USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 914 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 401 ASN : amide:sc= 0 X(o=-0.34,f=-0.78) USER MOD Set 1.2: A 416 MET CE :methyl 157:sc= -0.344 (180deg=-1.41!) USER MOD Set 2.1: A 396 HIS : no HD1:sc= -2.95 K(o=-4.4,f=-6.8) USER MOD Set 2.2: A 399 LYS NZ :NH3+ 164:sc= -1.43! (180deg=-2.08!) USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 334 MET CE :methyl 159:sc= -0.173 (180deg=-0.789) USER MOD Single : A 340 TYR OH : rot 124:sc= -0.159 USER MOD Single : A 342 TYR OH : rot 123:sc= -1.09! USER MOD Single : A 343 GLN : amide:sc= -3.23! C(o=-3.2!,f=-1.6!) USER MOD Single : A 346 SER OG : rot -85:sc= 1.27 USER MOD Single : A 348 SER OG : rot 50:sc= 1.21 USER MOD Single : A 350 TYR OH : rot 180:sc= 0.0118 USER MOD Single : A 352 ASN : amide:sc= -0.269 K(o=-0.27,f=-1.4!) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 75:sc= 1.26 USER MOD Single : A 362 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.2 K(o=-0.2,f=-1.1!) USER MOD Single : A 379 HIS : no HE2:sc= -0.143 X(o=-0.14,f=-0.068) USER MOD Single : A 380 LYS NZ :NH3+ -152:sc= 1.93 (180deg=0.0543) USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.007) USER MOD Single : A 385 MET CE :methyl 171:sc= -6.36! (180deg=-6.76!) USER MOD Single : A 386 THR OG1 : rot -140:sc= -2.2! USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ -167:sc= 1.26 (180deg=1.16) USER MOD Single : A 390 MET CE :methyl -165:sc= -1.22 (180deg=-2.02) USER MOD Single : A 391 SER OG : rot -5:sc= 0.347 USER MOD Single : A 397 TYR OH : rot -30:sc= -0.603 USER MOD Single : A 398 TYR OH : rot -24:sc= 0.69 USER MOD Single : A 405 LYS NZ :NH3+ 175:sc= 0.409 (180deg=0.338) USER MOD Single : A 409 GLN : amide:sc= -4.18! K(o=-4.2!,f=-2.5) USER MOD Single : A 417 LYS NZ :NH3+ -172:sc= 1.13 (180deg=0.911) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.00325 USER MOD Single : A 423 MET CE :methyl -172:sc= 0 (180deg=-0.163) USER MOD Single : A 424 SER OG : rot -58:sc= 0.148 USER MOD Single : A 427 THR OG1 : rot -49:sc= -0.953 USER MOD Single : A 432 HIS : no HD1:sc= -0.0981 X(o=-0.098,f=0.0088) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.092) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -11.610 1.208 9.099 1.00 6.78 N ATOM 2 CA GLY A 331 -10.451 0.775 9.917 1.00 6.11 C ATOM 3 C GLY A 331 -10.604 -0.647 10.424 1.00 5.22 C ATOM 4 O GLY A 331 -11.122 -1.509 9.710 1.00 5.14 O ATOM 0 HA2 GLY A 331 -9.541 0.850 9.322 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -10.335 1.450 10.765 1.00 6.11 H new ATOM 10 N SER A 332 -10.139 -0.883 11.651 1.00 4.99 N ATOM 11 CA SER A 332 -10.232 -2.186 12.317 1.00 4.63 C ATOM 12 C SER A 332 -9.406 -3.240 11.574 1.00 3.82 C ATOM 13 O SER A 332 -8.201 -3.357 11.801 1.00 4.13 O ATOM 14 CB SER A 332 -11.692 -2.631 12.459 1.00 5.44 C ATOM 15 OG SER A 332 -12.482 -1.615 13.056 1.00 6.08 O ATOM 0 H SER A 332 -9.682 -0.169 12.218 1.00 4.99 H new ATOM 0 HA SER A 332 -9.818 -2.080 13.320 1.00 4.63 H new ATOM 0 HB2 SER A 332 -12.096 -2.880 11.478 1.00 5.44 H new ATOM 0 HB3 SER A 332 -11.742 -3.537 13.064 1.00 5.44 H new ATOM 0 HG SER A 332 -13.409 -1.924 13.133 1.00 6.08 H new ATOM 21 N HIS A 333 -10.037 -3.989 10.674 1.00 3.28 N ATOM 22 CA HIS A 333 -9.307 -4.961 9.875 1.00 2.94 C ATOM 23 C HIS A 333 -9.660 -4.806 8.401 1.00 2.02 C ATOM 24 O HIS A 333 -9.341 -5.660 7.578 1.00 2.49 O ATOM 25 CB HIS A 333 -9.546 -6.403 10.357 1.00 3.89 C ATOM 26 CG HIS A 333 -10.950 -6.904 10.201 1.00 4.68 C ATOM 27 ND1 HIS A 333 -11.340 -7.738 9.175 1.00 5.34 N ATOM 28 CD2 HIS A 333 -12.050 -6.716 10.967 1.00 5.35 C ATOM 29 CE1 HIS A 333 -12.617 -8.038 9.315 1.00 6.24 C ATOM 30 NE2 HIS A 333 -13.071 -7.432 10.394 1.00 6.26 N ATOM 0 H HIS A 333 -11.038 -3.941 10.483 1.00 3.28 H new ATOM 0 HA HIS A 333 -8.243 -4.761 10.001 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -8.877 -7.067 9.810 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -9.269 -6.468 11.409 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -12.113 -6.115 11.862 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -13.193 -8.672 8.657 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -14.027 -7.486 10.746 1.00 6.26 H new ATOM 39 N MET A 334 -10.316 -3.703 8.073 1.00 1.20 N ATOM 40 CA MET A 334 -10.568 -3.349 6.681 1.00 0.62 C ATOM 41 C MET A 334 -9.441 -2.464 6.175 1.00 0.57 C ATOM 42 O MET A 334 -9.665 -1.339 5.727 1.00 0.92 O ATOM 43 CB MET A 334 -11.910 -2.631 6.525 1.00 1.35 C ATOM 44 CG MET A 334 -13.117 -3.526 6.735 1.00 2.01 C ATOM 45 SD MET A 334 -14.675 -2.634 6.569 1.00 3.03 S ATOM 46 CE MET A 334 -14.558 -2.054 4.876 1.00 3.71 C ATOM 0 H MET A 334 -10.684 -3.036 8.751 1.00 1.20 H new ATOM 0 HA MET A 334 -10.610 -4.265 6.092 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.954 -1.806 7.236 1.00 1.35 H new ATOM 0 HB3 MET A 334 -11.963 -2.195 5.528 1.00 1.35 H new ATOM 0 HG2 MET A 334 -13.090 -4.342 6.013 1.00 2.01 H new ATOM 0 HG3 MET A 334 -13.064 -3.976 7.726 1.00 2.01 H new ATOM 0 HE1 MET A 334 -15.555 -1.821 4.501 1.00 3.71 H new ATOM 0 HE2 MET A 334 -13.939 -1.158 4.840 1.00 3.71 H new ATOM 0 HE3 MET A 334 -14.109 -2.830 4.256 1.00 3.71 H new ATOM 56 N ARG A 335 -8.223 -2.980 6.271 1.00 0.40 N ATOM 57 CA ARG A 335 -7.041 -2.232 5.877 1.00 0.32 C ATOM 58 C ARG A 335 -7.023 -2.019 4.378 1.00 0.28 C ATOM 59 O ARG A 335 -7.141 -2.970 3.602 1.00 0.42 O ATOM 60 CB ARG A 335 -5.773 -2.956 6.304 1.00 0.37 C ATOM 61 CG ARG A 335 -5.818 -3.410 7.742 1.00 0.56 C ATOM 62 CD ARG A 335 -4.440 -3.754 8.243 1.00 0.93 C ATOM 63 NE ARG A 335 -4.479 -4.334 9.585 1.00 1.32 N ATOM 64 CZ ARG A 335 -4.176 -5.604 9.856 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.808 -6.424 8.878 1.00 2.81 N ATOM 66 NH2 ARG A 335 -4.257 -6.054 11.099 1.00 2.51 N ATOM 0 H ARG A 335 -8.029 -3.919 6.620 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.077 -1.264 6.376 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.619 -3.821 5.659 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.917 -2.296 6.162 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -6.248 -2.624 8.362 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -6.469 -4.279 7.832 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.969 -4.458 7.557 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.822 -2.856 8.253 1.00 0.93 H new ATOM 0 HE ARG A 335 -4.754 -3.731 10.360 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -3.757 -6.082 7.918 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -3.576 -7.395 9.087 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -4.551 -5.429 11.849 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -4.025 -7.026 11.306 1.00 2.51 H new ATOM 80 N LEU A 336 -6.916 -0.762 3.985 1.00 0.23 N ATOM 81 CA LEU A 336 -6.716 -0.407 2.590 1.00 0.28 C ATOM 82 C LEU A 336 -5.406 -0.973 2.104 1.00 0.14 C ATOM 83 O LEU A 336 -4.621 -1.464 2.901 1.00 0.20 O ATOM 84 CB LEU A 336 -6.704 1.110 2.415 1.00 0.48 C ATOM 85 CG LEU A 336 -8.065 1.794 2.439 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.385 2.317 1.061 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.137 0.834 2.893 1.00 0.67 C ATOM 0 H LEU A 336 -6.965 0.036 4.618 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.539 -0.823 2.008 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.088 1.542 3.203 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.219 1.343 1.467 1.00 0.48 H new ATOM 0 HG LEU A 336 -8.032 2.624 3.145 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.359 2.807 1.075 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.622 3.034 0.758 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.406 1.488 0.353 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.101 1.343 2.903 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.181 -0.013 2.208 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.905 0.477 3.896 1.00 0.67 H new ATOM 99 N LEU A 337 -5.144 -0.890 0.818 1.00 0.15 N ATOM 100 CA LEU A 337 -3.909 -1.430 0.294 1.00 0.12 C ATOM 101 C LEU A 337 -2.727 -0.713 0.943 1.00 0.11 C ATOM 102 O LEU A 337 -1.810 -1.351 1.446 1.00 0.12 O ATOM 103 CB LEU A 337 -3.900 -1.301 -1.232 1.00 0.14 C ATOM 104 CG LEU A 337 -2.733 -1.950 -1.972 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.634 -0.946 -2.178 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.202 -3.157 -1.223 1.00 0.15 C ATOM 0 H LEU A 337 -5.758 -0.461 0.126 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.824 -2.490 0.533 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.826 -1.731 -1.614 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.914 -0.240 -1.483 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.098 -2.292 -2.940 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.805 -1.417 -2.707 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.011 -0.109 -2.766 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.287 -0.582 -1.211 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.372 -3.594 -1.779 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.856 -2.850 -0.236 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.996 -3.896 -1.115 1.00 0.15 H new ATOM 118 N TRP A 338 -2.797 0.610 0.999 1.00 0.12 N ATOM 119 CA TRP A 338 -1.760 1.403 1.659 1.00 0.14 C ATOM 120 C TRP A 338 -1.797 1.202 3.183 1.00 0.14 C ATOM 121 O TRP A 338 -0.763 1.222 3.844 1.00 0.17 O ATOM 122 CB TRP A 338 -1.909 2.897 1.298 1.00 0.16 C ATOM 123 CG TRP A 338 -3.214 3.502 1.714 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.306 3.704 0.925 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.566 3.986 3.015 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.315 4.273 1.653 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.887 4.453 2.938 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.895 4.062 4.236 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.549 4.985 4.034 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.554 4.590 5.324 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.873 5.046 5.214 1.00 0.21 C ATOM 0 H TRP A 338 -3.557 1.159 0.598 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.790 1.058 1.301 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.097 3.455 1.765 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.795 3.012 0.220 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.366 3.452 -0.123 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.237 4.522 1.295 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.877 3.713 4.326 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.566 5.339 3.954 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -3.046 4.653 6.275 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.365 5.455 6.084 1.00 0.21 H new ATOM 142 N ASP A 339 -2.991 0.988 3.736 1.00 0.14 N ATOM 143 CA ASP A 339 -3.140 0.793 5.182 1.00 0.17 C ATOM 144 C ASP A 339 -2.594 -0.571 5.569 1.00 0.16 C ATOM 145 O ASP A 339 -2.080 -0.779 6.670 1.00 0.23 O ATOM 146 CB ASP A 339 -4.610 0.947 5.606 1.00 0.23 C ATOM 147 CG ASP A 339 -4.791 0.859 7.112 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.522 1.860 7.806 1.00 1.15 O ATOM 149 OD2 ASP A 339 -5.210 -0.205 7.609 1.00 0.86 O ATOM 0 H ASP A 339 -3.864 0.945 3.211 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.569 1.559 5.707 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -4.989 1.906 5.253 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.207 0.172 5.125 1.00 0.23 H new ATOM 154 N TYR A 340 -2.684 -1.484 4.624 1.00 0.11 N ATOM 155 CA TYR A 340 -2.127 -2.808 4.760 1.00 0.10 C ATOM 156 C TYR A 340 -0.608 -2.745 4.710 1.00 0.08 C ATOM 157 O TYR A 340 0.058 -3.323 5.562 1.00 0.09 O ATOM 158 CB TYR A 340 -2.652 -3.689 3.635 1.00 0.11 C ATOM 159 CG TYR A 340 -2.416 -5.145 3.878 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.871 -5.736 5.041 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.744 -5.925 2.957 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.661 -7.068 5.287 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.529 -7.266 3.189 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.990 -7.835 4.360 1.00 0.16 C ATOM 165 OH TYR A 340 -1.774 -9.172 4.608 1.00 0.20 O ATOM 0 H TYR A 340 -3.151 -1.323 3.732 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.424 -3.230 5.720 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.721 -3.515 3.513 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.173 -3.400 2.700 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.401 -5.139 5.768 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.382 -5.478 2.043 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -3.020 -7.514 6.203 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.004 -7.867 2.461 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.144 -9.705 3.874 1.00 0.20 H new ATOM 175 N VAL A 341 -0.063 -2.016 3.729 1.00 0.08 N ATOM 176 CA VAL A 341 1.393 -1.942 3.562 1.00 0.07 C ATOM 177 C VAL A 341 2.051 -1.373 4.813 1.00 0.08 C ATOM 178 O VAL A 341 3.157 -1.753 5.146 1.00 0.08 O ATOM 179 CB VAL A 341 1.851 -1.113 2.325 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.048 -1.462 1.096 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.829 0.385 2.570 1.00 0.09 C ATOM 0 H VAL A 341 -0.598 -1.477 3.049 1.00 0.08 H new ATOM 0 HA VAL A 341 1.713 -2.970 3.393 1.00 0.07 H new ATOM 0 HB VAL A 341 2.891 -1.389 2.151 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.395 -0.865 0.253 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.174 -2.520 0.867 1.00 0.07 H new ATOM 0 HG13 VAL A 341 -0.006 -1.254 1.279 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.159 0.906 1.671 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.815 0.698 2.820 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.497 0.628 3.396 1.00 0.09 H new ATOM 191 N TYR A 342 1.362 -0.465 5.498 1.00 0.08 N ATOM 192 CA TYR A 342 1.858 0.070 6.775 1.00 0.10 C ATOM 193 C TYR A 342 2.119 -1.052 7.787 1.00 0.11 C ATOM 194 O TYR A 342 3.089 -1.001 8.542 1.00 0.14 O ATOM 195 CB TYR A 342 0.881 1.083 7.387 1.00 0.11 C ATOM 196 CG TYR A 342 1.073 2.509 6.918 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.206 3.228 7.282 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.120 3.147 6.135 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.385 4.537 6.875 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.298 4.453 5.725 1.00 0.19 C ATOM 201 CZ TYR A 342 1.433 5.142 6.096 1.00 0.17 C ATOM 202 OH TYR A 342 1.611 6.446 5.692 1.00 0.21 O ATOM 0 H TYR A 342 0.465 -0.083 5.199 1.00 0.08 H new ATOM 0 HA TYR A 342 2.796 0.578 6.553 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.137 0.772 7.153 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.982 1.055 8.472 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.960 2.755 7.894 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.773 2.614 5.843 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.271 5.080 7.169 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.451 4.935 5.114 1.00 0.19 H new ATOM 0 HH TYR A 342 1.574 6.493 4.714 1.00 0.21 H new ATOM 212 N GLN A 343 1.250 -2.058 7.801 1.00 0.12 N ATOM 213 CA GLN A 343 1.428 -3.231 8.663 1.00 0.18 C ATOM 214 C GLN A 343 2.680 -3.960 8.287 1.00 0.18 C ATOM 215 O GLN A 343 3.485 -4.355 9.125 1.00 0.25 O ATOM 216 CB GLN A 343 0.231 -4.178 8.521 1.00 0.28 C ATOM 217 CG GLN A 343 -1.029 -3.582 9.077 1.00 0.55 C ATOM 218 CD GLN A 343 -0.881 -3.291 10.548 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.321 -4.059 11.405 1.00 1.40 O ATOM 220 NE2 GLN A 343 -0.173 -2.222 10.834 1.00 1.15 N ATOM 0 H GLN A 343 0.410 -2.088 7.223 1.00 0.12 H new ATOM 0 HA GLN A 343 1.501 -2.893 9.697 1.00 0.18 H new ATOM 0 HB2 GLN A 343 0.083 -4.420 7.468 1.00 0.28 H new ATOM 0 HB3 GLN A 343 0.447 -5.114 9.036 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.268 -2.663 8.542 1.00 0.55 H new ATOM 0 HG3 GLN A 343 -1.861 -4.268 8.920 1.00 0.55 H new ATOM 0 HE21 GLN A 343 0.167 -1.620 10.084 1.00 1.15 H new ATOM 0 HE22 GLN A 343 0.037 -1.994 11.806 1.00 1.15 H new ATOM 229 N LEU A 344 2.822 -4.100 7.007 1.00 0.15 N ATOM 230 CA LEU A 344 3.882 -4.870 6.414 1.00 0.16 C ATOM 231 C LEU A 344 5.203 -4.114 6.482 1.00 0.18 C ATOM 232 O LEU A 344 6.284 -4.697 6.496 1.00 0.27 O ATOM 233 CB LEU A 344 3.460 -5.141 4.983 1.00 0.13 C ATOM 234 CG LEU A 344 1.953 -5.361 4.814 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.607 -5.706 3.394 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.443 -6.438 5.749 1.00 0.18 C ATOM 0 H LEU A 344 2.193 -3.675 6.326 1.00 0.15 H new ATOM 0 HA LEU A 344 4.045 -5.806 6.948 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.768 -4.302 4.358 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.989 -6.021 4.618 1.00 0.13 H new ATOM 0 HG LEU A 344 1.463 -4.422 5.071 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.531 -5.856 3.308 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.914 -4.892 2.737 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.125 -6.621 3.105 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.371 -6.569 5.603 1.00 0.18 H new ATOM 0 HD22 LEU A 344 1.955 -7.377 5.537 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.636 -6.145 6.781 1.00 0.18 H new ATOM 248 N LEU A 345 5.073 -2.807 6.521 1.00 0.12 N ATOM 249 CA LEU A 345 6.189 -1.888 6.670 1.00 0.13 C ATOM 250 C LEU A 345 6.728 -1.901 8.095 1.00 0.19 C ATOM 251 O LEU A 345 7.939 -1.841 8.314 1.00 0.29 O ATOM 252 CB LEU A 345 5.724 -0.473 6.309 1.00 0.10 C ATOM 253 CG LEU A 345 6.067 0.004 4.893 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.337 -1.168 3.980 1.00 0.12 C ATOM 255 CD2 LEU A 345 4.943 0.859 4.324 1.00 0.10 C ATOM 0 H LEU A 345 4.170 -2.339 6.449 1.00 0.12 H new ATOM 0 HA LEU A 345 6.991 -2.204 6.003 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.643 -0.423 6.436 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.161 0.225 7.023 1.00 0.10 H new ATOM 0 HG LEU A 345 6.970 0.611 4.956 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.578 -0.803 2.981 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.176 -1.745 4.368 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.452 -1.802 3.931 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.208 1.186 3.319 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.025 0.273 4.285 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.791 1.730 4.961 1.00 0.10 H new ATOM 267 N SER A 346 5.825 -1.973 9.061 1.00 0.25 N ATOM 268 CA SER A 346 6.206 -1.915 10.460 1.00 0.33 C ATOM 269 C SER A 346 6.578 -3.293 11.002 1.00 0.30 C ATOM 270 O SER A 346 7.555 -3.428 11.741 1.00 0.53 O ATOM 271 CB SER A 346 5.077 -1.293 11.280 1.00 0.51 C ATOM 272 OG SER A 346 3.825 -1.884 10.966 1.00 1.43 O ATOM 0 H SER A 346 4.823 -2.072 8.899 1.00 0.25 H new ATOM 0 HA SER A 346 7.094 -1.288 10.545 1.00 0.33 H new ATOM 0 HB2 SER A 346 5.285 -1.419 12.343 1.00 0.51 H new ATOM 0 HB3 SER A 346 5.034 -0.221 11.088 1.00 0.51 H new ATOM 0 HG SER A 346 3.440 -1.438 10.183 1.00 1.43 H new ATOM 278 N ASP A 347 5.804 -4.310 10.646 1.00 0.32 N ATOM 279 CA ASP A 347 6.092 -5.668 11.101 1.00 0.32 C ATOM 280 C ASP A 347 7.135 -6.336 10.204 1.00 0.30 C ATOM 281 O ASP A 347 7.007 -6.343 8.981 1.00 0.30 O ATOM 282 CB ASP A 347 4.823 -6.511 11.123 1.00 0.35 C ATOM 283 CG ASP A 347 4.887 -7.579 12.192 1.00 0.49 C ATOM 284 OD1 ASP A 347 5.685 -8.529 12.042 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.121 -7.488 13.168 1.00 0.67 O ATOM 0 H ASP A 347 4.980 -4.225 10.050 1.00 0.32 H new ATOM 0 HA ASP A 347 6.491 -5.599 12.113 1.00 0.32 H new ATOM 0 HB2 ASP A 347 3.961 -5.868 11.300 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.678 -6.978 10.149 1.00 0.35 H new ATOM 290 N SER A 348 8.147 -6.925 10.827 1.00 0.34 N ATOM 291 CA SER A 348 9.290 -7.476 10.108 1.00 0.35 C ATOM 292 C SER A 348 8.945 -8.782 9.401 1.00 0.31 C ATOM 293 O SER A 348 9.654 -9.210 8.491 1.00 0.32 O ATOM 294 CB SER A 348 10.450 -7.691 11.081 1.00 0.46 C ATOM 295 OG SER A 348 11.582 -8.256 10.443 1.00 1.53 O ATOM 0 H SER A 348 8.200 -7.034 11.840 1.00 0.34 H new ATOM 0 HA SER A 348 9.581 -6.760 9.339 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.726 -6.738 11.532 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.127 -8.345 11.891 1.00 0.46 H new ATOM 0 HG SER A 348 11.794 -7.741 9.637 1.00 1.53 H new ATOM 301 N ARG A 349 7.853 -9.417 9.796 1.00 0.33 N ATOM 302 CA ARG A 349 7.463 -10.670 9.181 1.00 0.35 C ATOM 303 C ARG A 349 7.056 -10.464 7.722 1.00 0.29 C ATOM 304 O ARG A 349 6.984 -11.419 6.953 1.00 0.34 O ATOM 305 CB ARG A 349 6.343 -11.325 9.964 1.00 0.42 C ATOM 306 CG ARG A 349 5.073 -10.522 9.990 1.00 0.55 C ATOM 307 CD ARG A 349 3.897 -11.450 10.046 1.00 0.59 C ATOM 308 NE ARG A 349 3.800 -12.151 11.320 1.00 1.23 N ATOM 309 CZ ARG A 349 2.998 -11.784 12.318 1.00 1.67 C ATOM 310 NH1 ARG A 349 2.215 -10.719 12.191 1.00 1.93 N ATOM 311 NH2 ARG A 349 2.980 -12.484 13.443 1.00 2.56 N ATOM 0 H ARG A 349 7.228 -9.088 10.532 1.00 0.33 H new ATOM 0 HA ARG A 349 8.326 -11.335 9.197 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.134 -12.304 9.533 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.677 -11.493 10.988 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.067 -9.858 10.854 1.00 0.55 H new ATOM 0 HG3 ARG A 349 5.010 -9.891 9.103 1.00 0.55 H new ATOM 0 HD2 ARG A 349 2.982 -10.882 9.877 1.00 0.59 H new ATOM 0 HD3 ARG A 349 3.974 -12.179 9.239 1.00 0.59 H new ATOM 0 HE ARG A 349 4.384 -12.976 11.456 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.226 -10.178 11.326 1.00 1.93 H new ATOM 0 HH12 ARG A 349 1.603 -10.442 12.958 1.00 1.93 H new ATOM 0 HH21 ARG A 349 3.580 -13.303 13.544 1.00 2.56 H new ATOM 0 HH22 ARG A 349 2.366 -12.204 14.208 1.00 2.56 H new ATOM 325 N TYR A 350 6.785 -9.216 7.348 1.00 0.22 N ATOM 326 CA TYR A 350 6.421 -8.902 5.976 1.00 0.17 C ATOM 327 C TYR A 350 7.532 -8.122 5.277 1.00 0.16 C ATOM 328 O TYR A 350 7.425 -7.831 4.088 1.00 0.15 O ATOM 329 CB TYR A 350 5.158 -8.054 5.930 1.00 0.17 C ATOM 330 CG TYR A 350 4.070 -8.451 6.891 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.280 -9.564 6.666 1.00 0.24 C ATOM 332 CD2 TYR A 350 3.810 -7.676 8.007 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.261 -9.892 7.526 1.00 0.29 C ATOM 334 CE2 TYR A 350 2.797 -7.998 8.877 1.00 0.28 C ATOM 335 CZ TYR A 350 2.019 -9.106 8.635 1.00 0.31 C ATOM 336 OH TYR A 350 1.004 -9.431 9.507 1.00 0.39 O ATOM 0 H TYR A 350 6.811 -8.412 7.975 1.00 0.22 H new ATOM 0 HA TYR A 350 6.256 -9.852 5.468 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.431 -7.017 6.127 1.00 0.17 H new ATOM 0 HB3 TYR A 350 4.755 -8.090 4.918 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.467 -10.184 5.802 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.415 -6.802 8.198 1.00 0.23 H new ATOM 0 HE1 TYR A 350 1.651 -10.762 7.335 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.612 -7.384 9.746 1.00 0.28 H new ATOM 0 HH TYR A 350 0.973 -8.773 10.233 1.00 0.39 H new ATOM 346 N GLU A 351 8.599 -7.796 6.010 1.00 0.18 N ATOM 347 CA GLU A 351 9.637 -6.892 5.497 1.00 0.21 C ATOM 348 C GLU A 351 10.343 -7.474 4.268 1.00 0.21 C ATOM 349 O GLU A 351 11.050 -6.765 3.546 1.00 0.24 O ATOM 350 CB GLU A 351 10.665 -6.549 6.581 1.00 0.28 C ATOM 351 CG GLU A 351 11.654 -7.659 6.861 1.00 0.48 C ATOM 352 CD GLU A 351 12.931 -7.152 7.496 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.911 -6.832 8.703 1.00 1.78 O ATOM 354 OE2 GLU A 351 13.962 -7.071 6.796 1.00 1.05 O ATOM 0 H GLU A 351 8.769 -8.141 6.955 1.00 0.18 H new ATOM 0 HA GLU A 351 9.132 -5.975 5.195 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.212 -5.656 6.279 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.138 -6.304 7.503 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.192 -8.395 7.519 1.00 0.48 H new ATOM 0 HG3 GLU A 351 11.894 -8.171 5.929 1.00 0.48 H new ATOM 361 N ASN A 352 10.151 -8.763 4.033 1.00 0.19 N ATOM 362 CA ASN A 352 10.712 -9.432 2.890 1.00 0.21 C ATOM 363 C ASN A 352 9.824 -9.270 1.655 1.00 0.16 C ATOM 364 O ASN A 352 10.263 -9.513 0.537 1.00 0.18 O ATOM 365 CB ASN A 352 10.905 -10.902 3.239 1.00 0.27 C ATOM 366 CG ASN A 352 9.674 -11.539 3.850 1.00 1.03 C ATOM 367 OD1 ASN A 352 9.422 -11.406 5.046 1.00 1.83 O ATOM 368 ND2 ASN A 352 8.918 -12.260 3.047 1.00 1.62 N ATOM 0 H ASN A 352 9.598 -9.369 4.638 1.00 0.19 H new ATOM 0 HA ASN A 352 11.674 -8.983 2.643 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.179 -11.449 2.337 1.00 0.27 H new ATOM 0 HB3 ASN A 352 11.738 -10.997 3.935 1.00 0.27 H new ATOM 0 HD21 ASN A 352 8.091 -12.732 3.412 1.00 1.62 H new ATOM 0 HD22 ASN A 352 9.160 -12.346 2.060 1.00 1.62 H new ATOM 375 N PHE A 353 8.576 -8.869 1.866 1.00 0.13 N ATOM 376 CA PHE A 353 7.661 -8.570 0.771 1.00 0.10 C ATOM 377 C PHE A 353 7.596 -7.064 0.515 1.00 0.08 C ATOM 378 O PHE A 353 7.287 -6.624 -0.590 1.00 0.07 O ATOM 379 CB PHE A 353 6.254 -9.068 1.093 1.00 0.09 C ATOM 380 CG PHE A 353 6.151 -10.538 1.360 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.833 -11.450 0.580 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.371 -11.004 2.400 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.741 -12.802 0.827 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.273 -12.356 2.658 1.00 0.17 C ATOM 385 CZ PHE A 353 5.961 -13.257 1.869 1.00 0.18 C ATOM 0 H PHE A 353 8.172 -8.743 2.794 1.00 0.13 H new ATOM 0 HA PHE A 353 8.037 -9.077 -0.117 1.00 0.10 H new ATOM 0 HB2 PHE A 353 5.884 -8.528 1.965 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.596 -8.818 0.261 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.448 -11.099 -0.236 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.831 -10.302 3.019 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.278 -13.504 0.206 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.660 -12.709 3.474 1.00 0.17 H new ATOM 0 HZ PHE A 353 5.888 -14.316 2.068 1.00 0.18 H new ATOM 395 N ILE A 354 7.897 -6.285 1.538 1.00 0.08 N ATOM 396 CA ILE A 354 7.778 -4.830 1.484 1.00 0.07 C ATOM 397 C ILE A 354 8.433 -4.250 2.728 1.00 0.08 C ATOM 398 O ILE A 354 8.481 -4.912 3.759 1.00 0.10 O ATOM 399 CB ILE A 354 6.294 -4.400 1.432 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.126 -2.929 1.046 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.639 -4.649 2.774 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.678 -2.477 1.038 1.00 0.07 C ATOM 0 H ILE A 354 8.232 -6.639 2.434 1.00 0.08 H new ATOM 0 HA ILE A 354 8.269 -4.461 0.583 1.00 0.07 H new ATOM 0 HB ILE A 354 5.811 -5.000 0.660 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.690 -2.310 1.744 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.556 -2.768 0.058 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.593 -4.344 2.731 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.698 -5.710 3.016 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.154 -4.072 3.543 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.627 -1.425 0.757 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.115 -3.073 0.320 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.251 -2.608 2.032 1.00 0.07 H new ATOM 414 N ARG A 355 8.943 -3.038 2.646 1.00 0.09 N ATOM 415 CA ARG A 355 9.628 -2.452 3.790 1.00 0.11 C ATOM 416 C ARG A 355 9.807 -0.955 3.620 1.00 0.10 C ATOM 417 O ARG A 355 9.825 -0.446 2.501 1.00 0.14 O ATOM 418 CB ARG A 355 11.004 -3.090 3.959 1.00 0.16 C ATOM 419 CG ARG A 355 12.001 -2.630 2.909 1.00 0.22 C ATOM 420 CD ARG A 355 13.371 -3.215 3.159 1.00 0.25 C ATOM 421 NE ARG A 355 14.414 -2.519 2.413 1.00 0.98 N ATOM 422 CZ ARG A 355 15.653 -2.977 2.267 1.00 1.40 C ATOM 423 NH1 ARG A 355 16.001 -4.154 2.765 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.547 -2.250 1.617 1.00 2.08 N ATOM 0 H ARG A 355 8.900 -2.445 1.817 1.00 0.09 H new ATOM 0 HA ARG A 355 9.013 -2.638 4.671 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.391 -2.851 4.950 1.00 0.16 H new ATOM 0 HB3 ARG A 355 10.905 -4.174 3.909 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.652 -2.925 1.919 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.062 -1.542 2.914 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.596 -3.167 4.225 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.370 -4.269 2.881 1.00 0.25 H new ATOM 0 HE ARG A 355 14.178 -1.627 1.977 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.315 -4.719 3.266 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.955 -4.496 2.647 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.284 -1.343 1.231 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.499 -2.596 1.502 1.00 2.08 H new ATOM 438 N TRP A 356 9.946 -0.259 4.737 1.00 0.10 N ATOM 439 CA TRP A 356 10.306 1.146 4.718 1.00 0.09 C ATOM 440 C TRP A 356 11.723 1.321 4.194 1.00 0.09 C ATOM 441 O TRP A 356 12.657 0.696 4.691 1.00 0.14 O ATOM 442 CB TRP A 356 10.253 1.748 6.118 1.00 0.10 C ATOM 443 CG TRP A 356 8.883 1.934 6.687 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.404 1.394 7.841 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.826 2.733 6.148 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.118 1.819 8.064 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.741 2.638 7.037 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.689 3.522 5.004 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.541 3.300 6.820 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.498 4.179 4.789 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.436 4.069 5.691 1.00 0.13 C ATOM 0 H TRP A 356 9.814 -0.648 5.671 1.00 0.10 H new ATOM 0 HA TRP A 356 9.590 1.652 4.071 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.823 1.108 6.791 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.754 2.716 6.098 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.956 0.728 8.487 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.539 1.565 8.865 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.503 3.615 4.300 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.720 3.212 7.516 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.382 4.791 3.907 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.516 4.600 5.494 1.00 0.13 H new ATOM 462 N GLU A 357 11.873 2.162 3.194 1.00 0.10 N ATOM 463 CA GLU A 357 13.186 2.599 2.757 1.00 0.12 C ATOM 464 C GLU A 357 13.551 3.858 3.522 1.00 0.14 C ATOM 465 O GLU A 357 14.713 4.113 3.837 1.00 0.21 O ATOM 466 CB GLU A 357 13.178 2.871 1.265 1.00 0.16 C ATOM 467 CG GLU A 357 13.067 1.614 0.426 1.00 0.25 C ATOM 468 CD GLU A 357 14.334 0.784 0.419 1.00 0.36 C ATOM 469 OE1 GLU A 357 15.227 1.058 -0.403 1.00 0.78 O ATOM 470 OE2 GLU A 357 14.446 -0.135 1.257 1.00 0.61 O ATOM 0 H GLU A 357 11.098 2.560 2.664 1.00 0.10 H new ATOM 0 HA GLU A 357 13.923 1.820 2.954 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.345 3.532 1.028 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.092 3.400 0.995 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.245 1.006 0.803 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.816 1.890 -0.598 1.00 0.25 H new ATOM 477 N ASP A 358 12.523 4.642 3.802 1.00 0.14 N ATOM 478 CA ASP A 358 12.626 5.806 4.664 1.00 0.16 C ATOM 479 C ASP A 358 11.315 5.966 5.411 1.00 0.16 C ATOM 480 O ASP A 358 10.381 6.576 4.900 1.00 0.20 O ATOM 481 CB ASP A 358 12.879 7.079 3.858 1.00 0.20 C ATOM 482 CG ASP A 358 13.783 8.053 4.582 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.292 8.754 5.493 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.984 8.124 4.246 1.00 1.33 O ATOM 0 H ASP A 358 11.585 4.486 3.433 1.00 0.14 H new ATOM 0 HA ASP A 358 13.462 5.657 5.347 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.327 6.816 2.900 1.00 0.20 H new ATOM 0 HB3 ASP A 358 11.927 7.564 3.642 1.00 0.20 H new ATOM 489 N LYS A 359 11.247 5.406 6.605 1.00 0.15 N ATOM 490 CA LYS A 359 10.019 5.405 7.392 1.00 0.17 C ATOM 491 C LYS A 359 9.496 6.816 7.622 1.00 0.19 C ATOM 492 O LYS A 359 8.313 7.090 7.432 1.00 0.23 O ATOM 493 CB LYS A 359 10.256 4.726 8.735 1.00 0.23 C ATOM 494 CG LYS A 359 9.047 4.789 9.649 1.00 0.29 C ATOM 495 CD LYS A 359 9.162 3.828 10.816 1.00 0.38 C ATOM 496 CE LYS A 359 7.876 3.791 11.621 1.00 0.91 C ATOM 497 NZ LYS A 359 8.015 2.990 12.865 1.00 1.50 N ATOM 0 H LYS A 359 12.034 4.941 7.058 1.00 0.15 H new ATOM 0 HA LYS A 359 9.269 4.852 6.826 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.524 3.683 8.567 1.00 0.23 H new ATOM 0 HB3 LYS A 359 11.105 5.198 9.230 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.932 5.805 10.027 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.148 4.558 9.077 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.393 2.829 10.447 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.989 4.129 11.459 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.580 4.808 11.877 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.078 3.372 11.008 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 7.113 2.993 13.382 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.271 2.012 12.621 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.758 3.404 13.463 1.00 1.50 H new ATOM 511 N GLU A 360 10.387 7.699 8.025 1.00 0.21 N ATOM 512 CA GLU A 360 10.022 9.074 8.326 1.00 0.27 C ATOM 513 C GLU A 360 9.560 9.812 7.077 1.00 0.24 C ATOM 514 O GLU A 360 8.617 10.602 7.124 1.00 0.37 O ATOM 515 CB GLU A 360 11.190 9.789 8.970 1.00 0.41 C ATOM 516 CG GLU A 360 11.541 9.207 10.323 1.00 0.63 C ATOM 517 CD GLU A 360 10.544 9.593 11.391 1.00 1.75 C ATOM 518 OE1 GLU A 360 10.511 10.781 11.776 1.00 1.97 O ATOM 519 OE2 GLU A 360 9.795 8.709 11.855 1.00 2.67 O ATOM 0 H GLU A 360 11.377 7.489 8.153 1.00 0.21 H new ATOM 0 HA GLU A 360 9.186 9.061 9.025 1.00 0.27 H new ATOM 0 HB2 GLU A 360 12.058 9.728 8.314 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.950 10.846 9.082 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.587 8.121 10.248 1.00 0.63 H new ATOM 0 HG3 GLU A 360 12.534 9.548 10.616 1.00 0.63 H new ATOM 526 N SER A 361 10.207 9.529 5.956 1.00 0.19 N ATOM 527 CA SER A 361 9.836 10.130 4.688 1.00 0.21 C ATOM 528 C SER A 361 8.664 9.377 4.059 1.00 0.19 C ATOM 529 O SER A 361 8.227 9.694 2.951 1.00 0.24 O ATOM 530 CB SER A 361 11.049 10.113 3.761 1.00 0.26 C ATOM 531 OG SER A 361 12.135 10.815 4.338 1.00 0.31 O ATOM 0 H SER A 361 10.995 8.884 5.901 1.00 0.19 H new ATOM 0 HA SER A 361 9.518 11.160 4.851 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.343 9.083 3.559 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.787 10.564 2.804 1.00 0.26 H new ATOM 0 HG SER A 361 12.533 10.273 5.051 1.00 0.31 H new ATOM 537 N LYS A 362 8.158 8.384 4.804 1.00 0.15 N ATOM 538 CA LYS A 362 7.097 7.494 4.345 1.00 0.14 C ATOM 539 C LYS A 362 7.434 6.883 2.993 1.00 0.12 C ATOM 540 O LYS A 362 6.582 6.729 2.125 1.00 0.15 O ATOM 541 CB LYS A 362 5.742 8.203 4.320 1.00 0.20 C ATOM 542 CG LYS A 362 4.943 8.004 5.600 1.00 0.48 C ATOM 543 CD LYS A 362 5.611 8.664 6.791 1.00 0.48 C ATOM 544 CE LYS A 362 4.923 8.303 8.102 1.00 0.51 C ATOM 545 NZ LYS A 362 5.569 8.962 9.269 1.00 1.23 N ATOM 0 H LYS A 362 8.481 8.179 5.750 1.00 0.15 H new ATOM 0 HA LYS A 362 7.021 6.677 5.063 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.899 9.269 4.158 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.161 7.835 3.475 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.942 8.415 5.471 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.827 6.938 5.794 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.657 8.360 6.835 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.598 9.746 6.661 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.874 8.597 8.054 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.945 7.222 8.238 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.071 8.690 10.141 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.563 8.662 9.330 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.525 9.995 9.153 1.00 1.23 H new ATOM 559 N ILE A 363 8.692 6.523 2.844 1.00 0.09 N ATOM 560 CA ILE A 363 9.185 5.883 1.645 1.00 0.09 C ATOM 561 C ILE A 363 9.333 4.398 1.896 1.00 0.08 C ATOM 562 O ILE A 363 9.940 3.997 2.884 1.00 0.10 O ATOM 563 CB ILE A 363 10.549 6.467 1.238 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.396 7.922 0.800 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.184 5.630 0.139 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.706 8.669 0.730 1.00 0.46 C ATOM 0 H ILE A 363 9.406 6.668 3.558 1.00 0.09 H new ATOM 0 HA ILE A 363 8.474 6.059 0.838 1.00 0.09 H new ATOM 0 HB ILE A 363 11.210 6.441 2.104 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.918 7.950 -0.179 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.731 8.435 1.495 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.148 6.060 -0.135 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.329 4.610 0.496 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.531 5.619 -0.733 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.523 9.696 0.413 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.176 8.672 1.713 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.366 8.180 0.013 1.00 0.46 H new ATOM 578 N PHE A 364 8.790 3.586 1.015 1.00 0.09 N ATOM 579 CA PHE A 364 8.853 2.154 1.189 1.00 0.09 C ATOM 580 C PHE A 364 9.158 1.476 -0.138 1.00 0.10 C ATOM 581 O PHE A 364 8.792 1.972 -1.203 1.00 0.13 O ATOM 582 CB PHE A 364 7.540 1.619 1.784 1.00 0.09 C ATOM 583 CG PHE A 364 6.384 1.570 0.833 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.194 0.477 0.008 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.481 2.607 0.783 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.119 0.422 -0.856 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.402 2.565 -0.080 1.00 0.14 C ATOM 588 CZ PHE A 364 4.221 1.468 -0.903 1.00 0.08 C ATOM 0 H PHE A 364 8.302 3.893 0.174 1.00 0.09 H new ATOM 0 HA PHE A 364 9.657 1.925 1.888 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.716 0.615 2.169 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.264 2.242 2.635 1.00 0.09 H new ATOM 0 HD1 PHE A 364 6.895 -0.344 0.040 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.617 3.464 1.426 1.00 0.13 H new ATOM 0 HE1 PHE A 364 4.981 -0.438 -1.494 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.702 3.387 -0.112 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.380 1.431 -1.580 1.00 0.08 H new ATOM 598 N ARG A 365 9.856 0.368 -0.070 1.00 0.10 N ATOM 599 CA ARG A 365 10.100 -0.445 -1.238 1.00 0.12 C ATOM 600 C ARG A 365 9.294 -1.726 -1.135 1.00 0.11 C ATOM 601 O ARG A 365 9.307 -2.380 -0.091 1.00 0.18 O ATOM 602 CB ARG A 365 11.578 -0.804 -1.319 1.00 0.17 C ATOM 603 CG ARG A 365 11.943 -1.596 -2.558 1.00 0.17 C ATOM 604 CD ARG A 365 12.300 -0.683 -3.713 1.00 0.31 C ATOM 605 NE ARG A 365 13.649 -0.145 -3.542 1.00 0.77 N ATOM 606 CZ ARG A 365 14.764 -0.884 -3.581 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.708 -2.178 -3.886 1.00 1.48 N ATOM 608 NH2 ARG A 365 15.935 -0.328 -3.309 1.00 0.99 N ATOM 0 H ARG A 365 10.268 0.006 0.790 1.00 0.10 H new ATOM 0 HA ARG A 365 9.808 0.113 -2.128 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.168 0.113 -1.297 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.852 -1.381 -0.436 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.785 -2.252 -2.337 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.107 -2.235 -2.842 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.238 -1.233 -4.652 1.00 0.31 H new ATOM 0 HD3 ARG A 365 11.581 0.134 -3.774 1.00 0.31 H new ATOM 0 HE ARG A 365 13.746 0.858 -3.383 1.00 0.77 H new ATOM 0 HH11 ARG A 365 13.810 -2.615 -4.093 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.563 -2.733 -3.913 1.00 1.48 H new ATOM 0 HH21 ARG A 365 15.986 0.662 -3.070 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.786 -0.890 -3.338 1.00 0.99 H new ATOM 622 N ILE A 366 8.582 -2.085 -2.187 1.00 0.07 N ATOM 623 CA ILE A 366 8.007 -3.399 -2.256 1.00 0.06 C ATOM 624 C ILE A 366 9.112 -4.375 -2.594 1.00 0.07 C ATOM 625 O ILE A 366 9.653 -4.389 -3.695 1.00 0.10 O ATOM 626 CB ILE A 366 6.849 -3.469 -3.262 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.644 -2.733 -2.670 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.507 -4.920 -3.591 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.557 -2.433 -3.663 1.00 0.09 C ATOM 0 H ILE A 366 8.394 -1.488 -2.992 1.00 0.07 H new ATOM 0 HA ILE A 366 7.570 -3.659 -1.292 1.00 0.06 H new ATOM 0 HB ILE A 366 7.140 -2.989 -4.197 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.227 -3.334 -1.862 1.00 0.07 H new ATOM 0 HG13 ILE A 366 5.985 -1.797 -2.228 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.684 -4.947 -4.305 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.379 -5.410 -4.023 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.213 -5.440 -2.679 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.741 -1.911 -3.163 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.955 -1.805 -4.460 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.185 -3.365 -4.088 1.00 0.09 H new ATOM 641 N VAL A 367 9.471 -5.141 -1.602 1.00 0.07 N ATOM 642 CA VAL A 367 10.638 -5.992 -1.666 1.00 0.08 C ATOM 643 C VAL A 367 10.345 -7.255 -2.460 1.00 0.09 C ATOM 644 O VAL A 367 11.128 -7.664 -3.320 1.00 0.12 O ATOM 645 CB VAL A 367 11.108 -6.335 -0.248 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.287 -7.280 -0.279 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.455 -5.058 0.501 1.00 0.10 C ATOM 0 H VAL A 367 8.963 -5.197 -0.719 1.00 0.07 H new ATOM 0 HA VAL A 367 11.436 -5.456 -2.180 1.00 0.08 H new ATOM 0 HB VAL A 367 10.297 -6.841 0.276 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.599 -7.506 0.741 1.00 0.12 H new ATOM 0 HG12 VAL A 367 12.001 -8.203 -0.784 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.113 -6.814 -0.816 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.789 -5.306 1.509 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.251 -4.532 -0.026 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.574 -4.419 0.558 1.00 0.10 H new ATOM 657 N ASP A 368 9.208 -7.852 -2.173 1.00 0.08 N ATOM 658 CA ASP A 368 8.731 -8.993 -2.924 1.00 0.09 C ATOM 659 C ASP A 368 7.238 -8.855 -3.154 1.00 0.08 C ATOM 660 O ASP A 368 6.414 -9.273 -2.341 1.00 0.09 O ATOM 661 CB ASP A 368 9.058 -10.298 -2.217 1.00 0.12 C ATOM 662 CG ASP A 368 8.781 -11.508 -3.085 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.599 -11.822 -3.326 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.753 -12.146 -3.545 1.00 0.78 O ATOM 0 H ASP A 368 8.590 -7.561 -1.415 1.00 0.08 H new ATOM 0 HA ASP A 368 9.240 -9.017 -3.888 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.108 -10.297 -1.924 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.472 -10.369 -1.301 1.00 0.12 H new ATOM 669 N PRO A 369 6.895 -8.224 -4.271 1.00 0.09 N ATOM 670 CA PRO A 369 5.518 -7.913 -4.659 1.00 0.10 C ATOM 671 C PRO A 369 4.646 -9.147 -4.808 1.00 0.12 C ATOM 672 O PRO A 369 3.448 -9.093 -4.568 1.00 0.14 O ATOM 673 CB PRO A 369 5.680 -7.212 -6.011 1.00 0.12 C ATOM 674 CG PRO A 369 7.032 -7.602 -6.484 1.00 0.12 C ATOM 675 CD PRO A 369 7.859 -7.745 -5.254 1.00 0.10 C ATOM 0 HA PRO A 369 5.018 -7.311 -3.900 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.909 -7.527 -6.714 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.594 -6.130 -5.908 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.997 -8.536 -7.044 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.448 -6.846 -7.150 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.677 -8.452 -5.396 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.305 -6.797 -4.954 1.00 0.10 H new ATOM 683 N ASN A 370 5.255 -10.253 -5.198 1.00 0.13 N ATOM 684 CA ASN A 370 4.530 -11.506 -5.352 1.00 0.17 C ATOM 685 C ASN A 370 4.044 -11.972 -3.992 1.00 0.17 C ATOM 686 O ASN A 370 2.894 -12.390 -3.828 1.00 0.21 O ATOM 687 CB ASN A 370 5.443 -12.561 -5.967 1.00 0.21 C ATOM 688 CG ASN A 370 4.701 -13.528 -6.876 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.563 -13.282 -8.076 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.231 -14.635 -6.325 1.00 0.59 N ATOM 0 H ASN A 370 6.250 -10.311 -5.414 1.00 0.13 H new ATOM 0 HA ASN A 370 3.675 -11.354 -6.011 1.00 0.17 H new ATOM 0 HB2 ASN A 370 6.230 -12.066 -6.536 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.931 -13.121 -5.170 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.735 -15.319 -6.897 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.364 -14.805 -5.328 1.00 0.59 H new ATOM 697 N GLY A 371 4.935 -11.863 -3.018 1.00 0.16 N ATOM 698 CA GLY A 371 4.608 -12.194 -1.650 1.00 0.19 C ATOM 699 C GLY A 371 3.680 -11.177 -1.029 1.00 0.13 C ATOM 700 O GLY A 371 2.821 -11.515 -0.217 1.00 0.13 O ATOM 0 H GLY A 371 5.894 -11.545 -3.157 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.142 -13.179 -1.617 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.524 -12.255 -1.063 1.00 0.19 H new ATOM 704 N LEU A 372 3.848 -9.926 -1.424 1.00 0.10 N ATOM 705 CA LEU A 372 3.092 -8.837 -0.826 1.00 0.08 C ATOM 706 C LEU A 372 1.673 -8.854 -1.367 1.00 0.11 C ATOM 707 O LEU A 372 0.707 -8.604 -0.651 1.00 0.13 O ATOM 708 CB LEU A 372 3.767 -7.494 -1.116 1.00 0.08 C ATOM 709 CG LEU A 372 3.531 -6.398 -0.069 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.115 -5.861 -0.126 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.814 -6.944 1.320 1.00 0.09 C ATOM 0 H LEU A 372 4.500 -9.639 -2.154 1.00 0.10 H new ATOM 0 HA LEU A 372 3.062 -8.970 0.255 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.840 -7.659 -1.209 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.416 -7.131 -2.082 1.00 0.08 H new ATOM 0 HG LEU A 372 4.210 -5.575 -0.291 1.00 0.08 H new ATOM 0 HD11 LEU A 372 1.989 -5.087 0.631 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.926 -5.438 -1.113 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.411 -6.671 0.062 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.645 -6.162 2.060 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.150 -7.785 1.523 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.850 -7.278 1.376 1.00 0.09 H new ATOM 723 N ALA A 373 1.567 -9.159 -2.647 1.00 0.12 N ATOM 724 CA ALA A 373 0.282 -9.306 -3.297 1.00 0.15 C ATOM 725 C ALA A 373 -0.490 -10.453 -2.680 1.00 0.14 C ATOM 726 O ALA A 373 -1.675 -10.328 -2.392 1.00 0.16 O ATOM 727 CB ALA A 373 0.481 -9.551 -4.774 1.00 0.20 C ATOM 0 H ALA A 373 2.367 -9.311 -3.262 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.290 -8.388 -3.161 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.489 -9.661 -5.259 1.00 0.20 H new ATOM 0 HB2 ALA A 373 1.013 -8.708 -5.214 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.063 -10.462 -4.917 1.00 0.20 H new ATOM 733 N ARG A 374 0.195 -11.570 -2.458 1.00 0.14 N ATOM 734 CA ARG A 374 -0.440 -12.732 -1.861 1.00 0.17 C ATOM 735 C ARG A 374 -0.904 -12.398 -0.448 1.00 0.14 C ATOM 736 O ARG A 374 -1.914 -12.911 0.012 1.00 0.16 O ATOM 737 CB ARG A 374 0.498 -13.942 -1.890 1.00 0.24 C ATOM 738 CG ARG A 374 1.278 -14.165 -0.624 1.00 0.28 C ATOM 739 CD ARG A 374 2.147 -15.404 -0.736 1.00 0.47 C ATOM 740 NE ARG A 374 1.346 -16.621 -0.876 1.00 1.44 N ATOM 741 CZ ARG A 374 1.275 -17.355 -1.990 1.00 2.04 C ATOM 742 NH1 ARG A 374 1.944 -16.997 -3.078 1.00 2.01 N ATOM 743 NH2 ARG A 374 0.531 -18.453 -2.011 1.00 3.03 N ATOM 0 H ARG A 374 1.183 -11.692 -2.682 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.319 -13.002 -2.447 1.00 0.17 H new ATOM 0 HB2 ARG A 374 -0.090 -14.835 -2.100 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.199 -13.821 -2.716 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.902 -13.295 -0.418 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.592 -14.271 0.217 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.811 -15.305 -1.595 1.00 0.47 H new ATOM 0 HD3 ARG A 374 2.779 -15.485 0.148 1.00 0.47 H new ATOM 0 HE ARG A 374 0.805 -16.930 -0.068 1.00 1.44 H new ATOM 0 HH11 ARG A 374 2.519 -16.155 -3.069 1.00 2.01 H new ATOM 0 HH12 ARG A 374 1.883 -17.564 -3.924 1.00 2.01 H new ATOM 0 HH21 ARG A 374 0.015 -18.735 -1.178 1.00 3.03 H new ATOM 0 HH22 ARG A 374 0.475 -19.015 -2.860 1.00 3.03 H new ATOM 757 N LEU A 375 -0.175 -11.506 0.218 1.00 0.13 N ATOM 758 CA LEU A 375 -0.591 -10.947 1.495 1.00 0.15 C ATOM 759 C LEU A 375 -1.895 -10.183 1.320 1.00 0.16 C ATOM 760 O LEU A 375 -2.856 -10.368 2.065 1.00 0.18 O ATOM 761 CB LEU A 375 0.498 -9.986 1.936 1.00 0.17 C ATOM 762 CG LEU A 375 1.091 -10.180 3.317 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.347 -11.649 3.602 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.384 -9.403 3.371 1.00 0.15 C ATOM 0 H LEU A 375 0.722 -11.152 -0.116 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.745 -11.735 2.232 1.00 0.15 H new ATOM 0 HB2 LEU A 375 1.310 -10.044 1.211 1.00 0.17 H new ATOM 0 HB3 LEU A 375 0.095 -8.975 1.883 1.00 0.17 H new ATOM 0 HG LEU A 375 0.393 -9.822 4.074 1.00 0.16 H new ATOM 0 HD11 LEU A 375 1.772 -11.757 4.600 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.408 -12.199 3.546 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.045 -12.046 2.865 1.00 0.29 H new ATOM 0 HD21 LEU A 375 2.839 -9.521 4.355 1.00 0.15 H new ATOM 0 HD22 LEU A 375 3.066 -9.778 2.608 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.182 -8.347 3.189 1.00 0.15 H new ATOM 776 N TRP A 376 -1.899 -9.325 0.309 1.00 0.16 N ATOM 777 CA TRP A 376 -3.046 -8.503 -0.037 1.00 0.18 C ATOM 778 C TRP A 376 -4.278 -9.373 -0.288 1.00 0.20 C ATOM 779 O TRP A 376 -5.345 -9.140 0.281 1.00 0.25 O ATOM 780 CB TRP A 376 -2.689 -7.680 -1.278 1.00 0.19 C ATOM 781 CG TRP A 376 -3.703 -6.655 -1.684 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.092 -6.365 -2.959 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.444 -5.777 -0.829 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.015 -5.353 -2.950 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.252 -4.980 -1.658 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.504 -5.580 0.556 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.110 -4.012 -1.157 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.355 -4.612 1.053 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.147 -3.839 0.197 1.00 0.24 C ATOM 0 H TRP A 376 -1.094 -9.180 -0.301 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.289 -7.834 0.788 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.740 -7.175 -1.098 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.533 -8.363 -2.113 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.726 -6.861 -3.846 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.454 -4.944 -3.775 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.896 -6.174 1.223 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.727 -3.417 -1.814 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.410 -4.449 2.119 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.802 -3.089 0.616 1.00 0.24 H new ATOM 800 N GLY A 377 -4.116 -10.389 -1.123 1.00 0.21 N ATOM 801 CA GLY A 377 -5.199 -11.314 -1.392 1.00 0.27 C ATOM 802 C GLY A 377 -5.531 -12.166 -0.192 1.00 0.30 C ATOM 803 O GLY A 377 -6.673 -12.584 -0.019 1.00 0.38 O ATOM 0 H GLY A 377 -3.249 -10.590 -1.622 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.085 -10.756 -1.695 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.926 -11.958 -2.228 1.00 0.27 H new ATOM 807 N ASN A 378 -4.528 -12.444 0.624 1.00 0.27 N ATOM 808 CA ASN A 378 -4.728 -13.157 1.877 1.00 0.30 C ATOM 809 C ASN A 378 -5.608 -12.351 2.819 1.00 0.30 C ATOM 810 O ASN A 378 -6.358 -12.904 3.621 1.00 0.35 O ATOM 811 CB ASN A 378 -3.388 -13.453 2.529 1.00 0.32 C ATOM 812 CG ASN A 378 -2.896 -14.845 2.205 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.679 -15.787 2.080 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.598 -14.970 2.039 1.00 0.42 N ATOM 0 H ASN A 378 -3.559 -12.185 0.440 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.231 -14.100 1.662 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.653 -12.721 2.194 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.478 -13.343 3.610 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.200 -15.877 1.796 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -0.989 -14.160 2.153 1.00 0.42 H new ATOM 821 N HIS A 379 -5.514 -11.037 2.699 1.00 0.28 N ATOM 822 CA HIS A 379 -6.284 -10.121 3.526 1.00 0.30 C ATOM 823 C HIS A 379 -7.688 -9.907 2.953 1.00 0.32 C ATOM 824 O HIS A 379 -8.670 -9.867 3.695 1.00 0.38 O ATOM 825 CB HIS A 379 -5.527 -8.790 3.641 1.00 0.28 C ATOM 826 CG HIS A 379 -6.245 -7.725 4.412 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.186 -7.667 5.782 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.008 -6.702 3.957 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.910 -6.618 6.129 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.430 -6.003 5.057 1.00 0.38 N ATOM 0 H HIS A 379 -4.902 -10.575 2.026 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.405 -10.552 4.520 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.563 -8.976 4.116 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.321 -8.417 2.638 1.00 0.28 H new ATOM 0 HD1 HIS A 379 -5.686 -8.303 6.404 1.00 0.43 H new ATOM 0 HD2 HIS A 379 -7.239 -6.480 2.926 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.064 -6.296 7.148 1.00 0.46 H new ATOM 838 N LYS A 380 -7.785 -9.780 1.633 1.00 0.32 N ATOM 839 CA LYS A 380 -9.070 -9.503 0.993 1.00 0.36 C ATOM 840 C LYS A 380 -9.822 -10.786 0.641 1.00 0.41 C ATOM 841 O LYS A 380 -10.927 -10.736 0.099 1.00 0.45 O ATOM 842 CB LYS A 380 -8.880 -8.663 -0.269 1.00 0.36 C ATOM 843 CG LYS A 380 -7.971 -7.462 -0.078 1.00 0.38 C ATOM 844 CD LYS A 380 -8.299 -6.346 -1.055 1.00 0.63 C ATOM 845 CE LYS A 380 -8.322 -6.819 -2.501 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.562 -5.691 -3.448 1.00 0.77 N ATOM 0 H LYS A 380 -6.998 -9.863 0.989 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.666 -8.944 1.714 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.469 -9.295 -1.056 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.855 -8.317 -0.614 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -8.067 -7.092 0.943 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -6.933 -7.767 -0.210 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.270 -5.920 -0.801 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -7.563 -5.549 -0.950 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.374 -7.300 -2.741 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.102 -7.571 -2.625 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.030 -6.050 -4.304 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.170 -4.980 -2.994 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -7.654 -5.256 -3.707 1.00 0.77 H new ATOM 860 N ASN A 381 -9.207 -11.925 0.960 1.00 0.44 N ATOM 861 CA ASN A 381 -9.779 -13.246 0.690 1.00 0.52 C ATOM 862 C ASN A 381 -10.025 -13.463 -0.802 1.00 0.53 C ATOM 863 O ASN A 381 -11.095 -13.915 -1.206 1.00 0.60 O ATOM 864 CB ASN A 381 -11.081 -13.449 1.471 1.00 0.58 C ATOM 865 CG ASN A 381 -10.874 -13.478 2.973 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.931 -12.445 3.641 1.00 1.87 O ATOM 867 ND2 ASN A 381 -10.643 -14.661 3.514 1.00 2.01 N ATOM 0 H ASN A 381 -8.295 -11.958 1.415 1.00 0.44 H new ATOM 0 HA ASN A 381 -9.049 -13.984 1.022 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -11.776 -12.648 1.221 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.545 -14.384 1.156 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -10.504 -14.743 4.521 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -10.604 -15.492 2.925 1.00 2.01 H new ATOM 874 N ARG A 382 -9.025 -13.152 -1.621 1.00 0.50 N ATOM 875 CA ARG A 382 -9.153 -13.308 -3.069 1.00 0.55 C ATOM 876 C ARG A 382 -8.160 -14.330 -3.594 1.00 0.68 C ATOM 877 O ARG A 382 -7.013 -14.386 -3.149 1.00 0.78 O ATOM 878 CB ARG A 382 -8.926 -11.976 -3.789 1.00 0.49 C ATOM 879 CG ARG A 382 -9.805 -10.850 -3.290 1.00 0.48 C ATOM 880 CD ARG A 382 -11.269 -11.140 -3.550 1.00 0.57 C ATOM 881 NE ARG A 382 -12.117 -10.025 -3.146 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.360 -10.153 -2.693 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.938 -11.347 -2.657 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.030 -9.082 -2.287 1.00 1.27 N ATOM 0 H ARG A 382 -8.122 -12.793 -1.311 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.167 -13.654 -3.268 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -7.882 -11.686 -3.675 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.103 -12.116 -4.855 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.644 -10.706 -2.222 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.523 -9.920 -3.783 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.417 -11.345 -4.610 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.565 -12.038 -3.007 1.00 0.57 H new ATOM 0 HE ARG A 382 -11.731 -9.084 -3.216 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.428 -12.170 -2.978 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.892 -11.441 -2.309 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.591 -8.162 -2.323 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -14.984 -9.179 -1.939 1.00 1.27 H new ATOM 898 N THR A 383 -8.612 -15.127 -4.547 1.00 0.76 N ATOM 899 CA THR A 383 -7.769 -16.110 -5.201 1.00 0.95 C ATOM 900 C THR A 383 -7.093 -15.491 -6.423 1.00 0.94 C ATOM 901 O THR A 383 -5.924 -15.747 -6.707 1.00 1.22 O ATOM 902 CB THR A 383 -8.603 -17.325 -5.659 1.00 1.17 C ATOM 903 OG1 THR A 383 -9.269 -17.932 -4.541 1.00 1.24 O ATOM 904 CG2 THR A 383 -7.724 -18.349 -6.354 1.00 1.37 C ATOM 0 H THR A 383 -9.573 -15.110 -4.888 1.00 0.76 H new ATOM 0 HA THR A 383 -7.016 -16.438 -4.484 1.00 0.95 H new ATOM 0 HB THR A 383 -9.353 -16.970 -6.366 1.00 1.17 H new ATOM 0 HG1 THR A 383 -9.794 -18.699 -4.850 1.00 1.24 H new ATOM 0 HG21 THR A 383 -8.332 -19.197 -6.669 1.00 1.37 H new ATOM 0 HG22 THR A 383 -7.256 -17.894 -7.227 1.00 1.37 H new ATOM 0 HG23 THR A 383 -6.951 -18.692 -5.666 1.00 1.37 H new ATOM 912 N ASN A 384 -7.844 -14.657 -7.127 1.00 0.84 N ATOM 913 CA ASN A 384 -7.380 -14.046 -8.373 1.00 0.81 C ATOM 914 C ASN A 384 -6.497 -12.842 -8.122 1.00 0.64 C ATOM 915 O ASN A 384 -6.147 -12.116 -9.054 1.00 0.77 O ATOM 916 CB ASN A 384 -8.559 -13.562 -9.186 1.00 0.89 C ATOM 917 CG ASN A 384 -8.398 -13.812 -10.677 1.00 1.40 C ATOM 918 OD1 ASN A 384 -9.378 -14.021 -11.388 1.00 2.21 O ATOM 919 ND2 ASN A 384 -7.164 -13.798 -11.162 1.00 1.70 N ATOM 0 H ASN A 384 -8.788 -14.383 -6.856 1.00 0.84 H new ATOM 0 HA ASN A 384 -6.815 -14.814 -8.901 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.463 -14.060 -8.836 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.697 -12.494 -9.015 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -7.005 -13.964 -12.156 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -6.374 -13.621 -10.541 1.00 1.70 H new ATOM 926 N MET A 385 -6.179 -12.599 -6.876 1.00 0.55 N ATOM 927 CA MET A 385 -5.381 -11.447 -6.525 1.00 0.42 C ATOM 928 C MET A 385 -3.977 -11.570 -7.101 1.00 0.53 C ATOM 929 O MET A 385 -3.403 -12.659 -7.148 1.00 0.94 O ATOM 930 CB MET A 385 -5.367 -11.274 -5.003 1.00 0.47 C ATOM 931 CG MET A 385 -4.028 -10.832 -4.421 1.00 0.92 C ATOM 932 SD MET A 385 -2.806 -12.170 -4.366 1.00 2.54 S ATOM 933 CE MET A 385 -3.715 -13.466 -3.526 1.00 3.18 C ATOM 0 H MET A 385 -6.459 -13.181 -6.087 1.00 0.55 H new ATOM 0 HA MET A 385 -5.824 -10.552 -6.961 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.126 -10.542 -4.728 1.00 0.47 H new ATOM 0 HB3 MET A 385 -5.653 -12.219 -4.541 1.00 0.47 H new ATOM 0 HG2 MET A 385 -3.632 -10.010 -5.017 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.185 -10.448 -3.413 1.00 0.92 H new ATOM 0 HE1 MET A 385 -3.145 -14.394 -3.566 1.00 3.18 H new ATOM 0 HE2 MET A 385 -3.875 -13.183 -2.486 1.00 3.18 H new ATOM 0 HE3 MET A 385 -4.678 -13.610 -4.015 1.00 3.18 H new ATOM 943 N THR A 386 -3.453 -10.458 -7.578 1.00 0.23 N ATOM 944 CA THR A 386 -2.097 -10.404 -8.076 1.00 0.24 C ATOM 945 C THR A 386 -1.462 -9.087 -7.647 1.00 0.16 C ATOM 946 O THR A 386 -2.126 -8.265 -7.006 1.00 0.18 O ATOM 947 CB THR A 386 -2.049 -10.523 -9.616 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.628 -9.364 -10.218 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.803 -11.756 -10.098 1.00 0.44 C ATOM 0 H THR A 386 -3.954 -9.571 -7.630 1.00 0.23 H new ATOM 0 HA THR A 386 -1.546 -11.247 -7.659 1.00 0.24 H new ATOM 0 HB THR A 386 -1.002 -10.612 -9.907 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.162 -9.631 -10.995 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.751 -11.812 -11.185 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.352 -12.650 -9.667 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.846 -11.689 -9.787 1.00 0.44 H new ATOM 957 N TYR A 387 -0.204 -8.868 -7.996 1.00 0.16 N ATOM 958 CA TYR A 387 0.429 -7.583 -7.713 1.00 0.13 C ATOM 959 C TYR A 387 -0.227 -6.512 -8.572 1.00 0.14 C ATOM 960 O TYR A 387 -0.293 -5.345 -8.197 1.00 0.17 O ATOM 961 CB TYR A 387 1.936 -7.608 -7.974 1.00 0.15 C ATOM 962 CG TYR A 387 2.565 -6.270 -7.675 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.518 -5.747 -6.391 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.153 -5.506 -8.677 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.041 -4.515 -6.111 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.676 -4.260 -8.401 1.00 0.14 C ATOM 967 CZ TYR A 387 3.617 -3.768 -7.116 1.00 0.12 C ATOM 968 OH TYR A 387 4.132 -2.524 -6.838 1.00 0.13 O ATOM 0 H TYR A 387 0.393 -9.548 -8.467 1.00 0.16 H new ATOM 0 HA TYR A 387 0.292 -7.364 -6.654 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.401 -8.377 -7.358 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.123 -7.876 -9.014 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.061 -6.322 -5.600 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.201 -5.893 -9.684 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.003 -4.128 -5.104 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.129 -3.674 -9.187 1.00 0.14 H new ATOM 0 HH TYR A 387 4.501 -2.132 -7.657 1.00 0.13 H new ATOM 978 N GLU A 388 -0.727 -6.931 -9.725 1.00 0.17 N ATOM 979 CA GLU A 388 -1.483 -6.051 -10.600 1.00 0.24 C ATOM 980 C GLU A 388 -2.691 -5.474 -9.860 1.00 0.25 C ATOM 981 O GLU A 388 -2.983 -4.278 -9.961 1.00 0.31 O ATOM 982 CB GLU A 388 -1.917 -6.816 -11.852 1.00 0.30 C ATOM 983 CG GLU A 388 -2.942 -6.102 -12.700 1.00 0.44 C ATOM 984 CD GLU A 388 -4.271 -6.831 -12.738 1.00 1.53 C ATOM 985 OE1 GLU A 388 -4.346 -7.921 -13.349 1.00 1.96 O ATOM 986 OE2 GLU A 388 -5.244 -6.321 -12.147 1.00 2.21 O ATOM 0 H GLU A 388 -0.621 -7.882 -10.077 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.850 -5.218 -10.906 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -1.037 -7.018 -12.462 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.323 -7.781 -11.550 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -3.094 -5.095 -12.310 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -2.560 -5.997 -13.715 1.00 0.44 H new ATOM 993 N LYS A 389 -3.373 -6.322 -9.095 1.00 0.23 N ATOM 994 CA LYS A 389 -4.494 -5.881 -8.265 1.00 0.28 C ATOM 995 C LYS A 389 -4.031 -4.899 -7.188 1.00 0.28 C ATOM 996 O LYS A 389 -4.783 -4.020 -6.775 1.00 0.40 O ATOM 997 CB LYS A 389 -5.205 -7.075 -7.615 1.00 0.32 C ATOM 998 CG LYS A 389 -6.158 -7.811 -8.546 1.00 0.45 C ATOM 999 CD LYS A 389 -5.430 -8.535 -9.663 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.388 -9.021 -10.742 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.420 -9.949 -10.208 1.00 1.39 N ATOM 0 H LYS A 389 -3.170 -7.320 -9.032 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.201 -5.370 -8.919 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.455 -7.777 -7.251 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.761 -6.724 -6.746 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.741 -8.530 -7.970 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.863 -7.100 -8.976 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.691 -7.868 -10.107 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.886 -9.385 -9.251 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.878 -8.163 -11.202 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -5.822 -9.524 -11.527 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.905 -10.421 -10.998 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -6.965 -10.663 -9.604 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -8.113 -9.413 -9.648 1.00 1.39 H new ATOM 1015 N MET A 390 -2.799 -5.056 -6.729 1.00 0.19 N ATOM 1016 CA MET A 390 -2.218 -4.127 -5.762 1.00 0.17 C ATOM 1017 C MET A 390 -1.824 -2.819 -6.439 1.00 0.16 C ATOM 1018 O MET A 390 -2.066 -1.733 -5.911 1.00 0.17 O ATOM 1019 CB MET A 390 -0.989 -4.744 -5.092 1.00 0.15 C ATOM 1020 CG MET A 390 -0.355 -3.828 -4.061 1.00 0.14 C ATOM 1021 SD MET A 390 1.114 -4.528 -3.293 1.00 0.18 S ATOM 1022 CE MET A 390 1.556 -3.194 -2.181 1.00 1.57 C ATOM 0 H MET A 390 -2.179 -5.817 -7.008 1.00 0.19 H new ATOM 0 HA MET A 390 -2.973 -3.921 -5.003 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.275 -5.680 -4.612 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.251 -4.990 -5.855 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.092 -2.883 -4.537 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.088 -3.602 -3.287 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.576 -3.340 -1.826 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.488 -2.243 -2.709 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.873 -3.187 -1.331 1.00 1.57 H new ATOM 1032 N SER A 391 -1.210 -2.928 -7.608 1.00 0.15 N ATOM 1033 CA SER A 391 -0.759 -1.757 -8.344 1.00 0.17 C ATOM 1034 C SER A 391 -1.933 -0.878 -8.766 1.00 0.19 C ATOM 1035 O SER A 391 -1.790 0.336 -8.849 1.00 0.21 O ATOM 1036 CB SER A 391 0.070 -2.171 -9.563 1.00 0.23 C ATOM 1037 OG SER A 391 -0.667 -3.009 -10.436 1.00 1.02 O ATOM 0 H SER A 391 -1.013 -3.817 -8.067 1.00 0.15 H new ATOM 0 HA SER A 391 -0.127 -1.170 -7.678 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.396 -1.281 -10.101 1.00 0.23 H new ATOM 0 HB3 SER A 391 0.969 -2.691 -9.232 1.00 0.23 H new ATOM 0 HG SER A 391 -1.538 -3.212 -10.036 1.00 1.02 H new ATOM 1043 N ARG A 392 -3.096 -1.489 -9.014 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.298 -0.731 -9.359 1.00 0.26 C ATOM 1045 C ARG A 392 -4.628 0.238 -8.235 1.00 0.22 C ATOM 1046 O ARG A 392 -4.989 1.391 -8.472 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.465 -1.672 -9.660 1.00 0.38 C ATOM 1048 CG ARG A 392 -6.306 -2.052 -8.468 1.00 1.12 C ATOM 1049 CD ARG A 392 -7.429 -1.056 -8.235 1.00 2.05 C ATOM 1050 NE ARG A 392 -8.633 -1.395 -8.994 1.00 2.61 N ATOM 1051 CZ ARG A 392 -9.833 -1.576 -8.439 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -10.011 -1.368 -7.139 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -10.865 -1.938 -9.189 1.00 4.06 N ATOM 0 H ARG A 392 -3.228 -2.500 -8.982 1.00 0.21 H new ATOM 0 HA ARG A 392 -4.114 -0.153 -10.265 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -6.108 -1.201 -10.403 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -5.070 -2.582 -10.111 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -6.726 -3.046 -8.621 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.676 -2.105 -7.580 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -7.669 -1.023 -7.172 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -7.092 -0.058 -8.517 1.00 2.05 H new ATOM 0 HE ARG A 392 -8.550 -1.499 -10.005 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -9.228 -1.068 -6.559 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -10.931 -1.508 -6.721 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -10.742 -2.079 -10.192 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -11.781 -2.076 -8.763 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.463 -0.244 -7.011 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.684 0.562 -5.829 1.00 0.17 C ATOM 1069 C ALA A 393 -3.649 1.672 -5.759 1.00 0.12 C ATOM 1070 O ALA A 393 -3.991 2.844 -5.642 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.620 -0.311 -4.589 1.00 0.20 C ATOM 0 H ALA A 393 -4.173 -1.202 -6.815 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.674 1.015 -5.882 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.787 0.302 -3.703 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.388 -1.082 -4.647 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.639 -0.781 -4.525 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.380 1.287 -5.857 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.274 2.238 -5.829 1.00 0.10 C ATOM 1079 C LEU A 394 -1.457 3.327 -6.880 1.00 0.11 C ATOM 1080 O LEU A 394 -1.366 4.511 -6.571 1.00 0.12 O ATOM 1081 CB LEU A 394 0.051 1.509 -6.055 1.00 0.11 C ATOM 1082 CG LEU A 394 0.423 0.496 -4.975 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.563 -0.389 -5.447 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.805 1.217 -3.697 1.00 0.13 C ATOM 0 H LEU A 394 -2.091 0.314 -5.957 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.261 2.713 -4.848 1.00 0.10 H new ATOM 0 HB2 LEU A 394 0.006 0.994 -7.015 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.848 2.249 -6.127 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.441 -0.137 -4.775 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.815 -1.105 -4.665 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.259 -0.925 -6.346 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.434 0.227 -5.669 1.00 0.13 H new ATOM 0 HD21 LEU A 394 1.069 0.487 -2.932 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.659 1.867 -3.887 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.038 1.816 -3.351 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.743 2.920 -8.114 1.00 0.12 N ATOM 1097 CA ARG A 395 -1.935 3.860 -9.215 1.00 0.14 C ATOM 1098 C ARG A 395 -3.050 4.851 -8.903 1.00 0.14 C ATOM 1099 O ARG A 395 -2.987 6.018 -9.294 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.256 3.113 -10.515 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.094 2.307 -11.080 1.00 0.33 C ATOM 1102 CD ARG A 395 0.020 3.208 -11.583 1.00 0.52 C ATOM 1103 NE ARG A 395 -0.464 4.167 -12.571 1.00 1.30 N ATOM 1104 CZ ARG A 395 0.179 5.287 -12.896 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.370 5.550 -12.372 1.00 1.66 N ATOM 1106 NH2 ARG A 395 -0.357 6.133 -13.760 1.00 2.64 N ATOM 0 H ARG A 395 -1.847 1.940 -8.377 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.004 4.413 -9.342 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.095 2.441 -10.336 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.580 3.835 -11.264 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.704 1.641 -10.310 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.450 1.678 -11.896 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.462 3.743 -10.743 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.809 2.599 -12.024 1.00 0.52 H new ATOM 0 HE ARG A 395 -1.347 3.968 -13.040 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.796 4.893 -11.718 1.00 1.66 H new ATOM 0 HH12 ARG A 395 1.859 6.409 -12.623 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -1.264 5.928 -14.179 1.00 2.64 H new ATOM 0 HH22 ARG A 395 0.137 6.990 -14.008 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.073 4.389 -8.200 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.182 5.250 -7.827 1.00 0.13 C ATOM 1122 C HIS A 396 -4.776 6.152 -6.669 1.00 0.11 C ATOM 1123 O HIS A 396 -5.133 7.331 -6.627 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.411 4.419 -7.461 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.697 5.164 -7.624 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -7.822 6.189 -8.531 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.875 4.994 -6.984 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.067 6.615 -8.423 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.745 5.922 -7.499 1.00 0.26 N ATOM 0 H HIS A 396 -4.157 3.425 -7.878 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.441 5.876 -8.681 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.435 3.525 -8.084 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.321 4.085 -6.427 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.090 4.267 -6.215 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.486 7.421 -9.007 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.720 6.058 -7.230 1.00 0.26 H new ATOM 1137 N TYR A 397 -3.986 5.595 -5.756 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.519 6.320 -4.580 1.00 0.10 C ATOM 1139 C TYR A 397 -2.711 7.550 -4.966 1.00 0.09 C ATOM 1140 O TYR A 397 -2.691 8.537 -4.235 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.675 5.411 -3.680 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.466 4.290 -3.064 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.848 4.341 -3.036 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.836 3.184 -2.523 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.589 3.324 -2.488 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.573 2.151 -1.968 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.953 2.228 -1.955 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.694 1.208 -1.401 1.00 0.30 O ATOM 0 H TYR A 397 -3.653 4.632 -5.810 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.402 6.647 -4.032 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.856 4.991 -4.264 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.227 6.010 -2.887 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.354 5.199 -3.454 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.758 3.125 -2.533 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.667 3.385 -2.476 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -3.073 1.291 -1.548 1.00 0.24 H new ATOM 0 HH TYR A 397 -6.525 1.571 -1.031 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.042 7.489 -6.110 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.210 8.602 -6.553 1.00 0.12 C ATOM 1160 C TYR A 398 -2.055 9.845 -6.785 1.00 0.14 C ATOM 1161 O TYR A 398 -1.748 10.925 -6.280 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.464 8.269 -7.849 1.00 0.14 C ATOM 1163 CG TYR A 398 0.368 7.002 -7.818 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.868 6.475 -6.628 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.655 6.333 -8.997 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.624 5.318 -6.622 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.408 5.182 -8.999 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.888 4.678 -7.813 1.00 0.14 C ATOM 1169 OH TYR A 398 2.637 3.531 -7.824 1.00 0.18 O ATOM 0 H TYR A 398 -2.058 6.689 -6.743 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.483 8.788 -5.763 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.193 8.184 -8.655 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.189 9.106 -8.096 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.661 6.979 -5.696 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.280 6.723 -9.932 1.00 0.15 H new ATOM 0 HE1 TYR A 398 2.004 4.920 -5.693 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.622 4.676 -9.929 1.00 0.16 H new ATOM 0 HH TYR A 398 3.214 3.509 -7.032 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.126 9.683 -7.552 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.003 10.796 -7.881 1.00 0.19 C ATOM 1181 C LYS A 399 -4.688 11.332 -6.640 1.00 0.19 C ATOM 1182 O LYS A 399 -4.897 12.536 -6.498 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.067 10.386 -8.888 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.542 10.171 -10.302 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.285 8.703 -10.593 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.556 7.890 -10.432 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.371 6.471 -10.835 1.00 0.71 N ATOM 0 H LYS A 399 -3.407 8.790 -7.957 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.377 11.573 -8.318 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.540 9.466 -8.545 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -5.841 11.153 -8.913 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.262 10.563 -11.020 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.619 10.735 -10.436 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -3.902 8.591 -11.607 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.517 8.323 -9.919 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -5.882 7.931 -9.393 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.349 8.336 -11.033 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.157 5.899 -10.464 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.354 6.404 -11.873 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.472 6.115 -10.451 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.026 10.428 -5.739 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.774 10.779 -4.549 1.00 0.18 C ATOM 1203 C LEU A 400 -4.851 11.268 -3.441 1.00 0.18 C ATOM 1204 O LEU A 400 -5.238 11.322 -2.272 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.593 9.574 -4.121 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.402 8.961 -5.263 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.089 7.693 -4.816 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.412 9.963 -5.805 1.00 0.21 C ATOM 0 H LEU A 400 -4.791 9.438 -5.811 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.449 11.607 -4.767 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -5.926 8.817 -3.709 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.272 9.869 -3.321 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.713 8.704 -6.067 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.658 7.276 -5.646 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.342 6.970 -4.489 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.764 7.917 -3.990 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -8.977 9.506 -6.617 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.095 10.258 -5.008 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -7.888 10.843 -6.178 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.633 11.634 -3.838 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.657 12.251 -2.936 1.00 0.20 C ATOM 1222 C ASN A 401 -2.306 11.347 -1.761 1.00 0.17 C ATOM 1223 O ASN A 401 -2.138 11.809 -0.631 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.187 13.586 -2.428 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.029 14.706 -3.431 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.000 15.381 -3.473 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -4.049 14.928 -4.238 1.00 1.21 N ATOM 0 H ASN A 401 -3.294 11.512 -4.792 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.743 12.412 -3.507 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.242 13.479 -2.175 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.664 13.852 -1.509 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -4.001 15.680 -4.926 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.886 14.348 -4.174 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.201 10.061 -2.035 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.922 9.073 -1.015 1.00 0.10 C ATOM 1236 C ILE A 402 -0.491 8.576 -1.099 1.00 0.09 C ATOM 1237 O ILE A 402 0.296 8.751 -0.172 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.888 7.906 -1.205 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.307 8.437 -1.126 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.666 6.811 -0.177 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.323 7.438 -1.561 1.00 0.13 C ATOM 0 H ILE A 402 -2.307 9.673 -2.972 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.053 9.527 -0.033 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.709 7.456 -2.182 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.519 8.742 -0.101 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.391 9.328 -1.748 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.375 6.001 -0.350 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.649 6.429 -0.266 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.815 7.216 0.824 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.319 7.874 -1.483 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.132 7.152 -2.595 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.262 6.556 -0.923 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.162 7.955 -2.214 1.00 0.07 N ATOM 1254 CA ILE A 403 1.174 7.456 -2.443 1.00 0.07 C ATOM 1255 C ILE A 403 1.681 8.021 -3.762 1.00 0.08 C ATOM 1256 O ILE A 403 0.890 8.492 -4.568 1.00 0.10 O ATOM 1257 CB ILE A 403 1.208 5.906 -2.479 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.629 5.307 -1.198 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.627 5.400 -2.686 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.678 3.795 -1.188 1.00 0.11 C ATOM 0 H ILE A 403 -0.811 7.784 -2.982 1.00 0.07 H new ATOM 0 HA ILE A 403 1.815 7.774 -1.621 1.00 0.07 H new ATOM 0 HB ILE A 403 0.591 5.588 -3.319 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.182 5.690 -0.340 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.404 5.634 -1.083 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.625 4.310 -2.708 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.015 5.781 -3.631 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.259 5.745 -1.868 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.254 3.423 -0.255 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.102 3.407 -2.028 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.713 3.464 -1.273 1.00 0.11 H new ATOM 1272 N ARG A 404 2.985 8.030 -3.961 1.00 0.10 N ATOM 1273 CA ARG A 404 3.550 8.458 -5.229 1.00 0.13 C ATOM 1274 C ARG A 404 4.635 7.497 -5.678 1.00 0.14 C ATOM 1275 O ARG A 404 5.134 6.691 -4.890 1.00 0.16 O ATOM 1276 CB ARG A 404 4.125 9.873 -5.117 1.00 0.17 C ATOM 1277 CG ARG A 404 5.615 9.906 -4.846 1.00 0.25 C ATOM 1278 CD ARG A 404 6.166 11.318 -4.867 1.00 0.36 C ATOM 1279 NE ARG A 404 7.626 11.325 -4.988 1.00 1.14 N ATOM 1280 CZ ARG A 404 8.304 12.072 -5.865 1.00 1.56 C ATOM 1281 NH1 ARG A 404 7.663 12.907 -6.675 1.00 1.63 N ATOM 1282 NH2 ARG A 404 9.628 11.982 -5.931 1.00 2.39 N ATOM 0 H ARG A 404 3.673 7.747 -3.263 1.00 0.10 H new ATOM 0 HA ARG A 404 2.750 8.463 -5.970 1.00 0.13 H new ATOM 0 HB2 ARG A 404 3.921 10.413 -6.042 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.608 10.404 -4.318 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.817 9.453 -3.875 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.133 9.304 -5.593 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.729 11.868 -5.700 1.00 0.36 H new ATOM 0 HD3 ARG A 404 5.873 11.837 -3.954 1.00 0.36 H new ATOM 0 HE ARG A 404 8.160 10.721 -4.363 1.00 1.14 H new ATOM 0 HH11 ARG A 404 6.647 12.981 -6.630 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.187 13.474 -7.342 1.00 1.63 H new ATOM 0 HH21 ARG A 404 10.127 11.343 -5.312 1.00 2.39 H new ATOM 0 HH22 ARG A 404 10.145 12.552 -6.600 1.00 2.39 H new ATOM 1296 N LYS A 405 4.998 7.604 -6.939 1.00 0.17 N ATOM 1297 CA LYS A 405 6.030 6.772 -7.515 1.00 0.19 C ATOM 1298 C LYS A 405 7.296 7.597 -7.701 1.00 0.22 C ATOM 1299 O LYS A 405 7.240 8.743 -8.152 1.00 0.27 O ATOM 1300 CB LYS A 405 5.550 6.217 -8.850 1.00 0.22 C ATOM 1301 CG LYS A 405 6.394 5.062 -9.351 1.00 0.34 C ATOM 1302 CD LYS A 405 6.622 4.058 -8.266 1.00 0.29 C ATOM 1303 CE LYS A 405 7.256 2.810 -8.814 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.501 3.078 -9.584 1.00 1.08 N ATOM 0 H LYS A 405 4.585 8.270 -7.592 1.00 0.17 H new ATOM 0 HA LYS A 405 6.249 5.937 -6.850 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.516 5.887 -8.749 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.559 7.015 -9.593 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.899 4.584 -10.196 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.352 5.436 -9.713 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.263 4.488 -7.496 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.674 3.810 -7.790 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.484 2.133 -7.990 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.540 2.299 -9.458 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 8.937 2.176 -9.864 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.271 3.630 -10.435 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.166 3.615 -8.992 1.00 1.08 H new ATOM 1318 N GLU A 406 8.425 7.017 -7.340 1.00 0.23 N ATOM 1319 CA GLU A 406 9.696 7.716 -7.377 1.00 0.28 C ATOM 1320 C GLU A 406 10.272 7.803 -8.783 1.00 0.34 C ATOM 1321 O GLU A 406 9.829 7.118 -9.707 1.00 0.43 O ATOM 1322 CB GLU A 406 10.699 7.023 -6.458 1.00 0.29 C ATOM 1323 CG GLU A 406 10.462 5.544 -6.301 1.00 0.63 C ATOM 1324 CD GLU A 406 10.578 4.739 -7.587 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.205 5.211 -8.545 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.071 3.603 -7.624 1.00 2.42 O ATOM 0 H GLU A 406 8.487 6.052 -7.014 1.00 0.23 H new ATOM 0 HA GLU A 406 9.511 8.734 -7.034 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.704 7.180 -6.849 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.662 7.493 -5.475 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.176 5.151 -5.577 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.467 5.392 -5.882 1.00 0.63 H new ATOM 1333 N PRO A 407 11.205 8.728 -8.957 1.00 0.41 N ATOM 1334 CA PRO A 407 12.045 8.804 -10.132 1.00 0.51 C ATOM 1335 C PRO A 407 13.143 7.730 -10.149 1.00 0.52 C ATOM 1336 O PRO A 407 14.076 7.780 -9.342 1.00 0.54 O ATOM 1337 CB PRO A 407 12.647 10.210 -10.066 1.00 0.61 C ATOM 1338 CG PRO A 407 12.434 10.708 -8.675 1.00 0.58 C ATOM 1339 CD PRO A 407 11.539 9.736 -7.960 1.00 0.45 C ATOM 0 HA PRO A 407 11.476 8.624 -11.044 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.709 10.187 -10.310 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.168 10.869 -10.790 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.387 10.801 -8.154 1.00 0.58 H new ATOM 0 HG3 PRO A 407 11.982 11.700 -8.691 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.044 9.291 -7.103 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.643 10.229 -7.582 1.00 0.45 H new ATOM 1347 N GLY A 408 13.036 6.769 -11.054 1.00 0.54 N ATOM 1348 CA GLY A 408 14.169 5.908 -11.355 1.00 0.58 C ATOM 1349 C GLY A 408 14.378 4.720 -10.419 1.00 0.58 C ATOM 1350 O GLY A 408 15.495 4.209 -10.325 1.00 0.86 O ATOM 0 H GLY A 408 12.189 6.567 -11.586 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.051 5.528 -12.370 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.074 6.516 -11.345 1.00 0.58 H new ATOM 1354 N GLN A 409 13.349 4.277 -9.713 1.00 0.47 N ATOM 1355 CA GLN A 409 13.426 3.008 -8.988 1.00 0.51 C ATOM 1356 C GLN A 409 12.350 2.061 -9.515 1.00 0.48 C ATOM 1357 O GLN A 409 11.687 2.362 -10.510 1.00 0.61 O ATOM 1358 CB GLN A 409 13.294 3.183 -7.469 1.00 0.63 C ATOM 1359 CG GLN A 409 14.093 4.343 -6.904 1.00 0.45 C ATOM 1360 CD GLN A 409 14.430 4.172 -5.434 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.514 5.147 -4.689 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.653 2.936 -5.009 1.00 0.45 N ATOM 0 H GLN A 409 12.459 4.767 -9.624 1.00 0.47 H new ATOM 0 HA GLN A 409 14.415 2.585 -9.163 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.242 3.326 -7.221 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.614 2.263 -6.980 1.00 0.63 H new ATOM 0 HG2 GLN A 409 15.017 4.452 -7.472 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.527 5.265 -7.036 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.574 2.152 -5.657 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.904 2.769 -4.034 1.00 0.45 H new ATOM 1371 N ARG A 410 12.177 0.922 -8.865 1.00 0.41 N ATOM 1372 CA ARG A 410 11.245 -0.096 -9.346 1.00 0.39 C ATOM 1373 C ARG A 410 10.007 -0.186 -8.475 1.00 0.31 C ATOM 1374 O ARG A 410 8.933 0.267 -8.858 1.00 0.42 O ATOM 1375 CB ARG A 410 11.935 -1.465 -9.436 1.00 0.47 C ATOM 1376 CG ARG A 410 12.875 -1.772 -8.280 1.00 0.86 C ATOM 1377 CD ARG A 410 14.268 -1.229 -8.551 1.00 1.11 C ATOM 1378 NE ARG A 410 15.188 -1.474 -7.445 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.838 -2.623 -7.253 1.00 2.04 C ATOM 1380 NH1 ARG A 410 15.609 -3.670 -8.037 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.717 -2.723 -6.270 1.00 2.43 N ATOM 0 H ARG A 410 12.666 0.675 -8.005 1.00 0.41 H new ATOM 0 HA ARG A 410 10.925 0.204 -10.344 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.171 -2.241 -9.483 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.497 -1.514 -10.369 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.483 -1.335 -7.362 1.00 0.86 H new ATOM 0 HG3 ARG A 410 12.925 -2.850 -8.124 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.664 -1.688 -9.457 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.207 -0.157 -8.738 1.00 1.11 H new ATOM 0 HE ARG A 410 15.344 -0.719 -6.777 1.00 1.27 H new ATOM 0 HH11 ARG A 410 14.930 -3.601 -8.795 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.112 -4.544 -7.881 1.00 2.65 H new ATOM 0 HH21 ARG A 410 16.896 -1.924 -5.662 1.00 2.43 H new ATOM 0 HH22 ARG A 410 17.216 -3.600 -6.120 1.00 2.43 H new ATOM 1395 N LEU A 411 10.165 -0.769 -7.310 1.00 0.21 N ATOM 1396 CA LEU A 411 9.053 -0.988 -6.409 1.00 0.14 C ATOM 1397 C LEU A 411 9.127 -0.036 -5.237 1.00 0.11 C ATOM 1398 O LEU A 411 8.710 -0.350 -4.131 1.00 0.12 O ATOM 1399 CB LEU A 411 9.056 -2.441 -5.958 1.00 0.11 C ATOM 1400 CG LEU A 411 8.726 -3.420 -7.078 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.017 -4.847 -6.662 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.271 -3.254 -7.475 1.00 0.16 C ATOM 0 H LEU A 411 11.062 -1.104 -6.959 1.00 0.21 H new ATOM 0 HA LEU A 411 8.114 -0.788 -6.925 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.036 -2.685 -5.548 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.334 -2.565 -5.151 1.00 0.11 H new ATOM 0 HG LEU A 411 9.359 -3.201 -7.938 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.772 -5.522 -7.482 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.074 -4.946 -6.415 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.415 -5.102 -5.790 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.031 -3.953 -8.276 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.634 -3.456 -6.614 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.102 -2.234 -7.820 1.00 0.16 H new ATOM 1414 N LEU A 412 9.690 1.121 -5.493 1.00 0.13 N ATOM 1415 CA LEU A 412 9.811 2.155 -4.484 1.00 0.11 C ATOM 1416 C LEU A 412 8.586 3.062 -4.556 1.00 0.10 C ATOM 1417 O LEU A 412 8.164 3.458 -5.638 1.00 0.11 O ATOM 1418 CB LEU A 412 11.084 2.956 -4.750 1.00 0.13 C ATOM 1419 CG LEU A 412 11.699 3.722 -3.578 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.680 4.550 -2.824 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.397 2.761 -2.654 1.00 0.16 C ATOM 0 H LEU A 412 10.077 1.375 -6.402 1.00 0.13 H new ATOM 0 HA LEU A 412 9.868 1.715 -3.488 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.838 2.269 -5.135 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.870 3.672 -5.544 1.00 0.13 H new ATOM 0 HG LEU A 412 12.424 4.425 -3.988 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.171 5.072 -2.003 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.231 5.278 -3.500 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.903 3.897 -2.426 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.834 3.310 -1.820 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.678 2.035 -2.273 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.185 2.240 -3.198 1.00 0.16 H new ATOM 1433 N PHE A 413 8.010 3.377 -3.409 1.00 0.10 N ATOM 1434 CA PHE A 413 6.861 4.258 -3.359 1.00 0.11 C ATOM 1435 C PHE A 413 6.962 5.147 -2.131 1.00 0.12 C ATOM 1436 O PHE A 413 7.409 4.702 -1.074 1.00 0.19 O ATOM 1437 CB PHE A 413 5.558 3.454 -3.304 1.00 0.12 C ATOM 1438 CG PHE A 413 5.410 2.448 -4.407 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.930 1.177 -4.266 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.756 2.771 -5.580 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.804 0.241 -5.274 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.625 1.840 -6.592 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.149 0.575 -6.440 1.00 0.11 C ATOM 0 H PHE A 413 8.321 3.034 -2.500 1.00 0.10 H new ATOM 0 HA PHE A 413 6.851 4.869 -4.262 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.503 2.937 -2.346 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.716 4.145 -3.342 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.443 0.910 -3.354 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.343 3.761 -5.707 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.217 -0.749 -5.149 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.111 2.104 -7.504 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.047 -0.153 -7.232 1.00 0.11 H new ATOM 1453 N ARG A 414 6.577 6.402 -2.264 1.00 0.10 N ATOM 1454 CA ARG A 414 6.545 7.295 -1.146 1.00 0.12 C ATOM 1455 C ARG A 414 5.118 7.672 -0.837 1.00 0.11 C ATOM 1456 O ARG A 414 4.335 7.951 -1.738 1.00 0.15 O ATOM 1457 CB ARG A 414 7.327 8.557 -1.442 1.00 0.20 C ATOM 1458 CG ARG A 414 7.358 9.475 -0.257 1.00 0.35 C ATOM 1459 CD ARG A 414 8.307 10.629 -0.437 1.00 0.37 C ATOM 1460 NE ARG A 414 8.365 11.476 0.752 1.00 1.21 N ATOM 1461 CZ ARG A 414 8.641 12.781 0.730 1.00 1.46 C ATOM 1462 NH1 ARG A 414 8.894 13.392 -0.423 1.00 1.06 N ATOM 1463 NH2 ARG A 414 8.671 13.477 1.862 1.00 2.58 N ATOM 0 H ARG A 414 6.282 6.819 -3.147 1.00 0.10 H new ATOM 0 HA ARG A 414 6.995 6.787 -0.293 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.346 8.296 -1.728 1.00 0.20 H new ATOM 0 HB3 ARG A 414 6.879 9.073 -2.292 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.355 9.861 -0.076 1.00 0.35 H new ATOM 0 HG3 ARG A 414 7.646 8.908 0.628 1.00 0.35 H new ATOM 0 HD2 ARG A 414 9.304 10.248 -0.661 1.00 0.37 H new ATOM 0 HD3 ARG A 414 7.994 11.226 -1.294 1.00 0.37 H new ATOM 0 HE ARG A 414 8.183 11.042 1.657 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.877 12.863 -1.295 1.00 1.06 H new ATOM 0 HH12 ARG A 414 9.105 14.390 -0.436 1.00 1.06 H new ATOM 0 HH21 ARG A 414 8.483 13.013 2.751 1.00 2.58 H new ATOM 0 HH22 ARG A 414 8.882 14.475 1.842 1.00 2.58 H new ATOM 1477 N PHE A 415 4.789 7.685 0.425 1.00 0.10 N ATOM 1478 CA PHE A 415 3.491 8.141 0.857 1.00 0.09 C ATOM 1479 C PHE A 415 3.434 9.655 0.765 1.00 0.11 C ATOM 1480 O PHE A 415 4.147 10.365 1.476 1.00 0.14 O ATOM 1481 CB PHE A 415 3.203 7.700 2.291 1.00 0.10 C ATOM 1482 CG PHE A 415 2.538 6.369 2.428 1.00 0.10 C ATOM 1483 CD1 PHE A 415 3.290 5.219 2.545 1.00 0.10 C ATOM 1484 CD2 PHE A 415 1.156 6.275 2.472 1.00 0.11 C ATOM 1485 CE1 PHE A 415 2.687 3.995 2.697 1.00 0.11 C ATOM 1486 CE2 PHE A 415 0.539 5.054 2.629 1.00 0.13 C ATOM 1487 CZ PHE A 415 1.308 3.908 2.739 1.00 0.12 C ATOM 0 H PHE A 415 5.405 7.383 1.180 1.00 0.10 H new ATOM 0 HA PHE A 415 2.734 7.700 0.208 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.143 7.677 2.842 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.574 8.453 2.766 1.00 0.10 H new ATOM 0 HD1 PHE A 415 4.368 5.282 2.517 1.00 0.10 H new ATOM 0 HD2 PHE A 415 0.557 7.169 2.382 1.00 0.11 H new ATOM 0 HE1 PHE A 415 3.289 3.102 2.784 1.00 0.11 H new ATOM 0 HE2 PHE A 415 -0.539 4.991 2.666 1.00 0.13 H new ATOM 0 HZ PHE A 415 0.831 2.946 2.858 1.00 0.12 H new ATOM 1497 N MET A 416 2.623 10.131 -0.157 1.00 0.11 N ATOM 1498 CA MET A 416 2.372 11.553 -0.317 1.00 0.15 C ATOM 1499 C MET A 416 1.763 12.143 0.954 1.00 0.17 C ATOM 1500 O MET A 416 1.963 13.318 1.269 1.00 0.23 O ATOM 1501 CB MET A 416 1.438 11.783 -1.501 1.00 0.15 C ATOM 1502 CG MET A 416 2.020 11.344 -2.825 1.00 0.24 C ATOM 1503 SD MET A 416 1.081 11.959 -4.237 1.00 1.41 S ATOM 1504 CE MET A 416 1.182 13.728 -3.971 1.00 1.47 C ATOM 0 H MET A 416 2.117 9.543 -0.819 1.00 0.11 H new ATOM 0 HA MET A 416 3.322 12.054 -0.505 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.506 11.246 -1.327 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.189 12.843 -1.556 1.00 0.15 H new ATOM 0 HG2 MET A 416 3.050 11.694 -2.898 1.00 0.24 H new ATOM 0 HG3 MET A 416 2.050 10.255 -2.861 1.00 0.24 H new ATOM 0 HE1 MET A 416 1.027 14.248 -4.917 1.00 1.47 H new ATOM 0 HE2 MET A 416 0.415 14.033 -3.259 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.165 13.981 -3.575 1.00 1.47 H new ATOM 1514 N LYS A 417 1.013 11.316 1.670 1.00 0.16 N ATOM 1515 CA LYS A 417 0.422 11.705 2.936 1.00 0.21 C ATOM 1516 C LYS A 417 0.525 10.571 3.934 1.00 0.21 C ATOM 1517 O LYS A 417 0.881 9.450 3.584 1.00 0.22 O ATOM 1518 CB LYS A 417 -1.046 12.071 2.760 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.275 13.432 2.150 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.726 13.834 2.283 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.965 15.250 1.789 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.264 16.253 2.635 1.00 1.36 N ATOM 0 H LYS A 417 0.800 10.359 1.387 1.00 0.16 H new ATOM 0 HA LYS A 417 0.968 12.574 3.304 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.524 11.319 2.132 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.537 12.034 3.732 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.641 14.169 2.642 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.990 13.418 1.098 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.349 13.141 1.717 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -3.031 13.757 3.327 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -2.621 15.339 0.759 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -4.035 15.459 1.787 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -2.557 17.210 2.353 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -2.508 16.096 3.634 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -1.236 16.155 2.510 1.00 1.36 H new ATOM 1536 N THR A 418 0.216 10.879 5.178 1.00 0.24 N ATOM 1537 CA THR A 418 0.127 9.877 6.211 1.00 0.24 C ATOM 1538 C THR A 418 -1.332 9.509 6.444 1.00 0.26 C ATOM 1539 O THR A 418 -2.225 10.281 6.094 1.00 0.28 O ATOM 1540 CB THR A 418 0.784 10.380 7.498 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.321 11.705 7.809 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.286 10.377 7.318 1.00 0.22 C ATOM 0 H THR A 418 0.021 11.828 5.496 1.00 0.24 H new ATOM 0 HA THR A 418 0.662 8.982 5.893 1.00 0.24 H new ATOM 0 HB THR A 418 0.516 9.723 8.325 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.747 12.015 8.635 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.763 10.734 8.231 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.625 9.363 7.105 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.554 11.031 6.489 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.590 8.331 7.035 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.938 7.746 7.136 1.00 0.28 C ATOM 1552 C PRO A 419 -4.015 8.713 7.622 1.00 0.31 C ATOM 1553 O PRO A 419 -5.122 8.720 7.089 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.733 6.602 8.125 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.329 6.181 7.882 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.578 7.456 7.659 1.00 0.25 C ATOM 0 HA PRO A 419 -3.312 7.440 6.159 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.881 6.930 9.154 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.433 5.786 7.946 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -0.929 5.630 8.733 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.258 5.524 7.015 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.204 7.874 8.594 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.284 7.308 7.009 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.696 9.534 8.612 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.662 10.508 9.134 1.00 0.42 C ATOM 1566 C ASP A 420 -5.046 11.517 8.055 1.00 0.43 C ATOM 1567 O ASP A 420 -6.225 11.814 7.856 1.00 0.48 O ATOM 1568 CB ASP A 420 -4.101 11.234 10.354 1.00 0.49 C ATOM 1569 CG ASP A 420 -5.069 12.258 10.917 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -6.076 11.853 11.539 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -4.822 13.472 10.749 1.00 0.72 O ATOM 0 H ASP A 420 -2.785 9.551 9.071 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.555 9.962 9.438 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.858 10.505 11.127 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -3.170 11.731 10.081 1.00 0.49 H new ATOM 1576 N GLU A 421 -4.043 12.016 7.346 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.257 12.940 6.243 1.00 0.45 C ATOM 1578 C GLU A 421 -5.022 12.259 5.115 1.00 0.42 C ATOM 1579 O GLU A 421 -5.905 12.848 4.493 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.909 13.433 5.719 1.00 0.49 C ATOM 1581 CG GLU A 421 -2.297 14.551 6.536 1.00 0.81 C ATOM 1582 CD GLU A 421 -3.063 15.844 6.381 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -3.111 16.386 5.259 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -3.618 16.328 7.393 1.00 2.17 O ATOM 0 H GLU A 421 -3.063 11.793 7.519 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.843 13.785 6.605 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.213 12.594 5.693 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.034 13.775 4.692 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.277 14.264 7.587 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.263 14.702 6.228 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.674 11.007 4.864 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.251 10.254 3.763 1.00 0.33 C ATOM 1593 C ILE A 422 -6.716 9.896 4.025 1.00 0.36 C ATOM 1594 O ILE A 422 -7.566 10.029 3.142 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.451 8.966 3.497 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.977 9.286 3.262 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.029 8.237 2.309 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.134 8.066 2.969 1.00 0.27 C ATOM 0 H ILE A 422 -3.989 10.488 5.413 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.204 10.897 2.884 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.523 8.323 4.374 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.893 9.984 2.429 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.578 9.791 4.142 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.457 7.327 2.127 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.068 7.978 2.511 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.979 8.878 1.429 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.098 8.368 2.813 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.187 7.376 3.811 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.507 7.573 2.072 1.00 0.27 H new ATOM 1610 N MET A 423 -7.013 9.456 5.243 1.00 0.42 N ATOM 1611 CA MET A 423 -8.370 9.066 5.616 1.00 0.51 C ATOM 1612 C MET A 423 -9.283 10.273 5.721 1.00 0.58 C ATOM 1613 O MET A 423 -10.493 10.147 5.905 1.00 0.71 O ATOM 1614 CB MET A 423 -8.360 8.316 6.939 1.00 0.58 C ATOM 1615 CG MET A 423 -7.707 6.961 6.842 1.00 0.58 C ATOM 1616 SD MET A 423 -8.150 5.879 8.217 1.00 0.90 S ATOM 1617 CE MET A 423 -7.244 4.394 7.791 1.00 2.01 C ATOM 0 H MET A 423 -6.329 9.360 5.993 1.00 0.42 H new ATOM 0 HA MET A 423 -8.753 8.413 4.832 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.836 8.913 7.685 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.385 8.195 7.290 1.00 0.58 H new ATOM 0 HG2 MET A 423 -7.997 6.488 5.904 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.624 7.084 6.815 1.00 0.58 H new ATOM 0 HE1 MET A 423 -7.528 3.588 8.468 1.00 2.01 H new ATOM 0 HE2 MET A 423 -7.478 4.107 6.766 1.00 2.01 H new ATOM 0 HE3 MET A 423 -6.174 4.582 7.880 1.00 2.01 H new ATOM 1627 N SER A 424 -8.691 11.433 5.572 1.00 0.59 N ATOM 1628 CA SER A 424 -9.409 12.692 5.697 1.00 0.72 C ATOM 1629 C SER A 424 -10.088 13.073 4.374 1.00 0.67 C ATOM 1630 O SER A 424 -10.107 14.243 3.981 1.00 1.09 O ATOM 1631 CB SER A 424 -8.459 13.799 6.166 1.00 0.92 C ATOM 1632 OG SER A 424 -9.173 14.945 6.602 1.00 1.57 O ATOM 0 H SER A 424 -7.699 11.538 5.361 1.00 0.59 H new ATOM 0 HA SER A 424 -10.192 12.569 6.445 1.00 0.72 H new ATOM 0 HB2 SER A 424 -7.836 13.426 6.979 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.789 14.074 5.352 1.00 0.92 H new ATOM 0 HG SER A 424 -9.737 15.276 5.872 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.627 12.074 3.680 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.375 12.332 2.464 1.00 0.42 C ATOM 1640 C GLY A 425 -10.756 11.698 1.235 1.00 0.37 C ATOM 1641 O GLY A 425 -11.469 11.283 0.322 1.00 0.50 O ATOM 0 H GLY A 425 -10.558 11.090 3.939 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.392 11.958 2.585 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.448 13.409 2.312 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.432 11.599 1.220 1.00 0.38 N ATOM 1646 CA ARG A 426 -8.708 11.111 0.048 1.00 0.36 C ATOM 1647 C ARG A 426 -9.082 9.666 -0.268 1.00 0.33 C ATOM 1648 O ARG A 426 -9.479 9.341 -1.386 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.198 11.224 0.286 1.00 0.39 C ATOM 1650 CG ARG A 426 -6.767 12.580 0.773 1.00 0.56 C ATOM 1651 CD ARG A 426 -6.788 13.575 -0.354 1.00 0.92 C ATOM 1652 NE ARG A 426 -6.534 14.935 0.114 1.00 1.37 N ATOM 1653 CZ ARG A 426 -6.250 15.957 -0.685 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -6.168 15.781 -1.995 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.073 17.167 -0.176 1.00 2.67 N ATOM 0 H ARG A 426 -8.835 11.851 2.008 1.00 0.38 H new ATOM 0 HA ARG A 426 -8.987 11.726 -0.807 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -6.896 10.472 1.015 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.674 10.997 -0.642 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.429 12.913 1.573 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -5.763 12.520 1.194 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.037 13.300 -1.095 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -7.756 13.538 -0.853 1.00 0.92 H new ATOM 0 HE ARG A 426 -6.577 15.111 1.118 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -6.323 14.856 -2.396 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -5.950 16.570 -2.603 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -6.155 17.314 0.830 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -5.855 17.952 -0.790 1.00 2.67 H new ATOM 1669 N THR A 427 -8.971 8.812 0.733 1.00 0.33 N ATOM 1670 CA THR A 427 -9.237 7.387 0.570 1.00 0.37 C ATOM 1671 C THR A 427 -10.558 6.981 1.218 1.00 0.43 C ATOM 1672 O THR A 427 -10.785 5.808 1.510 1.00 0.58 O ATOM 1673 CB THR A 427 -8.080 6.562 1.164 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.301 5.170 0.989 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.909 6.849 2.635 1.00 0.41 C ATOM 0 H THR A 427 -8.696 9.080 1.678 1.00 0.33 H new ATOM 0 HA THR A 427 -9.316 7.184 -0.498 1.00 0.37 H new ATOM 0 HB THR A 427 -7.174 6.852 0.632 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.205 4.942 1.290 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.086 6.253 3.029 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.691 7.908 2.776 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.827 6.594 3.165 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.438 7.948 1.416 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.744 7.674 2.002 1.00 0.62 C ATOM 1685 C ASP A 428 -13.560 6.774 1.081 1.00 0.61 C ATOM 1686 O ASP A 428 -14.161 5.793 1.512 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.500 8.977 2.255 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.940 8.735 2.658 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -15.196 8.506 3.858 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.825 8.777 1.780 1.00 1.75 O ATOM 0 H ASP A 428 -11.275 8.927 1.181 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.592 7.164 2.953 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.995 9.541 3.039 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.475 9.590 1.354 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.553 7.115 -0.199 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.278 6.354 -1.206 1.00 0.65 C ATOM 1697 C ARG A 429 -13.564 5.045 -1.475 1.00 0.55 C ATOM 1698 O ARG A 429 -14.176 4.007 -1.730 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.357 7.163 -2.491 1.00 0.81 C ATOM 1700 CG ARG A 429 -14.588 8.636 -2.238 1.00 0.98 C ATOM 1701 CD ARG A 429 -14.617 9.433 -3.534 1.00 1.12 C ATOM 1702 NE ARG A 429 -13.284 9.549 -4.129 1.00 1.64 N ATOM 1703 CZ ARG A 429 -12.915 8.966 -5.269 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -13.780 8.240 -5.967 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -11.677 9.126 -5.716 1.00 3.05 N ATOM 0 H ARG A 429 -13.048 7.921 -0.567 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.284 6.145 -0.843 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.432 7.036 -3.054 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -15.164 6.774 -3.112 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.530 8.770 -1.707 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.800 9.022 -1.591 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -15.291 8.951 -4.242 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -15.017 10.428 -3.340 1.00 1.12 H new ATOM 0 HE ARG A 429 -12.591 10.114 -3.638 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -14.736 8.125 -5.632 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -13.488 7.798 -6.839 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -11.013 9.693 -5.188 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -11.388 8.682 -6.588 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.251 5.124 -1.380 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.356 4.026 -1.706 1.00 0.36 C ATOM 1721 C LEU A 430 -11.653 2.758 -0.931 1.00 0.39 C ATOM 1722 O LEU A 430 -11.585 1.656 -1.479 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.937 4.461 -1.443 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.267 5.181 -2.587 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.981 5.763 -2.088 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -9.008 4.228 -3.739 1.00 0.56 C ATOM 0 H LEU A 430 -11.766 5.966 -1.069 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.506 3.786 -2.759 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -9.929 5.113 -0.569 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.345 3.582 -1.190 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.916 5.975 -2.955 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.480 6.289 -2.901 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.188 6.461 -1.277 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.337 4.963 -1.722 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.524 4.766 -4.554 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.360 3.419 -3.403 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.954 3.814 -4.088 1.00 0.56 H new ATOM 1738 N GLU A 431 -11.975 2.932 0.340 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.292 1.811 1.234 1.00 0.53 C ATOM 1740 C GLU A 431 -13.324 0.859 0.623 1.00 0.59 C ATOM 1741 O GLU A 431 -13.365 -0.325 0.954 1.00 0.72 O ATOM 1742 CB GLU A 431 -12.837 2.324 2.570 1.00 0.61 C ATOM 1743 CG GLU A 431 -11.964 3.358 3.250 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.455 3.694 4.642 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -13.485 4.392 4.770 1.00 1.25 O ATOM 1746 OE2 GLU A 431 -11.831 3.230 5.620 1.00 1.31 O ATOM 0 H GLU A 431 -12.026 3.847 0.788 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.361 1.266 1.389 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -13.825 2.754 2.404 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -12.967 1.477 3.244 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -10.941 2.986 3.307 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.940 4.265 2.646 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.146 1.380 -0.278 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.264 0.623 -0.821 1.00 0.66 C ATOM 1755 C HIS A 432 -14.864 -0.152 -2.076 1.00 0.60 C ATOM 1756 O HIS A 432 -15.259 -1.305 -2.249 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.431 1.564 -1.130 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.857 2.380 0.047 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.919 2.051 0.856 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -16.344 3.522 0.546 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -18.041 2.957 1.805 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -17.096 3.864 1.642 1.00 3.38 N ATOM 0 H HIS A 432 -14.059 2.326 -0.649 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.573 -0.103 -0.069 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -16.145 2.232 -1.943 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.279 0.977 -1.483 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -15.497 4.067 0.156 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -18.788 2.957 2.585 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -16.949 4.683 2.232 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.065 0.467 -2.940 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.693 -0.155 -4.209 1.00 0.53 C ATOM 1773 C LEU A 433 -12.567 -1.164 -4.023 1.00 0.54 C ATOM 1774 O LEU A 433 -12.534 -2.202 -4.687 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.290 0.894 -5.247 1.00 0.60 C ATOM 1776 CG LEU A 433 -12.151 1.818 -4.847 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -11.123 1.914 -5.965 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.695 3.195 -4.516 1.00 0.88 C ATOM 0 H LEU A 433 -13.664 1.393 -2.787 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.573 -0.683 -4.576 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -13.009 0.379 -6.166 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -14.164 1.504 -5.477 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.661 1.407 -3.964 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -10.315 2.580 -5.660 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.718 0.924 -6.173 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.598 2.308 -6.863 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.873 3.852 -4.230 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -13.201 3.606 -5.390 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.402 3.118 -3.690 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.652 -0.860 -3.114 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.529 -1.746 -2.831 1.00 0.60 C ATOM 1792 C GLU A 434 -10.959 -3.002 -2.084 1.00 0.76 C ATOM 1793 O GLU A 434 -10.159 -3.911 -1.867 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.455 -1.003 -2.050 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.702 -0.015 -2.913 1.00 0.63 C ATOM 1796 CD GLU A 434 -8.152 -0.669 -4.164 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -7.343 -1.609 -4.035 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -8.536 -0.258 -5.275 1.00 1.90 O ATOM 0 H GLU A 434 -11.664 -0.005 -2.558 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.119 -2.067 -3.789 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -9.915 -0.476 -1.214 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -8.753 -1.722 -1.626 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -9.365 0.804 -3.192 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -7.883 0.419 -2.339 1.00 0.63 H new ATOM 1805 N SER A 435 -12.230 -3.060 -1.715 1.00 0.72 N ATOM 1806 CA SER A 435 -12.779 -4.229 -1.050 1.00 0.89 C ATOM 1807 C SER A 435 -12.874 -5.400 -2.023 1.00 1.03 C ATOM 1808 O SER A 435 -13.060 -6.547 -1.618 1.00 1.20 O ATOM 1809 CB SER A 435 -14.157 -3.908 -0.476 1.00 0.97 C ATOM 1810 OG SER A 435 -14.721 -5.036 0.176 1.00 1.47 O ATOM 0 H SER A 435 -12.902 -2.307 -1.866 1.00 0.72 H new ATOM 0 HA SER A 435 -12.113 -4.510 -0.234 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.076 -3.081 0.229 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.819 -3.580 -1.277 1.00 0.97 H new ATOM 0 HG SER A 435 -15.602 -4.800 0.535 1.00 1.47 H new ATOM 1816 N GLN A 436 -12.767 -5.097 -3.307 1.00 1.04 N ATOM 1817 CA GLN A 436 -12.775 -6.116 -4.337 1.00 1.24 C ATOM 1818 C GLN A 436 -11.373 -6.689 -4.512 1.00 1.47 C ATOM 1819 O GLN A 436 -11.073 -7.722 -3.889 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.281 -5.527 -5.655 1.00 1.17 C ATOM 1821 CG GLN A 436 -14.698 -4.979 -5.578 1.00 1.30 C ATOM 1822 CD GLN A 436 -15.726 -6.030 -5.200 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -16.292 -6.703 -6.062 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -15.991 -6.164 -3.910 1.00 2.60 N ATOM 1825 OXT GLN A 436 -10.562 -6.083 -5.239 1.00 2.10 O ATOM 0 H GLN A 436 -12.673 -4.145 -3.660 1.00 1.04 H new ATOM 0 HA GLN A 436 -13.446 -6.921 -4.037 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -12.609 -4.728 -5.967 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.240 -6.297 -6.426 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -14.729 -4.171 -4.847 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -14.967 -4.548 -6.542 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -15.501 -5.588 -3.226 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -16.686 -6.844 -3.600 1.00 2.60 H new TER 1834 GLN A 436