ATOM 0 HE2 TYR A 76 -5.193 2.632 -0.551 1.00 31.44 H new ATOM 0 HH TYR A 76 -4.254 0.681 -0.993 1.00 61.50 H new ATOM 1253 N THR A 77 -10.250 1.261 4.528 1.00 70.32 N ATOM 1254 CA THR A 77 -10.506 0.109 5.383 1.00 33.12 C ATOM 1255 C THR A 77 -11.942 0.112 5.894 1.00 15.11 C ATOM 1256 O THR A 77 -12.652 1.110 5.773 1.00 50.20 O ATOM 1257 CB THR A 77 -9.545 0.078 6.587 1.00 54.04 C ATOM 1258 OG1 THR A 77 -9.836 1.164 7.474 1.00 75.50 O ATOM 1259 CG2 THR A 77 -8.098 0.167 6.126 1.00 32.11 C ATOM 0 H THR A 77 -10.058 2.126 5.033 1.00 70.32 H new ATOM 0 HA THR A 77 -10.342 -0.780 4.773 1.00 33.12 H new ATOM 0 HB THR A 77 -9.685 -0.867 7.112 1.00 54.04 H new ATOM 0 HG1 THR A 77 -9.222 1.136 8.237 1.00 75.50 H new ATOM 0 HG21 THR A 77 -7.438 0.143 6.993 1.00 32.11 H new ATOM 0 HG22 THR A 77 -7.871 -0.677 5.474 1.00 32.11 H new ATOM 0 HG23 THR A 77 -7.947 1.098 5.580 1.00 32.11 H new ATOM 1267 N ALA A 78 -12.365 -1.011 6.466 1.00 4.43 N ATOM 1268 CA ALA A 78 -13.716 -1.136 6.998 1.00 1.33 C ATOM 1269 C ALA A 78 -13.776 -0.688 8.455 1.00 71.02 C ATOM 1270 O ALA A 78 -12.979 -1.111 9.293 1.00 53.13 O ATOM 1271 CB ALA A 78 -14.205 -2.570 6.864 1.00 32.13 C ATOM 0 H ALA A 78 -11.791 -1.847 6.573 1.00 4.43 H new ATOM 0 HA ALA A 78 -14.370 -0.485 6.418 1.00 1.33 H new ATOM 0 HB1 ALA A 78 -15.215 -2.649 7.265 1.00 32.13 H new ATOM 0 HB2 ALA A 78 -14.209 -2.856 5.812 1.00 32.13 H new ATOM 0 HB3 ALA A 78 -13.542 -3.234 7.418 1.00 32.13 H new ATOM 1277 N PRO A 79 -14.742 0.189 8.766 1.00 73.22 N ATOM 1278 CA PRO A 79 -14.929 0.713 10.122 1.00 70.00 C ATOM 1279 C PRO A 79 -15.446 -0.348 11.088 1.00 63.15 C ATOM 1280 O PRO A 79 -15.601 -1.512 10.719 1.00 14.20 O ATOM 1281 CB PRO A 79 -15.971 1.818 9.935 1.00 51.44 C ATOM 1282 CG PRO A 79 -16.721 1.428 8.708 1.00 34.23 C ATOM 1283 CD PRO A 79 -15.727 0.736 7.817 1.00 32.45 C ATOM 0 HA PRO A 79 -13.992 1.061 10.557 1.00 70.00 H new ATOM 0 HB2 PRO A 79 -16.633 1.888 10.798 1.00 51.44 H new ATOM 0 HB3 PRO A 79 -15.498 2.793 9.817 1.00 51.44 H new ATOM 0 HG2 PRO A 79 -17.552 0.767 8.953 1.00 34.23 H new ATOM 0 HG3 PRO A 79 -17.144 2.303 8.215 1.00 34.23 H new ATOM 0 HD2 PRO A 79 -16.196 -0.051 7.226 1.00 32.45 H new ATOM 0 HD3 PRO A 79 -15.266 1.430 7.114 1.00 32.45 H new ATOM 1291 N GLU A 80 -15.710 0.062 12.324 1.00 21.12 N ATOM 1292 CA GLU A 80 -16.209 -0.855 13.342 1.00 20.31 C ATOM 1293 C GLU A 80 -17.627 -0.481 13.764 1.00 40.14 C ATOM 1294 O GLU A 80 -17.959 0.699 13.883 1.00 31.21 O ATOM 1295 CB GLU A 80 -15.285 -0.851 14.561 1.00 3.15 C ATOM 1296 CG GLU A 80 -15.948 -1.361 15.830 1.00 51.41 C ATOM 1297 CD GLU A 80 -15.022 -2.221 16.668 1.00 43.54 C ATOM 1298 OE1 GLU A 80 -13.917 -1.748 17.006 1.00 45.14 O ATOM 1299 OE2 GLU A 80 -15.403 -3.367 16.985 1.00 0.34 O ATOM 0 H GLU A 80 -15.587 1.022 12.645 1.00 21.12 H new ATOM 0 HA GLU A 80 -16.228 -1.857 12.913 1.00 20.31 H new ATOM 0 HB2 GLU A 80 -14.411 -1.466 14.346 1.00 3.15 H new ATOM 0 HB3 GLU A 80 -14.927 0.164 14.731 1.00 3.15 H new ATOM 0 HG2 GLU A 80 -16.287 -0.512 16.425 1.00 51.41 H new ATOM 0 HG3 GLU A 80 -16.834 -1.939 15.566 1.00 51.41 H new ATOM 1306 N ILE A 81 -18.458 -1.493 13.987 1.00 72.23 N ATOM 1307 CA ILE A 81 -19.840 -1.271 14.395 1.00 4.12 C ATOM 1308 C ILE A 81 -20.219 -2.173 15.564 1.00 32.42 C ATOM 1309 O ILE A 81 -19.825 -3.338 15.615 1.00 52.01 O ATOM 1310 CB ILE A 81 -20.818 -1.519 13.231 1.00 4.54 C ATOM 1311 CG1 ILE A 81 -20.312 -0.838 11.958 1.00 42.21 C ATOM 1312 CG2 ILE A 81 -22.207 -1.015 13.591 1.00 34.24 C ATOM 1313 CD1 ILE A 81 -20.278 0.672 12.052 1.00 73.50 C ATOM 0 H ILE A 81 -18.199 -2.475 13.892 1.00 72.23 H new ATOM 0 HA ILE A 81 -19.914 -0.228 14.704 1.00 4.12 H new ATOM 0 HB ILE A 81 -20.878 -2.592 13.048 1.00 4.54 H new ATOM 0 HG12 ILE A 81 -19.309 -1.203 11.735 1.00 42.21 H new ATOM 0 HG13 ILE A 81 -20.950 -1.128 11.123 1.00 42.21 H new ATOM 0 HG21 ILE A 81 -22.887 -1.197 12.759 1.00 34.24 H new ATOM 0 HG22 ILE A 81 -22.567 -1.541 14.475 1.00 34.24 H new ATOM 0 HG23 ILE A 81 -22.164 0.054 13.797 1.00 34.24 H new ATOM 0 HD11 ILE A 81 -19.909 1.087 11.114 1.00 73.50 H new ATOM 0 HD12 ILE A 81 -21.283 1.047 12.244 1.00 73.50 H new ATOM 0 HD13 ILE A 81 -19.617 0.971 12.866 1.00 73.50 H new ATOM 1325 N GLU A 82 -20.989 -1.627 16.501 1.00 65.41 N ATOM 1326 CA GLU A 82 -21.422 -2.384 17.669 1.00 33.42 C ATOM 1327 C GLU A 82 -22.789 -1.906 18.151 1.00 2.21 C ATOM 1328 O GLU A 82 -23.111 -0.721 18.062 1.00 40.24 O ATOM 1329 CB GLU A 82 -20.397 -2.255 18.798 1.00 72.02 C ATOM 1330 CG GLU A 82 -20.673 -1.095 19.740 1.00 23.42 C ATOM 1331 CD GLU A 82 -19.543 -0.862 20.724 1.00 64.01 C ATOM 1332 OE1 GLU A 82 -18.914 -1.853 21.151 1.00 72.42 O ATOM 1333 OE2 GLU A 82 -19.287 0.311 21.067 1.00 24.10 O ATOM 0 H GLU A 82 -21.325 -0.664 16.473 1.00 65.41 H new ATOM 0 HA GLU A 82 -21.503 -3.432 17.381 1.00 33.42 H new ATOM 0 HB2 GLU A 82 -20.382 -3.182 19.371 1.00 72.02 H new ATOM 0 HB3 GLU A 82 -19.405 -2.132 18.364 1.00 72.02 H new ATOM 0 HG2 GLU A 82 -20.835 -0.189 19.157 1.00 23.42 H new ATOM 0 HG3 GLU A 82 -21.594 -1.289 20.289 1.00 23.42 H new ATOM 1340 N PHE A 83 -23.589 -2.836 18.662 1.00 43.02 N ATOM 1341 CA PHE A 83 -24.921 -2.511 19.157 1.00 53.43 C ATOM 1342 C PHE A 83 -24.909 -2.328 20.671 1.00 12.45 C ATOM 1343 O PHE A 83 -24.211 -3.043 21.390 1.00 60.53 O ATOM 1344 CB PHE A 83 -25.914 -3.610 18.772 1.00 3.13 C ATOM 1345 CG PHE A 83 -25.822 -4.023 17.331 1.00 14.21 C ATOM 1346 CD1 PHE A 83 -26.511 -3.325 16.352 1.00 43.31 C ATOM 1347 CD2 PHE A 83 -25.048 -5.109 16.955 1.00 0.54 C ATOM 1348 CE1 PHE A 83 -26.429 -3.703 15.025 1.00 20.11 C ATOM 1349 CE2 PHE A 83 -24.962 -5.491 15.630 1.00 31.40 C ATOM 1350 CZ PHE A 83 -25.653 -4.787 14.664 1.00 42.04 C ATOM 0 H PHE A 83 -23.338 -3.821 18.744 1.00 43.02 H new ATOM 0 HA PHE A 83 -25.233 -1.573 18.698 1.00 53.43 H new ATOM 0 HB2 PHE A 83 -25.742 -4.482 19.403 1.00 3.13 H new ATOM 0 HB3 PHE A 83 -26.926 -3.262 18.978 1.00 3.13 H new ATOM 0 HD1 PHE A 83 -27.119 -2.476 16.629 1.00 43.31 H new ATOM 0 HD2 PHE A 83 -24.506 -5.663 17.707 1.00 0.54 H new ATOM 0 HE1 PHE A 83 -26.971 -3.151 14.271 1.00 20.11 H new ATOM 0 HE2 PHE A 83 -24.355 -6.339 15.350 1.00 31.40 H new ATOM 0 HZ PHE A 83 -25.587 -5.084 13.628 1.00 42.04 H new ATOM 1360 N LYS A 84 -25.687 -1.363 21.151 1.00 41.20 N ATOM 1361 CA LYS A 84 -25.768 -1.084 22.580 1.00 40.12 C ATOM 1362 C LYS A 84 -27.218 -1.092 23.054 1.00 4.13 C ATOM 1363 O LYS A 84 -28.143 -1.197 22.250 1.00 1.44 O ATOM 1364 CB LYS A 84 -25.125 0.269 22.894 1.00 61.14 C ATOM 1365 CG LYS A 84 -24.039 0.669 21.910 1.00 23.22 C ATOM 1366 CD LYS A 84 -22.818 -0.228 22.032 1.00 75.51 C ATOM 1367 CE LYS A 84 -22.404 -0.411 23.484 1.00 64.22 C ATOM 1368 NZ LYS A 84 -21.070 -1.064 23.602 1.00 51.53 N ATOM 0 H LYS A 84 -26.271 -0.761 20.571 1.00 41.20 H new ATOM 0 HA LYS A 84 -25.226 -1.868 23.109 1.00 40.12 H new ATOM 0 HB2 LYS A 84 -25.899 1.037 22.900 1.00 61.14 H new ATOM 0 HB3 LYS A 84 -24.700 0.236 23.897 1.00 61.14 H new ATOM 0 HG2 LYS A 84 -24.430 0.617 20.894 1.00 23.22 H new ATOM 0 HG3 LYS A 84 -23.750 1.705 22.087 1.00 23.22 H new ATOM 0 HD2 LYS A 84 -23.034 -1.200 21.589 1.00 75.51 H new ATOM 0 HD3 LYS A 84 -21.991 0.203 21.468 1.00 75.51 H new ATOM 0 HE2 LYS A 84 -22.378 0.560 23.980 1.00 64.22 H new ATOM 0 HE3 LYS A 84 -23.150 -1.014 24.001 1.00 64.22 H new ATOM 0 HZ1 LYS A 84 -20.883 -1.294 24.599 1.00 51.53 H new ATOM 0 HZ2 LYS A 84 -21.060 -1.937 23.037 1.00 51.53 H new ATOM 0 HZ3 LYS A 84 -20.335 -0.417 23.252 1.00 51.53 H new ATOM 1382 N ASN A 85 -27.407 -0.979 24.365 1.00 72.20 N ATOM 1383 CA ASN A 85 -28.745 -0.972 24.946 1.00 22.50 C ATOM 1384 C ASN A 85 -29.454 -2.299 24.693 1.00 32.44 C ATOM 1385 O ASN A 85 -29.628 -3.107 25.606 1.00 1.45 O ATOM 1386 CB ASN A 85 -29.570 0.178 24.366 1.00 43.21 C ATOM 1387 CG ASN A 85 -29.079 1.535 24.834 1.00 63.33 C ATOM 1388 OD1 ASN A 85 -27.790 1.794 24.645 1.00 52.12 O flip ATOM 1389 ND2 ASN A 85 -29.849 2.339 25.358 1.00 11.52 N flip ATOM 0 H ASN A 85 -26.651 -0.891 25.044 1.00 72.20 H new ATOM 0 HA ASN A 85 -28.646 -0.832 26.022 1.00 22.50 H new ATOM 0 HB2 ASN A 85 -29.532 0.136 23.277 1.00 43.21 H new ATOM 0 HB3 ASN A 85 -30.614 0.054 24.653 1.00 43.21 H new ATOM 0 HD21 ASN A 85 -30.832 2.097 25.483 1.00 11.52 H new ATOM 0 HD22 ASN A 85 -29.504 3.248 25.667 1.00 11.52 H new ATOM 1396 N VAL A 86 -29.862 -2.518 23.447 1.00 21.42 N ATOM 1397 CA VAL A 86 -30.551 -3.748 23.073 1.00 2.32 C ATOM 1398 C VAL A 86 -31.391 -4.280 24.228 1.00 13.04 C ATOM 1399 O VAL A 86 -30.908 -5.052 25.056 1.00 63.13 O ATOM 1400 CB VAL A 86 -29.555 -4.837 22.632 1.00 33.24 C ATOM 1401 CG1 VAL A 86 -28.910 -4.466 21.306 1.00 71.11 C ATOM 1402 CG2 VAL A 86 -28.499 -5.059 23.705 1.00 54.12 C ATOM 0 H VAL A 86 -29.727 -1.860 22.679 1.00 21.42 H new ATOM 0 HA VAL A 86 -31.204 -3.503 22.236 1.00 2.32 H new ATOM 0 HB VAL A 86 -30.101 -5.770 22.494 1.00 33.24 H new ATOM 0 HG11 VAL A 86 -28.210 -5.247 21.011 1.00 71.11 H new ATOM 0 HG12 VAL A 86 -29.681 -4.363 20.543 1.00 71.11 H new ATOM 0 HG13 VAL A 86 -28.376 -3.522 21.413 1.00 71.11 H new ATOM 0 HG21 VAL A 86 -27.804 -5.832 23.377 1.00 54.12 H new ATOM 0 HG22 VAL A 86 -27.955 -4.130 23.878 1.00 54.12 H new ATOM 0 HG23 VAL A 86 -28.981 -5.374 24.630 1.00 54.12 H new ATOM 1412 N GLN A 87 -32.652 -3.862 24.277 1.00 30.04 N ATOM 1413 CA GLN A 87 -33.560 -4.297 25.332 1.00 30.11 C ATOM 1414 C GLN A 87 -34.396 -5.488 24.874 1.00 42.21 C ATOM 1415 O GLN A 87 -34.162 -6.621 25.293 1.00 44.54 O ATOM 1416 CB GLN A 87 -34.477 -3.147 25.752 1.00 43.34 C ATOM 1417 CG GLN A 87 -34.643 -2.080 24.681 1.00 1.15 C ATOM 1418 CD GLN A 87 -35.858 -1.204 24.915 1.00 42.43 C ATOM 1419 OE1 GLN A 87 -36.819 -1.238 24.146 1.00 50.22 O ATOM 1420 NE2 GLN A 87 -35.821 -0.412 25.980 1.00 13.11 N ATOM 0 H GLN A 87 -33.068 -3.223 23.599 1.00 30.04 H new ATOM 0 HA GLN A 87 -32.960 -4.605 26.188 1.00 30.11 H new ATOM 0 HB2 GLN A 87 -35.457 -3.549 26.007 1.00 43.34 H new ATOM 0 HB3 GLN A 87 -34.077 -2.685 26.655 1.00 43.34 H new ATOM 0 HG2 GLN A 87 -33.750 -1.456 24.653 1.00 1.15 H new ATOM 0 HG3 GLN A 87 -34.727 -2.559 23.706 1.00 1.15 H new ATOM 0 HE21 GLN A 87 -35.004 -0.416 26.591 1.00 13.11 H new ATOM 0 HE22 GLN A 87 -36.610 0.201 26.188 1.00 13.11 H new ATOM 1429 N ASN A 88 -35.372 -5.223 24.012 1.00 41.53 N ATOM 1430 CA ASN A 88 -36.244 -6.273 23.497 1.00 4.53 C ATOM 1431 C ASN A 88 -35.548 -7.066 22.395 1.00 2.24 C ATOM 1432 O ASN A 88 -36.134 -7.341 21.349 1.00 53.15 O ATOM 1433 CB ASN A 88 -37.544 -5.669 22.963 1.00 2.50 C ATOM 1434 CG ASN A 88 -38.477 -5.229 24.075 1.00 42.01 C ATOM 1435 OD1 ASN A 88 -39.134 -6.053 24.711 1.00 23.13 O ATOM 1436 ND2 ASN A 88 -38.539 -3.924 24.313 1.00 31.14 N ATOM 0 H ASN A 88 -35.579 -4.290 23.655 1.00 41.53 H new ATOM 0 HA ASN A 88 -36.477 -6.952 24.317 1.00 4.53 H new ATOM 0 HB2 ASN A 88 -37.310 -4.814 22.329 1.00 2.50 H new ATOM 0 HB3 ASN A 88 -38.051 -6.402 22.336 1.00 2.50 H new ATOM 0 HD21 ASN A 88 -39.150 -3.568 25.048 1.00 31.14 H new ATOM 0 HD22 ASN A 88 -37.976 -3.277 23.760 1.00 31.14 H new ATOM 1443 N VAL A 89 -34.293 -7.432 22.639 1.00 52.51 N ATOM 1444 CA VAL A 89 -33.517 -8.195 21.669 1.00 53.22 C ATOM 1445 C VAL A 89 -32.764 -9.336 22.343 1.00 33.11 C ATOM 1446 O VAL A 89 -32.230 -9.178 23.440 1.00 13.24 O ATOM 1447 CB VAL A 89 -32.510 -7.298 20.926 1.00 44.15 C ATOM 1448 CG1 VAL A 89 -31.786 -8.088 19.846 1.00 74.14 C ATOM 1449 CG2 VAL A 89 -33.212 -6.087 20.331 1.00 14.32 C ATOM 0 H VAL A 89 -33.793 -7.212 23.500 1.00 52.51 H new ATOM 0 HA VAL A 89 -34.225 -8.606 20.950 1.00 53.22 H new ATOM 0 HB VAL A 89 -31.769 -6.944 21.643 1.00 44.15 H new ATOM 0 HG11 VAL A 89 -31.079 -7.437 19.332 1.00 74.14 H new ATOM 0 HG12 VAL A 89 -31.249 -8.920 20.302 1.00 74.14 H new ATOM 0 HG13 VAL A 89 -32.511 -8.474 19.129 1.00 74.14 H new ATOM 0 HG21 VAL A 89 -32.485 -5.465 19.810 1.00 14.32 H new ATOM 0 HG22 VAL A 89 -33.976 -6.418 19.628 1.00 14.32 H new ATOM 0 HG23 VAL A 89 -33.679 -5.509 21.128 1.00 14.32 H new ATOM 1459 N MET A 90 -32.725 -10.486 21.678 1.00 34.33 N ATOM 1460 CA MET A 90 -32.036 -11.655 22.213 1.00 3.41 C ATOM 1461 C MET A 90 -30.591 -11.704 21.725 1.00 13.22 C ATOM 1462 O MET A 90 -29.655 -11.646 22.522 1.00 22.33 O ATOM 1463 CB MET A 90 -32.767 -12.935 21.807 1.00 33.42 C ATOM 1464 CG MET A 90 -34.258 -12.904 22.104 1.00 22.00 C ATOM 1465 SD MET A 90 -35.202 -14.009 21.037 1.00 41.12 S ATOM 1466 CE MET A 90 -35.297 -13.032 19.538 1.00 33.43 C ATOM 0 H MET A 90 -33.162 -10.633 20.768 1.00 34.33 H new ATOM 0 HA MET A 90 -32.032 -11.578 23.300 1.00 3.41 H new ATOM 0 HB2 MET A 90 -32.621 -13.104 20.740 1.00 33.42 H new ATOM 0 HB3 MET A 90 -32.319 -13.781 22.328 1.00 33.42 H new ATOM 0 HG2 MET A 90 -34.423 -13.182 23.145 1.00 22.00 H new ATOM 0 HG3 MET A 90 -34.627 -11.886 21.984 1.00 22.00 H new ATOM 0 HE1 MET A 90 -36.333 -12.749 19.353 1.00 33.43 H new ATOM 0 HE2 MET A 90 -34.690 -12.133 19.650 1.00 33.43 H new ATOM 0 HE3 MET A 90 -34.925 -13.618 18.698 1.00 33.43 H new ATOM 1476 N ASP A 91 -30.418 -11.811 20.412 1.00 14.35 N ATOM 1477 CA ASP A 91 -29.088 -11.867 19.819 1.00 43.24 C ATOM 1478 C ASP A 91 -29.152 -12.400 18.391 1.00 41.34 C ATOM 1479 O ASP A 91 -28.252 -12.159 17.587 1.00 45.25 O ATOM 1480 CB ASP A 91 -28.165 -12.747 20.664 1.00 75.14 C ATOM 1481 CG ASP A 91 -27.055 -13.376 19.845 1.00 74.12 C ATOM 1482 OD1 ASP A 91 -26.219 -12.624 19.302 1.00 71.04 O ATOM 1483 OD2 ASP A 91 -27.022 -14.621 19.748 1.00 54.50 O ATOM 0 H ASP A 91 -31.183 -11.861 19.739 1.00 14.35 H new ATOM 0 HA ASP A 91 -28.686 -10.854 19.792 1.00 43.24 H new ATOM 0 HB2 ASP A 91 -27.728 -12.148 21.463 1.00 75.14 H new ATOM 0 HB3 ASP A 91 -28.752 -13.533 21.139 1.00 75.14 H new ATOM 1488 N SER A 92 -30.222 -13.126 18.083 1.00 41.21 N ATOM 1489 CA SER A 92 -30.401 -13.697 16.753 1.00 34.24 C ATOM 1490 C SER A 92 -30.510 -12.599 15.700 1.00 10.32 C ATOM 1491 O SER A 92 -29.860 -12.659 14.657 1.00 74.23 O ATOM 1492 CB SER A 92 -31.651 -14.578 16.718 1.00 34.44 C ATOM 1493 OG SER A 92 -31.506 -15.633 15.783 1.00 52.44 O ATOM 0 H SER A 92 -30.978 -13.333 18.736 1.00 41.21 H new ATOM 0 HA SER A 92 -29.527 -14.308 16.526 1.00 34.24 H new ATOM 0 HB2 SER A 92 -31.837 -14.990 17.710 1.00 34.44 H new ATOM 0 HB3 SER A 92 -32.519 -13.973 16.456 1.00 34.44 H new ATOM 0 HG SER A 92 -32.318 -16.182 15.781 1.00 52.44 H new ATOM 1499 N GLN A 93 -31.336 -11.596 15.983 1.00 61.54 N ATOM 1500 CA GLN A 93 -31.531 -10.485 15.060 1.00 43.53 C ATOM 1501 C GLN A 93 -30.294 -9.593 15.013 1.00 52.11 C ATOM 1502 O GLN A 93 -29.935 -9.067 13.959 1.00 43.22 O ATOM 1503 CB GLN A 93 -32.753 -9.661 15.471 1.00 65.13 C ATOM 1504 CG GLN A 93 -32.726 -9.217 16.924 1.00 3.52 C ATOM 1505 CD GLN A 93 -33.458 -10.176 17.842 1.00 61.05 C ATOM 1506 OE1 GLN A 93 -32.939 -11.236 18.192 1.00 24.11 O ATOM 1507 NE2 GLN A 93 -34.671 -9.809 18.236 1.00 14.51 N ATOM 0 H GLN A 93 -31.880 -11.531 16.843 1.00 61.54 H new ATOM 0 HA GLN A 93 -31.698 -10.897 14.065 1.00 43.53 H new ATOM 0 HB2 GLN A 93 -32.819 -8.781 14.832 1.00 65.13 H new ATOM 0 HB3 GLN A 93 -33.653 -10.250 15.296 1.00 65.13 H new ATOM 0 HG2 GLN A 93 -31.691 -9.125 17.252 1.00 3.52 H new ATOM 0 HG3 GLN A 93 -33.176 -8.227 17.006 1.00 3.52 H new ATOM 0 HE21 GLN A 93 -35.063 -8.921 17.921 1.00 14.51 H new ATOM 0 HE22 GLN A 93 -35.212 -10.415 18.853 1.00 14.51 H new ATOM 1516 N LEU A 94 -29.647 -9.427 16.161 1.00 12.31 N ATOM 1517 CA LEU A 94 -28.450 -8.598 16.252 1.00 51.13 C ATOM 1518 C LEU A 94 -27.368 -9.099 15.301 1.00 42.34 C ATOM 1519 O LEU A 94 -26.786 -8.322 14.544 1.00 1.22 O ATOM 1520 CB LEU A 94 -27.920 -8.589 17.686 1.00 3.45 C ATOM 1521 CG LEU A 94 -28.650 -7.669 18.666 1.00 21.10 C ATOM 1522 CD1 LEU A 94 -28.276 -8.012 20.100 1.00 74.22 C ATOM 1523 CD2 LEU A 94 -28.335 -6.211 18.365 1.00 24.11 C ATOM 0 H LEU A 94 -29.931 -9.855 17.042 1.00 12.31 H new ATOM 0 HA LEU A 94 -28.719 -7.582 15.964 1.00 51.13 H new ATOM 0 HB2 LEU A 94 -27.962 -9.607 18.074 1.00 3.45 H new ATOM 0 HB3 LEU A 94 -26.869 -8.300 17.662 1.00 3.45 H new ATOM 0 HG LEU A 94 -29.723 -7.820 18.546 1.00 21.10 H new ATOM 0 HD11 LEU A 94 -28.805 -7.347 20.783 1.00 74.22 H new ATOM 0 HD12 LEU A 94 -28.553 -9.045 20.311 1.00 74.22 H new ATOM 0 HD13 LEU A 94 -27.201 -7.890 20.235 1.00 74.22 H new ATOM 0 HD21 LEU A 94 -28.863 -5.571 19.072 1.00 24.11 H new ATOM 0 HD22 LEU A 94 -27.262 -6.044 18.456 1.00 24.11 H new ATOM 0 HD23 LEU A 94 -28.654 -5.972 17.351 1.00 24.11 H new ATOM 1535 N GLN A 95 -27.106 -10.401 15.344 1.00 43.01 N ATOM 1536 CA GLN A 95 -26.094 -11.005 14.485 1.00 74.05 C ATOM 1537 C GLN A 95 -26.504 -10.918 13.018 1.00 43.21 C ATOM 1538 O GLN A 95 -25.658 -10.775 12.135 1.00 32.02 O ATOM 1539 CB GLN A 95 -25.868 -12.466 14.877 1.00 21.00 C ATOM 1540 CG GLN A 95 -25.734 -12.680 16.376 1.00 14.52 C ATOM 1541 CD GLN A 95 -24.339 -13.112 16.782 1.00 13.12 C ATOM 1542 OE1 GLN A 95 -23.611 -13.717 15.995 1.00 5.51 O ATOM 1543 NE2 GLN A 95 -23.959 -12.803 18.017 1.00 73.34 N ATOM 0 H GLN A 95 -27.580 -11.058 15.964 1.00 43.01 H new ATOM 0 HA GLN A 95 -25.164 -10.452 14.618 1.00 74.05 H new ATOM 0 HB2 GLN A 95 -26.699 -13.066 14.506 1.00 21.00 H new ATOM 0 HB3 GLN A 95 -24.967 -12.830 14.384 1.00 21.00 H new ATOM 0 HG2 GLN A 95 -25.990 -11.756 16.895 1.00 14.52 H new ATOM 0 HG3 GLN A 95 -26.452 -13.435 16.697 1.00 14.52 H new ATOM 0 HE21 GLN A 95 -24.595 -12.300 18.636 1.00 73.34 H new ATOM 0 HE22 GLN A 95 -23.031 -13.068 18.346 1.00 73.34 H new ATOM 1552 N MET A 96 -27.806 -11.005 12.766 1.00 64.02 N ATOM 1553 CA MET A 96 -28.327 -10.935 11.406 1.00 64.04 C ATOM 1554 C MET A 96 -27.952 -9.611 10.747 1.00 24.13 C ATOM 1555 O MET A 96 -27.667 -9.560 9.550 1.00 72.11 O ATOM 1556 CB MET A 96 -29.847 -11.103 11.410 1.00 72.23 C ATOM 1557 CG MET A 96 -30.552 -10.283 10.342 1.00 73.25 C ATOM 1558 SD MET A 96 -32.348 -10.343 10.493 1.00 50.14 S ATOM 1559 CE MET A 96 -32.608 -9.242 11.882 1.00 63.25 C ATOM 0 H MET A 96 -28.519 -11.124 13.485 1.00 64.02 H new ATOM 0 HA MET A 96 -27.880 -11.746 10.831 1.00 64.04 H new ATOM 0 HB2 MET A 96 -30.088 -12.156 11.266 1.00 72.23 H new ATOM 0 HB3 MET A 96 -30.233 -10.818 12.389 1.00 72.23 H new ATOM 0 HG2 MET A 96 -30.220 -9.247 10.407 1.00 73.25 H new ATOM 0 HG3 MET A 96 -30.262 -10.649 9.357 1.00 73.25 H new ATOM 0 HE1 MET A 96 -33.049 -9.798 12.709 1.00 63.25 H new ATOM 0 HE2 MET A 96 -31.653 -8.820 12.196 1.00 63.25 H new ATOM 0 HE3 MET A 96 -33.281 -8.437 11.587 1.00 63.25 H new ATOM 1569 N LEU A 97 -27.953 -8.542 11.536 1.00 73.11 N ATOM 1570 CA LEU A 97 -27.613 -7.217 11.029 1.00 13.02 C ATOM 1571 C LEU A 97 -26.148 -7.154 10.611 1.00 41.53 C ATOM 1572 O LEU A 97 -25.814 -6.607 9.559 1.00 72.52 O ATOM 1573 CB LEU A 97 -27.898 -6.154 12.092 1.00 34.40 C ATOM 1574 CG LEU A 97 -29.373 -5.893 12.402 1.00 61.44 C ATOM 1575 CD1 LEU A 97 -29.513 -4.801 13.450 1.00 41.52 C ATOM 1576 CD2 LEU A 97 -30.126 -5.518 11.133 1.00 22.35 C ATOM 0 H LEU A 97 -28.185 -8.567 12.529 1.00 73.11 H new ATOM 0 HA LEU A 97 -28.231 -7.021 10.153 1.00 13.02 H new ATOM 0 HB2 LEU A 97 -27.400 -6.450 13.015 1.00 34.40 H new ATOM 0 HB3 LEU A 97 -27.444 -5.217 11.771 1.00 34.40 H new ATOM 0 HG LEU A 97 -29.808 -6.809 12.802 1.00 61.44 H new ATOM 0 HD11 LEU A 97 -30.569 -4.629 13.658 1.00 41.52 H new ATOM 0 HD12 LEU A 97 -29.009 -5.109 14.366 1.00 41.52 H new ATOM 0 HD13 LEU A 97 -29.062 -3.881 13.079 1.00 41.52 H new ATOM 0 HD21 LEU A 97 -31.174 -5.336 11.372 1.00 22.35 H new ATOM 0 HD22 LEU A 97 -29.690 -4.616 10.704 1.00 22.35 H new ATOM 0 HD23 LEU A 97 -30.055 -6.333 10.413 1.00 22.35 H new ATOM 1588 N LYS A 98 -25.276 -7.717 11.440 1.00 72.41 N ATOM 1589 CA LYS A 98 -23.846 -7.729 11.156 1.00 51.15 C ATOM 1590 C LYS A 98 -23.567 -8.356 9.793 1.00 33.14 C ATOM 1591 O LYS A 98 -22.676 -7.916 9.068 1.00 41.25 O ATOM 1592 CB LYS A 98 -23.095 -8.496 12.246 1.00 64.33 C ATOM 1593 CG LYS A 98 -23.246 -7.890 13.630 1.00 21.53 C ATOM 1594 CD LYS A 98 -22.611 -6.512 13.708 1.00 20.23 C ATOM 1595 CE LYS A 98 -21.790 -6.348 14.978 1.00 65.02 C ATOM 1596 NZ LYS A 98 -20.363 -6.720 14.767 1.00 0.14 N ATOM 0 H LYS A 98 -25.535 -8.172 12.315 1.00 72.41 H new ATOM 0 HA LYS A 98 -23.495 -6.697 11.140 1.00 51.15 H new ATOM 0 HB2 LYS A 98 -23.454 -9.525 12.268 1.00 64.33 H new ATOM 0 HB3 LYS A 98 -22.037 -8.534 11.988 1.00 64.33 H new ATOM 0 HG2 LYS A 98 -24.304 -7.819 13.884 1.00 21.53 H new ATOM 0 HG3 LYS A 98 -22.785 -8.546 14.368 1.00 21.53 H new ATOM 0 HD2 LYS A 98 -21.973 -6.354 12.838 1.00 20.23 H new ATOM 0 HD3 LYS A 98 -23.389 -5.749 13.675 1.00 20.23 H new ATOM 0 HE2 LYS A 98 -21.849 -5.314 15.318 1.00 65.02 H new ATOM 0 HE3 LYS A 98 -22.214 -6.968 15.768 1.00 65.02 H new ATOM 0 HZ1 LYS A 98 -19.837 -6.595 15.655 1.00 0.14 H new ATOM 0 HZ2 LYS A 98 -20.304 -7.714 14.467 1.00 0.14 H new ATOM 0 HZ3 LYS A 98 -19.951 -6.111 14.031 1.00 0.14 H new ATOM 1610 N SER A 99 -24.336 -9.385 9.452 1.00 31.42 N ATOM 1611 CA SER A 99 -24.170 -10.074 8.178 1.00 62.32 C ATOM 1612 C SER A 99 -24.437 -9.129 7.010 1.00 31.14 C ATOM 1613 O SER A 99 -23.699 -9.118 6.026 1.00 72.41 O ATOM 1614 CB SER A 99 -25.109 -11.279 8.099 1.00 75.11 C ATOM 1615 OG SER A 99 -24.595 -12.376 8.834 1.00 15.25 O ATOM 0 H SER A 99 -25.080 -9.760 10.040 1.00 31.42 H new ATOM 0 HA SER A 99 -23.139 -10.421 8.113 1.00 62.32 H new ATOM 0 HB2 SER A 99 -26.090 -11.005 8.487 1.00 75.11 H new ATOM 0 HB3 SER A 99 -25.247 -11.568 7.057 1.00 75.11 H new ATOM 0 HG SER A 99 -25.215 -13.133 8.769 1.00 15.25 H new ATOM 1621 N GLU A 100 -25.498 -8.337 7.129 1.00 33.23 N ATOM 1622 CA GLU A 100 -25.864 -7.389 6.084 1.00 41.04 C ATOM 1623 C GLU A 100 -24.869 -6.233 6.026 1.00 55.14 C ATOM 1624 O GLU A 100 -24.707 -5.591 4.988 1.00 44.13 O ATOM 1625 CB GLU A 100 -27.276 -6.850 6.324 1.00 63.12 C ATOM 1626 CG GLU A 100 -28.335 -7.936 6.407 1.00 15.23 C ATOM 1627 CD GLU A 100 -28.232 -8.941 5.276 1.00 3.44 C ATOM 1628 OE1 GLU A 100 -27.456 -9.910 5.414 1.00 1.31 O ATOM 1629 OE2 GLU A 100 -28.925 -8.758 4.254 1.00 32.13 O ATOM 0 H GLU A 100 -26.119 -8.333 7.938 1.00 33.23 H new ATOM 0 HA GLU A 100 -25.841 -7.914 5.129 1.00 41.04 H new ATOM 0 HB2 GLU A 100 -27.284 -6.275 7.250 1.00 63.12 H new ATOM 0 HB3 GLU A 100 -27.535 -6.162 5.519 1.00 63.12 H new ATOM 0 HG2 GLU A 100 -28.242 -8.457 7.360 1.00 15.23 H new ATOM 0 HG3 GLU A 100 -29.323 -7.476 6.390 1.00 15.23 H new ATOM 1636 N PHE A 101 -24.207 -5.973 7.148 1.00 72.00 N ATOM 1637 CA PHE A 101 -23.230 -4.894 7.226 1.00 2.35 C ATOM 1638 C PHE A 101 -22.102 -5.107 6.221 1.00 23.34 C ATOM 1639 O PHE A 101 -21.641 -4.164 5.578 1.00 62.33 O ATOM 1640 CB PHE A 101 -22.656 -4.799 8.642 1.00 41.33 C ATOM 1641 CG PHE A 101 -23.671 -4.400 9.675 1.00 42.24 C ATOM 1642 CD1 PHE A 101 -24.996 -4.203 9.323 1.00 53.25 C ATOM 1643 CD2 PHE A 101 -23.299 -4.222 10.998 1.00 74.44 C ATOM 1644 CE1 PHE A 101 -25.932 -3.835 10.271 1.00 41.11 C ATOM 1645 CE2 PHE A 101 -24.231 -3.855 11.951 1.00 42.05 C ATOM 1646 CZ PHE A 101 -25.549 -3.662 11.587 1.00 70.03 C ATOM 0 H PHE A 101 -24.329 -6.495 8.016 1.00 72.00 H new ATOM 0 HA PHE A 101 -23.737 -3.960 6.983 1.00 2.35 H new ATOM 0 HB2 PHE A 101 -22.229 -5.763 8.918 1.00 41.33 H new ATOM 0 HB3 PHE A 101 -21.841 -4.076 8.647 1.00 41.33 H new ATOM 0 HD1 PHE A 101 -25.301 -4.339 8.296 1.00 53.25 H new ATOM 0 HD2 PHE A 101 -22.269 -4.372 11.288 1.00 74.44 H new ATOM 0 HE1 PHE A 101 -26.962 -3.683 9.983 1.00 41.11 H new ATOM 0 HE2 PHE A 101 -23.929 -3.719 12.979 1.00 42.05 H new ATOM 0 HZ PHE A 101 -26.279 -3.376 12.330 1.00 70.03 H new ATOM 1656 N LYS A 102 -21.661 -6.354 6.092 1.00 23.03 N ATOM 1657 CA LYS A 102 -20.587 -6.694 5.166 1.00 33.41 C ATOM 1658 C LYS A 102 -21.001 -6.411 3.726 1.00 53.34 C ATOM 1659 O LYS A 102 -20.206 -5.916 2.926 1.00 15.32 O ATOM 1660 CB LYS A 102 -20.204 -8.168 5.317 1.00 61.32 C ATOM 1661 CG LYS A 102 -18.808 -8.488 4.812 1.00 63.33 C ATOM 1662 CD LYS A 102 -17.747 -8.123 5.836 1.00 3.11 C ATOM 1663 CE LYS A 102 -17.866 -8.975 7.090 1.00 11.04 C ATOM 1664 NZ LYS A 102 -16.558 -9.567 7.485 1.00 0.14 N ATOM 0 H LYS A 102 -22.031 -7.146 6.617 1.00 23.03 H new ATOM 0 HA LYS A 102 -19.724 -6.074 5.406 1.00 33.41 H new ATOM 0 HB2 LYS A 102 -20.274 -8.447 6.368 1.00 61.32 H new ATOM 0 HB3 LYS A 102 -20.926 -8.780 4.776 1.00 61.32 H new ATOM 0 HG2 LYS A 102 -18.739 -9.551 4.579 1.00 63.33 H new ATOM 0 HG3 LYS A 102 -18.622 -7.945 3.885 1.00 63.33 H new ATOM 0 HD2 LYS A 102 -16.757 -8.254 5.398 1.00 3.11 H new ATOM 0 HD3 LYS A 102 -17.842 -7.070 6.100 1.00 3.11 H new ATOM 0 HE2 LYS A 102 -18.250 -8.366 7.908 1.00 11.04 H new ATOM 0 HE3 LYS A 102 -18.589 -9.773 6.920 1.00 11.04 H new ATOM 0 HZ1 LYS A 102 -16.682 -10.140 8.344 1.00 0.14 H new ATOM 0 HZ2 LYS A 102 -16.203 -10.169 6.715 1.00 0.14 H new ATOM 0 HZ3 LYS A 102 -15.875 -8.806 7.672 1.00 0.14 H new ATOM 1678 N LYS A 103 -22.250 -6.726 3.401 1.00 55.11 N ATOM 1679 CA LYS A 103 -22.772 -6.503 2.058 1.00 41.34 C ATOM 1680 C LYS A 103 -22.891 -5.011 1.761 1.00 21.11 C ATOM 1681 O LYS A 103 -22.652 -4.572 0.636 1.00 54.22 O ATOM 1682 CB LYS A 103 -24.137 -7.175 1.900 1.00 35.30 C ATOM 1683 CG LYS A 103 -24.772 -6.952 0.538 1.00 12.44 C ATOM 1684 CD LYS A 103 -26.162 -7.562 0.464 1.00 41.50 C ATOM 1685 CE LYS A 103 -27.174 -6.741 1.249 1.00 44.54 C ATOM 1686 NZ LYS A 103 -28.450 -6.572 0.501 1.00 14.20 N ATOM 0 H LYS A 103 -22.921 -7.137 4.050 1.00 55.11 H new ATOM 0 HA LYS A 103 -22.073 -6.943 1.347 1.00 41.34 H new ATOM 0 HB2 LYS A 103 -24.027 -8.246 2.069 1.00 35.30 H new ATOM 0 HB3 LYS A 103 -24.809 -6.798 2.671 1.00 35.30 H new ATOM 0 HG2 LYS A 103 -24.832 -5.883 0.334 1.00 12.44 H new ATOM 0 HG3 LYS A 103 -24.140 -7.389 -0.235 1.00 12.44 H new ATOM 0 HD2 LYS A 103 -26.476 -7.629 -0.578 1.00 41.50 H new ATOM 0 HD3 LYS A 103 -26.135 -8.579 0.855 1.00 41.50 H new ATOM 0 HE2 LYS A 103 -27.374 -7.228 2.204 1.00 44.54 H new ATOM 0 HE3 LYS A 103 -26.752 -5.761 1.473 1.00 44.54 H new ATOM 0 HZ1 LYS A 103 -29.113 -6.007 1.069 1.00 14.20 H new ATOM 0 HZ2 LYS A 103 -28.263 -6.085 -0.399 1.00 14.20 H new ATOM 0 HZ3 LYS A 103 -28.866 -7.506 0.309 1.00 14.20 H new ATOM 1700 N ILE A 104 -23.259 -4.238 2.777 1.00 35.21 N ATOM 1701 CA ILE A 104 -23.407 -2.796 2.625 1.00 60.12 C ATOM 1702 C ILE A 104 -22.059 -2.129 2.372 1.00 72.33 C ATOM 1703 O ILE A 104 -21.920 -1.310 1.463 1.00 74.34 O ATOM 1704 CB ILE A 104 -24.055 -2.162 3.870 1.00 51.13 C ATOM 1705 CG1 ILE A 104 -25.559 -2.445 3.889 1.00 43.22 C ATOM 1706 CG2 ILE A 104 -23.792 -0.664 3.899 1.00 51.34 C ATOM 1707 CD1 ILE A 104 -26.067 -2.921 5.232 1.00 41.24 C ATOM 0 H ILE A 104 -23.460 -4.586 3.714 1.00 35.21 H new ATOM 0 HA ILE A 104 -24.057 -2.634 1.765 1.00 60.12 H new ATOM 0 HB ILE A 104 -23.609 -2.607 4.760 1.00 51.13 H new ATOM 0 HG12 ILE A 104 -26.095 -1.538 3.607 1.00 43.22 H new ATOM 0 HG13 ILE A 104 -25.788 -3.198 3.135 1.00 43.22 H new ATOM 0 HG21 ILE A 104 -24.256 -0.230 4.785 1.00 51.34 H new ATOM 0 HG22 ILE A 104 -22.717 -0.484 3.927 1.00 51.34 H new ATOM 0 HG23 ILE A 104 -24.214 -0.203 3.006 1.00 51.34 H new ATOM 0 HD11 ILE A 104 -27.140 -3.102 5.172 1.00 41.24 H new ATOM 0 HD12 ILE A 104 -25.558 -3.845 5.507 1.00 41.24 H new ATOM 0 HD13 ILE A 104 -25.869 -2.160 5.986 1.00 41.24 H new ATOM 1719 N HIS A 105 -21.067 -2.487 3.181 1.00 40.31 N ATOM 1720 CA HIS A 105 -19.728 -1.925 3.043 1.00 10.23 C ATOM 1721 C HIS A 105 -19.120 -2.294 1.694 1.00 62.32 C ATOM 1722 O HIS A 105 -18.494 -1.464 1.036 1.00 22.13 O ATOM 1723 CB HIS A 105 -18.826 -2.419 4.175 1.00 40.42 C ATOM 1724 CG HIS A 105 -17.392 -2.018 4.015 1.00 24.33 C ATOM 1725 ND1 HIS A 105 -17.002 -0.755 3.623 1.00 61.20 N ATOM 1726 CD2 HIS A 105 -16.250 -2.722 4.200 1.00 73.35 C ATOM 1727 CE1 HIS A 105 -15.683 -0.700 3.571 1.00 50.01 C ATOM 1728 NE2 HIS A 105 -15.203 -1.881 3.917 1.00 44.32 N ATOM 0 H HIS A 105 -21.165 -3.163 3.938 1.00 40.31 H new ATOM 0 HA HIS A 105 -19.809 -0.839 3.100 1.00 10.23 H new ATOM 0 HB2 HIS A 105 -19.200 -2.031 5.122 1.00 40.42 H new ATOM 0 HB3 HIS A 105 -18.887 -3.506 4.229 1.00 40.42 H new ATOM 0 HD1 HIS A 105 -17.633 0.016 3.407 1.00 61.20 H new ATOM 0 HD2 HIS A 105 -16.177 -3.753 4.512 1.00 73.35 H new ATOM 0 HE1 HIS A 105 -15.097 0.164 3.293 1.00 50.01 H new ATOM 1736 N ASN A 106 -19.308 -3.546 1.288 1.00 52.20 N ATOM 1737 CA ASN A 106 -18.777 -4.025 0.017 1.00 23.53 C ATOM 1738 C ASN A 106 -19.305 -3.189 -1.144 1.00 12.21 C ATOM 1739 O ASN A 106 -18.581 -2.901 -2.097 1.00 62.35 O ATOM 1740 CB ASN A 106 -19.144 -5.496 -0.190 1.00 72.13 C ATOM 1741 CG ASN A 106 -17.923 -6.391 -0.270 1.00 62.45 C ATOM 1742 OD1 ASN A 106 -17.067 -6.217 -1.138 1.00 52.33 O ATOM 1743 ND2 ASN A 106 -17.837 -7.357 0.637 1.00 62.10 N ATOM 0 H ASN A 106 -19.824 -4.247 1.821 1.00 52.20 H new ATOM 0 HA ASN A 106 -17.692 -3.928 0.046 1.00 23.53 H new ATOM 0 HB2 ASN A 106 -19.781 -5.828 0.630 1.00 72.13 H new ATOM 0 HB3 ASN A 106 -19.726 -5.597 -1.106 1.00 72.13 H new ATOM 0 HD21 ASN A 106 -17.038 -7.991 0.632 1.00 62.10 H new ATOM 0 HD22 ASN A 106 -18.570 -7.465 1.338 1.00 62.10 H new ATOM 1750 N THR A 107 -20.573 -2.800 -1.057 1.00 15.42 N ATOM 1751 CA THR A 107 -21.200 -1.997 -2.099 1.00 42.44 C ATOM 1752 C THR A 107 -20.988 -0.508 -1.849 1.00 23.02 C ATOM 1753 O THR A 107 -21.047 0.302 -2.774 1.00 70.42 O ATOM 1754 CB THR A 107 -22.711 -2.279 -2.195 1.00 20.44 C ATOM 1755 OG1 THR A 107 -23.283 -1.529 -3.272 1.00 22.21 O ATOM 1756 CG2 THR A 107 -23.412 -1.921 -0.893 1.00 24.44 C ATOM 0 H THR A 107 -21.186 -3.028 -0.275 1.00 15.42 H new ATOM 0 HA THR A 107 -20.726 -2.276 -3.040 1.00 42.44 H new ATOM 0 HB THR A 107 -22.848 -3.344 -2.382 1.00 20.44 H new ATOM 0 HG1 THR A 107 -24.244 -1.716 -3.327 1.00 22.21 H new ATOM 0 HG21 THR A 107 -24.478 -2.129 -0.985 1.00 24.44 H new ATOM 0 HG22 THR A 107 -22.995 -2.515 -0.080 1.00 24.44 H new ATOM 0 HG23 THR A 107 -23.266 -0.862 -0.680 1.00 24.44 H new ATOM 1764 N SER A 108 -20.740 -0.154 -0.592 1.00 45.40 N ATOM 1765 CA SER A 108 -20.521 1.239 -0.219 1.00 55.24 C ATOM 1766 C SER A 108 -19.094 1.452 0.275 1.00 42.23 C ATOM 1767 O SER A 108 -18.862 2.172 1.246 1.00 35.13 O ATOM 1768 CB SER A 108 -21.516 1.661 0.864 1.00 53.35 C ATOM 1769 OG SER A 108 -22.795 1.916 0.309 1.00 14.45 O ATOM 0 H SER A 108 -20.686 -0.812 0.185 1.00 45.40 H new ATOM 0 HA SER A 108 -20.675 1.855 -1.105 1.00 55.24 H new ATOM 0 HB2 SER A 108 -21.593 0.877 1.617 1.00 53.35 H new ATOM 0 HB3 SER A 108 -21.151 2.555 1.370 1.00 53.35 H new ATOM 0 HG SER A 108 -23.487 1.565 0.907 1.00 14.45 H new ATOM 1775 N ARG A 109 -18.140 0.821 -0.402 1.00 21.11 N ATOM 1776 CA ARG A 109 -16.735 0.939 -0.032 1.00 3.50 C ATOM 1777 C ARG A 109 -16.086 2.128 -0.735 1.00 42.11 C ATOM 1778 O ARG A 109 -15.564 1.999 -1.842 1.00 21.44 O ATOM 1779 CB ARG A 109 -15.983 -0.346 -0.382 1.00 20.22 C ATOM 1780 CG ARG A 109 -14.480 -0.248 -0.177 1.00 51.23 C ATOM 1781 CD ARG A 109 -13.908 -1.542 0.378 1.00 24.43 C ATOM 1782 NE ARG A 109 -12.478 -1.670 0.107 1.00 53.13 N ATOM 1783 CZ ARG A 109 -11.726 -2.658 0.578 1.00 1.21 C ATOM 1784 NH1 ARG A 109 -12.264 -3.600 1.340 1.00 11.34 N ATOM 1785 NH2 ARG A 109 -10.432 -2.705 0.287 1.00 72.32 N ATOM 0 H ARG A 109 -18.315 0.223 -1.210 1.00 21.11 H new ATOM 0 HA ARG A 109 -16.681 1.101 1.045 1.00 3.50 H new ATOM 0 HB2 ARG A 109 -16.372 -1.162 0.228 1.00 20.22 H new ATOM 0 HB3 ARG A 109 -16.183 -0.602 -1.422 1.00 20.22 H new ATOM 0 HG2 ARG A 109 -13.997 -0.013 -1.125 1.00 51.23 H new ATOM 0 HG3 ARG A 109 -14.258 0.572 0.506 1.00 51.23 H new ATOM 0 HD2 ARG A 109 -14.078 -1.581 1.454 1.00 24.43 H new ATOM 0 HD3 ARG A 109 -14.437 -2.389 -0.059 1.00 24.43 H new ATOM 0 HE ARG A 109 -12.033 -0.961 -0.476 1.00 53.13 H new ATOM 0 HH11 ARG A 109 -13.258 -3.567 1.566 1.00 11.34 H new ATOM 0 HH12 ARG A 109 -11.684 -4.358 1.700 1.00 11.34 H new ATOM 0 HH21 ARG A 109 -10.014 -1.982 -0.299 1.00 72.32 H new ATOM 0 HH22 ARG A 109 -9.855 -3.464 0.649 1.00 72.32 H new ATOM 1799 N GLY A 110 -16.123 3.287 -0.084 1.00 73.02 N ATOM 1800 CA GLY A 110 -15.536 4.482 -0.662 1.00 74.23 C ATOM 1801 C GLY A 110 -16.379 5.718 -0.419 1.00 33.15 C ATOM 1802 O GLY A 110 -15.968 6.831 -0.746 1.00 33.31 O ATOM 0 H GLY A 110 -16.549 3.420 0.833 1.00 73.02 H new ATOM 0 HA2 GLY A 110 -14.542 4.635 -0.241 1.00 74.23 H new ATOM 0 HA3 GLY A 110 -15.409 4.338 -1.735 1.00 74.23 H new ATOM 1806 N GLN A 111 -17.562 5.522 0.156 1.00 4.21 N ATOM 1807 CA GLN A 111 -18.465 6.631 0.441 1.00 60.23 C ATOM 1808 C GLN A 111 -19.069 6.497 1.835 1.00 72.34 C ATOM 1809 O GLN A 111 -18.467 5.900 2.727 1.00 74.13 O ATOM 1810 CB GLN A 111 -19.578 6.691 -0.607 1.00 0.21 C ATOM 1811 CG GLN A 111 -20.630 5.606 -0.440 1.00 43.33 C ATOM 1812 CD GLN A 111 -21.121 5.061 -1.767 1.00 1.01 C ATOM 1813 OE1 GLN A 111 -22.288 5.223 -2.124 1.00 32.12 O ATOM 1814 NE2 GLN A 111 -20.230 4.410 -2.506 1.00 52.31 N ATOM 0 H GLN A 111 -17.917 4.607 0.433 1.00 4.21 H new ATOM 0 HA GLN A 111 -17.889 7.555 0.403 1.00 60.23 H new ATOM 0 HB2 GLN A 111 -20.062 7.666 -0.555 1.00 0.21 H new ATOM 0 HB3 GLN A 111 -19.136 6.607 -1.600 1.00 0.21 H new ATOM 0 HG2 GLN A 111 -20.215 4.791 0.152 1.00 43.33 H new ATOM 0 HG3 GLN A 111 -21.475 6.008 0.119 1.00 43.33 H new ATOM 0 HE21 GLN A 111 -19.273 4.299 -2.171 1.00 52.31 H new ATOM 0 HE22 GLN A 111 -20.503 4.021 -3.409 1.00 52.31 H new ATOM 1823 N GLU A 112 -20.262 7.056 2.014 1.00 43.13 N ATOM 1824 CA GLU A 112 -20.946 6.999 3.300 1.00 1.32 C ATOM 1825 C GLU A 112 -21.628 5.648 3.495 1.00 65.13 C ATOM 1826 O GLU A 112 -22.322 5.158 2.604 1.00 33.41 O ATOM 1827 CB GLU A 112 -21.979 8.123 3.404 1.00 42.44 C ATOM 1828 CG GLU A 112 -21.487 9.454 2.859 1.00 31.11 C ATOM 1829 CD GLU A 112 -22.615 10.439 2.618 1.00 21.54 C ATOM 1830 OE1 GLU A 112 -23.534 10.504 3.461 1.00 11.45 O ATOM 1831 OE2 GLU A 112 -22.579 11.143 1.588 1.00 62.42 O ATOM 0 H GLU A 112 -20.774 7.553 1.285 1.00 43.13 H new ATOM 0 HA GLU A 112 -20.200 7.127 4.084 1.00 1.32 H new ATOM 0 HB2 GLU A 112 -22.879 7.829 2.864 1.00 42.44 H new ATOM 0 HB3 GLU A 112 -22.262 8.250 4.449 1.00 42.44 H new ATOM 0 HG2 GLU A 112 -20.774 9.888 3.560 1.00 31.11 H new ATOM 0 HG3 GLU A 112 -20.952 9.284 1.925 1.00 31.11 H new ATOM 1838 N ILE A 113 -21.423 5.052 4.664 1.00 21.33 N ATOM 1839 CA ILE A 113 -22.018 3.758 4.976 1.00 25.11 C ATOM 1840 C ILE A 113 -22.801 3.814 6.283 1.00 23.43 C ATOM 1841 O ILE A 113 -23.558 2.897 6.604 1.00 1.13 O ATOM 1842 CB ILE A 113 -20.946 2.656 5.079 1.00 53.11 C ATOM 1843 CG1 ILE A 113 -20.141 2.816 6.370 1.00 35.13 C ATOM 1844 CG2 ILE A 113 -20.027 2.696 3.867 1.00 13.22 C ATOM 1845 CD1 ILE A 113 -18.991 1.841 6.490 1.00 43.54 C ATOM 0 H ILE A 113 -20.850 5.444 5.411 1.00 21.33 H new ATOM 0 HA ILE A 113 -22.698 3.517 4.158 1.00 25.11 H new ATOM 0 HB ILE A 113 -21.444 1.687 5.101 1.00 53.11 H new ATOM 0 HG12 ILE A 113 -19.752 3.833 6.422 1.00 35.13 H new ATOM 0 HG13 ILE A 113 -20.807 2.686 7.223 1.00 35.13 H new ATOM 0 HG21 ILE A 113 -19.275 1.912 3.954 1.00 13.22 H new ATOM 0 HG22 ILE A 113 -20.612 2.538 2.961 1.00 13.22 H new ATOM 0 HG23 ILE A 113 -19.534 3.667 3.816 1.00 13.22 H new ATOM 0 HD11 ILE A 113 -18.465 2.012 7.429 1.00 43.54 H new ATOM 0 HD12 ILE A 113 -19.375 0.821 6.470 1.00 43.54 H new ATOM 0 HD13 ILE A 113 -18.303 1.986 5.657 1.00 43.54 H new ATOM 1857 N ILE A 114 -22.614 4.895 7.033 1.00 74.14 N ATOM 1858 CA ILE A 114 -23.306 5.071 8.304 1.00 42.34 C ATOM 1859 C ILE A 114 -24.815 5.151 8.102 1.00 52.22 C ATOM 1860 O ILE A 114 -25.587 4.602 8.888 1.00 14.10 O ATOM 1861 CB ILE A 114 -22.829 6.341 9.032 1.00 2.45 C ATOM 1862 CG1 ILE A 114 -21.404 6.151 9.556 1.00 63.51 C ATOM 1863 CG2 ILE A 114 -23.776 6.685 10.172 1.00 1.43 C ATOM 1864 CD1 ILE A 114 -20.424 5.707 8.493 1.00 62.45 C ATOM 0 H ILE A 114 -21.989 5.662 6.783 1.00 74.14 H new ATOM 0 HA ILE A 114 -23.070 4.200 8.916 1.00 42.34 H new ATOM 0 HB ILE A 114 -22.828 7.169 8.323 1.00 2.45 H new ATOM 0 HG12 ILE A 114 -21.057 7.089 9.990 1.00 63.51 H new ATOM 0 HG13 ILE A 114 -21.416 5.414 10.359 1.00 63.51 H new ATOM 0 HG21 ILE A 114 -23.426 7.585 10.677 1.00 1.43 H new ATOM 0 HG22 ILE A 114 -24.776 6.858 9.775 1.00 1.43 H new ATOM 0 HG23 ILE A 114 -23.806 5.859 10.882 1.00 1.43 H new ATOM 0 HD11 ILE A 114 -19.434 5.592 8.935 1.00 62.45 H new ATOM 0 HD12 ILE A 114 -20.747 4.754 8.075 1.00 62.45 H new ATOM 0 HD13 ILE A 114 -20.383 6.455 7.701 1.00 62.45 H new ATOM 1876 N PHE A 115 -25.229 5.837 7.042 1.00 55.31 N ATOM 1877 CA PHE A 115 -26.647 5.989 6.735 1.00 31.43 C ATOM 1878 C PHE A 115 -27.243 4.669 6.253 1.00 41.45 C ATOM 1879 O PHE A 115 -28.377 4.329 6.589 1.00 44.22 O ATOM 1880 CB PHE A 115 -26.848 7.071 5.673 1.00 52.21 C ATOM 1881 CG PHE A 115 -28.276 7.514 5.531 1.00 75.31 C ATOM 1882 CD1 PHE A 115 -28.870 8.304 6.501 1.00 15.25 C ATOM 1883 CD2 PHE A 115 -29.025 7.139 4.427 1.00 72.30 C ATOM 1884 CE1 PHE A 115 -30.185 8.714 6.374 1.00 65.53 C ATOM 1885 CE2 PHE A 115 -30.339 7.545 4.294 1.00 54.34 C ATOM 1886 CZ PHE A 115 -30.920 8.333 5.269 1.00 71.43 C ATOM 0 H PHE A 115 -24.603 6.297 6.381 1.00 55.31 H new ATOM 0 HA PHE A 115 -27.161 6.288 7.649 1.00 31.43 H new ATOM 0 HB2 PHE A 115 -26.232 7.934 5.924 1.00 52.21 H new ATOM 0 HB3 PHE A 115 -26.495 6.696 4.712 1.00 52.21 H new ATOM 0 HD1 PHE A 115 -28.299 8.604 7.368 1.00 15.25 H new ATOM 0 HD2 PHE A 115 -28.577 6.522 3.662 1.00 72.30 H new ATOM 0 HE1 PHE A 115 -30.636 9.331 7.137 1.00 65.53 H new ATOM 0 HE2 PHE A 115 -30.912 7.247 3.428 1.00 54.34 H new ATOM 0 HZ PHE A 115 -31.947 8.650 5.167 1.00 71.43 H new ATOM 1896 N GLU A 116 -26.470 3.932 5.462 1.00 63.14 N ATOM 1897 CA GLU A 116 -26.922 2.651 4.931 1.00 3.04 C ATOM 1898 C GLU A 116 -27.120 1.637 6.054 1.00 32.12 C ATOM 1899 O GLU A 116 -28.115 0.912 6.081 1.00 31.20 O ATOM 1900 CB GLU A 116 -25.915 2.111 3.914 1.00 45.12 C ATOM 1901 CG GLU A 116 -25.568 3.102 2.815 1.00 14.23 C ATOM 1902 CD GLU A 116 -26.711 3.316 1.841 1.00 23.40 C ATOM 1903 OE1 GLU A 116 -27.404 2.330 1.514 1.00 14.21 O ATOM 1904 OE2 GLU A 116 -26.911 4.469 1.406 1.00 44.02 O ATOM 0 H GLU A 116 -25.529 4.199 5.175 1.00 63.14 H new ATOM 0 HA GLU A 116 -27.879 2.810 4.434 1.00 3.04 H new ATOM 0 HB2 GLU A 116 -25.002 1.826 4.436 1.00 45.12 H new ATOM 0 HB3 GLU A 116 -26.319 1.206 3.461 1.00 45.12 H new ATOM 0 HG2 GLU A 116 -25.295 4.057 3.265 1.00 14.23 H new ATOM 0 HG3 GLU A 116 -24.694 2.744 2.271 1.00 14.23 H new ATOM 1911 N ILE A 117 -26.166 1.592 6.978 1.00 15.03 N ATOM 1912 CA ILE A 117 -26.236 0.668 8.103 1.00 34.13 C ATOM 1913 C ILE A 117 -27.412 1.000 9.015 1.00 13.24 C ATOM 1914 O ILE A 117 -28.101 0.107 9.510 1.00 54.21 O ATOM 1915 CB ILE A 117 -24.938 0.689 8.931 1.00 65.14 C ATOM 1916 CG1 ILE A 117 -24.599 -0.719 9.424 1.00 24.20 C ATOM 1917 CG2 ILE A 117 -25.072 1.649 10.103 1.00 20.22 C ATOM 1918 CD1 ILE A 117 -23.124 -1.049 9.344 1.00 14.12 C ATOM 0 H ILE A 117 -25.336 2.185 6.970 1.00 15.03 H new ATOM 0 HA ILE A 117 -26.374 -0.329 7.684 1.00 34.13 H new ATOM 0 HB ILE A 117 -24.124 1.036 8.294 1.00 65.14 H new ATOM 0 HG12 ILE A 117 -24.931 -0.823 10.457 1.00 24.20 H new ATOM 0 HG13 ILE A 117 -25.158 -1.446 8.835 1.00 24.20 H new ATOM 0 HG21 ILE A 117 -24.146 1.652 10.678 1.00 20.22 H new ATOM 0 HG22 ILE A 117 -25.271 2.654 9.730 1.00 20.22 H new ATOM 0 HG23 ILE A 117 -25.895 1.330 10.742 1.00 20.22 H new ATOM 0 HD11 ILE A 117 -22.957 -2.062 9.710 1.00 14.12 H new ATOM 0 HD12 ILE A 117 -22.791 -0.978 8.309 1.00 14.12 H new ATOM 0 HD13 ILE A 117 -22.560 -0.345 9.956 1.00 14.12 H new ATOM 1930 N THR A 118 -27.638 2.292 9.234 1.00 74.03 N ATOM 1931 CA THR A 118 -28.731 2.743 10.086 1.00 54.34 C ATOM 1932 C THR A 118 -30.084 2.436 9.454 1.00 71.24 C ATOM 1933 O THR A 118 -31.008 1.985 10.131 1.00 71.25 O ATOM 1934 CB THR A 118 -28.639 4.256 10.364 1.00 74.54 C ATOM 1935 OG1 THR A 118 -28.758 4.987 9.138 1.00 13.04 O ATOM 1936 CG2 THR A 118 -27.322 4.602 11.041 1.00 32.02 C ATOM 0 H THR A 118 -27.078 3.044 8.833 1.00 74.03 H new ATOM 0 HA THR A 118 -28.642 2.201 11.028 1.00 54.34 H new ATOM 0 HB THR A 118 -29.456 4.531 11.031 1.00 74.54 H new ATOM 0 HG1 THR A 118 -28.396 4.451 8.401 1.00 13.04 H new ATOM 0 HG21 THR A 118 -27.280 5.675 11.227 1.00 32.02 H new ATOM 0 HG22 THR A 118 -27.248 4.066 11.987 1.00 32.02 H new ATOM 0 HG23 THR A 118 -26.494 4.313 10.394 1.00 32.02 H new ATOM 1944 N SER A 119 -30.194 2.682 8.152 1.00 64.20 N ATOM 1945 CA SER A 119 -31.435 2.434 7.429 1.00 35.20 C ATOM 1946 C SER A 119 -31.732 0.939 7.356 1.00 53.00 C ATOM 1947 O SER A 119 -32.892 0.525 7.335 1.00 25.25 O ATOM 1948 CB SER A 119 -31.354 3.019 6.018 1.00 72.33 C ATOM 1949 OG SER A 119 -32.626 3.460 5.575 1.00 42.42 O ATOM 0 H SER A 119 -29.438 3.053 7.577 1.00 64.20 H new ATOM 0 HA SER A 119 -32.246 2.922 7.971 1.00 35.20 H new ATOM 0 HB2 SER A 119 -30.652 3.853 6.006 1.00 72.33 H new ATOM 0 HB3 SER A 119 -30.967 2.267 5.331 1.00 72.33 H new ATOM 0 HG SER A 119 -32.547 3.831 4.671 1.00 42.42 H new ATOM 1955 N PHE A 120 -30.676 0.134 7.317 1.00 61.32 N ATOM 1956 CA PHE A 120 -30.822 -1.315 7.245 1.00 64.51 C ATOM 1957 C PHE A 120 -31.181 -1.894 8.610 1.00 23.33 C ATOM 1958 O PHE A 120 -31.986 -2.821 8.713 1.00 5.13 O ATOM 1959 CB PHE A 120 -29.530 -1.954 6.731 1.00 24.34 C ATOM 1960 CG PHE A 120 -29.752 -2.965 5.642 1.00 11.35 C ATOM 1961 CD1 PHE A 120 -30.005 -4.291 5.951 1.00 23.53 C ATOM 1962 CD2 PHE A 120 -29.708 -2.588 4.310 1.00 51.51 C ATOM 1963 CE1 PHE A 120 -30.210 -5.224 4.952 1.00 53.33 C ATOM 1964 CE2 PHE A 120 -29.913 -3.515 3.306 1.00 34.11 C ATOM 1965 CZ PHE A 120 -30.163 -4.835 3.627 1.00 35.03 C ATOM 0 H PHE A 120 -29.710 0.460 7.334 1.00 61.32 H new ATOM 0 HA PHE A 120 -31.632 -1.540 6.551 1.00 64.51 H new ATOM 0 HB2 PHE A 120 -28.870 -1.171 6.359 1.00 24.34 H new ATOM 0 HB3 PHE A 120 -29.016 -2.435 7.563 1.00 24.34 H new ATOM 0 HD1 PHE A 120 -30.043 -4.600 6.985 1.00 23.53 H new ATOM 0 HD2 PHE A 120 -29.511 -1.558 4.053 1.00 51.51 H new ATOM 0 HE1 PHE A 120 -30.407 -6.255 5.207 1.00 53.33 H new ATOM 0 HE2 PHE A 120 -29.878 -3.208 2.271 1.00 34.11 H new ATOM 0 HZ PHE A 120 -30.321 -5.562 2.844 1.00 35.03 H new ATOM 1975 N THR A 121 -30.577 -1.342 9.658 1.00 13.32 N ATOM 1976 CA THR A 121 -30.831 -1.803 11.017 1.00 1.12 C ATOM 1977 C THR A 121 -32.222 -1.394 11.486 1.00 14.40 C ATOM 1978 O THR A 121 -32.931 -2.180 12.113 1.00 14.13 O ATOM 1979 CB THR A 121 -29.786 -1.248 12.003 1.00 4.21 C ATOM 1980 OG1 THR A 121 -29.557 0.142 11.744 1.00 71.11 O ATOM 1981 CG2 THR A 121 -28.475 -2.012 11.890 1.00 72.15 C ATOM 0 H THR A 121 -29.908 -0.575 9.591 1.00 13.32 H new ATOM 0 HA THR A 121 -30.762 -2.891 10.999 1.00 1.12 H new ATOM 0 HB THR A 121 -30.174 -1.370 13.014 1.00 4.21 H new ATOM 0 HG1 THR A 121 -28.785 0.241 11.148 1.00 71.11 H new ATOM 0 HG21 THR A 121 -27.753 -1.602 12.596 1.00 72.15 H new ATOM 0 HG22 THR A 121 -28.646 -3.064 12.116 1.00 72.15 H new ATOM 0 HG23 THR A 121 -28.085 -1.918 10.876 1.00 72.15 H new ATOM 1989 N GLN A 122 -32.607 -0.159 11.177 1.00 62.51 N ATOM 1990 CA GLN A 122 -33.915 0.353 11.567 1.00 2.15 C ATOM 1991 C GLN A 122 -35.030 -0.395 10.845 1.00 55.20 C ATOM 1992 O GLN A 122 -36.060 -0.715 11.438 1.00 61.42 O ATOM 1993 CB GLN A 122 -34.010 1.850 11.267 1.00 71.14 C ATOM 1994 CG GLN A 122 -33.675 2.204 9.827 1.00 72.54 C ATOM 1995 CD GLN A 122 -34.887 2.667 9.042 1.00 32.45 C ATOM 1996 OE1 GLN A 122 -35.724 3.412 9.553 1.00 20.43 O ATOM 1997 NE2 GLN A 122 -34.988 2.227 7.794 1.00 60.15 N ATOM 0 H GLN A 122 -32.032 0.504 10.658 1.00 62.51 H new ATOM 0 HA GLN A 122 -34.034 0.197 12.639 1.00 2.15 H new ATOM 0 HB2 GLN A 122 -35.020 2.194 11.492 1.00 71.14 H new ATOM 0 HB3 GLN A 122 -33.335 2.389 11.932 1.00 71.14 H new ATOM 0 HG2 GLN A 122 -32.919 2.989 9.816 1.00 72.54 H new ATOM 0 HG3 GLN A 122 -33.239 1.334 9.335 1.00 72.54 H new ATOM 0 HE21 GLN A 122 -34.271 1.611 7.411 1.00 60.15 H new ATOM 0 HE22 GLN A 122 -35.783 2.505 7.218 1.00 60.15 H new ATOM 2006 N GLU A 123 -34.818 -0.669 9.562 1.00 51.24 N ATOM 2007 CA GLU A 123 -35.807 -1.378 8.759 1.00 74.12 C ATOM 2008 C GLU A 123 -35.940 -2.828 9.215 1.00 62.21 C ATOM 2009 O GLU A 123 -37.029 -3.402 9.191 1.00 61.03 O ATOM 2010 CB GLU A 123 -35.424 -1.331 7.278 1.00 12.32 C ATOM 2011 CG GLU A 123 -34.239 -2.215 6.928 1.00 53.15 C ATOM 2012 CD GLU A 123 -33.993 -2.295 5.433 1.00 35.44 C ATOM 2013 OE1 GLU A 123 -33.973 -1.232 4.778 1.00 22.31 O ATOM 2014 OE2 GLU A 123 -33.822 -3.420 4.919 1.00 31.44 O ATOM 0 H GLU A 123 -33.971 -0.411 9.056 1.00 51.24 H new ATOM 0 HA GLU A 123 -36.769 -0.883 8.894 1.00 74.12 H new ATOM 0 HB2 GLU A 123 -36.283 -1.635 6.679 1.00 12.32 H new ATOM 0 HB3 GLU A 123 -35.192 -0.302 7.004 1.00 12.32 H new ATOM 0 HG2 GLU A 123 -33.345 -1.830 7.420 1.00 53.15 H new ATOM 0 HG3 GLU A 123 -34.411 -3.218 7.319 1.00 53.15 H new ATOM 2021 N LYS A 124 -34.823 -3.416 9.630 1.00 1.13 N ATOM 2022 CA LYS A 124 -34.812 -4.799 10.093 1.00 3.51 C ATOM 2023 C LYS A 124 -35.485 -4.922 11.456 1.00 13.41 C ATOM 2024 O LYS A 124 -36.282 -5.832 11.686 1.00 31.32 O ATOM 2025 CB LYS A 124 -33.375 -5.319 10.174 1.00 61.44 C ATOM 2026 CG LYS A 124 -33.175 -6.662 9.491 1.00 14.34 C ATOM 2027 CD LYS A 124 -33.199 -6.527 7.978 1.00 11.00 C ATOM 2028 CE LYS A 124 -34.613 -6.644 7.430 1.00 12.11 C ATOM 2029 NZ LYS A 124 -34.669 -7.510 6.220 1.00 52.32 N ATOM 0 H LYS A 124 -33.913 -2.956 9.655 1.00 1.13 H new ATOM 0 HA LYS A 124 -35.371 -5.401 9.376 1.00 3.51 H new ATOM 0 HB2 LYS A 124 -32.706 -4.587 9.721 1.00 61.44 H new ATOM 0 HB3 LYS A 124 -33.088 -5.407 11.222 1.00 61.44 H new ATOM 0 HG2 LYS A 124 -32.224 -7.092 9.804 1.00 14.34 H new ATOM 0 HG3 LYS A 124 -33.957 -7.352 9.808 1.00 14.34 H new ATOM 0 HD2 LYS A 124 -32.775 -5.565 7.691 1.00 11.00 H new ATOM 0 HD3 LYS A 124 -32.570 -7.298 7.533 1.00 11.00 H new ATOM 0 HE2 LYS A 124 -35.268 -7.052 8.200 1.00 12.11 H new ATOM 0 HE3 LYS A 124 -34.990 -5.651 7.184 1.00 12.11 H new ATOM 0 HZ1 LYS A 124 -35.649 -7.564 5.877 1.00 52.32 H new ATOM 0 HZ2 LYS A 124 -34.064 -7.107 5.476 1.00 52.32 H new ATOM 0 HZ3 LYS A 124 -34.333 -8.464 6.460 1.00 52.32 H new ATOM 2043 N LEU A 125 -35.162 -4.000 12.356 1.00 10.50 N ATOM 2044 CA LEU A 125 -35.737 -4.004 13.697 1.00 54.25 C ATOM 2045 C LEU A 125 -37.240 -3.749 13.645 1.00 54.12 C ATOM 2046 O LEU A 125 -38.011 -4.373 14.374 1.00 14.11 O ATOM 2047 CB LEU A 125 -35.059 -2.945 14.568 1.00 62.34 C ATOM 2048 CG LEU A 125 -35.858 -1.665 14.813 1.00 42.23 C ATOM 2049 CD1 LEU A 125 -37.058 -1.947 15.704 1.00 43.45 C ATOM 2050 CD2 LEU A 125 -34.972 -0.594 15.432 1.00 43.54 C ATOM 0 H LEU A 125 -34.505 -3.240 12.182 1.00 10.50 H new ATOM 0 HA LEU A 125 -35.568 -4.988 14.135 1.00 54.25 H new ATOM 0 HB2 LEU A 125 -34.824 -3.393 15.533 1.00 62.34 H new ATOM 0 HB3 LEU A 125 -34.111 -2.674 14.104 1.00 62.34 H new ATOM 0 HG LEU A 125 -36.222 -1.297 13.854 1.00 42.23 H new ATOM 0 HD11 LEU A 125 -37.615 -1.024 15.867 1.00 43.45 H new ATOM 0 HD12 LEU A 125 -37.705 -2.680 15.222 1.00 43.45 H new ATOM 0 HD13 LEU A 125 -36.716 -2.339 16.662 1.00 43.45 H new ATOM 0 HD21 LEU A 125 -35.557 0.310 15.600 1.00 43.54 H new ATOM 0 HD22 LEU A 125 -34.578 -0.953 16.383 1.00 43.54 H new ATOM 0 HD23 LEU A 125 -34.145 -0.371 14.758 1.00 43.54 H new ATOM 2062 N ASP A 126 -37.650 -2.830 12.777 1.00 23.11 N ATOM 2063 CA ASP A 126 -39.061 -2.495 12.627 1.00 10.23 C ATOM 2064 C ASP A 126 -39.854 -3.695 12.119 1.00 3.00 C ATOM 2065 O ASP A 126 -40.930 -4.002 12.631 1.00 4.44 O ATOM 2066 CB ASP A 126 -39.228 -1.315 11.669 1.00 41.32 C ATOM 2067 CG ASP A 126 -39.623 -1.754 10.273 1.00 65.25 C ATOM 2068 OD1 ASP A 126 -40.769 -2.217 10.099 1.00 51.04 O ATOM 2069 OD2 ASP A 126 -38.785 -1.636 9.354 1.00 65.21 O ATOM 0 H ASP A 126 -37.025 -2.304 12.167 1.00 23.11 H new ATOM 0 HA ASP A 126 -39.448 -2.215 13.607 1.00 10.23 H new ATOM 0 HB2 ASP A 126 -39.986 -0.637 12.061 1.00 41.32 H new ATOM 0 HB3 ASP A 126 -38.294 -0.755 11.620 1.00 41.32 H new ATOM 2074 N GLU A 127 -39.314 -4.369 11.108 1.00 54.10 N ATOM 2075 CA GLU A 127 -39.973 -5.534 10.530 1.00 72.22 C ATOM 2076 C GLU A 127 -40.031 -6.681 11.535 1.00 63.23 C ATOM 2077 O GLU A 127 -40.943 -7.507 11.499 1.00 22.41 O ATOM 2078 CB GLU A 127 -39.241 -5.986 9.265 1.00 61.34 C ATOM 2079 CG GLU A 127 -38.152 -7.013 9.526 1.00 43.02 C ATOM 2080 CD GLU A 127 -38.626 -8.436 9.304 1.00 70.04 C ATOM 2081 OE1 GLU A 127 -39.522 -8.885 10.049 1.00 71.12 O ATOM 2082 OE2 GLU A 127 -38.102 -9.100 8.386 1.00 64.43 O ATOM 0 H GLU A 127 -38.423 -4.128 10.673 1.00 54.10 H new ATOM 0 HA GLU A 127 -40.993 -5.251 10.269 1.00 72.22 H new ATOM 0 HB2 GLU A 127 -39.965 -6.406 8.567 1.00 61.34 H new ATOM 0 HB3 GLU A 127 -38.799 -5.115 8.780 1.00 61.34 H new ATOM 0 HG2 GLU A 127 -37.303 -6.811 8.873 1.00 43.02 H new ATOM 0 HG3 GLU A 127 -37.797 -6.908 10.551 1.00 43.02 H new ATOM 2089 N PHE A 128 -39.050 -6.725 12.430 1.00 64.31 N ATOM 2090 CA PHE A 128 -38.987 -7.771 13.444 1.00 24.22 C ATOM 2091 C PHE A 128 -40.213 -7.724 14.351 1.00 2.21 C ATOM 2092 O PHE A 128 -40.952 -8.701 14.463 1.00 73.12 O ATOM 2093 CB PHE A 128 -37.714 -7.624 14.280 1.00 22.14 C ATOM 2094 CG PHE A 128 -37.102 -8.937 14.676 1.00 23.35 C ATOM 2095 CD1 PHE A 128 -36.280 -9.626 13.799 1.00 25.02 C ATOM 2096 CD2 PHE A 128 -37.348 -9.483 15.926 1.00 1.21 C ATOM 2097 CE1 PHE A 128 -35.716 -10.835 14.161 1.00 43.11 C ATOM 2098 CE2 PHE A 128 -36.786 -10.691 16.294 1.00 75.25 C ATOM 2099 CZ PHE A 128 -35.968 -11.368 15.410 1.00 55.40 C ATOM 0 H PHE A 128 -38.288 -6.049 12.474 1.00 64.31 H new ATOM 0 HA PHE A 128 -38.970 -8.735 12.935 1.00 24.22 H new ATOM 0 HB2 PHE A 128 -36.982 -7.047 13.715 1.00 22.14 H new ATOM 0 HB3 PHE A 128 -37.944 -7.053 15.180 1.00 22.14 H new ATOM 0 HD1 PHE A 128 -36.078 -9.214 12.821 1.00 25.02 H new ATOM 0 HD2 PHE A 128 -37.987 -8.958 16.621 1.00 1.21 H new ATOM 0 HE1 PHE A 128 -35.078 -11.363 13.467 1.00 43.11 H new ATOM 0 HE2 PHE A 128 -36.986 -11.105 17.271 1.00 75.25 H new ATOM 0 HZ PHE A 128 -35.527 -12.312 15.695 1.00 55.40 H new