USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1034 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 117 HIS : no HD1:sc= -11.4! C(o=-16!,f=-25!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -169:sc= -1.91! (180deg=-2.57!) USER MOD Set 1.3: A 132 GLN :FLIP amide:sc= -2.28 F(o=-17,f=-16) USER MOD Set 2.1: A 42 CYS SG : rot 180:sc= 0.699 USER MOD Set 2.2: A 69 CYS SG : rot -134:sc= 0.122 USER MOD Set 2.3: A 72 CYS SG : rot 116:sc= -0.74 USER MOD Single : A 8 THR OG1 : rot 34:sc= 0.437 USER MOD Single : A 11 GLN : amide:sc= -0.986 X(o=-0.99,f=-0.91) USER MOD Single : A 14 GLN : amide:sc= -6.41! C(o=-6.4!,f=-10!) USER MOD Single : A 15 SER OG : rot 160:sc= 0 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.614 F(o=-2!,f=-0.61) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -30:sc= 0.525 USER MOD Single : A 41 SER OG : rot -114:sc= 0.661 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -1.94 F(o=-3.2!,f=-1.9) USER MOD Single : A 51 ASN : amide:sc= -1.14 X(o=-1.1,f=-0.7) USER MOD Single : A 53 SER OG : rot 180:sc= -2.07! USER MOD Single : A 55 TYR OH : rot 180:sc= -0.0274 USER MOD Single : A 57 ASN : amide:sc= -4.96! C(o=-5!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -134:sc=-0.00924 (180deg=-0.197) USER MOD Single : A 73 GLN : amide:sc= -5.9! C(o=-5.9!,f=-10!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN :FLIP amide:sc= -10.2! C(o=-11!,f=-10!) USER MOD Single : A 81 GLN : amide:sc= -0.327 X(o=-0.33,f=-0.12) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 86 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.18) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0117 USER MOD Single : A 89 HIS : no HD1:sc= -0.219 K(o=-0.22,f=-0.77) USER MOD Single : A 91 CYS SG : rot 122:sc= -3.75! USER MOD Single : A 96 GLN : amide:sc= -0.314 X(o=-0.31,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -79:sc= -0.612! USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 111 MET CE :methyl 165:sc= -16.3! (180deg=-17.8!) USER MOD Single : A 112 SER OG : rot -104:sc= 0.126 USER MOD Single : A 115 HIS : no HD1:sc= -0.282 X(o=-0.28,f=-0.055) USER MOD Single : A 121 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0121) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0718 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -54:sc= -0.6! USER MOD Single : A 133 GLN : amide:sc= -0.098 K(o=-0.098,f=-1) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 7.315 15.247 17.862 1.00 0.00 N ATOM 119 CA THR A 8 6.353 16.347 17.886 1.00 0.00 C ATOM 120 C THR A 8 7.096 17.652 18.124 1.00 0.00 C ATOM 121 O THR A 8 6.876 18.339 19.120 1.00 0.00 O ATOM 122 CB THR A 8 5.420 16.040 19.058 1.00 0.00 C ATOM 123 OG1 THR A 8 4.961 14.700 18.960 1.00 0.00 O ATOM 124 CG2 THR A 8 4.225 16.994 19.032 1.00 0.00 C ATOM 0 HA THR A 8 5.800 16.445 16.952 1.00 0.00 H new ATOM 0 HB THR A 8 5.963 16.171 19.994 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.667 14.140 18.576 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.563 16.771 19.869 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.578 18.022 19.112 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.681 16.870 18.096 1.00 0.00 H new ATOM 132 N ASP A 9 7.948 18.030 17.203 1.00 0.00 N ATOM 133 CA ASP A 9 8.676 19.328 17.357 1.00 0.00 C ATOM 134 C ASP A 9 7.637 20.417 17.592 1.00 0.00 C ATOM 135 O ASP A 9 7.899 21.429 18.236 1.00 0.00 O ATOM 136 CB ASP A 9 9.417 19.556 16.036 1.00 0.00 C ATOM 137 CG ASP A 9 8.443 19.429 14.862 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.802 20.416 14.538 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.354 18.346 14.306 1.00 0.00 O ATOM 0 H ASP A 9 8.170 17.502 16.359 1.00 0.00 H new ATOM 0 HA ASP A 9 9.379 19.332 18.190 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.877 20.544 16.033 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.223 18.830 15.931 1.00 0.00 H new ATOM 144 N ASP A 10 6.437 20.198 17.109 1.00 0.00 N ATOM 145 CA ASP A 10 5.357 21.159 17.324 1.00 0.00 C ATOM 146 C ASP A 10 5.180 21.362 18.824 1.00 0.00 C ATOM 147 O ASP A 10 5.084 22.491 19.310 1.00 0.00 O ATOM 148 CB ASP A 10 4.146 20.476 16.704 1.00 0.00 C ATOM 149 CG ASP A 10 4.173 20.669 15.187 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.212 21.810 14.757 1.00 0.00 O ATOM 151 OD2 ASP A 10 4.155 19.674 14.482 1.00 0.00 O ATOM 0 H ASP A 10 6.175 19.374 16.568 1.00 0.00 H new ATOM 0 HA ASP A 10 5.532 22.143 16.889 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.151 19.413 16.946 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.228 20.893 17.118 1.00 0.00 H new ATOM 156 N GLN A 11 5.177 20.300 19.588 1.00 0.00 N ATOM 157 CA GLN A 11 5.048 20.507 21.048 1.00 0.00 C ATOM 158 C GLN A 11 6.400 20.880 21.620 1.00 0.00 C ATOM 159 O GLN A 11 6.478 21.659 22.563 1.00 0.00 O ATOM 160 CB GLN A 11 4.551 19.226 21.677 1.00 0.00 C ATOM 161 CG GLN A 11 4.399 19.501 23.169 1.00 0.00 C ATOM 162 CD GLN A 11 2.946 19.270 23.592 1.00 0.00 C ATOM 163 OE1 GLN A 11 2.678 18.518 24.527 1.00 0.00 O ATOM 164 NE2 GLN A 11 1.988 19.881 22.951 1.00 0.00 N ATOM 0 H GLN A 11 5.256 19.333 19.273 1.00 0.00 H new ATOM 0 HA GLN A 11 4.342 21.311 21.257 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.599 18.924 21.240 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.254 18.411 21.503 1.00 0.00 H new ATOM 0 HG2 GLN A 11 5.061 18.849 23.738 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.694 20.527 23.391 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.210 20.505 22.175 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.017 19.735 23.226 1.00 0.00 H new ATOM 173 N ARG A 12 7.479 20.391 21.055 1.00 0.00 N ATOM 174 CA ARG A 12 8.794 20.816 21.570 1.00 0.00 C ATOM 175 C ARG A 12 8.746 22.330 21.547 1.00 0.00 C ATOM 176 O ARG A 12 9.123 23.014 22.494 1.00 0.00 O ATOM 177 CB ARG A 12 9.816 20.289 20.569 1.00 0.00 C ATOM 178 CG ARG A 12 9.856 18.752 20.567 1.00 0.00 C ATOM 179 CD ARG A 12 9.548 18.181 21.958 1.00 0.00 C ATOM 180 NE ARG A 12 9.579 16.699 21.779 1.00 0.00 N ATOM 181 CZ ARG A 12 9.062 15.903 22.685 1.00 0.00 C ATOM 182 NH1 ARG A 12 8.509 16.391 23.766 1.00 0.00 N ATOM 183 NH2 ARG A 12 9.101 14.611 22.507 1.00 0.00 N ATOM 0 H ARG A 12 7.496 19.731 20.277 1.00 0.00 H new ATOM 0 HA ARG A 12 9.042 20.458 22.569 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.569 20.650 19.570 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.803 20.680 20.814 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.133 18.369 19.847 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.840 18.413 20.243 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.286 18.506 22.691 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.574 18.516 22.316 1.00 0.00 H new ATOM 0 HE ARG A 12 10.007 16.301 20.943 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.477 17.400 23.911 1.00 0.00 H new ATOM 0 HH12 ARG A 12 8.110 15.762 24.463 1.00 0.00 H new ATOM 0 HH21 ARG A 12 9.532 14.225 21.667 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.701 13.987 23.208 1.00 0.00 H new ATOM 197 N TRP A 13 8.195 22.850 20.482 1.00 0.00 N ATOM 198 CA TRP A 13 8.020 24.306 20.375 1.00 0.00 C ATOM 199 C TRP A 13 7.108 24.760 21.502 1.00 0.00 C ATOM 200 O TRP A 13 7.354 25.779 22.143 1.00 0.00 O ATOM 201 CB TRP A 13 7.331 24.551 19.037 1.00 0.00 C ATOM 202 CG TRP A 13 7.248 26.023 18.829 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.131 26.707 18.495 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.305 27.005 18.974 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.440 28.053 18.427 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.770 28.286 18.716 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.665 26.904 19.300 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.559 29.433 18.787 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.464 28.050 19.368 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.917 29.313 19.117 1.00 0.00 C ATOM 0 H TRP A 13 7.860 22.314 19.681 1.00 0.00 H new ATOM 0 HA TRP A 13 8.966 24.844 20.439 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.891 24.082 18.228 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.335 24.108 19.034 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.159 26.274 18.312 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.768 28.784 18.192 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.098 25.935 19.500 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.129 30.404 18.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.511 27.959 19.616 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.539 30.194 19.177 1.00 0.00 H new ATOM 221 N GLN A 14 6.072 24.003 21.797 1.00 0.00 N ATOM 222 CA GLN A 14 5.197 24.412 22.924 1.00 0.00 C ATOM 223 C GLN A 14 6.069 24.446 24.178 1.00 0.00 C ATOM 224 O GLN A 14 5.914 25.297 25.043 1.00 0.00 O ATOM 225 CB GLN A 14 4.097 23.340 23.016 1.00 0.00 C ATOM 226 CG GLN A 14 3.222 23.608 24.245 1.00 0.00 C ATOM 227 CD GLN A 14 3.884 23.018 25.491 1.00 0.00 C ATOM 228 OE1 GLN A 14 4.303 23.749 26.384 1.00 0.00 O ATOM 229 NE2 GLN A 14 4.002 21.727 25.598 1.00 0.00 N ATOM 0 H GLN A 14 5.807 23.144 21.315 1.00 0.00 H new ATOM 0 HA GLN A 14 4.737 25.392 22.799 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.487 23.352 22.113 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.545 22.349 23.085 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.077 24.681 24.373 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.235 23.168 24.103 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.654 21.120 24.856 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.443 21.322 26.424 1.00 0.00 H new ATOM 238 N SER A 15 7.025 23.557 24.249 1.00 0.00 N ATOM 239 CA SER A 15 7.963 23.545 25.398 1.00 0.00 C ATOM 240 C SER A 15 8.858 24.773 25.304 1.00 0.00 C ATOM 241 O SER A 15 9.287 25.352 26.307 1.00 0.00 O ATOM 242 CB SER A 15 8.788 22.265 25.233 1.00 0.00 C ATOM 243 OG SER A 15 8.424 21.341 26.250 1.00 0.00 O ATOM 0 H SER A 15 7.193 22.833 23.550 1.00 0.00 H new ATOM 0 HA SER A 15 7.458 23.566 26.364 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.613 21.829 24.249 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.852 22.493 25.296 1.00 0.00 H new ATOM 0 HG SER A 15 8.688 20.437 25.980 1.00 0.00 H new ATOM 249 N VAL A 16 9.145 25.176 24.100 1.00 0.00 N ATOM 250 CA VAL A 16 10.027 26.348 23.896 1.00 0.00 C ATOM 251 C VAL A 16 9.329 27.637 24.229 1.00 0.00 C ATOM 252 O VAL A 16 9.924 28.598 24.715 1.00 0.00 O ATOM 253 CB VAL A 16 10.407 26.318 22.418 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.364 27.455 22.125 1.00 0.00 C ATOM 255 CG2 VAL A 16 11.093 25.004 22.074 1.00 0.00 C ATOM 0 H VAL A 16 8.802 24.739 23.245 1.00 0.00 H new ATOM 0 HA VAL A 16 10.898 26.298 24.550 1.00 0.00 H new ATOM 0 HB VAL A 16 9.501 26.419 21.821 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.638 27.437 21.070 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.883 28.405 22.359 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.260 27.342 22.735 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.358 24.998 21.017 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.996 24.897 22.675 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.417 24.175 22.284 1.00 0.00 H new ATOM 265 N LEU A 17 8.095 27.673 23.963 1.00 0.00 N ATOM 266 CA LEU A 17 7.310 28.879 24.232 1.00 0.00 C ATOM 267 C LEU A 17 6.766 28.802 25.646 1.00 0.00 C ATOM 268 O LEU A 17 6.611 29.802 26.345 1.00 0.00 O ATOM 269 CB LEU A 17 6.206 28.786 23.205 1.00 0.00 C ATOM 270 CG LEU A 17 6.776 28.648 21.778 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.860 29.378 20.813 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.192 29.242 21.654 1.00 0.00 C ATOM 0 H LEU A 17 7.569 26.899 23.557 1.00 0.00 H new ATOM 0 HA LEU A 17 7.863 29.816 24.163 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.570 27.930 23.429 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.577 29.674 23.263 1.00 0.00 H new ATOM 0 HG LEU A 17 6.836 27.585 21.546 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.252 29.288 19.800 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.863 28.940 20.856 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.806 30.431 21.089 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.549 29.120 20.631 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.165 30.302 21.905 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.865 28.724 22.337 1.00 0.00 H new ATOM 284 N ALA A 18 6.499 27.612 26.073 1.00 0.00 N ATOM 285 CA ALA A 18 5.984 27.403 27.453 1.00 0.00 C ATOM 286 C ALA A 18 7.138 27.473 28.456 1.00 0.00 C ATOM 287 O ALA A 18 6.919 27.517 29.660 1.00 0.00 O ATOM 288 CB ALA A 18 5.363 26.008 27.463 1.00 0.00 C ATOM 0 H ALA A 18 6.615 26.761 25.523 1.00 0.00 H new ATOM 0 HA ALA A 18 5.257 28.166 27.732 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.965 25.794 28.455 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.557 25.963 26.731 1.00 0.00 H new ATOM 0 HB3 ALA A 18 6.124 25.269 27.210 1.00 0.00 H new ATOM 294 N ARG A 19 8.361 27.454 27.975 1.00 0.00 N ATOM 295 CA ARG A 19 9.548 27.500 28.881 1.00 0.00 C ATOM 296 C ARG A 19 9.537 26.306 29.814 1.00 0.00 C ATOM 297 O ARG A 19 9.875 26.395 30.991 1.00 0.00 O ATOM 298 CB ARG A 19 9.505 28.863 29.615 1.00 0.00 C ATOM 299 CG ARG A 19 8.618 28.830 30.870 1.00 0.00 C ATOM 300 CD ARG A 19 9.326 29.568 32.011 1.00 0.00 C ATOM 301 NE ARG A 19 10.374 28.624 32.497 1.00 0.00 N ATOM 302 CZ ARG A 19 11.111 28.928 33.538 1.00 0.00 C ATOM 303 NH1 ARG A 19 10.941 30.063 34.168 1.00 0.00 N ATOM 304 NH2 ARG A 19 12.023 28.091 33.950 1.00 0.00 N ATOM 0 H ARG A 19 8.586 27.408 26.981 1.00 0.00 H new ATOM 0 HA ARG A 19 10.488 27.430 28.333 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.517 29.152 29.897 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.134 29.628 28.932 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.656 29.297 30.661 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.416 27.799 31.159 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.768 30.501 31.662 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.627 29.825 32.807 1.00 0.00 H new ATOM 0 HE ARG A 19 10.518 27.736 32.016 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.230 30.721 33.850 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.520 30.289 34.977 1.00 0.00 H new ATOM 0 HH21 ARG A 19 12.160 27.205 33.463 1.00 0.00 H new ATOM 0 HH22 ARG A 19 12.599 28.322 34.759 1.00 0.00 H new ATOM 318 N ASP A 20 9.189 25.174 29.279 1.00 0.00 N ATOM 319 CA ASP A 20 9.180 23.939 30.092 1.00 0.00 C ATOM 320 C ASP A 20 10.621 23.577 30.466 1.00 0.00 C ATOM 321 O ASP A 20 11.402 23.167 29.610 1.00 0.00 O ATOM 322 CB ASP A 20 8.569 22.870 29.184 1.00 0.00 C ATOM 323 CG ASP A 20 8.327 21.589 29.985 1.00 0.00 C ATOM 324 OD1 ASP A 20 8.178 21.684 31.192 1.00 0.00 O ATOM 325 OD2 ASP A 20 8.292 20.532 29.376 1.00 0.00 O ATOM 0 H ASP A 20 8.909 25.053 28.306 1.00 0.00 H new ATOM 0 HA ASP A 20 8.616 24.042 31.019 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.630 23.230 28.763 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.236 22.666 28.347 1.00 0.00 H new ATOM 330 N PRO A 21 10.937 23.722 31.727 1.00 0.00 N ATOM 331 CA PRO A 21 12.300 23.393 32.221 1.00 0.00 C ATOM 332 C PRO A 21 12.535 21.881 32.136 1.00 0.00 C ATOM 333 O PRO A 21 13.536 21.362 32.624 1.00 0.00 O ATOM 334 CB PRO A 21 12.290 23.871 33.671 1.00 0.00 C ATOM 335 CG PRO A 21 10.850 23.855 34.063 1.00 0.00 C ATOM 336 CD PRO A 21 10.069 24.190 32.820 1.00 0.00 C ATOM 0 HA PRO A 21 13.096 23.860 31.640 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.882 23.214 34.309 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.714 24.871 33.762 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.563 22.877 34.450 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.654 24.581 34.853 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.102 23.687 32.807 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.873 25.260 32.746 1.00 0.00 H new ATOM 344 N ASN A 22 11.610 21.165 31.551 1.00 0.00 N ATOM 345 CA ASN A 22 11.732 19.704 31.449 1.00 0.00 C ATOM 346 C ASN A 22 12.190 19.336 30.054 1.00 0.00 C ATOM 347 O ASN A 22 12.614 18.214 29.785 1.00 0.00 O ATOM 348 CB ASN A 22 10.302 19.273 31.662 1.00 0.00 C ATOM 349 CG ASN A 22 10.170 17.791 31.383 1.00 0.00 C ATOM 350 OD1 ASN A 22 10.114 17.412 30.145 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 10.116 16.969 32.296 1.00 0.00 N flip ATOM 0 H ASN A 22 10.763 21.552 31.135 1.00 0.00 H new ATOM 0 HA ASN A 22 12.441 19.251 32.141 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.995 19.489 32.685 1.00 0.00 H new ATOM 0 HB3 ASN A 22 9.640 19.837 31.005 1.00 0.00 H new ATOM 0 HD21 ASN A 22 10.161 17.281 33.266 1.00 0.00 H new ATOM 0 HD22 ASN A 22 10.026 15.976 32.083 1.00 0.00 H new ATOM 358 N ALA A 23 12.163 20.286 29.182 1.00 0.00 N ATOM 359 CA ALA A 23 12.653 20.032 27.812 1.00 0.00 C ATOM 360 C ALA A 23 13.956 20.781 27.622 1.00 0.00 C ATOM 361 O ALA A 23 14.644 20.653 26.605 1.00 0.00 O ATOM 362 CB ALA A 23 11.611 20.606 26.872 1.00 0.00 C ATOM 0 H ALA A 23 11.822 21.231 29.357 1.00 0.00 H new ATOM 0 HA ALA A 23 12.814 18.970 27.627 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.924 20.445 25.840 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.655 20.111 27.043 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.504 21.675 27.056 1.00 0.00 H new ATOM 368 N ASP A 24 14.307 21.557 28.600 1.00 0.00 N ATOM 369 CA ASP A 24 15.554 22.325 28.531 1.00 0.00 C ATOM 370 C ASP A 24 16.671 21.362 28.891 1.00 0.00 C ATOM 371 O ASP A 24 16.582 20.666 29.877 1.00 0.00 O ATOM 372 CB ASP A 24 15.358 23.419 29.589 1.00 0.00 C ATOM 373 CG ASP A 24 16.295 24.588 29.323 1.00 0.00 C ATOM 374 OD1 ASP A 24 17.004 24.530 28.346 1.00 0.00 O ATOM 375 OD2 ASP A 24 16.281 25.527 30.102 1.00 0.00 O ATOM 0 H ASP A 24 13.768 21.688 29.456 1.00 0.00 H new ATOM 0 HA ASP A 24 15.795 22.767 27.564 1.00 0.00 H new ATOM 0 HB2 ASP A 24 14.324 23.764 29.578 1.00 0.00 H new ATOM 0 HB3 ASP A 24 15.547 23.012 30.582 1.00 0.00 H new ATOM 380 N GLY A 25 17.680 21.256 28.083 1.00 0.00 N ATOM 381 CA GLY A 25 18.764 20.249 28.363 1.00 0.00 C ATOM 382 C GLY A 25 18.489 19.050 27.443 1.00 0.00 C ATOM 383 O GLY A 25 19.390 18.296 27.080 1.00 0.00 O ATOM 0 H GLY A 25 17.813 21.815 27.240 1.00 0.00 H new ATOM 0 HA2 GLY A 25 19.749 20.673 28.165 1.00 0.00 H new ATOM 0 HA3 GLY A 25 18.752 19.946 29.410 1.00 0.00 H new ATOM 387 N GLU A 26 17.243 18.881 27.048 1.00 0.00 N ATOM 388 CA GLU A 26 16.870 17.771 26.144 1.00 0.00 C ATOM 389 C GLU A 26 16.979 18.223 24.679 1.00 0.00 C ATOM 390 O GLU A 26 17.588 17.548 23.857 1.00 0.00 O ATOM 391 CB GLU A 26 15.422 17.428 26.497 1.00 0.00 C ATOM 392 CG GLU A 26 15.104 16.014 26.008 1.00 0.00 C ATOM 393 CD GLU A 26 15.780 14.995 26.926 1.00 0.00 C ATOM 394 OE1 GLU A 26 15.290 14.801 28.027 1.00 0.00 O ATOM 395 OE2 GLU A 26 16.777 14.424 26.514 1.00 0.00 O ATOM 0 H GLU A 26 16.467 19.482 27.326 1.00 0.00 H new ATOM 0 HA GLU A 26 17.526 16.908 26.261 1.00 0.00 H new ATOM 0 HB2 GLU A 26 15.273 17.495 27.575 1.00 0.00 H new ATOM 0 HB3 GLU A 26 14.743 18.146 26.036 1.00 0.00 H new ATOM 0 HG2 GLU A 26 14.026 15.854 26.000 1.00 0.00 H new ATOM 0 HG3 GLU A 26 15.453 15.885 24.983 1.00 0.00 H new ATOM 402 N PHE A 27 16.408 19.359 24.337 1.00 0.00 N ATOM 403 CA PHE A 27 16.506 19.851 22.921 1.00 0.00 C ATOM 404 C PHE A 27 16.694 21.357 22.880 1.00 0.00 C ATOM 405 O PHE A 27 16.559 22.063 23.878 1.00 0.00 O ATOM 406 CB PHE A 27 15.205 19.473 22.200 1.00 0.00 C ATOM 407 CG PHE A 27 14.058 20.428 22.522 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.984 21.701 21.921 1.00 0.00 C ATOM 409 CD2 PHE A 27 13.043 20.013 23.387 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.891 22.541 22.196 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.958 20.858 23.665 1.00 0.00 C ATOM 412 CZ PHE A 27 11.881 22.113 23.069 1.00 0.00 C ATOM 0 H PHE A 27 15.883 19.961 24.971 1.00 0.00 H new ATOM 0 HA PHE A 27 17.368 19.394 22.434 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.378 19.468 21.124 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.919 18.459 22.481 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.765 22.030 21.251 1.00 0.00 H new ATOM 0 HD2 PHE A 27 13.094 19.036 23.845 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.829 23.516 21.735 1.00 0.00 H new ATOM 0 HE2 PHE A 27 11.182 20.534 24.342 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.041 22.759 23.279 1.00 0.00 H new ATOM 422 N VAL A 28 16.982 21.845 21.722 1.00 0.00 N ATOM 423 CA VAL A 28 17.166 23.304 21.525 1.00 0.00 C ATOM 424 C VAL A 28 16.286 23.732 20.384 1.00 0.00 C ATOM 425 O VAL A 28 15.690 22.908 19.700 1.00 0.00 O ATOM 426 CB VAL A 28 18.634 23.527 21.143 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.441 22.283 21.442 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.769 23.805 19.655 1.00 0.00 C ATOM 0 H VAL A 28 17.102 21.284 20.878 1.00 0.00 H new ATOM 0 HA VAL A 28 16.912 23.870 22.421 1.00 0.00 H new ATOM 0 HB VAL A 28 18.997 24.378 21.720 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.483 22.450 21.168 1.00 0.00 H new ATOM 0 HG12 VAL A 28 19.378 22.056 22.506 1.00 0.00 H new ATOM 0 HG13 VAL A 28 19.045 21.445 20.868 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.819 23.960 19.408 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.385 22.956 19.090 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.200 24.699 19.399 1.00 0.00 H new ATOM 438 N PHE A 29 16.244 24.986 20.113 1.00 0.00 N ATOM 439 CA PHE A 29 15.453 25.422 18.953 1.00 0.00 C ATOM 440 C PHE A 29 16.216 26.496 18.213 1.00 0.00 C ATOM 441 O PHE A 29 16.627 27.506 18.772 1.00 0.00 O ATOM 442 CB PHE A 29 14.079 25.842 19.469 1.00 0.00 C ATOM 443 CG PHE A 29 13.939 27.346 19.676 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.610 28.182 18.598 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.067 27.894 20.961 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.420 29.558 18.807 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.867 29.268 21.165 1.00 0.00 C ATOM 448 CZ PHE A 29 13.545 30.098 20.089 1.00 0.00 C ATOM 0 H PHE A 29 16.716 25.724 20.636 1.00 0.00 H new ATOM 0 HA PHE A 29 15.289 24.631 18.221 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.318 25.508 18.764 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.884 25.334 20.413 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.503 27.767 17.607 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.320 27.257 21.795 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.176 30.200 17.974 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.962 29.685 22.157 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.393 31.155 20.248 1.00 0.00 H new ATOM 458 N ALA A 30 16.475 26.229 16.973 1.00 0.00 N ATOM 459 CA ALA A 30 17.307 27.153 16.152 1.00 0.00 C ATOM 460 C ALA A 30 16.496 28.075 15.253 1.00 0.00 C ATOM 461 O ALA A 30 15.863 27.650 14.290 1.00 0.00 O ATOM 462 CB ALA A 30 18.168 26.232 15.291 1.00 0.00 C ATOM 0 H ALA A 30 16.144 25.399 16.481 1.00 0.00 H new ATOM 0 HA ALA A 30 17.875 27.818 16.802 1.00 0.00 H new ATOM 0 HB1 ALA A 30 18.815 26.832 14.651 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.779 25.599 15.934 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.525 25.607 14.672 1.00 0.00 H new ATOM 468 N VAL A 31 16.566 29.341 15.527 1.00 0.00 N ATOM 469 CA VAL A 31 15.873 30.338 14.682 1.00 0.00 C ATOM 470 C VAL A 31 16.863 30.759 13.584 1.00 0.00 C ATOM 471 O VAL A 31 17.861 31.434 13.854 1.00 0.00 O ATOM 472 CB VAL A 31 15.582 31.514 15.608 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.459 32.353 15.026 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.167 31.010 16.982 1.00 0.00 C ATOM 0 H VAL A 31 17.083 29.732 16.314 1.00 0.00 H new ATOM 0 HA VAL A 31 14.957 29.969 14.221 1.00 0.00 H new ATOM 0 HB VAL A 31 16.484 32.118 15.704 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.252 33.193 15.689 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.755 32.728 14.046 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.563 31.741 14.925 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.962 31.859 17.634 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.270 30.398 16.889 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.972 30.411 17.408 1.00 0.00 H new ATOM 484 N ARG A 32 16.623 30.356 12.370 1.00 0.00 N ATOM 485 CA ARG A 32 17.549 30.698 11.251 1.00 0.00 C ATOM 486 C ARG A 32 17.511 32.187 10.940 1.00 0.00 C ATOM 487 O ARG A 32 18.419 32.746 10.327 1.00 0.00 O ATOM 488 CB ARG A 32 16.955 29.964 10.068 1.00 0.00 C ATOM 489 CG ARG A 32 17.372 28.492 10.090 1.00 0.00 C ATOM 490 CD ARG A 32 16.415 27.674 9.218 1.00 0.00 C ATOM 491 NE ARG A 32 15.417 27.100 10.168 1.00 0.00 N ATOM 492 CZ ARG A 32 14.631 26.115 9.801 1.00 0.00 C ATOM 493 NH1 ARG A 32 14.706 25.617 8.592 1.00 0.00 N ATOM 494 NH2 ARG A 32 13.767 25.628 10.647 1.00 0.00 N ATOM 0 H ARG A 32 15.814 29.796 12.099 1.00 0.00 H new ATOM 0 HA ARG A 32 18.581 30.435 11.486 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.868 30.041 10.092 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.287 30.429 9.140 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.393 28.387 9.724 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.360 28.115 11.113 1.00 0.00 H new ATOM 0 HD2 ARG A 32 15.931 28.301 8.469 1.00 0.00 H new ATOM 0 HD3 ARG A 32 16.946 26.888 8.681 1.00 0.00 H new ATOM 0 HE ARG A 32 15.345 27.477 11.113 1.00 0.00 H new ATOM 0 HH11 ARG A 32 15.380 25.995 7.926 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.091 24.852 8.317 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.704 26.012 11.590 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.154 24.863 10.366 1.00 0.00 H new ATOM 508 N THR A 33 16.470 32.826 11.353 1.00 0.00 N ATOM 509 CA THR A 33 16.327 34.287 11.097 1.00 0.00 C ATOM 510 C THR A 33 17.397 35.039 11.879 1.00 0.00 C ATOM 511 O THR A 33 17.917 36.061 11.440 1.00 0.00 O ATOM 512 CB THR A 33 14.921 34.645 11.595 1.00 0.00 C ATOM 513 OG1 THR A 33 14.504 35.861 10.992 1.00 0.00 O ATOM 514 CG2 THR A 33 14.916 34.813 13.118 1.00 0.00 C ATOM 0 H THR A 33 15.697 32.401 11.865 1.00 0.00 H new ATOM 0 HA THR A 33 16.450 34.551 10.047 1.00 0.00 H new ATOM 0 HB THR A 33 14.239 33.839 11.326 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.605 36.091 11.307 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.910 35.067 13.453 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.231 33.881 13.588 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.604 35.611 13.398 1.00 0.00 H new ATOM 522 N THR A 34 17.737 34.533 13.031 1.00 0.00 N ATOM 523 CA THR A 34 18.788 35.208 13.853 1.00 0.00 C ATOM 524 C THR A 34 20.018 34.307 13.988 1.00 0.00 C ATOM 525 O THR A 34 20.978 34.645 14.675 1.00 0.00 O ATOM 526 CB THR A 34 18.153 35.453 15.224 1.00 0.00 C ATOM 527 OG1 THR A 34 19.106 36.070 16.079 1.00 0.00 O ATOM 528 CG2 THR A 34 17.704 34.129 15.837 1.00 0.00 C ATOM 0 H THR A 34 17.338 33.688 13.440 1.00 0.00 H new ATOM 0 HA THR A 34 19.120 36.139 13.394 1.00 0.00 H new ATOM 0 HB THR A 34 17.286 36.103 15.106 1.00 0.00 H new ATOM 0 HG1 THR A 34 20.008 35.784 15.824 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.254 34.314 16.812 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.972 33.655 15.183 1.00 0.00 H new ATOM 0 HG23 THR A 34 18.565 33.472 15.954 1.00 0.00 H new ATOM 536 N GLY A 35 20.008 33.168 13.348 1.00 0.00 N ATOM 537 CA GLY A 35 21.175 32.252 13.442 1.00 0.00 C ATOM 538 C GLY A 35 21.407 31.863 14.902 1.00 0.00 C ATOM 539 O GLY A 35 22.538 31.648 15.326 1.00 0.00 O ATOM 0 H GLY A 35 19.240 32.835 12.765 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.999 31.360 12.841 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.064 32.737 13.039 1.00 0.00 H new ATOM 543 N ILE A 36 20.361 31.755 15.678 1.00 0.00 N ATOM 544 CA ILE A 36 20.539 31.361 17.112 1.00 0.00 C ATOM 545 C ILE A 36 19.730 30.112 17.399 1.00 0.00 C ATOM 546 O ILE A 36 18.792 29.778 16.684 1.00 0.00 O ATOM 547 CB ILE A 36 19.952 32.501 17.962 1.00 0.00 C ATOM 548 CG1 ILE A 36 20.820 33.753 17.869 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.869 32.070 19.445 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.197 34.838 18.752 1.00 0.00 C ATOM 0 H ILE A 36 19.398 31.920 15.387 1.00 0.00 H new ATOM 0 HA ILE A 36 21.591 31.178 17.331 1.00 0.00 H new ATOM 0 HB ILE A 36 18.956 32.723 17.578 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.837 33.535 18.196 1.00 0.00 H new ATOM 0 HG13 ILE A 36 20.884 34.095 16.836 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.452 32.884 20.038 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.229 31.192 19.533 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.867 31.829 19.810 1.00 0.00 H new ATOM 0 HD11 ILE A 36 20.803 35.742 18.699 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.188 35.057 18.402 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.156 34.488 19.784 1.00 0.00 H new ATOM 562 N PHE A 37 20.027 29.472 18.478 1.00 0.00 N ATOM 563 CA PHE A 37 19.230 28.303 18.888 1.00 0.00 C ATOM 564 C PHE A 37 19.186 28.302 20.401 1.00 0.00 C ATOM 565 O PHE A 37 20.213 28.258 21.076 1.00 0.00 O ATOM 566 CB PHE A 37 19.896 27.051 18.309 1.00 0.00 C ATOM 567 CG PHE A 37 21.046 26.589 19.157 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.786 25.863 20.318 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.361 26.840 18.764 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.833 25.390 21.096 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.416 26.355 19.538 1.00 0.00 C ATOM 572 CZ PHE A 37 23.149 25.629 20.706 1.00 0.00 C ATOM 0 H PHE A 37 20.798 29.711 19.102 1.00 0.00 H new ATOM 0 HA PHE A 37 18.206 28.329 18.517 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.159 26.252 18.229 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.250 27.261 17.300 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.766 25.668 20.613 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.561 27.406 17.866 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.628 24.838 22.001 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.437 26.539 19.237 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.965 25.254 21.305 1.00 0.00 H new ATOM 596 N ARG A 39 17.155 27.258 24.258 1.00 0.00 N ATOM 597 CA ARG A 39 16.540 26.143 24.948 1.00 0.00 C ATOM 598 C ARG A 39 15.037 26.368 24.837 1.00 0.00 C ATOM 599 O ARG A 39 14.614 27.376 24.272 1.00 0.00 O ATOM 600 CB ARG A 39 17.048 26.343 26.359 1.00 0.00 C ATOM 601 CG ARG A 39 18.387 25.605 26.525 1.00 0.00 C ATOM 602 CD ARG A 39 19.134 26.095 27.781 1.00 0.00 C ATOM 603 NE ARG A 39 18.631 27.477 28.051 1.00 0.00 N ATOM 604 CZ ARG A 39 18.410 27.889 29.275 1.00 0.00 C ATOM 605 NH1 ARG A 39 18.626 27.106 30.300 1.00 0.00 N ATOM 606 NH2 ARG A 39 17.968 29.100 29.478 1.00 0.00 N ATOM 0 HA ARG A 39 16.756 25.139 24.582 1.00 0.00 H new ATOM 0 HB2 ARG A 39 17.177 27.406 26.564 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.320 25.966 27.077 1.00 0.00 H new ATOM 0 HG2 ARG A 39 18.209 24.532 26.599 1.00 0.00 H new ATOM 0 HG3 ARG A 39 19.007 25.765 25.643 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.942 25.438 28.629 1.00 0.00 H new ATOM 0 HD3 ARG A 39 20.212 26.098 27.617 1.00 0.00 H new ATOM 0 HE ARG A 39 18.457 28.109 27.270 1.00 0.00 H new ATOM 0 HH11 ARG A 39 18.972 26.158 30.153 1.00 0.00 H new ATOM 0 HH12 ARG A 39 18.448 27.444 31.246 1.00 0.00 H new ATOM 0 HH21 ARG A 39 17.797 29.720 28.686 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.794 29.427 30.428 1.00 0.00 H new ATOM 620 N PRO A 40 14.258 25.474 25.347 1.00 0.00 N ATOM 621 CA PRO A 40 12.804 25.659 25.255 1.00 0.00 C ATOM 622 C PRO A 40 12.330 26.741 26.232 1.00 0.00 C ATOM 623 O PRO A 40 11.180 27.170 26.193 1.00 0.00 O ATOM 624 CB PRO A 40 12.241 24.294 25.621 1.00 0.00 C ATOM 625 CG PRO A 40 13.303 23.638 26.444 1.00 0.00 C ATOM 626 CD PRO A 40 14.627 24.241 26.042 1.00 0.00 C ATOM 0 HA PRO A 40 12.478 25.992 24.269 1.00 0.00 H new ATOM 0 HB2 PRO A 40 11.311 24.389 26.182 1.00 0.00 H new ATOM 0 HB3 PRO A 40 12.017 23.709 24.729 1.00 0.00 H new ATOM 0 HG2 PRO A 40 13.117 23.796 27.506 1.00 0.00 H new ATOM 0 HG3 PRO A 40 13.306 22.561 26.278 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.253 24.445 26.911 1.00 0.00 H new ATOM 0 HD3 PRO A 40 15.190 23.570 25.393 1.00 0.00 H new ATOM 634 N SER A 41 13.166 27.169 27.131 1.00 0.00 N ATOM 635 CA SER A 41 12.728 28.177 28.103 1.00 0.00 C ATOM 636 C SER A 41 13.480 29.520 27.962 1.00 0.00 C ATOM 637 O SER A 41 13.641 30.246 28.941 1.00 0.00 O ATOM 638 CB SER A 41 12.956 27.489 29.444 1.00 0.00 C ATOM 639 OG SER A 41 14.332 27.560 29.792 1.00 0.00 O ATOM 0 H SER A 41 14.133 26.858 27.227 1.00 0.00 H new ATOM 0 HA SER A 41 11.689 28.476 27.963 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.351 27.965 30.215 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.639 26.448 29.388 1.00 0.00 H new ATOM 0 HG SER A 41 14.716 26.658 29.795 1.00 0.00 H new ATOM 645 N CYS A 42 13.912 29.894 26.768 1.00 0.00 N ATOM 646 CA CYS A 42 14.600 31.216 26.621 1.00 0.00 C ATOM 647 C CYS A 42 13.645 32.328 27.042 1.00 0.00 C ATOM 648 O CYS A 42 12.534 32.455 26.535 1.00 0.00 O ATOM 649 CB CYS A 42 14.947 31.413 25.151 1.00 0.00 C ATOM 650 SG CYS A 42 15.918 32.949 25.005 1.00 0.00 S ATOM 0 H CYS A 42 13.817 29.349 25.911 1.00 0.00 H new ATOM 0 HA CYS A 42 15.497 31.241 27.239 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.518 30.564 24.777 1.00 0.00 H new ATOM 0 HB3 CYS A 42 14.040 31.477 24.550 1.00 0.00 H new ATOM 0 HG CYS A 42 16.233 33.146 23.759 1.00 0.00 H new ATOM 655 N ARG A 43 14.075 33.130 27.946 1.00 0.00 N ATOM 656 CA ARG A 43 13.232 34.269 28.425 1.00 0.00 C ATOM 657 C ARG A 43 13.663 35.596 27.796 1.00 0.00 C ATOM 658 O ARG A 43 13.316 36.666 28.296 1.00 0.00 O ATOM 659 CB ARG A 43 13.359 34.306 29.961 1.00 0.00 C ATOM 660 CG ARG A 43 14.795 34.013 30.426 1.00 0.00 C ATOM 661 CD ARG A 43 15.770 35.043 29.850 1.00 0.00 C ATOM 662 NE ARG A 43 16.455 34.331 28.732 1.00 0.00 N ATOM 663 CZ ARG A 43 17.317 33.372 28.980 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.594 33.022 30.210 1.00 0.00 N ATOM 665 NH2 ARG A 43 17.904 32.760 27.988 1.00 0.00 N ATOM 0 H ARG A 43 14.989 33.058 28.392 1.00 0.00 H new ATOM 0 HA ARG A 43 12.193 34.124 28.128 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.052 35.286 30.327 1.00 0.00 H new ATOM 0 HB3 ARG A 43 12.680 33.575 30.399 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.841 34.030 31.515 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.088 33.011 30.111 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.245 35.929 29.493 1.00 0.00 H new ATOM 0 HD3 ARG A 43 16.484 35.377 30.603 1.00 0.00 H new ATOM 0 HE ARG A 43 16.252 34.591 27.767 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.138 33.496 30.990 1.00 0.00 H new ATOM 0 HH12 ARG A 43 18.266 32.275 30.389 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.692 33.027 27.027 1.00 0.00 H new ATOM 0 HH22 ARG A 43 18.575 32.014 28.174 1.00 0.00 H new ATOM 679 N ALA A 44 14.430 35.571 26.738 1.00 0.00 N ATOM 680 CA ALA A 44 14.882 36.870 26.141 1.00 0.00 C ATOM 681 C ALA A 44 13.889 37.400 25.104 1.00 0.00 C ATOM 682 O ALA A 44 13.466 38.553 25.160 1.00 0.00 O ATOM 683 CB ALA A 44 16.225 36.556 25.485 1.00 0.00 C ATOM 0 H ALA A 44 14.759 34.728 26.267 1.00 0.00 H new ATOM 0 HA ALA A 44 14.958 37.648 26.901 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.624 37.459 25.023 1.00 0.00 H new ATOM 0 HB2 ALA A 44 16.923 36.195 26.240 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.087 35.789 24.723 1.00 0.00 H new ATOM 689 N ARG A 45 13.505 36.580 24.172 1.00 0.00 N ATOM 690 CA ARG A 45 12.530 37.007 23.113 1.00 0.00 C ATOM 691 C ARG A 45 12.380 35.815 22.143 1.00 0.00 C ATOM 692 O ARG A 45 13.127 34.844 22.245 1.00 0.00 O ATOM 693 CB ARG A 45 13.169 38.251 22.445 1.00 0.00 C ATOM 694 CG ARG A 45 12.098 39.094 21.732 1.00 0.00 C ATOM 695 CD ARG A 45 11.831 40.374 22.550 1.00 0.00 C ATOM 696 NE ARG A 45 12.558 41.486 21.844 1.00 0.00 N ATOM 697 CZ ARG A 45 12.101 41.975 20.717 1.00 0.00 C ATOM 698 NH1 ARG A 45 11.004 41.506 20.180 1.00 0.00 N ATOM 699 NH2 ARG A 45 12.746 42.940 20.125 1.00 0.00 N ATOM 0 H ARG A 45 13.825 35.615 24.090 1.00 0.00 H new ATOM 0 HA ARG A 45 11.537 37.268 23.478 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.673 38.856 23.198 1.00 0.00 H new ATOM 0 HB3 ARG A 45 13.928 37.936 21.729 1.00 0.00 H new ATOM 0 HG2 ARG A 45 12.432 39.353 20.727 1.00 0.00 H new ATOM 0 HG3 ARG A 45 11.178 38.519 21.624 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.763 40.583 22.607 1.00 0.00 H new ATOM 0 HD3 ARG A 45 12.190 40.263 23.573 1.00 0.00 H new ATOM 0 HE ARG A 45 13.416 41.863 22.247 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.494 40.751 20.639 1.00 0.00 H new ATOM 0 HH12 ARG A 45 10.659 41.895 19.303 1.00 0.00 H new ATOM 0 HH21 ARG A 45 13.601 43.311 20.539 1.00 0.00 H new ATOM 0 HH22 ARG A 45 12.395 43.325 19.248 1.00 0.00 H new ATOM 713 N HIS A 46 11.424 35.817 21.241 1.00 0.00 N ATOM 714 CA HIS A 46 11.262 34.621 20.348 1.00 0.00 C ATOM 715 C HIS A 46 10.928 34.954 18.901 1.00 0.00 C ATOM 716 O HIS A 46 10.396 36.008 18.571 1.00 0.00 O ATOM 717 CB HIS A 46 10.082 33.860 20.918 1.00 0.00 C ATOM 718 CG HIS A 46 10.547 32.861 21.920 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.865 32.962 23.247 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 10.656 31.525 21.600 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 11.149 31.700 23.750 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 11.001 30.875 22.710 1.00 0.00 N flip ATOM 0 H HIS A 46 10.762 36.577 21.086 1.00 0.00 H new ATOM 0 HA HIS A 46 12.206 34.077 20.327 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.383 34.555 21.384 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.543 33.357 20.115 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.890 33.829 23.783 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.492 31.086 20.627 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.428 31.442 24.761 1.00 0.00 H new ATOM 730 N ALA A 47 11.178 33.997 18.051 1.00 0.00 N ATOM 731 CA ALA A 47 10.851 34.121 16.615 1.00 0.00 C ATOM 732 C ALA A 47 9.857 33.013 16.253 1.00 0.00 C ATOM 733 O ALA A 47 9.738 32.018 16.965 1.00 0.00 O ATOM 734 CB ALA A 47 12.171 33.926 15.875 1.00 0.00 C ATOM 0 H ALA A 47 11.609 33.109 18.307 1.00 0.00 H new ATOM 0 HA ALA A 47 10.402 35.080 16.358 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.001 34.006 14.801 1.00 0.00 H new ATOM 0 HB2 ALA A 47 12.880 34.692 16.188 1.00 0.00 H new ATOM 0 HB3 ALA A 47 12.576 32.941 16.106 1.00 0.00 H new ATOM 740 N LEU A 48 9.122 33.170 15.190 1.00 0.00 N ATOM 741 CA LEU A 48 8.124 32.140 14.817 1.00 0.00 C ATOM 742 C LEU A 48 8.759 30.750 14.678 1.00 0.00 C ATOM 743 O LEU A 48 9.972 30.606 14.540 1.00 0.00 O ATOM 744 CB LEU A 48 7.552 32.603 13.477 1.00 0.00 C ATOM 745 CG LEU A 48 6.659 33.824 13.699 1.00 0.00 C ATOM 746 CD1 LEU A 48 6.618 34.667 12.424 1.00 0.00 C ATOM 747 CD2 LEU A 48 5.243 33.361 14.050 1.00 0.00 C ATOM 0 H LEU A 48 9.172 33.972 14.562 1.00 0.00 H new ATOM 0 HA LEU A 48 7.358 32.041 15.586 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.361 32.851 12.790 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.978 31.798 13.017 1.00 0.00 H new ATOM 0 HG LEU A 48 7.060 34.423 14.516 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.981 35.537 12.583 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.626 34.996 12.173 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.217 34.069 11.605 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.605 34.230 14.209 1.00 0.00 H new ATOM 0 HD22 LEU A 48 4.843 32.762 13.232 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.271 32.761 14.959 1.00 0.00 H new ATOM 759 N ARG A 49 7.944 29.725 14.696 1.00 0.00 N ATOM 760 CA ARG A 49 8.459 28.329 14.547 1.00 0.00 C ATOM 761 C ARG A 49 9.068 28.181 13.162 1.00 0.00 C ATOM 762 O ARG A 49 9.995 27.413 12.921 1.00 0.00 O ATOM 763 CB ARG A 49 7.206 27.483 14.620 1.00 0.00 C ATOM 764 CG ARG A 49 7.573 26.047 14.999 1.00 0.00 C ATOM 765 CD ARG A 49 6.467 25.093 14.540 1.00 0.00 C ATOM 766 NE ARG A 49 6.743 24.856 13.093 1.00 0.00 N ATOM 767 CZ ARG A 49 7.789 24.159 12.716 1.00 0.00 C ATOM 768 NH1 ARG A 49 8.613 23.655 13.600 1.00 0.00 N ATOM 769 NH2 ARG A 49 8.009 23.965 11.446 1.00 0.00 N ATOM 0 H ARG A 49 6.933 29.797 14.809 1.00 0.00 H new ATOM 0 HA ARG A 49 9.210 28.059 15.290 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.518 27.899 15.356 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.691 27.495 13.659 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.521 25.770 14.537 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.709 25.969 16.078 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.489 24.161 15.105 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.480 25.532 14.688 1.00 0.00 H new ATOM 0 HE ARG A 49 6.112 25.240 12.389 1.00 0.00 H new ATOM 0 HH11 ARG A 49 8.446 23.802 14.595 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.422 23.115 13.293 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.370 24.354 10.752 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.820 23.424 11.146 1.00 0.00 H new ATOM 783 N GLU A 50 8.518 28.928 12.264 1.00 0.00 N ATOM 784 CA GLU A 50 8.946 28.947 10.849 1.00 0.00 C ATOM 785 C GLU A 50 10.457 28.838 10.705 1.00 0.00 C ATOM 786 O GLU A 50 10.988 27.890 10.130 1.00 0.00 O ATOM 787 CB GLU A 50 8.483 30.323 10.416 1.00 0.00 C ATOM 788 CG GLU A 50 8.485 30.401 8.918 1.00 0.00 C ATOM 789 CD GLU A 50 9.894 30.710 8.403 1.00 0.00 C ATOM 790 OE1 GLU A 50 10.658 29.775 8.223 1.00 0.00 O ATOM 791 OE2 GLU A 50 10.184 31.876 8.194 1.00 0.00 O ATOM 0 H GLU A 50 7.745 29.562 12.465 1.00 0.00 H new ATOM 0 HA GLU A 50 8.545 28.117 10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.482 30.519 10.800 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.140 31.087 10.832 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.136 29.458 8.498 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.792 31.174 8.586 1.00 0.00 H new ATOM 798 N ASN A 51 11.147 29.797 11.227 1.00 0.00 N ATOM 799 CA ASN A 51 12.633 29.789 11.148 1.00 0.00 C ATOM 800 C ASN A 51 13.186 29.101 12.381 1.00 0.00 C ATOM 801 O ASN A 51 14.346 29.250 12.727 1.00 0.00 O ATOM 802 CB ASN A 51 13.028 31.263 11.176 1.00 0.00 C ATOM 803 CG ASN A 51 12.586 31.947 9.883 1.00 0.00 C ATOM 804 OD1 ASN A 51 12.953 31.522 8.790 1.00 0.00 O ATOM 805 ND2 ASN A 51 11.806 32.992 9.952 1.00 0.00 N ATOM 0 H ASN A 51 10.746 30.599 11.713 1.00 0.00 H new ATOM 0 HA ASN A 51 13.008 29.272 10.264 1.00 0.00 H new ATOM 0 HB2 ASN A 51 12.568 31.755 12.033 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.107 31.357 11.296 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.500 33.457 9.097 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.503 33.343 10.860 1.00 0.00 H new ATOM 812 N VAL A 52 12.365 28.373 13.061 1.00 0.00 N ATOM 813 CA VAL A 52 12.817 27.699 14.301 1.00 0.00 C ATOM 814 C VAL A 52 12.828 26.167 14.140 1.00 0.00 C ATOM 815 O VAL A 52 11.819 25.552 13.802 1.00 0.00 O ATOM 816 CB VAL A 52 11.772 28.144 15.326 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.574 27.073 16.391 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.230 29.441 15.999 1.00 0.00 C ATOM 0 H VAL A 52 11.389 28.212 12.812 1.00 0.00 H new ATOM 0 HA VAL A 52 13.838 27.958 14.583 1.00 0.00 H new ATOM 0 HB VAL A 52 10.828 28.307 14.807 1.00 0.00 H new ATOM 0 HG11 VAL A 52 10.827 27.409 17.110 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.235 26.150 15.920 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.518 26.893 16.906 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.484 29.756 16.729 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.182 29.273 16.503 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.351 30.219 15.245 1.00 0.00 H new ATOM 828 N SER A 53 13.945 25.545 14.417 1.00 0.00 N ATOM 829 CA SER A 53 14.035 24.060 14.330 1.00 0.00 C ATOM 830 C SER A 53 14.475 23.526 15.690 1.00 0.00 C ATOM 831 O SER A 53 14.739 24.299 16.600 1.00 0.00 O ATOM 832 CB SER A 53 15.088 23.770 13.266 1.00 0.00 C ATOM 833 OG SER A 53 16.168 24.683 13.410 1.00 0.00 O ATOM 0 H SER A 53 14.807 26.010 14.703 1.00 0.00 H new ATOM 0 HA SER A 53 13.087 23.589 14.070 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.448 22.746 13.364 1.00 0.00 H new ATOM 0 HB3 SER A 53 14.651 23.861 12.272 1.00 0.00 H new ATOM 0 HG SER A 53 16.847 24.497 12.728 1.00 0.00 H new ATOM 839 N PHE A 54 14.527 22.236 15.867 1.00 0.00 N ATOM 840 CA PHE A 54 14.908 21.688 17.173 1.00 0.00 C ATOM 841 C PHE A 54 16.106 20.758 17.056 1.00 0.00 C ATOM 842 O PHE A 54 16.331 20.109 16.037 1.00 0.00 O ATOM 843 CB PHE A 54 13.669 20.934 17.604 1.00 0.00 C ATOM 844 CG PHE A 54 12.524 21.909 17.648 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.280 22.653 18.807 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.733 22.100 16.511 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.238 23.584 18.830 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.697 23.037 16.531 1.00 0.00 C ATOM 849 CZ PHE A 54 10.450 23.777 17.691 1.00 0.00 C ATOM 0 H PHE A 54 14.318 21.542 15.150 1.00 0.00 H new ATOM 0 HA PHE A 54 15.212 22.456 17.885 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.454 20.124 16.907 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.821 20.480 18.583 1.00 0.00 H new ATOM 0 HD1 PHE A 54 12.896 22.508 19.682 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.923 21.523 15.618 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.042 24.154 19.726 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.088 23.189 15.652 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.648 24.500 17.708 1.00 0.00 H new ATOM 859 N TYR A 55 16.875 20.697 18.094 1.00 0.00 N ATOM 860 CA TYR A 55 18.080 19.828 18.097 1.00 0.00 C ATOM 861 C TYR A 55 18.110 18.982 19.357 1.00 0.00 C ATOM 862 O TYR A 55 17.568 19.366 20.388 1.00 0.00 O ATOM 863 CB TYR A 55 19.258 20.798 18.112 1.00 0.00 C ATOM 864 CG TYR A 55 19.398 21.430 16.753 1.00 0.00 C ATOM 865 CD1 TYR A 55 19.449 20.614 15.625 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.478 22.821 16.619 1.00 0.00 C ATOM 867 CE1 TYR A 55 19.582 21.180 14.355 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.611 23.390 15.350 1.00 0.00 C ATOM 869 CZ TYR A 55 19.664 22.570 14.215 1.00 0.00 C ATOM 870 OH TYR A 55 19.794 23.130 12.961 1.00 0.00 O ATOM 0 H TYR A 55 16.721 21.219 18.957 1.00 0.00 H new ATOM 0 HA TYR A 55 18.100 19.152 17.242 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.102 21.567 18.869 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.175 20.271 18.377 1.00 0.00 H new ATOM 0 HD1 TYR A 55 19.386 19.541 15.733 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.437 23.453 17.494 1.00 0.00 H new ATOM 0 HE1 TYR A 55 19.622 20.546 13.482 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.673 24.463 15.244 1.00 0.00 H new ATOM 0 HH TYR A 55 19.836 24.106 13.041 1.00 0.00 H new ATOM 880 N ALA A 56 18.762 17.858 19.312 1.00 0.00 N ATOM 881 CA ALA A 56 18.858 17.025 20.532 1.00 0.00 C ATOM 882 C ALA A 56 19.758 17.755 21.519 1.00 0.00 C ATOM 883 O ALA A 56 19.502 17.790 22.717 1.00 0.00 O ATOM 884 CB ALA A 56 19.489 15.714 20.090 1.00 0.00 C ATOM 0 H ALA A 56 19.230 17.483 18.487 1.00 0.00 H new ATOM 0 HA ALA A 56 17.895 16.841 21.009 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.589 15.050 20.949 1.00 0.00 H new ATOM 0 HB2 ALA A 56 18.857 15.242 19.338 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.474 15.909 19.666 1.00 0.00 H new ATOM 890 N ASN A 57 20.810 18.355 21.030 1.00 0.00 N ATOM 891 CA ASN A 57 21.708 19.095 21.928 1.00 0.00 C ATOM 892 C ASN A 57 22.140 20.405 21.298 1.00 0.00 C ATOM 893 O ASN A 57 22.057 20.619 20.081 1.00 0.00 O ATOM 894 CB ASN A 57 22.929 18.223 22.113 1.00 0.00 C ATOM 895 CG ASN A 57 23.536 17.906 20.756 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.423 18.620 20.299 1.00 0.00 O ATOM 897 ND2 ASN A 57 23.098 16.883 20.081 1.00 0.00 N ATOM 0 H ASN A 57 21.077 18.358 20.045 1.00 0.00 H new ATOM 0 HA ASN A 57 21.207 19.320 22.869 1.00 0.00 H new ATOM 0 HB2 ASN A 57 23.661 18.732 22.741 1.00 0.00 H new ATOM 0 HB3 ASN A 57 22.656 17.301 22.626 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.492 16.670 19.165 1.00 0.00 H new ATOM 0 HD22 ASN A 57 22.360 16.294 20.468 1.00 0.00 H new ATOM 904 N ALA A 58 22.627 21.268 22.114 1.00 0.00 N ATOM 905 CA ALA A 58 23.109 22.569 21.623 1.00 0.00 C ATOM 906 C ALA A 58 24.294 22.365 20.683 1.00 0.00 C ATOM 907 O ALA A 58 24.566 23.208 19.849 1.00 0.00 O ATOM 908 CB ALA A 58 23.552 23.318 22.877 1.00 0.00 C ATOM 0 H ALA A 58 22.715 21.128 23.121 1.00 0.00 H new ATOM 0 HA ALA A 58 22.346 23.113 21.066 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.927 24.303 22.599 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.704 23.430 23.553 1.00 0.00 H new ATOM 0 HB3 ALA A 58 24.342 22.757 23.376 1.00 0.00 H new ATOM 914 N SER A 59 25.004 21.263 20.780 1.00 0.00 N ATOM 915 CA SER A 59 26.160 21.074 19.857 1.00 0.00 C ATOM 916 C SER A 59 25.637 20.812 18.454 1.00 0.00 C ATOM 917 O SER A 59 26.189 21.294 17.469 1.00 0.00 O ATOM 918 CB SER A 59 26.949 19.883 20.401 1.00 0.00 C ATOM 919 OG SER A 59 27.766 19.349 19.367 1.00 0.00 O ATOM 0 H SER A 59 24.836 20.506 21.443 1.00 0.00 H new ATOM 0 HA SER A 59 26.803 21.953 19.802 1.00 0.00 H new ATOM 0 HB2 SER A 59 27.566 20.195 21.243 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.266 19.119 20.772 1.00 0.00 H new ATOM 0 HG SER A 59 28.274 18.586 19.713 1.00 0.00 H new ATOM 925 N GLU A 60 24.553 20.094 18.342 1.00 0.00 N ATOM 926 CA GLU A 60 23.968 19.854 17.002 1.00 0.00 C ATOM 927 C GLU A 60 23.583 21.213 16.438 1.00 0.00 C ATOM 928 O GLU A 60 23.957 21.596 15.325 1.00 0.00 O ATOM 929 CB GLU A 60 22.737 18.981 17.248 1.00 0.00 C ATOM 930 CG GLU A 60 22.121 18.585 15.909 1.00 0.00 C ATOM 931 CD GLU A 60 23.172 17.898 15.032 1.00 0.00 C ATOM 932 OE1 GLU A 60 23.857 17.024 15.537 1.00 0.00 O ATOM 933 OE2 GLU A 60 23.275 18.261 13.871 1.00 0.00 O ATOM 0 H GLU A 60 24.052 19.666 19.121 1.00 0.00 H new ATOM 0 HA GLU A 60 24.640 19.363 16.298 1.00 0.00 H new ATOM 0 HB2 GLU A 60 23.016 18.090 17.810 1.00 0.00 H new ATOM 0 HB3 GLU A 60 22.008 19.523 17.850 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.277 17.915 16.072 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.734 19.469 15.402 1.00 0.00 H new ATOM 940 N ALA A 61 22.889 21.978 17.231 1.00 0.00 N ATOM 941 CA ALA A 61 22.521 23.351 16.798 1.00 0.00 C ATOM 942 C ALA A 61 23.798 24.120 16.513 1.00 0.00 C ATOM 943 O ALA A 61 23.931 24.817 15.509 1.00 0.00 O ATOM 944 CB ALA A 61 21.825 23.956 17.999 1.00 0.00 C ATOM 0 H ALA A 61 22.561 21.711 18.159 1.00 0.00 H new ATOM 0 HA ALA A 61 21.895 23.369 15.906 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.518 24.976 17.766 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.947 23.361 18.249 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.509 23.968 18.848 1.00 0.00 H new ATOM 950 N LEU A 62 24.750 23.974 17.386 1.00 0.00 N ATOM 951 CA LEU A 62 26.050 24.649 17.203 1.00 0.00 C ATOM 952 C LEU A 62 26.678 24.133 15.905 1.00 0.00 C ATOM 953 O LEU A 62 27.442 24.828 15.238 1.00 0.00 O ATOM 954 CB LEU A 62 26.861 24.221 18.431 1.00 0.00 C ATOM 955 CG LEU A 62 26.380 24.956 19.695 1.00 0.00 C ATOM 956 CD1 LEU A 62 27.016 24.311 20.928 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.771 26.433 19.654 1.00 0.00 C ATOM 0 H LEU A 62 24.677 23.406 18.230 1.00 0.00 H new ATOM 0 HA LEU A 62 25.991 25.735 17.124 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.768 23.145 18.575 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.918 24.431 18.264 1.00 0.00 H new ATOM 0 HG LEU A 62 25.294 24.882 19.741 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.677 24.829 21.825 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.723 23.263 20.982 1.00 0.00 H new ATOM 0 HD13 LEU A 62 28.101 24.381 20.856 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.419 26.928 20.559 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.856 26.521 19.591 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.318 26.905 18.782 1.00 0.00 H new ATOM 969 N ALA A 63 26.348 22.920 15.529 1.00 0.00 N ATOM 970 CA ALA A 63 26.887 22.344 14.279 1.00 0.00 C ATOM 971 C ALA A 63 26.104 22.877 13.075 1.00 0.00 C ATOM 972 O ALA A 63 26.561 22.803 11.937 1.00 0.00 O ATOM 973 CB ALA A 63 26.705 20.829 14.416 1.00 0.00 C ATOM 0 H ALA A 63 25.720 22.306 16.048 1.00 0.00 H new ATOM 0 HA ALA A 63 27.933 22.608 14.122 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.084 20.335 13.522 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.255 20.474 15.288 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.646 20.599 14.536 1.00 0.00 H new ATOM 979 N ALA A 64 24.934 23.427 13.304 1.00 0.00 N ATOM 980 CA ALA A 64 24.136 23.977 12.161 1.00 0.00 C ATOM 981 C ALA A 64 24.688 25.327 11.732 1.00 0.00 C ATOM 982 O ALA A 64 24.186 25.975 10.816 1.00 0.00 O ATOM 983 CB ALA A 64 22.695 24.124 12.662 1.00 0.00 C ATOM 0 H ALA A 64 24.501 23.518 14.223 1.00 0.00 H new ATOM 0 HA ALA A 64 24.184 23.316 11.296 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.071 24.523 11.863 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.315 23.149 12.967 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.673 24.805 13.513 1.00 0.00 H new ATOM 989 N GLY A 65 25.706 25.751 12.390 1.00 0.00 N ATOM 990 CA GLY A 65 26.328 27.063 12.064 1.00 0.00 C ATOM 991 C GLY A 65 25.564 28.183 12.776 1.00 0.00 C ATOM 992 O GLY A 65 25.412 29.283 12.248 1.00 0.00 O ATOM 0 H GLY A 65 26.150 25.244 13.156 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.373 27.068 12.373 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.313 27.227 10.986 1.00 0.00 H new ATOM 996 N PHE A 66 25.087 27.929 13.967 1.00 0.00 N ATOM 997 CA PHE A 66 24.339 28.984 14.712 1.00 0.00 C ATOM 998 C PHE A 66 25.121 29.460 15.928 1.00 0.00 C ATOM 999 O PHE A 66 26.003 28.774 16.440 1.00 0.00 O ATOM 1000 CB PHE A 66 23.033 28.338 15.185 1.00 0.00 C ATOM 1001 CG PHE A 66 22.108 28.094 14.023 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.468 27.216 13.000 1.00 0.00 C ATOM 1003 CD2 PHE A 66 20.874 28.752 13.979 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.595 26.998 11.928 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.002 28.534 12.911 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.363 27.658 11.886 1.00 0.00 C ATOM 0 H PHE A 66 25.183 27.038 14.455 1.00 0.00 H new ATOM 0 HA PHE A 66 24.167 29.847 14.068 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.249 27.396 15.688 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.545 28.984 15.915 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.419 26.705 13.035 1.00 0.00 H new ATOM 0 HD2 PHE A 66 20.596 29.430 14.773 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.873 26.321 11.134 1.00 0.00 H new ATOM 0 HE2 PHE A 66 19.050 29.042 12.878 1.00 0.00 H new ATOM 0 HZ PHE A 66 19.689 27.490 11.059 1.00 0.00 H new ATOM 1016 N ARG A 67 24.772 30.611 16.422 1.00 0.00 N ATOM 1017 CA ARG A 67 25.435 31.141 17.634 1.00 0.00 C ATOM 1018 C ARG A 67 24.513 30.855 18.817 1.00 0.00 C ATOM 1019 O ARG A 67 23.368 31.302 18.832 1.00 0.00 O ATOM 1020 CB ARG A 67 25.569 32.647 17.402 1.00 0.00 C ATOM 1021 CG ARG A 67 26.436 32.905 16.166 1.00 0.00 C ATOM 1022 CD ARG A 67 27.631 33.781 16.551 1.00 0.00 C ATOM 1023 NE ARG A 67 27.037 35.086 16.960 1.00 0.00 N ATOM 1024 CZ ARG A 67 26.544 35.908 16.066 1.00 0.00 C ATOM 1025 NH1 ARG A 67 26.563 35.602 14.793 1.00 0.00 N ATOM 1026 NH2 ARG A 67 26.029 37.045 16.448 1.00 0.00 N ATOM 0 H ARG A 67 24.047 31.212 16.031 1.00 0.00 H new ATOM 0 HA ARG A 67 26.410 30.697 17.832 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.584 33.093 17.266 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.015 33.121 18.276 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.784 31.960 15.750 1.00 0.00 H new ATOM 0 HG3 ARG A 67 25.847 33.396 15.392 1.00 0.00 H new ATOM 0 HD2 ARG A 67 28.201 33.335 17.365 1.00 0.00 H new ATOM 0 HD3 ARG A 67 28.316 33.905 15.712 1.00 0.00 H new ATOM 0 HE ARG A 67 27.014 35.342 17.947 1.00 0.00 H new ATOM 0 HH11 ARG A 67 26.965 34.716 14.488 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.176 36.250 14.107 1.00 0.00 H new ATOM 0 HH21 ARG A 67 26.012 37.290 17.438 1.00 0.00 H new ATOM 0 HH22 ARG A 67 25.644 37.688 15.757 1.00 0.00 H new ATOM 1040 N PRO A 68 25.004 30.103 19.761 1.00 0.00 N ATOM 1041 CA PRO A 68 24.172 29.745 20.928 1.00 0.00 C ATOM 1042 C PRO A 68 23.811 30.994 21.732 1.00 0.00 C ATOM 1043 O PRO A 68 24.639 31.873 21.966 1.00 0.00 O ATOM 1044 CB PRO A 68 25.038 28.753 21.701 1.00 0.00 C ATOM 1045 CG PRO A 68 26.440 29.033 21.263 1.00 0.00 C ATOM 1046 CD PRO A 68 26.356 29.539 19.847 1.00 0.00 C ATOM 0 HA PRO A 68 23.210 29.304 20.667 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.927 28.888 22.777 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.754 27.725 21.478 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.908 29.773 21.912 1.00 0.00 H new ATOM 0 HG3 PRO A 68 27.050 28.131 21.317 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.118 30.292 19.645 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.502 28.736 19.125 1.00 0.00 H new ATOM 1054 N CYS A 69 22.571 31.092 22.128 1.00 0.00 N ATOM 1055 CA CYS A 69 22.101 32.283 22.887 1.00 0.00 C ATOM 1056 C CYS A 69 22.956 32.475 24.146 1.00 0.00 C ATOM 1057 O CYS A 69 23.046 31.597 25.005 1.00 0.00 O ATOM 1058 CB CYS A 69 20.638 31.965 23.193 1.00 0.00 C ATOM 1059 SG CYS A 69 19.960 33.023 24.506 1.00 0.00 S ATOM 0 H CYS A 69 21.855 30.387 21.955 1.00 0.00 H new ATOM 0 HA CYS A 69 22.191 33.223 22.343 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.045 32.089 22.287 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.551 30.920 23.490 1.00 0.00 H new ATOM 0 HG CYS A 69 19.295 32.293 25.351 1.00 0.00 H new ATOM 1064 N LYS A 70 23.585 33.616 24.259 1.00 0.00 N ATOM 1065 CA LYS A 70 24.470 33.903 25.435 1.00 0.00 C ATOM 1066 C LYS A 70 23.678 33.945 26.740 1.00 0.00 C ATOM 1067 O LYS A 70 24.180 34.364 27.779 1.00 0.00 O ATOM 1068 CB LYS A 70 25.085 35.272 25.140 1.00 0.00 C ATOM 1069 CG LYS A 70 26.415 35.405 25.885 1.00 0.00 C ATOM 1070 CD LYS A 70 27.505 34.650 25.122 1.00 0.00 C ATOM 1071 CE LYS A 70 27.962 35.486 23.926 1.00 0.00 C ATOM 1072 NZ LYS A 70 28.919 36.476 24.494 1.00 0.00 N ATOM 0 H LYS A 70 23.524 34.373 23.579 1.00 0.00 H new ATOM 0 HA LYS A 70 25.222 33.125 25.565 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.243 35.388 24.068 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.402 36.063 25.449 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.686 36.456 25.982 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.320 35.006 26.895 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.349 34.445 25.780 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.125 33.687 24.782 1.00 0.00 H new ATOM 0 HE2 LYS A 70 28.440 34.864 23.169 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.119 35.982 23.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 28.705 37.421 24.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.832 36.488 25.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 29.890 36.211 24.231 1.00 0.00 H new ATOM 1086 N ARG A 71 22.452 33.531 26.703 1.00 0.00 N ATOM 1087 CA ARG A 71 21.616 33.544 27.923 1.00 0.00 C ATOM 1088 C ARG A 71 21.104 32.127 28.176 1.00 0.00 C ATOM 1089 O ARG A 71 20.872 31.707 29.307 1.00 0.00 O ATOM 1090 CB ARG A 71 20.464 34.450 27.541 1.00 0.00 C ATOM 1091 CG ARG A 71 19.957 35.189 28.784 1.00 0.00 C ATOM 1092 CD ARG A 71 18.694 35.981 28.444 1.00 0.00 C ATOM 1093 NE ARG A 71 19.121 37.410 28.342 1.00 0.00 N ATOM 1094 CZ ARG A 71 18.230 38.346 28.126 1.00 0.00 C ATOM 1095 NH1 ARG A 71 16.965 38.045 27.997 1.00 0.00 N ATOM 1096 NH2 ARG A 71 18.603 39.591 28.038 1.00 0.00 N ATOM 0 H ARG A 71 21.986 33.179 25.867 1.00 0.00 H new ATOM 0 HA ARG A 71 22.138 33.877 28.820 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.787 35.167 26.786 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.658 33.864 27.100 1.00 0.00 H new ATOM 0 HG2 ARG A 71 19.745 34.475 29.580 1.00 0.00 H new ATOM 0 HG3 ARG A 71 20.729 35.862 29.157 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.257 35.636 27.507 1.00 0.00 H new ATOM 0 HD3 ARG A 71 17.934 35.855 29.215 1.00 0.00 H new ATOM 0 HE ARG A 71 20.106 37.656 28.441 1.00 0.00 H new ATOM 0 HH11 ARG A 71 16.663 37.073 28.064 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.280 38.782 27.829 1.00 0.00 H new ATOM 0 HH21 ARG A 71 19.588 39.837 28.137 1.00 0.00 H new ATOM 0 HH22 ARG A 71 17.910 40.320 27.870 1.00 0.00 H new ATOM 1110 N CYS A 72 20.924 31.395 27.114 1.00 0.00 N ATOM 1111 CA CYS A 72 20.422 29.988 27.219 1.00 0.00 C ATOM 1112 C CYS A 72 21.595 29.006 27.258 1.00 0.00 C ATOM 1113 O CYS A 72 21.505 27.923 27.830 1.00 0.00 O ATOM 1114 CB CYS A 72 19.622 29.753 25.935 1.00 0.00 C ATOM 1115 SG CYS A 72 17.914 30.285 26.139 1.00 0.00 S ATOM 0 H CYS A 72 21.105 31.712 26.162 1.00 0.00 H new ATOM 0 HA CYS A 72 19.830 29.840 28.122 1.00 0.00 H new ATOM 0 HB2 CYS A 72 20.081 30.298 25.110 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.649 28.695 25.673 1.00 0.00 H new ATOM 0 HG CYS A 72 17.665 31.267 25.324 1.00 0.00 H new ATOM 1120 N GLN A 73 22.683 29.359 26.631 1.00 0.00 N ATOM 1121 CA GLN A 73 23.860 28.446 26.590 1.00 0.00 C ATOM 1122 C GLN A 73 24.679 28.510 27.894 1.00 0.00 C ATOM 1123 O GLN A 73 25.121 27.473 28.385 1.00 0.00 O ATOM 1124 CB GLN A 73 24.677 28.929 25.384 1.00 0.00 C ATOM 1125 CG GLN A 73 25.961 28.101 25.254 1.00 0.00 C ATOM 1126 CD GLN A 73 25.755 26.991 24.222 1.00 0.00 C ATOM 1127 OE1 GLN A 73 26.408 26.974 23.182 1.00 0.00 O ATOM 1128 NE2 GLN A 73 24.880 26.051 24.456 1.00 0.00 N ATOM 0 H GLN A 73 22.808 30.246 26.143 1.00 0.00 H new ATOM 0 HA GLN A 73 23.565 27.401 26.495 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.084 28.841 24.474 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.925 29.984 25.502 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.790 28.742 24.953 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.226 27.669 26.219 1.00 0.00 H new ATOM 0 HE21 GLN A 73 24.337 26.063 25.319 1.00 0.00 H new ATOM 0 HE22 GLN A 73 24.740 25.304 23.776 1.00 0.00 H new ATOM 1137 N PRO A 74 24.873 29.693 28.432 1.00 0.00 N ATOM 1138 CA PRO A 74 25.655 29.814 29.687 1.00 0.00 C ATOM 1139 C PRO A 74 24.816 29.382 30.894 1.00 0.00 C ATOM 1140 O PRO A 74 25.347 28.903 31.894 1.00 0.00 O ATOM 1141 CB PRO A 74 25.998 31.296 29.760 1.00 0.00 C ATOM 1142 CG PRO A 74 24.946 31.989 28.956 1.00 0.00 C ATOM 1143 CD PRO A 74 24.404 30.999 27.950 1.00 0.00 C ATOM 0 HA PRO A 74 26.541 29.179 29.698 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.999 31.648 30.792 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.992 31.489 29.356 1.00 0.00 H new ATOM 0 HG2 PRO A 74 24.147 32.351 29.604 1.00 0.00 H new ATOM 0 HG3 PRO A 74 25.364 32.858 28.449 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.316 31.037 27.902 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.775 31.209 26.947 1.00 0.00 H new ATOM 1151 N ASP A 75 23.520 29.534 30.824 1.00 0.00 N ATOM 1152 CA ASP A 75 22.662 29.120 31.972 1.00 0.00 C ATOM 1153 C ASP A 75 22.397 27.609 31.904 1.00 0.00 C ATOM 1154 O ASP A 75 22.873 26.925 31.000 1.00 0.00 O ATOM 1155 CB ASP A 75 21.379 29.959 31.846 1.00 0.00 C ATOM 1156 CG ASP A 75 20.285 29.193 31.099 1.00 0.00 C ATOM 1157 OD1 ASP A 75 20.621 28.368 30.266 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.125 29.449 31.374 1.00 0.00 O ATOM 0 H ASP A 75 23.020 29.925 30.025 1.00 0.00 H new ATOM 0 HA ASP A 75 23.129 29.294 32.941 1.00 0.00 H new ATOM 0 HB2 ASP A 75 21.022 30.232 32.839 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.600 30.888 31.320 1.00 0.00 H new ATOM 1163 N LYS A 76 21.686 27.066 32.858 1.00 0.00 N ATOM 1164 CA LYS A 76 21.440 25.597 32.857 1.00 0.00 C ATOM 1165 C LYS A 76 20.045 25.224 32.328 1.00 0.00 C ATOM 1166 O LYS A 76 19.040 25.854 32.649 1.00 0.00 O ATOM 1167 CB LYS A 76 21.561 25.205 34.327 1.00 0.00 C ATOM 1168 CG LYS A 76 22.977 25.509 34.830 1.00 0.00 C ATOM 1169 CD LYS A 76 22.902 26.319 36.128 1.00 0.00 C ATOM 1170 CE LYS A 76 23.851 27.518 36.041 1.00 0.00 C ATOM 1171 NZ LYS A 76 22.965 28.696 35.827 1.00 0.00 N ATOM 0 H LYS A 76 21.267 27.577 33.635 1.00 0.00 H new ATOM 0 HA LYS A 76 22.141 25.082 32.201 1.00 0.00 H new ATOM 0 HB2 LYS A 76 20.829 25.753 34.920 1.00 0.00 H new ATOM 0 HB3 LYS A 76 21.341 24.144 34.449 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.520 24.579 35.001 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.530 26.066 34.074 1.00 0.00 H new ATOM 0 HD2 LYS A 76 21.881 26.662 36.296 1.00 0.00 H new ATOM 0 HD3 LYS A 76 23.171 25.690 36.977 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.436 27.625 36.954 1.00 0.00 H new ATOM 0 HE3 LYS A 76 24.559 27.402 35.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 23.544 29.557 35.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 22.425 28.569 34.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 22.307 28.785 36.627 1.00 0.00 H new ATOM 1185 N ALA A 77 19.985 24.177 31.541 1.00 0.00 N ATOM 1186 CA ALA A 77 18.687 23.684 30.986 1.00 0.00 C ATOM 1187 C ALA A 77 18.174 22.541 31.894 1.00 0.00 C ATOM 1188 O ALA A 77 17.943 22.754 33.075 1.00 0.00 O ATOM 1189 CB ALA A 77 19.063 23.191 29.587 1.00 0.00 C ATOM 0 H ALA A 77 20.799 23.633 31.255 1.00 0.00 H new ATOM 0 HA ALA A 77 17.891 24.428 30.941 1.00 0.00 H new ATOM 0 HB1 ALA A 77 18.175 22.805 29.087 1.00 0.00 H new ATOM 0 HB2 ALA A 77 19.475 24.018 29.008 1.00 0.00 H new ATOM 0 HB3 ALA A 77 19.807 22.399 29.668 1.00 0.00 H new ATOM 1195 N ASN A 78 18.057 21.313 31.416 1.00 0.00 N ATOM 1196 CA ASN A 78 17.647 20.222 32.356 1.00 0.00 C ATOM 1197 C ASN A 78 18.712 20.104 33.438 1.00 0.00 C ATOM 1198 O ASN A 78 18.400 19.796 34.585 1.00 0.00 O ATOM 1199 CB ASN A 78 17.564 18.899 31.578 1.00 0.00 C ATOM 1200 CG ASN A 78 16.239 18.792 30.818 1.00 0.00 C ATOM 1201 OD1 ASN A 78 15.140 19.236 31.367 1.00 0.00 O flip ATOM 1202 ND2 ASN A 78 16.202 18.284 29.698 1.00 0.00 N flip ATOM 0 H ASN A 78 18.223 21.032 30.449 1.00 0.00 H new ATOM 0 HA ASN A 78 16.678 20.443 32.803 1.00 0.00 H new ATOM 0 HB2 ASN A 78 18.396 18.832 30.877 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.661 18.061 32.268 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.059 17.937 29.267 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.315 18.210 29.200 1.00 0.00 H new ATOM 1209 N PRO A 79 19.936 20.409 33.072 1.00 0.00 N ATOM 1210 CA PRO A 79 21.035 20.394 34.080 1.00 0.00 C ATOM 1211 C PRO A 79 20.700 21.435 35.166 1.00 0.00 C ATOM 1212 O PRO A 79 21.208 21.384 36.284 1.00 0.00 O ATOM 1213 CB PRO A 79 22.241 20.787 33.208 1.00 0.00 C ATOM 1214 CG PRO A 79 21.642 21.568 32.110 1.00 0.00 C ATOM 1215 CD PRO A 79 20.439 20.782 31.746 1.00 0.00 C ATOM 0 HA PRO A 79 21.205 19.459 34.614 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.965 21.377 33.770 1.00 0.00 H new ATOM 0 HB3 PRO A 79 22.767 19.909 32.834 1.00 0.00 H new ATOM 0 HG2 PRO A 79 21.381 22.577 32.430 1.00 0.00 H new ATOM 0 HG3 PRO A 79 22.327 21.668 31.268 1.00 0.00 H new ATOM 0 HD2 PRO A 79 19.716 21.372 31.182 1.00 0.00 H new ATOM 0 HD3 PRO A 79 20.684 19.911 31.138 1.00 0.00 H new ATOM 1223 N ARG A 80 19.820 22.369 34.847 1.00 0.00 N ATOM 1224 CA ARG A 80 19.407 23.395 35.834 1.00 0.00 C ATOM 1225 C ARG A 80 18.899 22.690 37.101 1.00 0.00 C ATOM 1226 O ARG A 80 19.472 22.818 38.184 1.00 0.00 O ATOM 1227 CB ARG A 80 18.272 24.177 35.183 1.00 0.00 C ATOM 1228 CG ARG A 80 18.115 25.532 35.874 1.00 0.00 C ATOM 1229 CD ARG A 80 17.170 26.411 35.051 1.00 0.00 C ATOM 1230 NE ARG A 80 16.413 27.218 36.051 1.00 0.00 N ATOM 1231 CZ ARG A 80 15.669 28.227 35.667 1.00 0.00 C ATOM 1232 NH1 ARG A 80 15.577 28.545 34.401 1.00 0.00 N ATOM 1233 NH2 ARG A 80 15.013 28.921 36.556 1.00 0.00 N ATOM 0 H ARG A 80 19.375 22.452 33.933 1.00 0.00 H new ATOM 0 HA ARG A 80 20.230 24.054 36.111 1.00 0.00 H new ATOM 0 HB2 ARG A 80 18.479 24.321 34.122 1.00 0.00 H new ATOM 0 HB3 ARG A 80 17.342 23.613 35.253 1.00 0.00 H new ATOM 0 HG2 ARG A 80 17.720 25.396 36.881 1.00 0.00 H new ATOM 0 HG3 ARG A 80 19.086 26.017 35.975 1.00 0.00 H new ATOM 0 HD2 ARG A 80 17.725 27.053 34.367 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.497 25.805 34.444 1.00 0.00 H new ATOM 0 HE ARG A 80 16.475 26.983 37.042 1.00 0.00 H new ATOM 0 HH11 ARG A 80 16.087 28.006 33.701 1.00 0.00 H new ATOM 0 HH12 ARG A 80 14.995 29.332 34.114 1.00 0.00 H new ATOM 0 HH21 ARG A 80 15.080 28.678 37.544 1.00 0.00 H new ATOM 0 HH22 ARG A 80 14.433 29.707 36.263 1.00 0.00 H new ATOM 1247 N GLN A 81 17.836 21.935 36.976 1.00 0.00 N ATOM 1248 CA GLN A 81 17.265 21.191 38.149 1.00 0.00 C ATOM 1249 C GLN A 81 18.355 20.390 38.899 1.00 0.00 C ATOM 1250 O GLN A 81 18.304 20.236 40.118 1.00 0.00 O ATOM 1251 CB GLN A 81 16.226 20.241 37.547 1.00 0.00 C ATOM 1252 CG GLN A 81 14.875 20.955 37.450 1.00 0.00 C ATOM 1253 CD GLN A 81 14.016 20.598 38.664 1.00 0.00 C ATOM 1254 OE1 GLN A 81 13.474 21.478 39.328 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.859 19.345 38.994 1.00 0.00 N ATOM 0 H GLN A 81 17.331 21.799 36.101 1.00 0.00 H new ATOM 0 HA GLN A 81 16.833 21.874 38.881 1.00 0.00 H new ATOM 0 HB2 GLN A 81 16.547 19.913 36.559 1.00 0.00 H new ATOM 0 HB3 GLN A 81 16.134 19.348 38.165 1.00 0.00 H new ATOM 0 HG2 GLN A 81 15.025 22.034 37.403 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.364 20.664 36.532 1.00 0.00 H new ATOM 0 HE21 GLN A 81 14.308 18.613 38.444 1.00 0.00 H new ATOM 0 HE22 GLN A 81 13.287 19.098 39.802 1.00 0.00 H new ATOM 1264 N HIS A 82 19.336 19.870 38.186 1.00 0.00 N ATOM 1265 CA HIS A 82 20.414 19.072 38.857 1.00 0.00 C ATOM 1266 C HIS A 82 21.274 20.011 39.725 1.00 0.00 C ATOM 1267 O HIS A 82 21.613 19.700 40.872 1.00 0.00 O ATOM 1268 CB HIS A 82 21.249 18.480 37.719 1.00 0.00 C ATOM 1269 CG HIS A 82 22.278 17.544 38.290 1.00 0.00 C ATOM 1270 ND1 HIS A 82 21.930 16.417 39.019 1.00 0.00 N ATOM 1271 CD2 HIS A 82 23.651 17.555 38.250 1.00 0.00 C ATOM 1272 CE1 HIS A 82 23.070 15.802 39.383 1.00 0.00 C ATOM 1273 NE2 HIS A 82 24.148 16.453 38.941 1.00 0.00 N ATOM 0 H HIS A 82 19.433 19.965 37.175 1.00 0.00 H new ATOM 0 HA HIS A 82 20.016 18.292 39.506 1.00 0.00 H new ATOM 0 HB2 HIS A 82 20.605 17.947 37.020 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.737 19.277 37.159 1.00 0.00 H new ATOM 0 HD2 HIS A 82 24.253 18.304 37.758 1.00 0.00 H new ATOM 0 HE1 HIS A 82 23.108 14.892 39.963 1.00 0.00 H new ATOM 0 HE2 HIS A 82 25.126 16.198 39.080 1.00 0.00 H new ATOM 1281 N ARG A 83 21.596 21.171 39.220 1.00 0.00 N ATOM 1282 CA ARG A 83 22.388 22.148 40.024 1.00 0.00 C ATOM 1283 C ARG A 83 21.523 22.646 41.191 1.00 0.00 C ATOM 1284 O ARG A 83 22.025 23.072 42.243 1.00 0.00 O ATOM 1285 CB ARG A 83 22.710 23.288 39.055 1.00 0.00 C ATOM 1286 CG ARG A 83 23.498 24.383 39.783 1.00 0.00 C ATOM 1287 CD ARG A 83 22.708 25.694 39.744 1.00 0.00 C ATOM 1288 NE ARG A 83 23.667 26.738 40.208 1.00 0.00 N ATOM 1289 CZ ARG A 83 23.416 28.011 40.011 1.00 0.00 C ATOM 1290 NH1 ARG A 83 22.321 28.391 39.405 1.00 0.00 N ATOM 1291 NH2 ARG A 83 24.268 28.908 40.425 1.00 0.00 N ATOM 0 H ARG A 83 21.344 21.486 38.283 1.00 0.00 H new ATOM 0 HA ARG A 83 23.297 21.721 40.448 1.00 0.00 H new ATOM 0 HB2 ARG A 83 23.290 22.909 38.213 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.788 23.702 38.647 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.682 24.088 40.816 1.00 0.00 H new ATOM 0 HG3 ARG A 83 24.472 24.519 39.312 1.00 0.00 H new ATOM 0 HD2 ARG A 83 22.348 25.908 38.738 1.00 0.00 H new ATOM 0 HD3 ARG A 83 21.833 25.647 40.392 1.00 0.00 H new ATOM 0 HE ARG A 83 24.526 26.460 40.683 1.00 0.00 H new ATOM 0 HH11 ARG A 83 21.650 27.695 39.079 1.00 0.00 H new ATOM 0 HH12 ARG A 83 22.138 29.384 39.258 1.00 0.00 H new ATOM 0 HH21 ARG A 83 25.124 28.618 40.899 1.00 0.00 H new ATOM 0 HH22 ARG A 83 24.079 29.899 40.275 1.00 0.00 H new ATOM 1305 N LEU A 84 20.223 22.563 41.045 1.00 0.00 N ATOM 1306 CA LEU A 84 19.343 23.002 42.140 1.00 0.00 C ATOM 1307 C LEU A 84 19.343 21.900 43.196 1.00 0.00 C ATOM 1308 O LEU A 84 19.299 22.165 44.402 1.00 0.00 O ATOM 1309 CB LEU A 84 17.960 23.164 41.537 1.00 0.00 C ATOM 1310 CG LEU A 84 17.170 24.313 42.213 1.00 0.00 C ATOM 1311 CD1 LEU A 84 18.052 25.223 43.123 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.563 25.152 41.099 1.00 0.00 C ATOM 0 H LEU A 84 19.747 22.210 40.214 1.00 0.00 H new ATOM 0 HA LEU A 84 19.664 23.937 42.600 1.00 0.00 H new ATOM 0 HB2 LEU A 84 18.050 23.363 40.469 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.406 22.231 41.641 1.00 0.00 H new ATOM 0 HG LEU A 84 16.416 23.874 42.866 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.434 26.005 43.563 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.497 24.622 43.916 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.842 25.678 42.526 1.00 0.00 H new ATOM 0 HD21 LEU A 84 15.996 25.976 41.532 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.358 25.551 40.469 1.00 0.00 H new ATOM 0 HD23 LEU A 84 15.900 24.532 40.497 1.00 0.00 H new ATOM 1324 N ASP A 85 19.472 20.667 42.771 1.00 0.00 N ATOM 1325 CA ASP A 85 19.564 19.552 43.755 1.00 0.00 C ATOM 1326 C ASP A 85 20.820 19.788 44.596 1.00 0.00 C ATOM 1327 O ASP A 85 20.846 19.578 45.814 1.00 0.00 O ATOM 1328 CB ASP A 85 19.708 18.288 42.916 1.00 0.00 C ATOM 1329 CG ASP A 85 18.324 17.713 42.613 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.445 18.487 42.272 1.00 0.00 O ATOM 1331 OD2 ASP A 85 18.165 16.509 42.728 1.00 0.00 O ATOM 0 H ASP A 85 19.517 20.389 41.791 1.00 0.00 H new ATOM 0 HA ASP A 85 18.704 19.478 44.421 1.00 0.00 H new ATOM 0 HB2 ASP A 85 20.230 18.514 41.986 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.310 17.552 43.449 1.00 0.00 H new ATOM 1336 N LYS A 86 21.853 20.272 43.959 1.00 0.00 N ATOM 1337 CA LYS A 86 23.122 20.586 44.690 1.00 0.00 C ATOM 1338 C LYS A 86 22.844 21.586 45.831 1.00 0.00 C ATOM 1339 O LYS A 86 23.257 21.386 46.979 1.00 0.00 O ATOM 1340 CB LYS A 86 24.037 21.219 43.637 1.00 0.00 C ATOM 1341 CG LYS A 86 25.477 21.255 44.159 1.00 0.00 C ATOM 1342 CD LYS A 86 26.233 22.410 43.497 1.00 0.00 C ATOM 1343 CE LYS A 86 27.593 22.585 44.177 1.00 0.00 C ATOM 1344 NZ LYS A 86 28.431 21.470 43.658 1.00 0.00 N ATOM 0 H LYS A 86 21.875 20.465 42.958 1.00 0.00 H new ATOM 0 HA LYS A 86 23.569 19.701 45.143 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.990 20.648 42.710 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.698 22.229 43.407 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.479 21.379 45.242 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.976 20.310 43.945 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.369 22.208 42.434 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.654 23.330 43.575 1.00 0.00 H new ATOM 0 HE2 LYS A 86 28.032 23.553 43.937 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.501 22.537 45.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 28.787 20.904 44.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 27.858 20.867 43.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 29.234 21.859 43.123 1.00 0.00 H new ATOM 1358 N ILE A 87 22.148 22.659 45.544 1.00 0.00 N ATOM 1359 CA ILE A 87 21.848 23.669 46.624 1.00 0.00 C ATOM 1360 C ILE A 87 21.020 23.021 47.770 1.00 0.00 C ATOM 1361 O ILE A 87 21.279 23.249 48.950 1.00 0.00 O ATOM 1362 CB ILE A 87 21.110 24.837 45.947 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.601 24.996 44.491 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.428 26.118 46.727 1.00 0.00 C ATOM 1365 CD1 ILE A 87 21.506 26.458 44.039 1.00 0.00 C ATOM 0 H ILE A 87 21.775 22.884 44.621 1.00 0.00 H new ATOM 0 HA ILE A 87 22.760 24.036 47.094 1.00 0.00 H new ATOM 0 HB ILE A 87 20.037 24.646 45.940 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.632 24.653 44.411 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.004 24.367 43.831 1.00 0.00 H new ATOM 0 HG21 ILE A 87 20.915 26.962 46.265 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.092 26.009 47.758 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.503 26.295 46.713 1.00 0.00 H new ATOM 0 HD11 ILE A 87 21.857 26.545 43.011 1.00 0.00 H new ATOM 0 HD12 ILE A 87 20.470 26.790 44.098 1.00 0.00 H new ATOM 0 HD13 ILE A 87 22.124 27.080 44.687 1.00 0.00 H new ATOM 1377 N THR A 88 20.066 22.177 47.459 1.00 0.00 N ATOM 1378 CA THR A 88 19.298 21.484 48.546 1.00 0.00 C ATOM 1379 C THR A 88 20.319 20.795 49.467 1.00 0.00 C ATOM 1380 O THR A 88 20.233 20.846 50.695 1.00 0.00 O ATOM 1381 CB THR A 88 18.414 20.452 47.841 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.668 21.091 46.814 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.455 19.822 48.853 1.00 0.00 C ATOM 0 H THR A 88 19.786 21.938 46.508 1.00 0.00 H new ATOM 0 HA THR A 88 18.687 22.159 49.145 1.00 0.00 H new ATOM 0 HB THR A 88 19.041 19.674 47.405 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.103 20.431 46.361 1.00 0.00 H new ATOM 0 HG21 THR A 88 16.826 19.087 48.350 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.028 19.331 49.640 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.827 20.598 49.291 1.00 0.00 H new ATOM 1391 N HIS A 89 21.335 20.200 48.890 1.00 0.00 N ATOM 1392 CA HIS A 89 22.399 19.582 49.735 1.00 0.00 C ATOM 1393 C HIS A 89 22.961 20.691 50.631 1.00 0.00 C ATOM 1394 O HIS A 89 23.206 20.496 51.820 1.00 0.00 O ATOM 1395 CB HIS A 89 23.464 19.078 48.758 1.00 0.00 C ATOM 1396 CG HIS A 89 24.320 18.041 49.434 1.00 0.00 C ATOM 1397 ND1 HIS A 89 24.257 17.800 50.799 1.00 0.00 N ATOM 1398 CD2 HIS A 89 25.265 17.176 48.945 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.140 16.824 51.079 1.00 0.00 C ATOM 1400 NE2 HIS A 89 25.782 16.408 49.985 1.00 0.00 N ATOM 0 H HIS A 89 21.471 20.117 47.883 1.00 0.00 H new ATOM 0 HA HIS A 89 22.045 18.764 50.362 1.00 0.00 H new ATOM 0 HB2 HIS A 89 22.989 18.652 47.874 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.082 19.909 48.418 1.00 0.00 H new ATOM 0 HD2 HIS A 89 25.563 17.102 47.910 1.00 0.00 H new ATOM 0 HE1 HIS A 89 25.309 16.426 52.069 1.00 0.00 H new ATOM 0 HE2 HIS A 89 26.497 15.683 49.924 1.00 0.00 H new ATOM 1408 N ALA A 90 23.109 21.879 50.078 1.00 0.00 N ATOM 1409 CA ALA A 90 23.588 23.041 50.891 1.00 0.00 C ATOM 1410 C ALA A 90 22.659 23.180 52.094 1.00 0.00 C ATOM 1411 O ALA A 90 23.083 23.539 53.189 1.00 0.00 O ATOM 1412 CB ALA A 90 23.479 24.286 49.983 1.00 0.00 C ATOM 0 H ALA A 90 22.917 22.089 49.098 1.00 0.00 H new ATOM 0 HA ALA A 90 24.612 22.917 51.242 1.00 0.00 H new ATOM 0 HB1 ALA A 90 23.818 25.166 50.530 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.101 24.147 49.099 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.442 24.425 49.679 1.00 0.00 H new ATOM 1418 N CYS A 91 21.400 22.847 51.919 1.00 0.00 N ATOM 1419 CA CYS A 91 20.441 22.920 53.068 1.00 0.00 C ATOM 1420 C CYS A 91 20.916 21.955 54.148 1.00 0.00 C ATOM 1421 O CYS A 91 21.129 22.329 55.308 1.00 0.00 O ATOM 1422 CB CYS A 91 19.086 22.435 52.504 1.00 0.00 C ATOM 1423 SG CYS A 91 18.085 21.618 53.800 1.00 0.00 S ATOM 0 H CYS A 91 20.998 22.530 51.037 1.00 0.00 H new ATOM 0 HA CYS A 91 20.366 23.921 53.493 1.00 0.00 H new ATOM 0 HB2 CYS A 91 18.535 23.282 52.095 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.259 21.740 51.682 1.00 0.00 H new ATOM 0 HG CYS A 91 16.948 22.236 53.924 1.00 0.00 H new ATOM 1429 N ARG A 92 21.092 20.715 53.787 1.00 0.00 N ATOM 1430 CA ARG A 92 21.558 19.708 54.784 1.00 0.00 C ATOM 1431 C ARG A 92 22.798 20.223 55.529 1.00 0.00 C ATOM 1432 O ARG A 92 22.840 20.254 56.756 1.00 0.00 O ATOM 1433 CB ARG A 92 21.902 18.463 53.965 1.00 0.00 C ATOM 1434 CG ARG A 92 21.677 17.211 54.818 1.00 0.00 C ATOM 1435 CD ARG A 92 22.422 16.026 54.196 1.00 0.00 C ATOM 1436 NE ARG A 92 22.816 15.162 55.350 1.00 0.00 N ATOM 1437 CZ ARG A 92 23.302 13.961 55.150 1.00 0.00 C ATOM 1438 NH1 ARG A 92 23.454 13.495 53.936 1.00 0.00 N ATOM 1439 NH2 ARG A 92 23.641 13.222 56.172 1.00 0.00 N ATOM 0 H ARG A 92 20.934 20.354 52.846 1.00 0.00 H new ATOM 0 HA ARG A 92 20.800 19.501 55.540 1.00 0.00 H new ATOM 0 HB2 ARG A 92 21.282 18.422 53.069 1.00 0.00 H new ATOM 0 HB3 ARG A 92 22.939 18.508 53.633 1.00 0.00 H new ATOM 0 HG2 ARG A 92 22.030 17.383 55.835 1.00 0.00 H new ATOM 0 HG3 ARG A 92 20.612 16.990 54.884 1.00 0.00 H new ATOM 0 HD2 ARG A 92 21.785 15.483 53.497 1.00 0.00 H new ATOM 0 HD3 ARG A 92 23.296 16.360 53.637 1.00 0.00 H new ATOM 0 HE ARG A 92 22.706 15.510 56.302 1.00 0.00 H new ATOM 0 HH11 ARG A 92 23.193 14.068 53.133 1.00 0.00 H new ATOM 0 HH12 ARG A 92 23.833 12.559 53.793 1.00 0.00 H new ATOM 0 HH21 ARG A 92 23.527 13.580 57.120 1.00 0.00 H new ATOM 0 HH22 ARG A 92 24.020 12.287 56.022 1.00 0.00 H new ATOM 1453 N LEU A 93 23.803 20.624 54.802 1.00 0.00 N ATOM 1454 CA LEU A 93 25.052 21.140 55.442 1.00 0.00 C ATOM 1455 C LEU A 93 24.755 22.317 56.393 1.00 0.00 C ATOM 1456 O LEU A 93 25.383 22.448 57.454 1.00 0.00 O ATOM 1457 CB LEU A 93 25.921 21.610 54.265 1.00 0.00 C ATOM 1458 CG LEU A 93 26.782 20.454 53.722 1.00 0.00 C ATOM 1459 CD1 LEU A 93 27.989 20.233 54.637 1.00 0.00 C ATOM 1460 CD2 LEU A 93 25.961 19.161 53.652 1.00 0.00 C ATOM 0 H LEU A 93 23.815 20.617 53.782 1.00 0.00 H new ATOM 0 HA LEU A 93 25.539 20.377 56.050 1.00 0.00 H new ATOM 0 HB2 LEU A 93 25.284 21.999 53.470 1.00 0.00 H new ATOM 0 HB3 LEU A 93 26.565 22.428 54.587 1.00 0.00 H new ATOM 0 HG LEU A 93 27.121 20.717 52.720 1.00 0.00 H new ATOM 0 HD11 LEU A 93 28.595 19.414 54.249 1.00 0.00 H new ATOM 0 HD12 LEU A 93 28.589 21.142 54.674 1.00 0.00 H new ATOM 0 HD13 LEU A 93 27.644 19.985 55.641 1.00 0.00 H new ATOM 0 HD21 LEU A 93 26.585 18.354 53.266 1.00 0.00 H new ATOM 0 HD22 LEU A 93 25.607 18.900 54.649 1.00 0.00 H new ATOM 0 HD23 LEU A 93 25.107 19.308 52.991 1.00 0.00 H new ATOM 1472 N LEU A 94 23.819 23.172 56.026 1.00 0.00 N ATOM 1473 CA LEU A 94 23.479 24.376 56.863 1.00 0.00 C ATOM 1474 C LEU A 94 22.789 23.953 58.165 1.00 0.00 C ATOM 1475 O LEU A 94 22.619 24.754 59.082 1.00 0.00 O ATOM 1476 CB LEU A 94 22.495 25.197 55.978 1.00 0.00 C ATOM 1477 CG LEU A 94 23.253 26.047 54.940 1.00 0.00 C ATOM 1478 CD1 LEU A 94 22.539 25.977 53.579 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.279 27.509 55.386 1.00 0.00 C ATOM 0 H LEU A 94 23.270 23.084 55.171 1.00 0.00 H new ATOM 0 HA LEU A 94 24.365 24.944 57.148 1.00 0.00 H new ATOM 0 HB2 LEU A 94 21.811 24.520 55.467 1.00 0.00 H new ATOM 0 HB3 LEU A 94 21.889 25.846 56.610 1.00 0.00 H new ATOM 0 HG LEU A 94 24.268 25.659 54.853 1.00 0.00 H new ATOM 0 HD11 LEU A 94 23.082 26.581 52.852 1.00 0.00 H new ATOM 0 HD12 LEU A 94 22.505 24.942 53.239 1.00 0.00 H new ATOM 0 HD13 LEU A 94 21.523 26.359 53.681 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.816 28.105 54.648 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.258 27.880 55.478 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.781 27.586 56.350 1.00 0.00 H new ATOM 1491 N GLU A 95 22.410 22.710 58.274 1.00 0.00 N ATOM 1492 CA GLU A 95 21.757 22.242 59.534 1.00 0.00 C ATOM 1493 C GLU A 95 22.437 20.965 60.034 1.00 0.00 C ATOM 1494 O GLU A 95 22.143 20.472 61.121 1.00 0.00 O ATOM 1495 CB GLU A 95 20.321 21.926 59.141 1.00 0.00 C ATOM 1496 CG GLU A 95 19.455 21.806 60.402 1.00 0.00 C ATOM 1497 CD GLU A 95 19.431 20.352 60.888 1.00 0.00 C ATOM 1498 OE1 GLU A 95 20.010 19.510 60.222 1.00 0.00 O ATOM 1499 OE2 GLU A 95 18.830 20.107 61.922 1.00 0.00 O ATOM 0 H GLU A 95 22.522 22.000 57.551 1.00 0.00 H new ATOM 0 HA GLU A 95 21.821 22.987 60.327 1.00 0.00 H new ATOM 0 HB2 GLU A 95 19.930 22.710 58.493 1.00 0.00 H new ATOM 0 HB3 GLU A 95 20.285 20.996 58.573 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.849 22.453 61.186 1.00 0.00 H new ATOM 0 HG3 GLU A 95 18.441 22.143 60.189 1.00 0.00 H new ATOM 1506 N GLN A 96 23.316 20.401 59.247 1.00 0.00 N ATOM 1507 CA GLN A 96 23.982 19.140 59.662 1.00 0.00 C ATOM 1508 C GLN A 96 25.277 19.401 60.435 1.00 0.00 C ATOM 1509 O GLN A 96 25.497 18.810 61.490 1.00 0.00 O ATOM 1510 CB GLN A 96 24.275 18.404 58.355 1.00 0.00 C ATOM 1511 CG GLN A 96 24.759 16.985 58.664 1.00 0.00 C ATOM 1512 CD GLN A 96 25.971 16.657 57.790 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.111 16.870 58.197 1.00 0.00 O ATOM 1514 NE2 GLN A 96 25.784 16.151 56.603 1.00 0.00 N ATOM 0 H GLN A 96 23.599 20.762 58.336 1.00 0.00 H new ATOM 0 HA GLN A 96 23.350 18.563 60.337 1.00 0.00 H new ATOM 0 HB2 GLN A 96 23.378 18.367 57.737 1.00 0.00 H new ATOM 0 HB3 GLN A 96 25.032 18.942 57.785 1.00 0.00 H new ATOM 0 HG2 GLN A 96 25.024 16.901 59.718 1.00 0.00 H new ATOM 0 HG3 GLN A 96 23.959 16.268 58.479 1.00 0.00 H new ATOM 0 HE21 GLN A 96 24.837 15.975 56.267 1.00 0.00 H new ATOM 0 HE22 GLN A 96 26.585 15.931 56.010 1.00 0.00 H new ATOM 1523 N GLU A 97 26.157 20.245 59.946 1.00 0.00 N ATOM 1524 CA GLU A 97 27.427 20.455 60.714 1.00 0.00 C ATOM 1525 C GLU A 97 27.264 21.555 61.769 1.00 0.00 C ATOM 1526 O GLU A 97 26.158 21.852 62.217 1.00 0.00 O ATOM 1527 CB GLU A 97 28.471 20.848 59.664 1.00 0.00 C ATOM 1528 CG GLU A 97 28.079 22.172 59.006 1.00 0.00 C ATOM 1529 CD GLU A 97 27.995 21.977 57.495 1.00 0.00 C ATOM 1530 OE1 GLU A 97 27.351 21.030 57.082 1.00 0.00 O ATOM 1531 OE2 GLU A 97 28.572 22.777 56.776 1.00 0.00 O ATOM 0 H GLU A 97 26.059 20.779 59.082 1.00 0.00 H new ATOM 0 HA GLU A 97 27.719 19.559 61.261 1.00 0.00 H new ATOM 0 HB2 GLU A 97 29.451 20.941 60.131 1.00 0.00 H new ATOM 0 HB3 GLU A 97 28.551 20.067 58.908 1.00 0.00 H new ATOM 0 HG2 GLU A 97 27.120 22.515 59.394 1.00 0.00 H new ATOM 0 HG3 GLU A 97 28.813 22.942 59.245 1.00 0.00 H new ATOM 1538 N THR A 98 28.348 22.174 62.163 1.00 0.00 N ATOM 1539 CA THR A 98 28.266 23.266 63.175 1.00 0.00 C ATOM 1540 C THR A 98 28.457 24.627 62.474 1.00 0.00 C ATOM 1541 O THR A 98 27.506 25.397 62.363 1.00 0.00 O ATOM 1542 CB THR A 98 29.367 22.956 64.203 1.00 0.00 C ATOM 1543 OG1 THR A 98 28.932 21.890 65.036 1.00 0.00 O ATOM 1544 CG2 THR A 98 29.647 24.190 65.067 1.00 0.00 C ATOM 0 H THR A 98 29.288 21.968 61.825 1.00 0.00 H new ATOM 0 HA THR A 98 27.300 23.322 63.677 1.00 0.00 H new ATOM 0 HB THR A 98 30.281 22.676 63.679 1.00 0.00 H new ATOM 0 HG1 THR A 98 29.628 21.684 65.694 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.428 23.958 65.791 1.00 0.00 H new ATOM 0 HG22 THR A 98 29.974 25.013 64.431 1.00 0.00 H new ATOM 0 HG23 THR A 98 28.738 24.479 65.595 1.00 0.00 H new ATOM 1552 N PRO A 99 29.625 24.835 61.901 1.00 0.00 N ATOM 1553 CA PRO A 99 29.879 26.063 61.096 1.00 0.00 C ATOM 1554 C PRO A 99 28.973 26.042 59.854 1.00 0.00 C ATOM 1555 O PRO A 99 28.722 24.988 59.279 1.00 0.00 O ATOM 1556 CB PRO A 99 31.356 25.962 60.721 1.00 0.00 C ATOM 1557 CG PRO A 99 31.660 24.506 60.801 1.00 0.00 C ATOM 1558 CD PRO A 99 30.814 23.968 61.922 1.00 0.00 C ATOM 0 HA PRO A 99 29.666 26.993 61.624 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.539 26.352 59.720 1.00 0.00 H new ATOM 0 HB3 PRO A 99 31.980 26.536 61.406 1.00 0.00 H new ATOM 0 HG2 PRO A 99 31.426 24.006 59.861 1.00 0.00 H new ATOM 0 HG3 PRO A 99 32.719 24.339 60.996 1.00 0.00 H new ATOM 0 HD2 PRO A 99 30.551 22.922 61.761 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.334 24.022 62.879 1.00 0.00 H new ATOM 1566 N VAL A 100 28.440 27.164 59.450 1.00 0.00 N ATOM 1567 CA VAL A 100 27.508 27.167 58.271 1.00 0.00 C ATOM 1568 C VAL A 100 28.299 27.068 56.958 1.00 0.00 C ATOM 1569 O VAL A 100 29.476 27.420 56.898 1.00 0.00 O ATOM 1570 CB VAL A 100 26.797 28.519 58.357 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.697 28.591 57.306 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.178 28.692 59.748 1.00 0.00 C ATOM 0 H VAL A 100 28.604 28.075 59.878 1.00 0.00 H new ATOM 0 HA VAL A 100 26.817 26.324 58.286 1.00 0.00 H new ATOM 0 HB VAL A 100 27.523 29.313 58.180 1.00 0.00 H new ATOM 0 HG11 VAL A 100 25.194 29.556 57.371 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.134 28.476 56.314 1.00 0.00 H new ATOM 0 HG13 VAL A 100 24.975 27.793 57.479 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.673 29.656 59.804 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.458 27.894 59.927 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.963 28.649 60.503 1.00 0.00 H new ATOM 1582 N THR A 101 27.686 26.554 55.910 1.00 0.00 N ATOM 1583 CA THR A 101 28.432 26.395 54.621 1.00 0.00 C ATOM 1584 C THR A 101 27.838 27.236 53.480 1.00 0.00 C ATOM 1585 O THR A 101 26.882 26.859 52.807 1.00 0.00 O ATOM 1586 CB THR A 101 28.316 24.917 54.266 1.00 0.00 C ATOM 1587 OG1 THR A 101 27.458 24.265 55.194 1.00 0.00 O ATOM 1588 CG2 THR A 101 29.698 24.269 54.311 1.00 0.00 C ATOM 0 H THR A 101 26.715 26.243 55.894 1.00 0.00 H new ATOM 0 HA THR A 101 29.461 26.734 54.744 1.00 0.00 H new ATOM 0 HB THR A 101 27.902 24.822 53.262 1.00 0.00 H new ATOM 0 HG1 THR A 101 27.949 24.086 56.023 1.00 0.00 H new ATOM 0 HG21 THR A 101 29.613 23.212 54.057 1.00 0.00 H new ATOM 0 HG22 THR A 101 30.355 24.763 53.595 1.00 0.00 H new ATOM 0 HG23 THR A 101 30.114 24.369 55.313 1.00 0.00 H new ATOM 1596 N LEU A 102 28.452 28.344 53.254 1.00 0.00 N ATOM 1597 CA LEU A 102 28.079 29.274 52.178 1.00 0.00 C ATOM 1598 C LEU A 102 29.378 29.618 51.468 1.00 0.00 C ATOM 1599 O LEU A 102 29.434 29.783 50.256 1.00 0.00 O ATOM 1600 CB LEU A 102 27.485 30.499 52.888 1.00 0.00 C ATOM 1601 CG LEU A 102 26.595 31.303 51.928 1.00 0.00 C ATOM 1602 CD1 LEU A 102 27.350 31.578 50.625 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.312 30.516 51.624 1.00 0.00 C ATOM 0 H LEU A 102 29.248 28.661 53.808 1.00 0.00 H new ATOM 0 HA LEU A 102 27.362 28.885 51.455 1.00 0.00 H new ATOM 0 HB2 LEU A 102 26.901 30.178 53.751 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.288 31.133 53.264 1.00 0.00 H new ATOM 0 HG LEU A 102 26.333 32.251 52.398 1.00 0.00 H new ATOM 0 HD11 LEU A 102 26.713 32.148 49.949 1.00 0.00 H new ATOM 0 HD12 LEU A 102 28.253 32.149 50.841 1.00 0.00 H new ATOM 0 HD13 LEU A 102 27.622 30.633 50.156 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.685 31.091 50.943 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.570 29.563 51.162 1.00 0.00 H new ATOM 0 HD23 LEU A 102 24.768 30.334 52.551 1.00 0.00 H new ATOM 1615 N GLU A 103 30.440 29.728 52.246 1.00 0.00 N ATOM 1616 CA GLU A 103 31.785 30.073 51.705 1.00 0.00 C ATOM 1617 C GLU A 103 32.082 29.403 50.354 1.00 0.00 C ATOM 1618 O GLU A 103 32.600 30.052 49.450 1.00 0.00 O ATOM 1619 CB GLU A 103 32.769 29.574 52.765 1.00 0.00 C ATOM 1620 CG GLU A 103 34.116 30.275 52.582 1.00 0.00 C ATOM 1621 CD GLU A 103 34.010 31.721 53.070 1.00 0.00 C ATOM 1622 OE1 GLU A 103 34.047 31.924 54.272 1.00 0.00 O ATOM 1623 OE2 GLU A 103 33.894 32.601 52.233 1.00 0.00 O ATOM 0 H GLU A 103 30.419 29.588 53.256 1.00 0.00 H new ATOM 0 HA GLU A 103 31.856 31.144 51.514 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.377 29.772 53.762 1.00 0.00 H new ATOM 0 HB3 GLU A 103 32.894 28.495 52.680 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.891 29.748 53.139 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.409 30.255 51.532 1.00 0.00 H new ATOM 1630 N ALA A 104 31.810 28.130 50.185 1.00 0.00 N ATOM 1631 CA ALA A 104 32.146 27.495 48.872 1.00 0.00 C ATOM 1632 C ALA A 104 31.207 28.020 47.782 1.00 0.00 C ATOM 1633 O ALA A 104 31.614 28.259 46.645 1.00 0.00 O ATOM 1634 CB ALA A 104 31.931 25.995 49.085 1.00 0.00 C ATOM 0 H ALA A 104 31.381 27.518 50.879 1.00 0.00 H new ATOM 0 HA ALA A 104 33.165 27.717 48.555 1.00 0.00 H new ATOM 0 HB1 ALA A 104 32.158 25.460 48.163 1.00 0.00 H new ATOM 0 HB2 ALA A 104 32.588 25.643 49.880 1.00 0.00 H new ATOM 0 HB3 ALA A 104 30.893 25.812 49.364 1.00 0.00 H new ATOM 1640 N LEU A 105 29.956 28.207 48.109 1.00 0.00 N ATOM 1641 CA LEU A 105 28.990 28.715 47.093 1.00 0.00 C ATOM 1642 C LEU A 105 29.228 30.207 46.833 1.00 0.00 C ATOM 1643 O LEU A 105 29.165 30.672 45.694 1.00 0.00 O ATOM 1644 CB LEU A 105 27.606 28.472 47.702 1.00 0.00 C ATOM 1645 CG LEU A 105 26.924 27.305 46.978 1.00 0.00 C ATOM 1646 CD1 LEU A 105 26.402 26.298 48.006 1.00 0.00 C ATOM 1647 CD2 LEU A 105 25.750 27.831 46.144 1.00 0.00 C ATOM 0 H LEU A 105 29.562 28.030 49.033 1.00 0.00 H new ATOM 0 HA LEU A 105 29.096 28.214 46.131 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.699 28.249 48.765 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.997 29.372 47.617 1.00 0.00 H new ATOM 0 HG LEU A 105 27.647 26.818 46.323 1.00 0.00 H new ATOM 0 HD11 LEU A 105 25.918 25.469 47.490 1.00 0.00 H new ATOM 0 HD12 LEU A 105 27.234 25.919 48.599 1.00 0.00 H new ATOM 0 HD13 LEU A 105 25.682 26.788 48.662 1.00 0.00 H new ATOM 0 HD21 LEU A 105 25.267 27.000 45.631 1.00 0.00 H new ATOM 0 HD22 LEU A 105 25.029 28.321 46.799 1.00 0.00 H new ATOM 0 HD23 LEU A 105 26.118 28.547 45.409 1.00 0.00 H new ATOM 1659 N ALA A 106 29.511 30.966 47.859 1.00 0.00 N ATOM 1660 CA ALA A 106 29.765 32.423 47.664 1.00 0.00 C ATOM 1661 C ALA A 106 31.072 32.618 46.904 1.00 0.00 C ATOM 1662 O ALA A 106 31.200 33.523 46.074 1.00 0.00 O ATOM 1663 CB ALA A 106 29.866 33.013 49.071 1.00 0.00 C ATOM 0 H ALA A 106 29.577 30.640 48.823 1.00 0.00 H new ATOM 0 HA ALA A 106 28.977 32.907 47.086 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.053 34.085 49.004 1.00 0.00 H new ATOM 0 HB2 ALA A 106 28.932 32.840 49.606 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.685 32.535 49.608 1.00 0.00 H new ATOM 1669 N ASP A 107 32.041 31.779 47.163 1.00 0.00 N ATOM 1670 CA ASP A 107 33.334 31.890 46.457 1.00 0.00 C ATOM 1671 C ASP A 107 33.143 31.524 44.984 1.00 0.00 C ATOM 1672 O ASP A 107 33.713 32.147 44.090 1.00 0.00 O ATOM 1673 CB ASP A 107 34.226 30.880 47.167 1.00 0.00 C ATOM 1674 CG ASP A 107 34.950 31.564 48.326 1.00 0.00 C ATOM 1675 OD1 ASP A 107 34.272 32.109 49.182 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.169 31.535 48.338 1.00 0.00 O ATOM 0 H ASP A 107 31.983 31.018 47.840 1.00 0.00 H new ATOM 0 HA ASP A 107 33.759 32.893 46.476 1.00 0.00 H new ATOM 0 HB2 ASP A 107 33.627 30.048 47.539 1.00 0.00 H new ATOM 0 HB3 ASP A 107 34.950 30.464 46.467 1.00 0.00 H new ATOM 1681 N GLN A 108 32.339 30.530 44.714 1.00 0.00 N ATOM 1682 CA GLN A 108 32.095 30.125 43.299 1.00 0.00 C ATOM 1683 C GLN A 108 31.429 31.273 42.530 1.00 0.00 C ATOM 1684 O GLN A 108 31.924 31.721 41.499 1.00 0.00 O ATOM 1685 CB GLN A 108 31.152 28.924 43.397 1.00 0.00 C ATOM 1686 CG GLN A 108 30.800 28.423 41.993 1.00 0.00 C ATOM 1687 CD GLN A 108 29.454 27.699 42.033 1.00 0.00 C ATOM 1688 OE1 GLN A 108 29.147 27.000 42.997 1.00 0.00 O ATOM 1689 NE2 GLN A 108 28.626 27.831 41.034 1.00 0.00 N ATOM 0 H GLN A 108 31.840 29.980 45.414 1.00 0.00 H new ATOM 0 HA GLN A 108 33.015 29.881 42.769 1.00 0.00 H new ATOM 0 HB2 GLN A 108 31.624 28.126 43.970 1.00 0.00 H new ATOM 0 HB3 GLN A 108 30.244 29.206 43.931 1.00 0.00 H new ATOM 0 HG2 GLN A 108 30.754 29.261 41.297 1.00 0.00 H new ATOM 0 HG3 GLN A 108 31.577 27.750 41.630 1.00 0.00 H new ATOM 0 HE21 GLN A 108 28.880 28.411 40.234 1.00 0.00 H new ATOM 0 HE22 GLN A 108 27.724 27.355 41.053 1.00 0.00 H new ATOM 1698 N VAL A 109 30.311 31.749 43.011 1.00 0.00 N ATOM 1699 CA VAL A 109 29.603 32.864 42.308 1.00 0.00 C ATOM 1700 C VAL A 109 30.388 34.174 42.447 1.00 0.00 C ATOM 1701 O VAL A 109 30.253 35.084 41.633 1.00 0.00 O ATOM 1702 CB VAL A 109 28.260 32.988 43.015 1.00 0.00 C ATOM 1703 CG1 VAL A 109 27.384 34.003 42.280 1.00 0.00 C ATOM 1704 CG2 VAL A 109 27.559 31.633 43.037 1.00 0.00 C ATOM 0 H VAL A 109 29.856 31.415 43.860 1.00 0.00 H new ATOM 0 HA VAL A 109 29.496 32.666 41.242 1.00 0.00 H new ATOM 0 HB VAL A 109 28.425 33.324 44.039 1.00 0.00 H new ATOM 0 HG11 VAL A 109 26.423 34.090 42.788 1.00 0.00 H new ATOM 0 HG12 VAL A 109 27.880 34.974 42.273 1.00 0.00 H new ATOM 0 HG13 VAL A 109 27.223 33.670 41.255 1.00 0.00 H new ATOM 0 HG21 VAL A 109 26.599 31.728 43.544 1.00 0.00 H new ATOM 0 HG22 VAL A 109 27.397 31.290 42.015 1.00 0.00 H new ATOM 0 HG23 VAL A 109 28.180 30.911 43.568 1.00 0.00 H new ATOM 1714 N ALA A 110 31.203 34.273 43.469 1.00 0.00 N ATOM 1715 CA ALA A 110 32.029 35.503 43.705 1.00 0.00 C ATOM 1716 C ALA A 110 31.226 36.610 44.405 1.00 0.00 C ATOM 1717 O ALA A 110 31.487 37.793 44.197 1.00 0.00 O ATOM 1718 CB ALA A 110 32.509 35.974 42.326 1.00 0.00 C ATOM 0 H ALA A 110 31.334 33.539 44.165 1.00 0.00 H new ATOM 0 HA ALA A 110 32.865 35.275 44.366 1.00 0.00 H new ATOM 0 HB1 ALA A 110 33.118 36.871 42.439 1.00 0.00 H new ATOM 0 HB2 ALA A 110 33.104 35.188 41.860 1.00 0.00 H new ATOM 0 HB3 ALA A 110 31.647 36.198 41.698 1.00 0.00 H new ATOM 1724 N MET A 111 30.274 36.271 45.251 1.00 0.00 N ATOM 1725 CA MET A 111 29.517 37.366 45.955 1.00 0.00 C ATOM 1726 C MET A 111 29.241 37.011 47.437 1.00 0.00 C ATOM 1727 O MET A 111 29.738 36.015 47.958 1.00 0.00 O ATOM 1728 CB MET A 111 28.230 37.590 45.138 1.00 0.00 C ATOM 1729 CG MET A 111 27.087 36.704 45.631 1.00 0.00 C ATOM 1730 SD MET A 111 27.468 34.979 45.299 1.00 0.00 S ATOM 1731 CE MET A 111 27.130 34.359 46.957 1.00 0.00 C ATOM 0 H MET A 111 29.995 35.317 45.480 1.00 0.00 H new ATOM 0 HA MET A 111 30.097 38.287 46.001 1.00 0.00 H new ATOM 0 HB2 MET A 111 27.934 38.637 45.205 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.425 37.381 44.086 1.00 0.00 H new ATOM 0 HG2 MET A 111 26.934 36.853 46.700 1.00 0.00 H new ATOM 0 HG3 MET A 111 26.158 36.983 45.134 1.00 0.00 H new ATOM 0 HE1 MET A 111 27.043 33.273 46.929 1.00 0.00 H new ATOM 0 HE2 MET A 111 27.945 34.640 47.624 1.00 0.00 H new ATOM 0 HE3 MET A 111 26.197 34.788 47.323 1.00 0.00 H new ATOM 1741 N SER A 112 28.498 37.846 48.130 1.00 0.00 N ATOM 1742 CA SER A 112 28.223 37.616 49.595 1.00 0.00 C ATOM 1743 C SER A 112 27.242 36.458 49.855 1.00 0.00 C ATOM 1744 O SER A 112 26.564 35.988 48.949 1.00 0.00 O ATOM 1745 CB SER A 112 27.614 38.931 50.084 1.00 0.00 C ATOM 1746 OG SER A 112 26.807 39.490 49.055 1.00 0.00 O ATOM 0 H SER A 112 28.065 38.685 47.743 1.00 0.00 H new ATOM 0 HA SER A 112 29.140 37.336 50.114 1.00 0.00 H new ATOM 0 HB2 SER A 112 27.014 38.757 50.977 1.00 0.00 H new ATOM 0 HB3 SER A 112 28.404 39.629 50.362 1.00 0.00 H new ATOM 0 HG SER A 112 27.282 40.239 48.637 1.00 0.00 H new ATOM 1752 N PRO A 113 27.198 36.040 51.109 1.00 0.00 N ATOM 1753 CA PRO A 113 26.305 34.923 51.543 1.00 0.00 C ATOM 1754 C PRO A 113 24.830 35.296 51.400 1.00 0.00 C ATOM 1755 O PRO A 113 23.989 34.441 51.107 1.00 0.00 O ATOM 1756 CB PRO A 113 26.682 34.711 53.009 1.00 0.00 C ATOM 1757 CG PRO A 113 27.261 36.016 53.441 1.00 0.00 C ATOM 1758 CD PRO A 113 27.973 36.573 52.240 1.00 0.00 C ATOM 0 HA PRO A 113 26.432 34.026 50.938 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.811 34.446 53.608 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.403 33.901 53.120 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.480 36.696 53.781 1.00 0.00 H new ATOM 0 HG3 PRO A 113 27.950 35.880 54.274 1.00 0.00 H new ATOM 0 HD2 PRO A 113 27.979 37.663 52.246 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.013 36.249 52.203 1.00 0.00 H new ATOM 1766 N PHE A 114 24.485 36.546 51.558 1.00 0.00 N ATOM 1767 CA PHE A 114 23.056 36.910 51.385 1.00 0.00 C ATOM 1768 C PHE A 114 22.690 36.770 49.921 1.00 0.00 C ATOM 1769 O PHE A 114 21.611 36.275 49.593 1.00 0.00 O ATOM 1770 CB PHE A 114 22.892 38.356 51.859 1.00 0.00 C ATOM 1771 CG PHE A 114 23.022 38.444 53.369 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.290 37.302 54.138 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.862 39.681 53.997 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.402 37.403 55.529 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.973 39.782 55.388 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.245 38.644 56.155 1.00 0.00 C ATOM 0 H PHE A 114 25.116 37.312 51.794 1.00 0.00 H new ATOM 0 HA PHE A 114 22.399 36.260 51.963 1.00 0.00 H new ATOM 0 HB2 PHE A 114 23.646 38.986 51.387 1.00 0.00 H new ATOM 0 HB3 PHE A 114 21.919 38.737 51.550 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.410 36.343 53.656 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.652 40.561 53.408 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.610 36.523 56.119 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.848 40.740 55.871 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.334 38.724 57.228 1.00 0.00 H new ATOM 1786 N HIS A 115 23.551 37.160 49.014 1.00 0.00 N ATOM 1787 CA HIS A 115 23.166 36.978 47.602 1.00 0.00 C ATOM 1788 C HIS A 115 23.172 35.484 47.217 1.00 0.00 C ATOM 1789 O HIS A 115 22.400 35.057 46.361 1.00 0.00 O ATOM 1790 CB HIS A 115 24.061 37.798 46.702 1.00 0.00 C ATOM 1791 CG HIS A 115 23.199 38.094 45.513 1.00 0.00 C ATOM 1792 ND1 HIS A 115 23.348 37.434 44.309 1.00 0.00 N ATOM 1793 CD2 HIS A 115 22.063 38.853 45.393 1.00 0.00 C ATOM 1794 CE1 HIS A 115 22.315 37.792 43.526 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.497 38.660 44.138 1.00 0.00 N ATOM 0 H HIS A 115 24.465 37.579 49.188 1.00 0.00 H new ATOM 0 HA HIS A 115 22.146 37.338 47.468 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.392 38.713 47.193 1.00 0.00 H new ATOM 0 HB3 HIS A 115 24.957 37.246 46.419 1.00 0.00 H new ATOM 0 HD2 HIS A 115 21.667 39.503 46.159 1.00 0.00 H new ATOM 0 HE1 HIS A 115 22.162 37.424 42.522 1.00 0.00 H new ATOM 0 HE2 HIS A 115 20.648 39.085 43.765 1.00 0.00 H new ATOM 1803 N LEU A 116 23.974 34.670 47.863 1.00 0.00 N ATOM 1804 CA LEU A 116 23.952 33.206 47.558 1.00 0.00 C ATOM 1805 C LEU A 116 22.557 32.701 47.894 1.00 0.00 C ATOM 1806 O LEU A 116 21.946 31.945 47.142 1.00 0.00 O ATOM 1807 CB LEU A 116 24.992 32.568 48.485 1.00 0.00 C ATOM 1808 CG LEU A 116 25.361 31.162 47.989 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.148 30.233 48.110 1.00 0.00 C ATOM 1810 CD2 LEU A 116 25.823 31.219 46.525 1.00 0.00 C ATOM 0 H LEU A 116 24.638 34.955 48.583 1.00 0.00 H new ATOM 0 HA LEU A 116 24.178 32.973 46.517 1.00 0.00 H new ATOM 0 HB2 LEU A 116 25.885 33.192 48.525 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.598 32.511 49.500 1.00 0.00 H new ATOM 0 HG LEU A 116 26.175 30.776 48.603 1.00 0.00 H new ATOM 0 HD11 LEU A 116 24.416 29.237 47.757 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.836 30.176 49.153 1.00 0.00 H new ATOM 0 HD13 LEU A 116 23.329 30.624 47.507 1.00 0.00 H new ATOM 0 HD21 LEU A 116 26.082 30.216 46.186 1.00 0.00 H new ATOM 0 HD22 LEU A 116 25.019 31.616 45.905 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.697 31.866 46.444 1.00 0.00 H new ATOM 1822 N HIS A 117 22.026 33.149 49.000 1.00 0.00 N ATOM 1823 CA HIS A 117 20.645 32.748 49.379 1.00 0.00 C ATOM 1824 C HIS A 117 19.675 33.272 48.298 1.00 0.00 C ATOM 1825 O HIS A 117 18.771 32.566 47.845 1.00 0.00 O ATOM 1826 CB HIS A 117 20.404 33.418 50.726 1.00 0.00 C ATOM 1827 CG HIS A 117 21.448 32.954 51.711 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.005 33.807 52.647 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.045 31.731 51.918 1.00 0.00 C ATOM 1830 CE1 HIS A 117 22.892 33.098 53.369 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.955 31.827 52.966 1.00 0.00 N ATOM 0 H HIS A 117 22.491 33.776 49.656 1.00 0.00 H new ATOM 0 HA HIS A 117 20.499 31.670 49.452 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.446 34.502 50.618 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.407 33.173 51.093 1.00 0.00 H new ATOM 0 HD2 HIS A 117 21.839 30.834 51.353 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.481 33.507 54.176 1.00 0.00 H new ATOM 0 HE2 HIS A 117 23.544 31.085 53.345 1.00 0.00 H new ATOM 1839 N ARG A 118 19.893 34.486 47.839 1.00 0.00 N ATOM 1840 CA ARG A 118 19.043 35.070 46.745 1.00 0.00 C ATOM 1841 C ARG A 118 19.142 34.180 45.489 1.00 0.00 C ATOM 1842 O ARG A 118 18.165 33.986 44.770 1.00 0.00 O ATOM 1843 CB ARG A 118 19.635 36.457 46.467 1.00 0.00 C ATOM 1844 CG ARG A 118 18.629 37.540 46.867 1.00 0.00 C ATOM 1845 CD ARG A 118 17.389 37.444 45.974 1.00 0.00 C ATOM 1846 NE ARG A 118 16.524 38.589 46.386 1.00 0.00 N ATOM 1847 CZ ARG A 118 15.215 38.471 46.402 1.00 0.00 C ATOM 1848 NH1 ARG A 118 14.640 37.352 46.056 1.00 0.00 N ATOM 1849 NH2 ARG A 118 14.481 39.485 46.764 1.00 0.00 N ATOM 0 H ARG A 118 20.631 35.103 48.179 1.00 0.00 H new ATOM 0 HA ARG A 118 17.991 35.133 47.023 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.562 36.585 47.025 1.00 0.00 H new ATOM 0 HB3 ARG A 118 19.884 36.551 45.410 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.347 37.420 47.913 1.00 0.00 H new ATOM 0 HG3 ARG A 118 19.083 38.526 46.771 1.00 0.00 H new ATOM 0 HD2 ARG A 118 17.656 37.511 44.919 1.00 0.00 H new ATOM 0 HD3 ARG A 118 16.876 36.492 46.113 1.00 0.00 H new ATOM 0 HE ARG A 118 16.954 39.473 46.658 1.00 0.00 H new ATOM 0 HH11 ARG A 118 15.207 36.555 45.768 1.00 0.00 H new ATOM 0 HH12 ARG A 118 13.623 37.275 46.073 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.923 40.364 47.033 1.00 0.00 H new ATOM 0 HH22 ARG A 118 13.465 39.400 46.778 1.00 0.00 H new ATOM 1863 N LEU A 119 20.299 33.601 45.237 1.00 0.00 N ATOM 1864 CA LEU A 119 20.459 32.681 44.057 1.00 0.00 C ATOM 1865 C LEU A 119 19.668 31.379 44.318 1.00 0.00 C ATOM 1866 O LEU A 119 18.902 30.919 43.473 1.00 0.00 O ATOM 1867 CB LEU A 119 21.967 32.400 43.974 1.00 0.00 C ATOM 1868 CG LEU A 119 22.276 31.393 42.852 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.074 29.967 43.369 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.357 31.635 41.647 1.00 0.00 C ATOM 0 H LEU A 119 21.141 33.727 45.799 1.00 0.00 H new ATOM 0 HA LEU A 119 20.083 33.109 43.128 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.505 33.330 43.792 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.321 32.008 44.928 1.00 0.00 H new ATOM 0 HG LEU A 119 23.312 31.526 42.539 1.00 0.00 H new ATOM 0 HD11 LEU A 119 22.294 29.257 42.572 1.00 0.00 H new ATOM 0 HD12 LEU A 119 22.743 29.787 44.210 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.041 29.840 43.693 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.588 30.915 40.862 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.317 31.517 41.953 1.00 0.00 H new ATOM 0 HD23 LEU A 119 21.511 32.646 41.269 1.00 0.00 H new ATOM 1882 N PHE A 120 19.813 30.803 45.500 1.00 0.00 N ATOM 1883 CA PHE A 120 19.044 29.555 45.865 1.00 0.00 C ATOM 1884 C PHE A 120 17.544 29.799 45.540 1.00 0.00 C ATOM 1885 O PHE A 120 16.875 28.928 44.996 1.00 0.00 O ATOM 1886 CB PHE A 120 19.304 29.391 47.397 1.00 0.00 C ATOM 1887 CG PHE A 120 19.250 27.927 47.881 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.600 26.946 47.119 1.00 0.00 C ATOM 1889 CD2 PHE A 120 19.818 27.559 49.138 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.515 25.626 47.583 1.00 0.00 C ATOM 1891 CE2 PHE A 120 19.717 26.236 49.600 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.066 25.274 48.821 1.00 0.00 C ATOM 0 H PHE A 120 20.435 31.147 46.231 1.00 0.00 H new ATOM 0 HA PHE A 120 19.340 28.657 45.323 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.282 29.808 47.637 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.565 29.974 47.947 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.162 27.209 46.168 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.327 28.300 49.736 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.022 24.876 46.982 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.141 25.962 50.555 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.988 24.257 49.175 1.00 0.00 H new ATOM 1902 N LYS A 121 17.022 30.984 45.814 1.00 0.00 N ATOM 1903 CA LYS A 121 15.580 31.290 45.465 1.00 0.00 C ATOM 1904 C LYS A 121 15.428 31.453 43.949 1.00 0.00 C ATOM 1905 O LYS A 121 14.474 30.968 43.349 1.00 0.00 O ATOM 1906 CB LYS A 121 15.262 32.628 46.125 1.00 0.00 C ATOM 1907 CG LYS A 121 13.873 33.116 45.676 1.00 0.00 C ATOM 1908 CD LYS A 121 13.887 34.636 45.519 1.00 0.00 C ATOM 1909 CE LYS A 121 12.509 35.121 45.057 1.00 0.00 C ATOM 1910 NZ LYS A 121 12.766 35.863 43.791 1.00 0.00 N ATOM 0 H LYS A 121 17.528 31.749 46.261 1.00 0.00 H new ATOM 0 HA LYS A 121 14.920 30.489 45.799 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.287 32.524 47.210 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.020 33.365 45.858 1.00 0.00 H new ATOM 0 HG2 LYS A 121 13.599 32.646 44.731 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.120 32.823 46.408 1.00 0.00 H new ATOM 0 HD2 LYS A 121 14.150 35.107 46.466 1.00 0.00 H new ATOM 0 HD3 LYS A 121 14.648 34.929 44.796 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.830 34.284 44.893 1.00 0.00 H new ATOM 0 HE3 LYS A 121 12.046 35.765 45.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.861 36.094 43.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 13.282 36.741 44.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 13.335 35.272 43.152 1.00 0.00 H new ATOM 1924 N ALA A 122 16.351 32.135 43.323 1.00 0.00 N ATOM 1925 CA ALA A 122 16.268 32.336 41.846 1.00 0.00 C ATOM 1926 C ALA A 122 16.179 30.976 41.155 1.00 0.00 C ATOM 1927 O ALA A 122 15.250 30.699 40.400 1.00 0.00 O ATOM 1928 CB ALA A 122 17.566 33.049 41.465 1.00 0.00 C ATOM 0 H ALA A 122 17.161 32.563 43.772 1.00 0.00 H new ATOM 0 HA ALA A 122 15.393 32.913 41.548 1.00 0.00 H new ATOM 0 HB1 ALA A 122 17.579 33.232 40.391 1.00 0.00 H new ATOM 0 HB2 ALA A 122 17.628 33.999 41.996 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.417 32.425 41.737 1.00 0.00 H new ATOM 1934 N THR A 123 17.140 30.131 41.397 1.00 0.00 N ATOM 1935 CA THR A 123 17.127 28.780 40.745 1.00 0.00 C ATOM 1936 C THR A 123 15.975 27.908 41.320 1.00 0.00 C ATOM 1937 O THR A 123 15.062 27.523 40.592 1.00 0.00 O ATOM 1938 CB THR A 123 18.497 28.175 41.088 1.00 0.00 C ATOM 1939 OG1 THR A 123 19.473 29.209 41.119 1.00 0.00 O ATOM 1940 CG2 THR A 123 18.895 27.152 40.023 1.00 0.00 C ATOM 0 H THR A 123 17.933 30.310 42.014 1.00 0.00 H new ATOM 0 HA THR A 123 16.960 28.836 39.669 1.00 0.00 H new ATOM 0 HB THR A 123 18.438 27.686 42.060 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.348 28.826 41.339 1.00 0.00 H new ATOM 0 HG21 THR A 123 19.867 26.727 40.272 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.150 26.357 39.986 1.00 0.00 H new ATOM 0 HG23 THR A 123 18.952 27.642 39.051 1.00 0.00 H new ATOM 1948 N THR A 124 15.970 27.627 42.612 1.00 0.00 N ATOM 1949 CA THR A 124 14.841 26.826 43.235 1.00 0.00 C ATOM 1950 C THR A 124 13.510 27.466 42.821 1.00 0.00 C ATOM 1951 O THR A 124 12.504 26.789 42.615 1.00 0.00 O ATOM 1952 CB THR A 124 15.064 26.894 44.756 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.520 25.729 45.360 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.388 28.135 45.349 1.00 0.00 C ATOM 0 H THR A 124 16.698 27.916 43.265 1.00 0.00 H new ATOM 0 HA THR A 124 14.819 25.786 42.911 1.00 0.00 H new ATOM 0 HB THR A 124 16.135 26.954 44.951 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.661 25.767 46.329 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.558 28.163 46.425 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.807 29.031 44.892 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.317 28.095 45.152 1.00 0.00 H new ATOM 1962 N GLY A 125 13.511 28.770 42.665 1.00 0.00 N ATOM 1963 CA GLY A 125 12.279 29.495 42.228 1.00 0.00 C ATOM 1964 C GLY A 125 11.623 30.395 43.304 1.00 0.00 C ATOM 1965 O GLY A 125 11.101 31.443 42.931 1.00 0.00 O ATOM 0 H GLY A 125 14.323 29.367 42.824 1.00 0.00 H new ATOM 0 HA2 GLY A 125 12.528 30.112 41.365 1.00 0.00 H new ATOM 0 HA3 GLY A 125 11.545 28.761 41.895 1.00 0.00 H new ATOM 1969 N MET A 126 11.601 30.093 44.591 1.00 0.00 N ATOM 1970 CA MET A 126 10.907 31.088 45.502 1.00 0.00 C ATOM 1971 C MET A 126 11.266 31.008 47.005 1.00 0.00 C ATOM 1972 O MET A 126 10.370 31.037 47.848 1.00 0.00 O ATOM 1973 CB MET A 126 9.414 30.774 45.331 1.00 0.00 C ATOM 1974 CG MET A 126 8.858 31.517 44.116 1.00 0.00 C ATOM 1975 SD MET A 126 7.111 31.908 44.388 1.00 0.00 S ATOM 1976 CE MET A 126 6.977 33.212 43.141 1.00 0.00 C ATOM 0 H MET A 126 12.001 29.264 45.030 1.00 0.00 H new ATOM 0 HA MET A 126 11.219 32.093 45.216 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.272 29.700 45.207 1.00 0.00 H new ATOM 0 HB3 MET A 126 8.868 31.067 46.228 1.00 0.00 H new ATOM 0 HG2 MET A 126 9.424 32.433 43.947 1.00 0.00 H new ATOM 0 HG3 MET A 126 8.969 30.905 43.221 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.961 33.606 43.134 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.675 34.015 43.378 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.214 32.802 42.159 1.00 0.00 H new ATOM 1986 N THR A 127 12.522 30.974 47.382 1.00 0.00 N ATOM 1987 CA THR A 127 12.861 30.962 48.838 1.00 0.00 C ATOM 1988 C THR A 127 14.370 31.163 49.043 1.00 0.00 C ATOM 1989 O THR A 127 15.091 30.189 49.235 1.00 0.00 O ATOM 1990 CB THR A 127 12.461 29.578 49.339 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.302 29.111 48.663 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.166 29.680 50.819 1.00 0.00 C ATOM 0 H THR A 127 13.321 30.954 46.748 1.00 0.00 H new ATOM 0 HA THR A 127 12.347 31.762 49.371 1.00 0.00 H new ATOM 0 HB THR A 127 13.274 28.877 49.150 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.585 29.774 48.747 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.877 28.701 51.201 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.056 30.026 51.344 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.352 30.387 50.980 1.00 0.00 H new ATOM 2000 N PRO A 128 14.841 32.388 49.004 1.00 0.00 N ATOM 2001 CA PRO A 128 16.303 32.585 49.159 1.00 0.00 C ATOM 2002 C PRO A 128 16.801 32.296 50.579 1.00 0.00 C ATOM 2003 O PRO A 128 16.837 31.145 51.010 1.00 0.00 O ATOM 2004 CB PRO A 128 16.490 34.049 48.754 1.00 0.00 C ATOM 2005 CG PRO A 128 15.168 34.705 49.017 1.00 0.00 C ATOM 2006 CD PRO A 128 14.104 33.650 48.859 1.00 0.00 C ATOM 0 HA PRO A 128 16.889 31.894 48.553 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.284 34.519 49.334 1.00 0.00 H new ATOM 0 HB3 PRO A 128 16.769 34.134 47.704 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.143 35.129 50.021 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.001 35.526 48.320 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.326 33.749 49.616 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.614 33.718 47.888 1.00 0.00 H new ATOM 2014 N LYS A 129 17.221 33.301 51.307 1.00 0.00 N ATOM 2015 CA LYS A 129 17.752 33.055 52.674 1.00 0.00 C ATOM 2016 C LYS A 129 16.692 32.399 53.578 1.00 0.00 C ATOM 2017 O LYS A 129 17.019 31.751 54.575 1.00 0.00 O ATOM 2018 CB LYS A 129 18.206 34.423 53.173 1.00 0.00 C ATOM 2019 CG LYS A 129 18.569 34.354 54.661 1.00 0.00 C ATOM 2020 CD LYS A 129 20.028 33.913 54.806 1.00 0.00 C ATOM 2021 CE LYS A 129 20.942 35.132 55.025 1.00 0.00 C ATOM 2022 NZ LYS A 129 20.379 36.238 54.193 1.00 0.00 N ATOM 0 H LYS A 129 17.217 34.277 51.011 1.00 0.00 H new ATOM 0 HA LYS A 129 18.582 32.349 52.680 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.068 34.760 52.597 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.413 35.155 53.019 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.423 35.328 55.128 1.00 0.00 H new ATOM 0 HG3 LYS A 129 17.912 33.652 55.175 1.00 0.00 H new ATOM 0 HD2 LYS A 129 20.124 33.224 55.645 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.341 33.373 53.913 1.00 0.00 H new ATOM 0 HE2 LYS A 129 20.968 35.413 56.078 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.967 34.907 54.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 21.058 37.025 54.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 20.200 35.891 53.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 19.487 36.569 54.613 1.00 0.00 H new ATOM 2036 N ALA A 130 15.442 32.510 53.232 1.00 0.00 N ATOM 2037 CA ALA A 130 14.382 31.852 54.058 1.00 0.00 C ATOM 2038 C ALA A 130 14.512 30.332 53.907 1.00 0.00 C ATOM 2039 O ALA A 130 14.403 29.592 54.883 1.00 0.00 O ATOM 2040 CB ALA A 130 13.054 32.326 53.465 1.00 0.00 C ATOM 0 H ALA A 130 15.105 33.024 52.418 1.00 0.00 H new ATOM 0 HA ALA A 130 14.458 32.099 55.117 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.228 31.883 54.021 1.00 0.00 H new ATOM 0 HB2 ALA A 130 12.994 33.412 53.530 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.993 32.021 52.420 1.00 0.00 H new ATOM 2046 N TRP A 131 14.785 29.841 52.709 1.00 0.00 N ATOM 2047 CA TRP A 131 14.961 28.369 52.561 1.00 0.00 C ATOM 2048 C TRP A 131 16.191 27.952 53.355 1.00 0.00 C ATOM 2049 O TRP A 131 16.192 26.924 54.024 1.00 0.00 O ATOM 2050 CB TRP A 131 15.166 28.127 51.068 1.00 0.00 C ATOM 2051 CG TRP A 131 14.177 27.128 50.541 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.363 26.411 49.410 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.868 26.725 51.070 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.269 25.585 49.214 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.322 25.744 50.205 1.00 0.00 C ATOM 2056 CE3 TRP A 131 12.108 27.101 52.198 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 11.077 25.162 50.449 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.856 26.516 52.443 1.00 0.00 C ATOM 2059 CH2 TRP A 131 10.342 25.548 51.572 1.00 0.00 C ATOM 0 H TRP A 131 14.889 30.389 51.855 1.00 0.00 H new ATOM 0 HA TRP A 131 14.110 27.796 52.930 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.061 29.067 50.526 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.180 27.768 50.891 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.226 26.473 48.763 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.175 24.937 48.432 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.493 27.846 52.879 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.684 24.417 49.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 10.285 26.815 53.310 1.00 0.00 H new ATOM 0 HH2 TRP A 131 9.379 25.101 51.768 1.00 0.00 H new ATOM 2070 N GLN A 132 17.228 28.747 53.328 1.00 0.00 N ATOM 2071 CA GLN A 132 18.444 28.400 54.123 1.00 0.00 C ATOM 2072 C GLN A 132 18.052 28.254 55.596 1.00 0.00 C ATOM 2073 O GLN A 132 18.550 27.388 56.313 1.00 0.00 O ATOM 2074 CB GLN A 132 19.403 29.577 53.937 1.00 0.00 C ATOM 2075 CG GLN A 132 20.776 29.211 54.507 1.00 0.00 C ATOM 2076 CD GLN A 132 21.271 30.334 55.420 1.00 0.00 C ATOM 2077 OE1 GLN A 132 22.527 30.684 55.379 1.00 0.00 O flip ATOM 2078 NE2 GLN A 132 20.499 30.904 56.187 1.00 0.00 N flip ATOM 0 H GLN A 132 17.287 29.615 52.795 1.00 0.00 H new ATOM 0 HA GLN A 132 18.902 27.463 53.805 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.491 29.825 52.879 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.012 30.461 54.440 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.712 28.277 55.065 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.486 29.049 53.696 1.00 0.00 H new ATOM 0 HE21 GLN A 132 19.517 30.630 56.219 1.00 0.00 H new ATOM 0 HE22 GLN A 132 20.840 31.651 56.792 1.00 0.00 H new ATOM 2087 N GLN A 133 17.153 29.085 56.054 1.00 0.00 N ATOM 2088 CA GLN A 133 16.709 28.995 57.474 1.00 0.00 C ATOM 2089 C GLN A 133 15.893 27.713 57.677 1.00 0.00 C ATOM 2090 O GLN A 133 16.179 26.906 58.567 1.00 0.00 O ATOM 2091 CB GLN A 133 15.837 30.232 57.697 1.00 0.00 C ATOM 2092 CG GLN A 133 15.845 30.607 59.181 1.00 0.00 C ATOM 2093 CD GLN A 133 15.986 32.124 59.324 1.00 0.00 C ATOM 2094 OE1 GLN A 133 15.583 32.875 58.438 1.00 0.00 O ATOM 2095 NE2 GLN A 133 16.540 32.618 60.396 1.00 0.00 N ATOM 0 H GLN A 133 16.708 29.821 55.506 1.00 0.00 H new ATOM 0 HA GLN A 133 17.544 28.961 58.174 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.210 31.064 57.100 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.817 30.034 57.367 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.924 30.270 59.657 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.668 30.105 59.689 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.874 31.995 61.131 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.639 33.628 60.500 1.00 0.00 H new ATOM 2104 N ALA A 134 14.889 27.500 56.862 1.00 0.00 N ATOM 2105 CA ALA A 134 14.068 26.258 57.009 1.00 0.00 C ATOM 2106 C ALA A 134 14.991 25.049 57.012 1.00 0.00 C ATOM 2107 O ALA A 134 14.868 24.147 57.837 1.00 0.00 O ATOM 2108 CB ALA A 134 13.133 26.234 55.798 1.00 0.00 C ATOM 0 H ALA A 134 14.604 28.126 56.108 1.00 0.00 H new ATOM 0 HA ALA A 134 13.498 26.237 57.938 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.501 25.347 55.843 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.507 27.126 55.804 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.724 26.212 54.882 1.00 0.00 H new ATOM 2114 N TRP A 135 15.945 25.049 56.135 1.00 0.00 N ATOM 2115 CA TRP A 135 16.939 23.940 56.093 1.00 0.00 C ATOM 2116 C TRP A 135 17.536 23.761 57.482 1.00 0.00 C ATOM 2117 O TRP A 135 17.516 22.685 58.075 1.00 0.00 O ATOM 2118 CB TRP A 135 18.006 24.486 55.161 1.00 0.00 C ATOM 2119 CG TRP A 135 17.468 24.621 53.777 1.00 0.00 C ATOM 2120 CD1 TRP A 135 18.108 25.270 52.791 1.00 0.00 C ATOM 2121 CD2 TRP A 135 16.243 24.074 53.191 1.00 0.00 C ATOM 2122 NE1 TRP A 135 17.359 25.177 51.631 1.00 0.00 N ATOM 2123 CE2 TRP A 135 16.203 24.445 51.826 1.00 0.00 C ATOM 2124 CE3 TRP A 135 15.173 23.307 53.698 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 15.147 24.067 50.997 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 14.110 22.928 52.863 1.00 0.00 C ATOM 2127 CH2 TRP A 135 14.099 23.305 51.514 1.00 0.00 C ATOM 0 H TRP A 135 16.085 25.777 55.434 1.00 0.00 H new ATOM 0 HA TRP A 135 16.524 22.983 55.776 1.00 0.00 H new ATOM 0 HB2 TRP A 135 18.350 25.456 55.520 1.00 0.00 H new ATOM 0 HB3 TRP A 135 18.870 23.822 55.159 1.00 0.00 H new ATOM 0 HD1 TRP A 135 19.054 25.782 52.888 1.00 0.00 H new ATOM 0 HE1 TRP A 135 17.627 25.597 50.741 1.00 0.00 H new ATOM 0 HE3 TRP A 135 15.172 23.009 54.736 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 15.141 24.363 49.958 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 13.296 22.342 53.263 1.00 0.00 H new ATOM 0 HH2 TRP A 135 13.281 23.006 50.875 1.00 0.00 H new ATOM 2138 N ARG A 136 18.056 24.834 58.004 1.00 0.00 N ATOM 2139 CA ARG A 136 18.675 24.793 59.361 1.00 0.00 C ATOM 2140 C ARG A 136 17.632 24.486 60.432 1.00 0.00 C ATOM 2141 O ARG A 136 17.969 24.195 61.579 1.00 0.00 O ATOM 2142 CB ARG A 136 19.264 26.188 59.576 1.00 0.00 C ATOM 2143 CG ARG A 136 20.180 26.171 60.802 1.00 0.00 C ATOM 2144 CD ARG A 136 20.794 27.558 61.003 1.00 0.00 C ATOM 2145 NE ARG A 136 20.090 28.128 62.191 1.00 0.00 N ATOM 2146 CZ ARG A 136 20.490 29.257 62.724 1.00 0.00 C ATOM 2147 NH1 ARG A 136 21.512 29.905 62.226 1.00 0.00 N ATOM 2148 NH2 ARG A 136 19.863 29.741 63.761 1.00 0.00 N ATOM 0 H ARG A 136 18.080 25.746 57.547 1.00 0.00 H new ATOM 0 HA ARG A 136 19.431 24.011 59.432 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.825 26.498 58.694 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.464 26.915 59.716 1.00 0.00 H new ATOM 0 HG2 ARG A 136 19.614 25.881 61.687 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.968 25.429 60.670 1.00 0.00 H new ATOM 0 HD2 ARG A 136 21.868 27.492 61.176 1.00 0.00 H new ATOM 0 HD3 ARG A 136 20.651 28.184 60.122 1.00 0.00 H new ATOM 0 HE ARG A 136 19.292 27.635 62.591 1.00 0.00 H new ATOM 0 HH11 ARG A 136 22.006 29.533 61.415 1.00 0.00 H new ATOM 0 HH12 ARG A 136 21.815 30.783 62.649 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.065 29.241 64.154 1.00 0.00 H new ATOM 0 HH22 ARG A 136 20.171 30.619 64.179 1.00 0.00 H new ATOM 2162 N ALA A 137 16.382 24.535 60.088 1.00 0.00 N ATOM 2163 CA ALA A 137 15.336 24.239 61.090 1.00 0.00 C ATOM 2164 C ALA A 137 15.052 22.739 61.112 1.00 0.00 C ATOM 2165 O ALA A 137 15.034 22.115 62.171 1.00 0.00 O ATOM 2166 CB ALA A 137 14.107 25.017 60.620 1.00 0.00 C ATOM 0 H ALA A 137 16.041 24.768 59.155 1.00 0.00 H new ATOM 0 HA ALA A 137 15.630 24.523 62.100 1.00 0.00 H new ATOM 0 HB1 ALA A 137 13.283 24.849 61.314 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.341 26.081 60.585 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.819 24.676 59.625 1.00 0.00 H new ATOM 2172 N ARG A 138 14.819 22.145 59.971 1.00 0.00 N ATOM 2173 CA ARG A 138 14.524 20.686 59.953 1.00 0.00 C ATOM 2174 C ARG A 138 15.738 19.851 59.537 1.00 0.00 C ATOM 2175 O ARG A 138 16.057 18.842 60.163 1.00 0.00 O ATOM 2176 CB ARG A 138 13.402 20.528 58.928 1.00 0.00 C ATOM 2177 CG ARG A 138 12.548 19.313 59.293 1.00 0.00 C ATOM 2178 CD ARG A 138 11.130 19.499 58.744 1.00 0.00 C ATOM 2179 NE ARG A 138 10.317 19.949 59.913 1.00 0.00 N ATOM 2180 CZ ARG A 138 9.058 20.281 59.763 1.00 0.00 C ATOM 2181 NH1 ARG A 138 8.486 20.225 58.588 1.00 0.00 N ATOM 2182 NH2 ARG A 138 8.366 20.670 60.799 1.00 0.00 N ATOM 0 H ARG A 138 14.820 22.604 59.060 1.00 0.00 H new ATOM 0 HA ARG A 138 14.250 20.332 60.947 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.785 21.426 58.906 1.00 0.00 H new ATOM 0 HB3 ARG A 138 13.821 20.405 57.929 1.00 0.00 H new ATOM 0 HG2 ARG A 138 12.992 18.407 58.882 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.517 19.190 60.376 1.00 0.00 H new ATOM 0 HD2 ARG A 138 11.111 20.238 57.943 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.743 18.569 58.329 1.00 0.00 H new ATOM 0 HE ARG A 138 10.746 19.998 60.837 1.00 0.00 H new ATOM 0 HH11 ARG A 138 9.021 19.920 57.775 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.505 20.486 58.485 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.805 20.714 61.718 1.00 0.00 H new ATOM 0 HH22 ARG A 138 7.386 20.930 60.689 1.00 0.00 H new ATOM 2196 N ARG A 139 16.393 20.221 58.463 1.00 0.00 N ATOM 2197 CA ARG A 139 17.551 19.399 57.991 1.00 0.00 C ATOM 2198 C ARG A 139 18.586 20.248 57.258 1.00 0.00 C ATOM 2199 O ARG A 139 18.201 21.229 56.650 1.00 0.00 O ATOM 2200 CB ARG A 139 16.934 18.375 57.037 1.00 0.00 C ATOM 2201 CG ARG A 139 17.818 17.126 56.982 1.00 0.00 C ATOM 2202 CD ARG A 139 16.952 15.894 56.700 1.00 0.00 C ATOM 2203 NE ARG A 139 16.253 16.193 55.415 1.00 0.00 N ATOM 2204 CZ ARG A 139 16.889 16.112 54.271 1.00 0.00 C ATOM 2205 NH1 ARG A 139 18.151 15.767 54.227 1.00 0.00 N ATOM 2206 NH2 ARG A 139 16.255 16.378 53.160 1.00 0.00 N ATOM 2207 OXT ARG A 139 19.747 19.878 57.290 1.00 0.00 O ATOM 0 H ARG A 139 16.180 21.044 57.900 1.00 0.00 H new ATOM 0 HA ARG A 139 18.079 18.938 58.825 1.00 0.00 H new ATOM 0 HB2 ARG A 139 15.932 18.109 57.372 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.833 18.806 56.041 1.00 0.00 H new ATOM 0 HG2 ARG A 139 18.574 17.237 56.204 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.348 17.002 57.926 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.562 14.995 56.616 1.00 0.00 H new ATOM 0 HD3 ARG A 139 16.238 15.721 57.506 1.00 0.00 H new ATOM 0 HE ARG A 139 15.270 16.463 55.427 1.00 0.00 H new ATOM 0 HH11 ARG A 139 18.653 15.557 55.090 1.00 0.00 H new ATOM 0 HH12 ARG A 139 18.633 15.708 53.330 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.271 16.647 53.186 1.00 0.00 H new ATOM 0 HH22 ARG A 139 16.744 16.317 52.267 1.00 0.00 H new