USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 760 hydrogens (6 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 NoAdj-H: A 341 AZH HN2 : A 341 AZH N : A 340 PHE C :(H bumps) USER MOD NoAdj-H: A 341 AZH HN1 : A 341 AZH N : A 340 PHE C :(H bumps) USER MOD Set 1.1: A 326 ASN : amide:sc= -0.763 X(o=-0.84,f=-1.2) USER MOD Set 1.2: A 339 SER OG : rot 140:sc= -0.0728 USER MOD Single : A 317 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.0062) USER MOD Single : A 320 SER OG : rot 180:sc= 0 USER MOD Single : A 321 THR OG1 : rot 180:sc= -0.0209 USER MOD Single : A 341 AZH NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 SER OG : rot 94:sc= 1.3 USER MOD Single : A 355 LYS NZ :NH3+ -158:sc= 0.453 (180deg=0.141) USER MOD Single : A 358 GLN : amide:sc= -0.614 X(o=-0.61,f=-0.59) USER MOD Single : A 361 SER OG : rot -36:sc= 0.255 USER MOD Single : A 363 ASN : amide:sc= -3.59! C(o=-3.6!,f=-7.9!) USER MOD Single : A 369 ASN : amide:sc= -0.105 K(o=-0.1,f=-1.8!) USER MOD Single : A 371 SER OG : rot 180:sc= 0.197 USER MOD Single : A 372 HIS : no HD1:sc= -0.276 K(o=-0.28,f=-3!) USER MOD Single : A 374 GLN : amide:sc= -0.572 K(o=-0.57,f=-5!) USER MOD Single : A 380 LYS NZ :NH3+ 169:sc= -0.0143 (180deg=-0.27) USER MOD Single : A 381 ASN : amide:sc= -0.275 K(o=-0.27,f=-2.5!) USER MOD Single : A 384 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 385 THR OG1 : rot 180:sc= -0.687 USER MOD Single : A 387 THR OG1 : rot 180:sc= 0.082 USER MOD Single : A 391 GLN : amide:sc= -0.933 K(o=-0.93,f=-7.3!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 LYS NZ :NH3+ -118:sc= -0.113 (180deg=-0.654) USER MOD Single : A 397 TYR OH : rot 180:sc= -0.0856 USER MOD Single : A 398 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 301 -1.931 14.072 -4.360 1.00 72.53 N ATOM 2 CA PHE A 301 -1.508 13.158 -3.305 1.00 21.15 C ATOM 3 C PHE A 301 -1.245 11.763 -3.865 1.00 43.23 C ATOM 4 O PHE A 301 -1.326 11.542 -5.074 1.00 1.32 O ATOM 5 CB PHE A 301 -2.571 13.087 -2.206 1.00 3.41 C ATOM 6 CG PHE A 301 -3.966 12.916 -2.733 1.00 14.35 C ATOM 7 CD1 PHE A 301 -4.474 11.654 -2.992 1.00 60.43 C ATOM 8 CD2 PHE A 301 -4.771 14.020 -2.969 1.00 14.25 C ATOM 9 CE1 PHE A 301 -5.759 11.494 -3.477 1.00 5.42 C ATOM 10 CE2 PHE A 301 -6.056 13.867 -3.454 1.00 51.51 C ATOM 11 CZ PHE A 301 -6.550 12.602 -3.709 1.00 31.11 C ATOM 0 HA PHE A 301 -0.580 13.540 -2.880 1.00 21.15 H new ATOM 0 HB2 PHE A 301 -2.338 12.256 -1.540 1.00 3.41 H new ATOM 0 HB3 PHE A 301 -2.526 13.997 -1.608 1.00 3.41 H new ATOM 0 HD1 PHE A 301 -3.859 10.784 -2.813 1.00 60.43 H new ATOM 0 HD2 PHE A 301 -4.389 15.011 -2.772 1.00 14.25 H new ATOM 0 HE1 PHE A 301 -6.143 10.504 -3.674 1.00 5.42 H new ATOM 0 HE2 PHE A 301 -6.673 14.735 -3.633 1.00 51.51 H new ATOM 0 HZ PHE A 301 -7.553 12.480 -4.089 1.00 31.11 H new ATOM 21 N LEU A 302 -0.929 10.826 -2.978 1.00 31.32 N ATOM 22 CA LEU A 302 -0.652 9.452 -3.382 1.00 2.43 C ATOM 23 C LEU A 302 -1.425 8.463 -2.516 1.00 4.33 C ATOM 24 O LEU A 302 -2.412 7.875 -2.955 1.00 13.12 O ATOM 25 CB LEU A 302 0.847 9.165 -3.292 1.00 30.21 C ATOM 26 CG LEU A 302 1.725 9.839 -4.346 1.00 34.55 C ATOM 27 CD1 LEU A 302 2.203 11.197 -3.854 1.00 51.52 C ATOM 28 CD2 LEU A 302 2.909 8.952 -4.702 1.00 21.25 C ATOM 0 H LEU A 302 -0.858 10.993 -1.974 1.00 31.32 H new ATOM 0 HA LEU A 302 -0.976 9.331 -4.416 1.00 2.43 H new ATOM 0 HB2 LEU A 302 1.197 9.473 -2.306 1.00 30.21 H new ATOM 0 HB3 LEU A 302 0.995 8.087 -3.361 1.00 30.21 H new ATOM 0 HG LEU A 302 1.127 9.991 -5.245 1.00 34.55 H new ATOM 0 HD11 LEU A 302 2.827 11.662 -4.618 1.00 51.52 H new ATOM 0 HD12 LEU A 302 1.342 11.834 -3.651 1.00 51.52 H new ATOM 0 HD13 LEU A 302 2.783 11.069 -2.940 1.00 51.52 H new ATOM 0 HD21 LEU A 302 3.523 9.449 -5.454 1.00 21.25 H new ATOM 0 HD22 LEU A 302 3.507 8.768 -3.809 1.00 21.25 H new ATOM 0 HD23 LEU A 302 2.547 8.003 -5.098 1.00 21.25 H new ATOM 40 N GLY A 303 -0.969 8.287 -1.279 1.00 1.21 N ATOM 41 CA GLY A 303 -1.630 7.370 -0.369 1.00 22.04 C ATOM 42 C GLY A 303 -1.011 7.379 1.015 1.00 53.15 C ATOM 43 O GLY A 303 -0.094 8.154 1.286 1.00 32.33 O ATOM 0 H GLY A 303 -0.154 8.763 -0.891 1.00 1.21 H new ATOM 0 HA2 GLY A 303 -2.685 7.635 -0.294 1.00 22.04 H new ATOM 0 HA3 GLY A 303 -1.583 6.361 -0.778 1.00 22.04 H new ATOM 47 N GLU A 304 -1.514 6.517 1.893 1.00 5.50 N ATOM 48 CA GLU A 304 -1.004 6.431 3.256 1.00 71.23 C ATOM 49 C GLU A 304 -0.602 4.999 3.597 1.00 1.45 C ATOM 50 O GLU A 304 -0.633 4.115 2.743 1.00 15.22 O ATOM 51 CB GLU A 304 -2.057 6.928 4.249 1.00 12.11 C ATOM 52 CG GLU A 304 -2.434 8.387 4.058 1.00 54.44 C ATOM 53 CD GLU A 304 -3.430 8.873 5.092 1.00 32.23 C ATOM 54 OE1 GLU A 304 -3.927 10.009 4.949 1.00 41.30 O ATOM 55 OE2 GLU A 304 -3.713 8.116 6.046 1.00 11.04 O1- ATOM 0 H GLU A 304 -2.274 5.869 1.685 1.00 5.50 H new ATOM 0 HA GLU A 304 -0.120 7.064 3.327 1.00 71.23 H new ATOM 0 HB2 GLU A 304 -2.953 6.315 4.153 1.00 12.11 H new ATOM 0 HB3 GLU A 304 -1.682 6.788 5.263 1.00 12.11 H new ATOM 0 HG2 GLU A 304 -1.534 9.000 4.109 1.00 54.44 H new ATOM 0 HG3 GLU A 304 -2.855 8.522 3.062 1.00 54.44 H new ATOM 62 N GLU A 305 -0.224 4.780 4.853 1.00 4.34 N ATOM 63 CA GLU A 305 0.185 3.456 5.307 1.00 73.11 C ATOM 64 C GLU A 305 0.229 3.393 6.832 1.00 22.04 C ATOM 65 O GLU A 305 0.179 4.421 7.507 1.00 50.04 O ATOM 66 CB GLU A 305 1.556 3.097 4.731 1.00 25.12 C ATOM 67 CG GLU A 305 1.731 1.613 4.455 1.00 74.14 C ATOM 68 CD GLU A 305 0.653 1.058 3.545 1.00 63.31 C ATOM 69 OE1 GLU A 305 0.648 1.413 2.347 1.00 34.11 O ATOM 70 OE2 GLU A 305 -0.185 0.269 4.029 1.00 5.44 O1- ATOM 0 H GLU A 305 -0.193 5.502 5.573 1.00 4.34 H new ATOM 0 HA GLU A 305 -0.551 2.734 4.952 1.00 73.11 H new ATOM 0 HB2 GLU A 305 1.708 3.651 3.804 1.00 25.12 H new ATOM 0 HB3 GLU A 305 2.329 3.422 5.427 1.00 25.12 H new ATOM 0 HG2 GLU A 305 2.707 1.444 4.000 1.00 74.14 H new ATOM 0 HG3 GLU A 305 1.721 1.068 5.399 1.00 74.14 H new ATOM 77 N ASP A 306 0.322 2.180 7.365 1.00 12.31 N ATOM 78 CA ASP A 306 0.374 1.982 8.808 1.00 0.04 C ATOM 79 C ASP A 306 1.458 2.850 9.438 1.00 4.53 C ATOM 80 O ASP A 306 1.300 3.345 10.554 1.00 53.15 O ATOM 81 CB ASP A 306 0.630 0.509 9.134 1.00 34.52 C ATOM 82 CG ASP A 306 1.992 0.041 8.662 1.00 60.34 C ATOM 83 OD1 ASP A 306 2.159 -0.165 7.442 1.00 34.53 O ATOM 84 OD2 ASP A 306 2.891 -0.121 9.514 1.00 31.24 O1- ATOM 0 H ASP A 306 0.363 1.319 6.819 1.00 12.31 H new ATOM 0 HA ASP A 306 -0.589 2.277 9.224 1.00 0.04 H new ATOM 0 HB2 ASP A 306 0.550 0.359 10.211 1.00 34.52 H new ATOM 0 HB3 ASP A 306 -0.143 -0.103 8.669 1.00 34.52 H new ATOM 89 N ILE A 307 2.558 3.030 8.716 1.00 74.43 N ATOM 90 CA ILE A 307 3.668 3.839 9.204 1.00 30.41 C ATOM 91 C ILE A 307 3.187 5.208 9.672 1.00 24.23 C ATOM 92 O ILE A 307 2.443 5.902 8.979 1.00 72.11 O ATOM 93 CB ILE A 307 4.746 4.029 8.121 1.00 71.05 C ATOM 94 CG1 ILE A 307 5.971 4.734 8.706 1.00 11.13 C ATOM 95 CG2 ILE A 307 4.185 4.818 6.947 1.00 31.35 C ATOM 96 CD1 ILE A 307 6.983 3.785 9.310 1.00 60.33 C ATOM 0 H ILE A 307 2.705 2.627 7.791 1.00 74.43 H new ATOM 0 HA ILE A 307 4.102 3.301 10.047 1.00 30.41 H new ATOM 0 HB ILE A 307 5.053 3.047 7.761 1.00 71.05 H new ATOM 0 HG12 ILE A 307 6.454 5.316 7.921 1.00 11.13 H new ATOM 0 HG13 ILE A 307 5.644 5.439 9.471 1.00 11.13 H new ATOM 0 HG21 ILE A 307 4.959 4.944 6.190 1.00 31.35 H new ATOM 0 HG22 ILE A 307 3.341 4.279 6.517 1.00 31.35 H new ATOM 0 HG23 ILE A 307 3.853 5.797 7.292 1.00 31.35 H new ATOM 0 HD11 ILE A 307 7.825 4.354 9.705 1.00 60.33 H new ATOM 0 HD12 ILE A 307 6.516 3.220 10.117 1.00 60.33 H new ATOM 0 HD13 ILE A 307 7.339 3.096 8.544 1.00 60.33 H new ATOM 108 N PRO A 308 3.623 5.609 10.876 1.00 21.42 N ATOM 109 CA PRO A 308 3.250 6.899 11.463 1.00 72.42 C ATOM 110 C PRO A 308 3.890 8.075 10.732 1.00 30.13 C ATOM 111 O PRO A 308 3.257 9.111 10.529 1.00 23.10 O ATOM 112 CB PRO A 308 3.784 6.806 12.894 1.00 13.44 C ATOM 113 CG PRO A 308 4.902 5.824 12.817 1.00 1.02 C ATOM 114 CD PRO A 308 4.511 4.833 11.756 1.00 0.13 C ATOM 0 HA PRO A 308 2.176 7.077 11.405 1.00 72.42 H new ATOM 0 HB2 PRO A 308 4.132 7.775 13.251 1.00 13.44 H new ATOM 0 HB3 PRO A 308 3.010 6.472 13.585 1.00 13.44 H new ATOM 0 HG2 PRO A 308 5.839 6.319 12.562 1.00 1.02 H new ATOM 0 HG3 PRO A 308 5.053 5.329 13.776 1.00 1.02 H new ATOM 0 HD2 PRO A 308 5.381 4.456 11.218 1.00 0.13 H new ATOM 0 HD3 PRO A 308 4.000 3.969 12.181 1.00 0.13 H new ATOM 122 N ARG A 309 5.148 7.907 10.338 1.00 25.12 N ATOM 123 CA ARG A 309 5.873 8.954 9.631 1.00 12.43 C ATOM 124 C ARG A 309 5.727 8.792 8.120 1.00 12.01 C ATOM 125 O ARG A 309 6.702 8.901 7.377 1.00 52.10 O ATOM 126 CB ARG A 309 7.354 8.928 10.015 1.00 1.03 C ATOM 127 CG ARG A 309 7.632 9.475 11.406 1.00 51.05 C ATOM 128 CD ARG A 309 7.489 10.988 11.449 1.00 43.32 C ATOM 129 NE ARG A 309 8.196 11.573 12.585 1.00 11.10 N ATOM 130 CZ ARG A 309 8.297 12.881 12.793 1.00 51.43 C ATOM 131 NH1 ARG A 309 7.739 13.736 11.947 1.00 34.12 N1+ ATOM 132 NH2 ARG A 309 8.957 13.336 13.850 1.00 12.41 N ATOM 0 H ARG A 309 5.686 7.055 10.497 1.00 25.12 H new ATOM 0 HA ARG A 309 5.446 9.914 9.920 1.00 12.43 H new ATOM 0 HB2 ARG A 309 7.718 7.902 9.958 1.00 1.03 H new ATOM 0 HB3 ARG A 309 7.920 9.508 9.286 1.00 1.03 H new ATOM 0 HG2 ARG A 309 6.944 9.023 12.120 1.00 51.05 H new ATOM 0 HG3 ARG A 309 8.639 9.195 11.714 1.00 51.05 H new ATOM 0 HD2 ARG A 309 7.875 11.415 10.523 1.00 43.32 H new ATOM 0 HD3 ARG A 309 6.433 11.251 11.505 1.00 43.32 H new ATOM 0 HE ARG A 309 8.636 10.943 13.255 1.00 11.10 H new ATOM 0 HH11 ARG A 309 7.230 13.390 11.133 1.00 34.12 H new ATOM 0 HH12 ARG A 309 7.818 14.740 12.110 1.00 34.12 H new ATOM 0 HH21 ARG A 309 9.387 12.681 14.503 1.00 12.41 H new ATOM 0 HH22 ARG A 309 9.034 14.340 14.009 1.00 12.41 H new ATOM 146 N GLU A 310 4.501 8.530 7.675 1.00 11.14 N ATOM 147 CA GLU A 310 4.228 8.352 6.254 1.00 40.13 C ATOM 148 C GLU A 310 4.700 9.563 5.453 1.00 13.32 C ATOM 149 O GLU A 310 4.782 10.681 5.961 1.00 4.03 O ATOM 150 CB GLU A 310 2.732 8.127 6.024 1.00 64.21 C ATOM 151 CG GLU A 310 1.902 9.394 6.130 1.00 34.43 C ATOM 152 CD GLU A 310 1.969 10.023 7.508 1.00 1.43 C ATOM 153 OE1 GLU A 310 2.463 11.165 7.617 1.00 31.20 O ATOM 154 OE2 GLU A 310 1.527 9.372 8.478 1.00 74.01 O1- ATOM 0 H GLU A 310 3.683 8.437 8.277 1.00 11.14 H new ATOM 0 HA GLU A 310 4.777 7.475 5.912 1.00 40.13 H new ATOM 0 HB2 GLU A 310 2.587 7.689 5.036 1.00 64.21 H new ATOM 0 HB3 GLU A 310 2.366 7.402 6.751 1.00 64.21 H new ATOM 0 HG2 GLU A 310 2.249 10.114 5.389 1.00 34.43 H new ATOM 0 HG3 GLU A 310 0.864 9.165 5.890 1.00 34.43 H new ATOM 161 N PRO A 311 5.017 9.335 4.170 1.00 23.33 N ATOM 162 CA PRO A 311 5.487 10.394 3.270 1.00 11.24 C ATOM 163 C PRO A 311 4.385 11.388 2.923 1.00 75.02 C ATOM 164 O PRO A 311 3.304 11.002 2.478 1.00 3.11 O ATOM 165 CB PRO A 311 5.929 9.627 2.021 1.00 13.14 C ATOM 166 CG PRO A 311 5.132 8.370 2.046 1.00 53.03 C ATOM 167 CD PRO A 311 4.944 8.027 3.498 1.00 40.00 C ATOM 0 HA PRO A 311 6.278 10.992 3.721 1.00 11.24 H new ATOM 0 HB2 PRO A 311 5.735 10.201 1.115 1.00 13.14 H new ATOM 0 HB3 PRO A 311 6.999 9.418 2.043 1.00 13.14 H new ATOM 0 HG2 PRO A 311 4.171 8.507 1.550 1.00 53.03 H new ATOM 0 HG3 PRO A 311 5.651 7.569 1.520 1.00 53.03 H new ATOM 0 HD2 PRO A 311 3.986 7.538 3.674 1.00 40.00 H new ATOM 0 HD3 PRO A 311 5.719 7.348 3.854 1.00 40.00 H new ATOM 175 N ARG A 312 4.667 12.671 3.128 1.00 61.33 N ATOM 176 CA ARG A 312 3.700 13.722 2.836 1.00 65.13 C ATOM 177 C ARG A 312 4.370 14.899 2.133 1.00 34.14 C ATOM 178 O ARG A 312 5.519 15.234 2.421 1.00 42.20 O ATOM 179 CB ARG A 312 3.029 14.200 4.126 1.00 62.32 C ATOM 180 CG ARG A 312 3.884 15.161 4.936 1.00 71.50 C ATOM 181 CD ARG A 312 5.136 14.482 5.468 1.00 52.51 C ATOM 182 NE ARG A 312 5.611 15.100 6.703 1.00 34.31 N ATOM 183 CZ ARG A 312 6.411 14.489 7.570 1.00 20.31 C ATOM 184 NH1 ARG A 312 6.825 13.251 7.336 1.00 13.53 N1+ ATOM 185 NH2 ARG A 312 6.801 15.117 8.672 1.00 35.04 N ATOM 0 H ARG A 312 5.557 13.007 3.495 1.00 61.33 H new ATOM 0 HA ARG A 312 2.942 13.308 2.171 1.00 65.13 H new ATOM 0 HB2 ARG A 312 2.086 14.687 3.877 1.00 62.32 H new ATOM 0 HB3 ARG A 312 2.787 13.334 4.742 1.00 62.32 H new ATOM 0 HG2 ARG A 312 4.166 16.011 4.314 1.00 71.50 H new ATOM 0 HG3 ARG A 312 3.301 15.555 5.769 1.00 71.50 H new ATOM 0 HD2 ARG A 312 4.928 13.427 5.647 1.00 52.51 H new ATOM 0 HD3 ARG A 312 5.922 14.528 4.714 1.00 52.51 H new ATOM 0 HE ARG A 312 5.312 16.053 6.911 1.00 34.31 H new ATOM 0 HH11 ARG A 312 6.529 12.766 6.489 1.00 13.53 H new ATOM 0 HH12 ARG A 312 7.439 12.784 8.003 1.00 13.53 H new ATOM 0 HH21 ARG A 312 6.487 16.070 8.854 1.00 35.04 H new ATOM 0 HH22 ARG A 312 7.415 14.647 9.337 1.00 35.04 H new ATOM 199 N ARG A 313 3.644 15.520 1.209 1.00 22.33 N ATOM 200 CA ARG A 313 4.169 16.658 0.463 1.00 23.35 C ATOM 201 C ARG A 313 4.163 17.919 1.321 1.00 52.24 C ATOM 202 O ARG A 313 3.235 18.152 2.095 1.00 13.30 O ATOM 203 CB ARG A 313 3.345 16.887 -0.806 1.00 11.12 C ATOM 204 CG ARG A 313 2.083 17.704 -0.572 1.00 71.14 C ATOM 205 CD ARG A 313 1.106 16.972 0.334 1.00 15.11 C ATOM 206 NE ARG A 313 -0.129 17.726 0.529 1.00 62.02 N ATOM 207 CZ ARG A 313 -1.133 17.308 1.292 1.00 31.34 C ATOM 208 NH1 ARG A 313 -1.048 16.148 1.929 1.00 41.44 N1+ ATOM 209 NH2 ARG A 313 -2.225 18.051 1.420 1.00 33.42 N ATOM 0 H ARG A 313 2.691 15.255 0.959 1.00 22.33 H new ATOM 0 HA ARG A 313 5.199 16.434 0.184 1.00 23.35 H new ATOM 0 HB2 ARG A 313 3.965 17.394 -1.545 1.00 11.12 H new ATOM 0 HB3 ARG A 313 3.070 15.921 -1.230 1.00 11.12 H new ATOM 0 HG2 ARG A 313 2.347 18.663 -0.126 1.00 71.14 H new ATOM 0 HG3 ARG A 313 1.604 17.918 -1.528 1.00 71.14 H new ATOM 0 HD2 ARG A 313 0.872 15.998 -0.097 1.00 15.11 H new ATOM 0 HD3 ARG A 313 1.575 16.789 1.301 1.00 15.11 H new ATOM 0 HE ARG A 313 -0.226 18.623 0.053 1.00 62.02 H new ATOM 0 HH11 ARG A 313 -0.210 15.574 1.834 1.00 41.44 H new ATOM 0 HH12 ARG A 313 -1.820 15.830 2.514 1.00 41.44 H new ATOM 0 HH21 ARG A 313 -2.294 18.944 0.932 1.00 33.42 H new ATOM 0 HH22 ARG A 313 -2.995 17.729 2.006 1.00 33.42 H new ATOM 223 N ILE A 314 5.207 18.730 1.178 1.00 33.21 N ATOM 224 CA ILE A 314 5.322 19.968 1.939 1.00 40.53 C ATOM 225 C ILE A 314 5.315 21.183 1.018 1.00 21.34 C ATOM 226 O ILE A 314 5.998 21.203 -0.005 1.00 73.33 O ATOM 227 CB ILE A 314 6.607 19.989 2.789 1.00 44.43 C ATOM 228 CG1 ILE A 314 6.730 18.697 3.599 1.00 61.03 C ATOM 229 CG2 ILE A 314 6.615 21.201 3.708 1.00 71.22 C ATOM 230 CD1 ILE A 314 8.044 18.571 4.339 1.00 71.22 C ATOM 0 H ILE A 314 5.985 18.552 0.542 1.00 33.21 H new ATOM 0 HA ILE A 314 4.457 20.013 2.601 1.00 40.53 H new ATOM 0 HB ILE A 314 7.466 20.059 2.121 1.00 44.43 H new ATOM 0 HG12 ILE A 314 5.912 18.649 4.317 1.00 61.03 H new ATOM 0 HG13 ILE A 314 6.617 17.845 2.929 1.00 61.03 H new ATOM 0 HG21 ILE A 314 7.529 21.201 4.302 1.00 71.22 H new ATOM 0 HG22 ILE A 314 6.570 22.111 3.110 1.00 71.22 H new ATOM 0 HG23 ILE A 314 5.751 21.160 4.372 1.00 71.22 H new ATOM 0 HD11 ILE A 314 8.062 17.632 4.892 1.00 71.22 H new ATOM 0 HD12 ILE A 314 8.867 18.587 3.624 1.00 71.22 H new ATOM 0 HD13 ILE A 314 8.151 19.403 5.035 1.00 71.22 H new ATOM 242 N VAL A 315 4.539 22.196 1.389 1.00 31.44 N ATOM 243 CA VAL A 315 4.444 23.416 0.599 1.00 40.55 C ATOM 244 C VAL A 315 5.640 24.327 0.848 1.00 12.11 C ATOM 245 O VAL A 315 5.867 24.775 1.972 1.00 32.30 O ATOM 246 CB VAL A 315 3.149 24.190 0.913 1.00 44.24 C ATOM 247 CG1 VAL A 315 3.036 24.459 2.405 1.00 25.10 C ATOM 248 CG2 VAL A 315 3.101 25.489 0.124 1.00 1.35 C ATOM 0 H VAL A 315 3.966 22.195 2.233 1.00 31.44 H new ATOM 0 HA VAL A 315 4.433 23.114 -0.448 1.00 40.55 H new ATOM 0 HB VAL A 315 2.299 23.578 0.613 1.00 44.24 H new ATOM 0 HG11 VAL A 315 2.115 25.006 2.607 1.00 25.10 H new ATOM 0 HG12 VAL A 315 3.022 23.512 2.945 1.00 25.10 H new ATOM 0 HG13 VAL A 315 3.890 25.051 2.734 1.00 25.10 H new ATOM 0 HG21 VAL A 315 2.180 26.023 0.358 1.00 1.35 H new ATOM 0 HG22 VAL A 315 3.957 26.109 0.391 1.00 1.35 H new ATOM 0 HG23 VAL A 315 3.131 25.268 -0.943 1.00 1.35 H new ATOM 258 N ILE A 316 6.402 24.597 -0.207 1.00 54.32 N ATOM 259 CA ILE A 316 7.575 25.456 -0.101 1.00 55.43 C ATOM 260 C ILE A 316 7.569 26.529 -1.186 1.00 70.43 C ATOM 261 O ILE A 316 6.908 26.384 -2.214 1.00 42.24 O ATOM 262 CB ILE A 316 8.879 24.644 -0.205 1.00 34.42 C ATOM 263 CG1 ILE A 316 8.768 23.353 0.607 1.00 73.45 C ATOM 264 CG2 ILE A 316 10.061 25.476 0.270 1.00 33.44 C ATOM 265 CD1 ILE A 316 8.508 23.586 2.079 1.00 54.32 C ATOM 0 H ILE A 316 6.228 24.234 -1.144 1.00 54.32 H new ATOM 0 HA ILE A 316 7.531 25.932 0.879 1.00 55.43 H new ATOM 0 HB ILE A 316 9.043 24.380 -1.250 1.00 34.42 H new ATOM 0 HG12 ILE A 316 7.964 22.743 0.196 1.00 73.45 H new ATOM 0 HG13 ILE A 316 9.690 22.782 0.495 1.00 73.45 H new ATOM 0 HG21 ILE A 316 10.975 24.888 0.190 1.00 33.44 H new ATOM 0 HG22 ILE A 316 10.149 26.369 -0.348 1.00 33.44 H new ATOM 0 HG23 ILE A 316 9.907 25.768 1.309 1.00 33.44 H new ATOM 0 HD11 ILE A 316 8.441 22.627 2.593 1.00 54.32 H new ATOM 0 HD12 ILE A 316 9.324 24.170 2.505 1.00 54.32 H new ATOM 0 HD13 ILE A 316 7.571 24.129 2.201 1.00 54.32 H new ATOM 277 N HIS A 317 8.312 27.605 -0.949 1.00 51.30 N ATOM 278 CA HIS A 317 8.396 28.702 -1.906 1.00 43.21 C ATOM 279 C HIS A 317 9.104 28.257 -3.182 1.00 13.34 C ATOM 280 O HIS A 317 9.628 27.146 -3.258 1.00 63.44 O ATOM 281 CB HIS A 317 9.131 29.891 -1.290 1.00 41.34 C ATOM 282 CG HIS A 317 8.384 30.541 -0.166 1.00 52.43 C ATOM 283 ND1 HIS A 317 8.068 31.884 -0.150 1.00 2.41 N ATOM 284 CD2 HIS A 317 7.886 30.026 0.982 1.00 21.05 C ATOM 285 CE1 HIS A 317 7.410 32.166 0.960 1.00 43.42 C ATOM 286 NE2 HIS A 317 7.287 31.055 1.664 1.00 50.44 N ATOM 0 H HIS A 317 8.865 27.741 -0.102 1.00 51.30 H new ATOM 0 HA HIS A 317 7.381 29.006 -2.161 1.00 43.21 H new ATOM 0 HB2 HIS A 317 10.102 29.557 -0.925 1.00 41.34 H new ATOM 0 HB3 HIS A 317 9.320 30.632 -2.066 1.00 41.34 H new ATOM 0 HD2 HIS A 317 7.948 28.996 1.302 1.00 21.05 H new ATOM 0 HE1 HIS A 317 7.036 33.139 1.244 1.00 43.42 H new ATOM 0 HE2 HIS A 317 6.822 30.975 2.568 1.00 50.44 H new ATOM 294 N ARG A 318 9.115 29.132 -4.183 1.00 45.32 N ATOM 295 CA ARG A 318 9.757 28.828 -5.456 1.00 11.31 C ATOM 296 C ARG A 318 11.124 28.184 -5.237 1.00 1.25 C ATOM 297 O ARG A 318 11.992 28.755 -4.578 1.00 61.32 O ATOM 298 CB ARG A 318 9.910 30.100 -6.291 1.00 33.22 C ATOM 299 CG ARG A 318 10.688 31.201 -5.587 1.00 11.42 C ATOM 300 CD ARG A 318 10.412 32.562 -6.209 1.00 63.51 C ATOM 301 NE ARG A 318 10.591 33.648 -5.249 1.00 71.10 N ATOM 302 CZ ARG A 318 10.655 34.929 -5.592 1.00 33.32 C ATOM 303 NH1 ARG A 318 10.556 35.283 -6.866 1.00 12.41 N1+ ATOM 304 NH2 ARG A 318 10.821 35.859 -4.661 1.00 25.43 N ATOM 0 H ARG A 318 8.687 30.057 -4.137 1.00 45.32 H new ATOM 0 HA ARG A 318 9.124 28.122 -5.993 1.00 11.31 H new ATOM 0 HB2 ARG A 318 10.413 29.852 -7.226 1.00 33.22 H new ATOM 0 HB3 ARG A 318 8.920 30.475 -6.551 1.00 33.22 H new ATOM 0 HG2 ARG A 318 10.418 31.221 -4.531 1.00 11.42 H new ATOM 0 HG3 ARG A 318 11.755 30.985 -5.640 1.00 11.42 H new ATOM 0 HD2 ARG A 318 11.079 32.715 -7.058 1.00 63.51 H new ATOM 0 HD3 ARG A 318 9.393 32.584 -6.596 1.00 63.51 H new ATOM 0 HE ARG A 318 10.671 33.409 -4.261 1.00 71.10 H new ATOM 0 HH11 ARG A 318 10.430 34.571 -7.585 1.00 12.41 H new ATOM 0 HH12 ARG A 318 10.605 36.268 -7.127 1.00 12.41 H new ATOM 0 HH21 ARG A 318 10.900 35.590 -3.680 1.00 25.43 H new ATOM 0 HH22 ARG A 318 10.870 36.843 -4.926 1.00 25.43 H new ATOM 318 N GLY A 319 11.306 26.990 -5.792 1.00 2.41 N ATOM 319 CA GLY A 319 12.568 26.288 -5.645 1.00 4.11 C ATOM 320 C GLY A 319 13.757 27.150 -6.020 1.00 43.43 C ATOM 321 O GLY A 319 14.858 26.955 -5.505 1.00 74.24 O ATOM 0 H GLY A 319 10.602 26.496 -6.341 1.00 2.41 H new ATOM 0 HA2 GLY A 319 12.676 25.954 -4.613 1.00 4.11 H new ATOM 0 HA3 GLY A 319 12.559 25.395 -6.270 1.00 4.11 H new ATOM 325 N SER A 320 13.536 28.102 -6.920 1.00 0.31 N ATOM 326 CA SER A 320 14.600 28.993 -7.367 1.00 42.33 C ATOM 327 C SER A 320 15.303 29.640 -6.177 1.00 20.34 C ATOM 328 O SER A 320 16.514 29.865 -6.203 1.00 74.13 O ATOM 329 CB SER A 320 14.035 30.074 -8.290 1.00 43.33 C ATOM 330 OG SER A 320 15.041 30.590 -9.146 1.00 62.43 O ATOM 0 H SER A 320 12.630 28.276 -7.354 1.00 0.31 H new ATOM 0 HA SER A 320 15.329 28.400 -7.919 1.00 42.33 H new ATOM 0 HB2 SER A 320 13.223 29.659 -8.887 1.00 43.33 H new ATOM 0 HB3 SER A 320 13.611 30.882 -7.693 1.00 43.33 H new ATOM 0 HG SER A 320 14.655 31.278 -9.727 1.00 62.43 H new ATOM 336 N THR A 321 14.534 29.938 -5.135 1.00 23.22 N ATOM 337 CA THR A 321 15.080 30.561 -3.936 1.00 15.11 C ATOM 338 C THR A 321 15.237 29.544 -2.811 1.00 25.31 C ATOM 339 O THR A 321 15.198 29.897 -1.633 1.00 62.45 O ATOM 340 CB THR A 321 14.188 31.717 -3.447 1.00 41.23 C ATOM 341 OG1 THR A 321 13.573 32.367 -4.564 1.00 51.11 O ATOM 342 CG2 THR A 321 14.999 32.728 -2.649 1.00 70.02 C ATOM 0 H THR A 321 13.531 29.758 -5.097 1.00 23.22 H new ATOM 0 HA THR A 321 16.060 30.957 -4.204 1.00 15.11 H new ATOM 0 HB THR A 321 13.417 31.301 -2.799 1.00 41.23 H new ATOM 0 HG1 THR A 321 13.006 33.100 -4.245 1.00 51.11 H new ATOM 0 HG21 THR A 321 14.347 33.535 -2.315 1.00 70.02 H new ATOM 0 HG22 THR A 321 15.442 32.237 -1.783 1.00 70.02 H new ATOM 0 HG23 THR A 321 15.790 33.137 -3.278 1.00 70.02 H new ATOM 350 N GLY A 322 15.414 28.280 -3.182 1.00 65.43 N ATOM 351 CA GLY A 322 15.575 27.231 -2.192 1.00 14.41 C ATOM 352 C GLY A 322 17.030 26.950 -1.876 1.00 54.00 C ATOM 353 O GLY A 322 17.400 25.812 -1.578 1.00 54.15 O ATOM 0 H GLY A 322 15.449 27.963 -4.151 1.00 65.43 H new ATOM 0 HA2 GLY A 322 15.056 27.517 -1.277 1.00 14.41 H new ATOM 0 HA3 GLY A 322 15.102 26.318 -2.554 1.00 14.41 H new ATOM 357 N LEU A 323 17.859 27.985 -1.940 1.00 44.11 N ATOM 358 CA LEU A 323 19.284 27.845 -1.660 1.00 53.22 C ATOM 359 C LEU A 323 19.532 27.700 -0.163 1.00 21.34 C ATOM 360 O LEU A 323 20.525 27.106 0.257 1.00 53.33 O ATOM 361 CB LEU A 323 20.052 29.051 -2.203 1.00 4.54 C ATOM 362 CG LEU A 323 21.551 28.848 -2.423 1.00 31.10 C ATOM 363 CD1 LEU A 323 21.820 28.319 -3.823 1.00 64.24 C ATOM 364 CD2 LEU A 323 22.306 30.149 -2.189 1.00 62.04 C ATOM 0 H LEU A 323 17.569 28.932 -2.184 1.00 44.11 H new ATOM 0 HA LEU A 323 19.640 26.943 -2.157 1.00 53.22 H new ATOM 0 HB2 LEU A 323 19.603 29.346 -3.151 1.00 4.54 H new ATOM 0 HB3 LEU A 323 19.916 29.884 -1.513 1.00 4.54 H new ATOM 0 HG LEU A 323 21.906 28.110 -1.704 1.00 31.10 H new ATOM 0 HD11 LEU A 323 22.893 28.181 -3.960 1.00 64.24 H new ATOM 0 HD12 LEU A 323 21.312 27.364 -3.955 1.00 64.24 H new ATOM 0 HD13 LEU A 323 21.449 29.032 -4.559 1.00 64.24 H new ATOM 0 HD21 LEU A 323 23.372 29.985 -2.350 1.00 62.04 H new ATOM 0 HD22 LEU A 323 21.946 30.908 -2.883 1.00 62.04 H new ATOM 0 HD23 LEU A 323 22.141 30.486 -1.166 1.00 62.04 H new ATOM 376 N GLY A 324 18.623 28.245 0.638 1.00 31.44 N ATOM 377 CA GLY A 324 18.760 28.164 2.081 1.00 71.03 C ATOM 378 C GLY A 324 19.059 26.756 2.556 1.00 75.42 C ATOM 379 O GLY A 324 19.876 26.558 3.457 1.00 21.33 O ATOM 0 H GLY A 324 17.793 28.742 0.314 1.00 31.44 H new ATOM 0 HA2 GLY A 324 19.559 28.831 2.405 1.00 71.03 H new ATOM 0 HA3 GLY A 324 17.841 28.515 2.551 1.00 71.03 H new ATOM 383 N PHE A 325 18.397 25.776 1.952 1.00 4.13 N ATOM 384 CA PHE A 325 18.595 24.379 2.321 1.00 14.42 C ATOM 385 C PHE A 325 19.549 23.689 1.351 1.00 41.24 C ATOM 386 O PHE A 325 19.741 24.145 0.224 1.00 35.12 O ATOM 387 CB PHE A 325 17.255 23.641 2.346 1.00 21.14 C ATOM 388 CG PHE A 325 16.460 23.797 1.080 1.00 31.11 C ATOM 389 CD1 PHE A 325 16.748 23.023 -0.032 1.00 40.52 C ATOM 390 CD2 PHE A 325 15.428 24.717 1.003 1.00 75.11 C ATOM 391 CE1 PHE A 325 16.020 23.165 -1.199 1.00 43.35 C ATOM 392 CE2 PHE A 325 14.696 24.862 -0.160 1.00 45.35 C ATOM 393 CZ PHE A 325 14.993 24.086 -1.262 1.00 14.33 C ATOM 0 H PHE A 325 17.719 25.923 1.205 1.00 4.13 H new ATOM 0 HA PHE A 325 19.036 24.352 3.317 1.00 14.42 H new ATOM 0 HB2 PHE A 325 17.437 22.581 2.523 1.00 21.14 H new ATOM 0 HB3 PHE A 325 16.663 24.008 3.185 1.00 21.14 H new ATOM 0 HD1 PHE A 325 17.550 22.301 0.013 1.00 40.52 H new ATOM 0 HD2 PHE A 325 15.193 25.328 1.862 1.00 75.11 H new ATOM 0 HE1 PHE A 325 16.254 22.556 -2.060 1.00 43.35 H new ATOM 0 HE2 PHE A 325 13.892 25.582 -0.207 1.00 45.35 H new ATOM 0 HZ PHE A 325 14.423 24.199 -2.172 1.00 14.33 H new ATOM 403 N ASN A 326 20.145 22.589 1.798 1.00 34.25 N ATOM 404 CA ASN A 326 21.081 21.837 0.970 1.00 15.45 C ATOM 405 C ASN A 326 20.587 20.411 0.747 1.00 33.43 C ATOM 406 O ASN A 326 19.664 19.951 1.422 1.00 71.11 O ATOM 407 CB ASN A 326 22.465 21.812 1.621 1.00 1.21 C ATOM 408 CG ASN A 326 23.549 21.363 0.661 1.00 30.05 C ATOM 409 OD1 ASN A 326 23.623 21.834 -0.474 1.00 60.34 O ATOM 410 ND2 ASN A 326 24.396 20.444 1.112 1.00 72.14 N ATOM 0 H ASN A 326 19.997 22.198 2.729 1.00 34.25 H new ATOM 0 HA ASN A 326 21.150 22.334 0.003 1.00 15.45 H new ATOM 0 HB2 ASN A 326 22.705 22.807 1.996 1.00 1.21 H new ATOM 0 HB3 ASN A 326 22.446 21.143 2.482 1.00 1.21 H new ATOM 0 HD21 ASN A 326 25.145 20.101 0.510 1.00 72.14 H new ATOM 0 HD22 ASN A 326 24.297 20.081 2.060 1.00 72.14 H new ATOM 417 N ILE A 327 21.204 19.718 -0.203 1.00 51.31 N ATOM 418 CA ILE A 327 20.828 18.344 -0.513 1.00 54.35 C ATOM 419 C ILE A 327 22.058 17.449 -0.626 1.00 32.34 C ATOM 420 O ILE A 327 23.106 17.876 -1.112 1.00 43.12 O ATOM 421 CB ILE A 327 20.025 18.262 -1.824 1.00 72.32 C ATOM 422 CG1 ILE A 327 20.798 18.930 -2.963 1.00 41.43 C ATOM 423 CG2 ILE A 327 18.660 18.912 -1.651 1.00 53.13 C ATOM 424 CD1 ILE A 327 20.527 20.413 -3.090 1.00 72.34 C ATOM 0 H ILE A 327 21.967 20.085 -0.772 1.00 51.31 H new ATOM 0 HA ILE A 327 20.202 17.995 0.309 1.00 54.35 H new ATOM 0 HB ILE A 327 19.876 17.212 -2.077 1.00 72.32 H new ATOM 0 HG12 ILE A 327 21.866 18.776 -2.806 1.00 41.43 H new ATOM 0 HG13 ILE A 327 20.540 18.440 -3.902 1.00 41.43 H new ATOM 0 HG21 ILE A 327 18.104 18.846 -2.586 1.00 53.13 H new ATOM 0 HG22 ILE A 327 18.109 18.397 -0.864 1.00 53.13 H new ATOM 0 HG23 ILE A 327 18.788 19.960 -1.378 1.00 53.13 H new ATOM 0 HD11 ILE A 327 21.109 20.820 -3.917 1.00 72.34 H new ATOM 0 HD12 ILE A 327 19.466 20.574 -3.279 1.00 72.34 H new ATOM 0 HD13 ILE A 327 20.811 20.915 -2.165 1.00 72.34 H new ATOM 436 N ILE A 328 21.921 16.206 -0.177 1.00 11.01 N ATOM 437 CA ILE A 328 23.021 15.250 -0.231 1.00 13.42 C ATOM 438 C ILE A 328 22.565 13.922 -0.826 1.00 45.50 C ATOM 439 O ILE A 328 21.478 13.435 -0.524 1.00 54.24 O ATOM 440 CB ILE A 328 23.615 14.996 1.167 1.00 73.10 C ATOM 441 CG1 ILE A 328 24.968 14.292 1.050 1.00 53.12 C ATOM 442 CG2 ILE A 328 22.654 14.170 2.009 1.00 53.22 C ATOM 443 CD1 ILE A 328 25.782 14.332 2.324 1.00 32.34 C ATOM 0 H ILE A 328 21.060 15.837 0.228 1.00 11.01 H new ATOM 0 HA ILE A 328 23.789 15.687 -0.869 1.00 13.42 H new ATOM 0 HB ILE A 328 23.767 15.956 1.660 1.00 73.10 H new ATOM 0 HG12 ILE A 328 24.804 13.253 0.766 1.00 53.12 H new ATOM 0 HG13 ILE A 328 25.541 14.756 0.247 1.00 53.12 H new ATOM 0 HG21 ILE A 328 23.088 13.999 2.994 1.00 53.22 H new ATOM 0 HG22 ILE A 328 21.711 14.706 2.116 1.00 53.22 H new ATOM 0 HG23 ILE A 328 22.473 13.212 1.521 1.00 53.22 H new ATOM 0 HD11 ILE A 328 26.728 13.814 2.168 1.00 32.34 H new ATOM 0 HD12 ILE A 328 25.977 15.369 2.599 1.00 32.34 H new ATOM 0 HD13 ILE A 328 25.228 13.842 3.125 1.00 32.34 H new ATOM 455 N GLY A 329 23.408 13.341 -1.675 1.00 64.24 N ATOM 456 CA GLY A 329 23.076 12.073 -2.299 1.00 61.42 C ATOM 457 C GLY A 329 24.303 11.242 -2.613 1.00 63.14 C ATOM 458 O GLY A 329 25.424 11.632 -2.290 1.00 70.23 O ATOM 0 H GLY A 329 24.314 13.726 -1.942 1.00 64.24 H new ATOM 0 HA2 GLY A 329 22.418 11.508 -1.639 1.00 61.42 H new ATOM 0 HA3 GLY A 329 22.522 12.259 -3.219 1.00 61.42 H new ATOM 462 N GLY A 330 24.091 10.091 -3.244 1.00 41.31 N ATOM 463 CA GLY A 330 25.199 9.220 -3.590 1.00 14.33 C ATOM 464 C GLY A 330 25.378 9.075 -5.088 1.00 35.30 C ATOM 465 O GLY A 330 25.244 10.047 -5.832 1.00 4.31 O ATOM 0 H GLY A 330 23.172 9.746 -3.522 1.00 41.31 H new ATOM 0 HA2 GLY A 330 26.117 9.615 -3.154 1.00 14.33 H new ATOM 0 HA3 GLY A 330 25.035 8.236 -3.150 1.00 14.33 H new ATOM 469 N GLU A 331 25.681 7.859 -5.532 1.00 55.42 N ATOM 470 CA GLU A 331 25.881 7.592 -6.951 1.00 45.23 C ATOM 471 C GLU A 331 24.624 6.989 -7.574 1.00 61.10 C ATOM 472 O GLU A 331 23.907 6.223 -6.930 1.00 71.34 O ATOM 473 CB GLU A 331 27.067 6.648 -7.154 1.00 71.41 C ATOM 474 CG GLU A 331 26.998 5.393 -6.301 1.00 21.35 C ATOM 475 CD GLU A 331 27.949 4.310 -6.778 1.00 1.11 C ATOM 476 OE1 GLU A 331 27.668 3.121 -6.524 1.00 13.10 O ATOM 477 OE2 GLU A 331 28.972 4.655 -7.405 1.00 15.51 O1- ATOM 0 H GLU A 331 25.793 7.044 -4.929 1.00 55.42 H new ATOM 0 HA GLU A 331 26.092 8.540 -7.446 1.00 45.23 H new ATOM 0 HB2 GLU A 331 27.117 6.361 -8.204 1.00 71.41 H new ATOM 0 HB3 GLU A 331 27.989 7.182 -6.926 1.00 71.41 H new ATOM 0 HG2 GLU A 331 27.232 5.647 -5.267 1.00 21.35 H new ATOM 0 HG3 GLU A 331 25.979 5.007 -6.311 1.00 21.35 H new ATOM 484 N ASP A 332 24.364 7.342 -8.827 1.00 34.22 N ATOM 485 CA ASP A 332 23.195 6.835 -9.537 1.00 54.55 C ATOM 486 C ASP A 332 21.928 7.041 -8.714 1.00 20.51 C ATOM 487 O ASP A 332 20.981 6.261 -8.808 1.00 45.45 O ATOM 488 CB ASP A 332 23.372 5.351 -9.861 1.00 30.44 C ATOM 489 CG ASP A 332 24.650 5.075 -10.630 1.00 42.20 C ATOM 490 OD1 ASP A 332 25.186 3.953 -10.506 1.00 25.10 O ATOM 491 OD2 ASP A 332 25.112 5.979 -11.357 1.00 12.24 O1- ATOM 0 H ASP A 332 24.946 7.977 -9.373 1.00 34.22 H new ATOM 0 HA ASP A 332 23.096 7.393 -10.468 1.00 54.55 H new ATOM 0 HB2 ASP A 332 23.378 4.778 -8.934 1.00 30.44 H new ATOM 0 HB3 ASP A 332 22.519 5.005 -10.444 1.00 30.44 H new ATOM 496 N GLY A 333 21.919 8.097 -7.905 1.00 50.11 N ATOM 497 CA GLY A 333 20.763 8.385 -7.076 1.00 62.04 C ATOM 498 C GLY A 333 20.417 7.240 -6.144 1.00 1.24 C ATOM 499 O GLY A 333 19.266 6.810 -6.080 1.00 52.13 O ATOM 0 H GLY A 333 22.691 8.757 -7.809 1.00 50.11 H new ATOM 0 HA2 GLY A 333 20.956 9.282 -6.488 1.00 62.04 H new ATOM 0 HA3 GLY A 333 19.907 8.601 -7.715 1.00 62.04 H new ATOM 503 N GLU A 334 21.417 6.743 -5.422 1.00 21.13 N ATOM 504 CA GLU A 334 21.213 5.640 -4.492 1.00 54.34 C ATOM 505 C GLU A 334 20.267 6.046 -3.366 1.00 71.03 C ATOM 506 O GLU A 334 19.542 5.215 -2.819 1.00 62.04 O ATOM 507 CB GLU A 334 22.551 5.180 -3.908 1.00 4.41 C ATOM 508 CG GLU A 334 23.265 4.148 -4.764 1.00 70.23 C ATOM 509 CD GLU A 334 22.836 2.729 -4.447 1.00 13.12 C ATOM 510 OE1 GLU A 334 23.431 2.117 -3.535 1.00 51.52 O ATOM 511 OE2 GLU A 334 21.903 2.229 -5.111 1.00 64.51 O1- ATOM 0 H GLU A 334 22.376 7.087 -5.464 1.00 21.13 H new ATOM 0 HA GLU A 334 20.762 4.814 -5.042 1.00 54.34 H new ATOM 0 HB2 GLU A 334 23.200 6.047 -3.781 1.00 4.41 H new ATOM 0 HB3 GLU A 334 22.380 4.762 -2.916 1.00 4.41 H new ATOM 0 HG2 GLU A 334 23.070 4.356 -5.816 1.00 70.23 H new ATOM 0 HG3 GLU A 334 24.341 4.240 -4.615 1.00 70.23 H new ATOM 518 N GLY A 335 20.279 7.330 -3.024 1.00 12.05 N ATOM 519 CA GLY A 335 19.420 7.825 -1.964 1.00 74.04 C ATOM 520 C GLY A 335 19.738 9.256 -1.580 1.00 72.20 C ATOM 521 O GLY A 335 20.733 9.517 -0.902 1.00 1.50 O ATOM 0 H GLY A 335 20.869 8.037 -3.462 1.00 12.05 H new ATOM 0 HA2 GLY A 335 18.380 7.761 -2.284 1.00 74.04 H new ATOM 0 HA3 GLY A 335 19.524 7.185 -1.088 1.00 74.04 H new ATOM 525 N ILE A 336 18.894 10.186 -2.013 1.00 11.34 N ATOM 526 CA ILE A 336 19.092 11.597 -1.710 1.00 53.22 C ATOM 527 C ILE A 336 18.175 12.051 -0.579 1.00 70.03 C ATOM 528 O ILE A 336 16.963 11.839 -0.625 1.00 51.25 O ATOM 529 CB ILE A 336 18.837 12.480 -2.946 1.00 51.54 C ATOM 530 CG1 ILE A 336 19.149 13.943 -2.628 1.00 73.13 C ATOM 531 CG2 ILE A 336 17.398 12.329 -3.417 1.00 21.51 C ATOM 532 CD1 ILE A 336 20.314 14.499 -3.418 1.00 2.51 C ATOM 0 H ILE A 336 18.066 9.987 -2.575 1.00 11.34 H new ATOM 0 HA ILE A 336 20.131 11.709 -1.400 1.00 53.22 H new ATOM 0 HB ILE A 336 19.498 12.154 -3.750 1.00 51.54 H new ATOM 0 HG12 ILE A 336 18.264 14.547 -2.828 1.00 73.13 H new ATOM 0 HG13 ILE A 336 19.365 14.037 -1.564 1.00 73.13 H new ATOM 0 HG21 ILE A 336 17.233 12.959 -4.291 1.00 21.51 H new ATOM 0 HG22 ILE A 336 17.208 11.288 -3.679 1.00 21.51 H new ATOM 0 HG23 ILE A 336 16.720 12.631 -2.619 1.00 21.51 H new ATOM 0 HD11 ILE A 336 20.478 15.540 -3.141 1.00 2.51 H new ATOM 0 HD12 ILE A 336 21.211 13.920 -3.199 1.00 2.51 H new ATOM 0 HD13 ILE A 336 20.093 14.438 -4.484 1.00 2.51 H new ATOM 544 N PHE A 337 18.761 12.676 0.436 1.00 13.53 N ATOM 545 CA PHE A 337 17.998 13.161 1.580 1.00 44.42 C ATOM 546 C PHE A 337 18.450 14.562 1.982 1.00 3.11 C ATOM 547 O PHE A 337 19.489 15.044 1.529 1.00 23.23 O ATOM 548 CB PHE A 337 18.150 12.204 2.764 1.00 22.41 C ATOM 549 CG PHE A 337 18.176 10.756 2.365 1.00 1.43 C ATOM 550 CD1 PHE A 337 17.088 10.180 1.728 1.00 52.41 C ATOM 551 CD2 PHE A 337 19.286 9.970 2.628 1.00 30.51 C ATOM 552 CE1 PHE A 337 17.108 8.849 1.358 1.00 11.01 C ATOM 553 CE2 PHE A 337 19.312 8.638 2.262 1.00 51.44 C ATOM 554 CZ PHE A 337 18.221 8.076 1.627 1.00 72.43 C ATOM 0 H PHE A 337 19.763 12.859 0.490 1.00 13.53 H new ATOM 0 HA PHE A 337 16.948 13.207 1.291 1.00 44.42 H new ATOM 0 HB2 PHE A 337 19.070 12.442 3.298 1.00 22.41 H new ATOM 0 HB3 PHE A 337 17.327 12.366 3.460 1.00 22.41 H new ATOM 0 HD1 PHE A 337 16.214 10.779 1.518 1.00 52.41 H new ATOM 0 HD2 PHE A 337 20.141 10.404 3.125 1.00 30.51 H new ATOM 0 HE1 PHE A 337 16.255 8.413 0.859 1.00 11.01 H new ATOM 0 HE2 PHE A 337 20.184 8.037 2.472 1.00 51.44 H new ATOM 0 HZ PHE A 337 18.238 7.035 1.342 1.00 72.43 H new ATOM 564 N ILE A 338 17.664 15.209 2.836 1.00 10.45 N ATOM 565 CA ILE A 338 17.983 16.553 3.299 1.00 20.14 C ATOM 566 C ILE A 338 19.288 16.567 4.088 1.00 32.21 C ATOM 567 O ILE A 338 19.564 15.655 4.867 1.00 61.42 O ATOM 568 CB ILE A 338 16.857 17.126 4.180 1.00 33.41 C ATOM 569 CG1 ILE A 338 15.508 16.996 3.470 1.00 41.54 C ATOM 570 CG2 ILE A 338 17.143 18.581 4.523 1.00 13.13 C ATOM 571 CD1 ILE A 338 15.448 17.725 2.146 1.00 35.32 C ATOM 0 H ILE A 338 16.802 14.824 3.221 1.00 10.45 H new ATOM 0 HA ILE A 338 18.092 17.176 2.411 1.00 20.14 H new ATOM 0 HB ILE A 338 16.814 16.555 5.108 1.00 33.41 H new ATOM 0 HG12 ILE A 338 15.295 15.940 3.304 1.00 41.54 H new ATOM 0 HG13 ILE A 338 14.725 17.381 4.123 1.00 41.54 H new ATOM 0 HG21 ILE A 338 16.339 18.973 5.146 1.00 13.13 H new ATOM 0 HG22 ILE A 338 18.087 18.649 5.064 1.00 13.13 H new ATOM 0 HG23 ILE A 338 17.208 19.165 3.605 1.00 13.13 H new ATOM 0 HD11 ILE A 338 14.463 17.589 1.700 1.00 35.32 H new ATOM 0 HD12 ILE A 338 15.630 18.788 2.307 1.00 35.32 H new ATOM 0 HD13 ILE A 338 16.208 17.325 1.475 1.00 35.32 H new ATOM 583 N SER A 339 20.086 17.609 3.882 1.00 53.21 N ATOM 584 CA SER A 339 21.364 17.742 4.572 1.00 21.04 C ATOM 585 C SER A 339 21.246 18.698 5.755 1.00 3.23 C ATOM 586 O SER A 339 21.453 18.310 6.906 1.00 14.32 O ATOM 587 CB SER A 339 22.440 18.239 3.607 1.00 72.42 C ATOM 588 OG SER A 339 23.236 19.248 4.204 1.00 60.13 O ATOM 0 H SER A 339 19.870 18.374 3.243 1.00 53.21 H new ATOM 0 HA SER A 339 21.649 16.759 4.948 1.00 21.04 H new ATOM 0 HB2 SER A 339 23.073 17.405 3.303 1.00 72.42 H new ATOM 0 HB3 SER A 339 21.970 18.629 2.704 1.00 72.42 H new ATOM 0 HG SER A 339 24.174 19.117 3.951 1.00 60.13 H new ATOM 594 N PHE A 340 20.910 19.951 5.465 1.00 10.12 N ATOM 595 CA PHE A 340 20.765 20.964 6.502 1.00 0.00 C ATOM 596 C PHE A 340 19.961 22.157 5.990 1.00 71.25 C ATOM 597 O PHE A 340 19.717 22.296 4.788 1.00 73.44 O ATOM 598 CB PHE A 340 22.139 21.431 6.985 1.00 62.34 C ATOM 599 CG PHE A 340 22.672 20.632 8.141 1.00 14.15 C ATOM 600 CD1 PHE A 340 23.833 19.888 8.008 1.00 54.53 C ATOM 601 CD2 PHE A 340 22.011 20.625 9.359 1.00 10.52 C ATOM 602 CE1 PHE A 340 24.327 19.152 9.069 1.00 33.00 C ATOM 603 CE2 PHE A 340 22.500 19.891 10.422 1.00 34.23 C ATOM 604 CZ PHE A 340 23.658 19.153 10.278 1.00 34.54 C ATOM 0 H PHE A 340 20.733 20.288 4.519 1.00 10.12 H new ATOM 0 HA PHE A 340 20.226 20.517 7.338 1.00 0.00 H new ATOM 0 HB2 PHE A 340 22.845 21.373 6.157 1.00 62.34 H new ATOM 0 HB3 PHE A 340 22.076 22.479 7.277 1.00 62.34 H new ATOM 0 HD1 PHE A 340 24.358 19.883 7.064 1.00 54.53 H new ATOM 0 HD2 PHE A 340 21.104 21.199 9.478 1.00 10.52 H new ATOM 0 HE1 PHE A 340 25.234 18.577 8.953 1.00 33.00 H new ATOM 0 HE2 PHE A 340 21.976 19.894 11.366 1.00 34.23 H new ATOM 0 HZ PHE A 340 24.040 18.578 11.108 1.00 34.54 H new HETATM 614 N AZH A 341 19.545 23.028 6.915 1.00 62.40 N HETATM 615 CA AZH A 341 18.768 24.213 6.579 1.00 10.20 C HETATM 616 CB AZH A 341 17.446 24.210 7.353 1.00 71.21 C HETATM 617 CG AZH A 341 16.632 22.952 7.172 1.00 40.14 C HETATM 618 ND AZH A 341 15.933 22.626 8.431 1.00 51.24 N HETATM 619 NE AZH A 341 16.599 22.127 9.429 1.00 51.40 N HETATM 620 NZ AZH A 341 17.216 21.601 10.447 1.00 30.12 N HETATM 621 C AZH A 341 19.521 25.511 6.856 1.00 25.33 C HETATM 622 O AZH A 341 20.141 25.464 7.920 1.00 11.24 O HETATM 0 HG2C AZH A 341 15.909 23.088 6.368 1.00 40.14 H new HETATM 0 HG1C AZH A 341 17.281 22.126 6.881 1.00 40.14 H new HETATM 0 HB2C AZH A 341 17.658 24.344 8.414 1.00 71.21 H new HETATM 0 HB1C AZH A 341 16.849 25.065 7.036 1.00 71.21 H new HETATM 0 HZ AZH A 341 18.197 21.879 10.431 1.00 30.12 H new HETATM 0 HA AZH A 341 18.576 24.172 5.507 1.00 10.20 H new ATOM 629 N LEU A 342 19.373 26.629 6.154 1.00 34.54 N ATOM 630 CA LEU A 342 19.944 27.895 6.601 1.00 12.21 C ATOM 631 C LEU A 342 18.851 28.847 7.076 1.00 50.14 C ATOM 632 O LEU A 342 17.693 28.728 6.674 1.00 42.41 O ATOM 633 CB LEU A 342 20.746 28.543 5.472 1.00 15.42 C ATOM 634 CG LEU A 342 22.027 27.818 5.057 1.00 70.31 C ATOM 635 CD1 LEU A 342 22.641 28.479 3.833 1.00 73.42 C ATOM 636 CD2 LEU A 342 23.022 27.791 6.207 1.00 2.52 C ATOM 0 H LEU A 342 18.862 26.685 5.273 1.00 34.54 H new ATOM 0 HA LEU A 342 20.610 27.689 7.439 1.00 12.21 H new ATOM 0 HB2 LEU A 342 20.101 28.628 4.598 1.00 15.42 H new ATOM 0 HB3 LEU A 342 21.008 29.557 5.775 1.00 15.42 H new ATOM 0 HG LEU A 342 21.773 26.790 4.800 1.00 70.31 H new ATOM 0 HD11 LEU A 342 23.552 27.950 3.552 1.00 73.42 H new ATOM 0 HD12 LEU A 342 21.931 28.444 3.006 1.00 73.42 H new ATOM 0 HD13 LEU A 342 22.881 29.517 4.062 1.00 73.42 H new ATOM 0 HD21 LEU A 342 23.927 27.271 5.893 1.00 2.52 H new ATOM 0 HD22 LEU A 342 23.272 28.812 6.496 1.00 2.52 H new ATOM 0 HD23 LEU A 342 22.581 27.271 7.057 1.00 2.52 H new ATOM 648 N ALA A 343 19.227 29.792 7.932 1.00 70.31 N ATOM 649 CA ALA A 343 18.280 30.767 8.457 1.00 42.20 C ATOM 650 C ALA A 343 17.854 31.756 7.377 1.00 72.12 C ATOM 651 O ALA A 343 18.668 32.194 6.566 1.00 64.03 O ATOM 652 CB ALA A 343 18.885 31.506 9.641 1.00 12.23 C ATOM 0 H ALA A 343 20.181 29.903 8.276 1.00 70.31 H new ATOM 0 HA ALA A 343 17.393 30.230 8.792 1.00 42.20 H new ATOM 0 HB1 ALA A 343 18.166 32.231 10.023 1.00 12.23 H new ATOM 0 HB2 ALA A 343 19.133 30.793 10.427 1.00 12.23 H new ATOM 0 HB3 ALA A 343 19.789 32.024 9.323 1.00 12.23 H new ATOM 658 N GLY A 344 16.570 32.103 7.372 1.00 73.32 N ATOM 659 CA GLY A 344 16.057 33.037 6.386 1.00 22.32 C ATOM 660 C GLY A 344 15.545 32.342 5.140 1.00 65.20 C ATOM 661 O GLY A 344 14.768 32.913 4.377 1.00 32.14 O ATOM 0 H GLY A 344 15.876 31.754 8.033 1.00 73.32 H new ATOM 0 HA2 GLY A 344 15.251 33.622 6.829 1.00 22.32 H new ATOM 0 HA3 GLY A 344 16.845 33.738 6.110 1.00 22.32 H new ATOM 665 N GLY A 345 15.985 31.104 4.931 1.00 23.12 N ATOM 666 CA GLY A 345 15.557 30.350 3.766 1.00 52.00 C ATOM 667 C GLY A 345 14.101 29.936 3.846 1.00 22.43 C ATOM 668 O GLY A 345 13.441 30.106 4.871 1.00 40.45 O ATOM 0 H GLY A 345 16.630 30.610 5.548 1.00 23.12 H new ATOM 0 HA2 GLY A 345 15.712 30.952 2.871 1.00 52.00 H new ATOM 0 HA3 GLY A 345 16.179 29.461 3.664 1.00 52.00 H new ATOM 672 N PRO A 346 13.578 29.381 2.743 1.00 53.14 N ATOM 673 CA PRO A 346 12.185 28.932 2.667 1.00 44.02 C ATOM 674 C PRO A 346 11.926 27.700 3.528 1.00 14.04 C ATOM 675 O PRO A 346 10.823 27.512 4.041 1.00 51.45 O ATOM 676 CB PRO A 346 12.002 28.596 1.185 1.00 2.12 C ATOM 677 CG PRO A 346 13.372 28.275 0.696 1.00 64.40 C ATOM 678 CD PRO A 346 14.308 29.149 1.485 1.00 75.50 C ATOM 0 HA PRO A 346 11.492 29.688 3.036 1.00 44.02 H new ATOM 0 HB2 PRO A 346 11.326 27.751 1.051 1.00 2.12 H new ATOM 0 HB3 PRO A 346 11.574 29.436 0.639 1.00 2.12 H new ATOM 0 HG2 PRO A 346 13.603 27.220 0.846 1.00 64.40 H new ATOM 0 HG3 PRO A 346 13.461 28.472 -0.372 1.00 64.40 H new ATOM 0 HD2 PRO A 346 15.265 28.658 1.660 1.00 75.50 H new ATOM 0 HD3 PRO A 346 14.520 30.083 0.965 1.00 75.50 H new ATOM 686 N ALA A 347 12.948 26.866 3.683 1.00 35.54 N ATOM 687 CA ALA A 347 12.831 25.654 4.484 1.00 74.21 C ATOM 688 C ALA A 347 12.714 25.987 5.969 1.00 62.43 C ATOM 689 O ALA A 347 11.998 25.313 6.710 1.00 51.24 O ATOM 690 CB ALA A 347 14.023 24.741 4.239 1.00 24.45 C ATOM 0 H ALA A 347 13.867 27.007 3.264 1.00 35.54 H new ATOM 0 HA ALA A 347 11.922 25.135 4.181 1.00 74.21 H new ATOM 0 HB1 ALA A 347 13.922 23.840 4.844 1.00 24.45 H new ATOM 0 HB2 ALA A 347 14.061 24.468 3.185 1.00 24.45 H new ATOM 0 HB3 ALA A 347 14.941 25.260 4.513 1.00 24.45 H new ATOM 696 N ASP A 348 13.421 27.028 6.394 1.00 14.33 N ATOM 697 CA ASP A 348 13.395 27.449 7.790 1.00 52.14 C ATOM 698 C ASP A 348 11.999 27.912 8.193 1.00 64.31 C ATOM 699 O ASP A 348 11.427 27.421 9.166 1.00 51.35 O ATOM 700 CB ASP A 348 14.406 28.573 8.023 1.00 40.52 C ATOM 701 CG ASP A 348 15.672 28.083 8.699 1.00 22.44 C ATOM 702 OD1 ASP A 348 16.040 28.648 9.751 1.00 2.53 O ATOM 703 OD2 ASP A 348 16.293 27.133 8.178 1.00 10.20 O1- ATOM 0 H ASP A 348 14.019 27.595 5.793 1.00 14.33 H new ATOM 0 HA ASP A 348 13.665 26.593 8.408 1.00 52.14 H new ATOM 0 HB2 ASP A 348 14.662 29.031 7.068 1.00 40.52 H new ATOM 0 HB3 ASP A 348 13.947 29.349 8.636 1.00 40.52 H new ATOM 708 N LEU A 349 11.455 28.862 7.438 1.00 71.31 N ATOM 709 CA LEU A 349 10.126 29.393 7.716 1.00 51.53 C ATOM 710 C LEU A 349 9.068 28.300 7.601 1.00 12.02 C ATOM 711 O LEU A 349 8.091 28.287 8.349 1.00 70.14 O ATOM 712 CB LEU A 349 9.801 30.537 6.755 1.00 24.32 C ATOM 713 CG LEU A 349 9.990 30.238 5.267 1.00 5.13 C ATOM 714 CD1 LEU A 349 8.723 29.636 4.679 1.00 0.23 C ATOM 715 CD2 LEU A 349 10.381 31.501 4.515 1.00 55.22 C ATOM 0 H LEU A 349 11.915 29.279 6.629 1.00 71.31 H new ATOM 0 HA LEU A 349 10.120 29.773 8.738 1.00 51.53 H new ATOM 0 HB2 LEU A 349 8.766 30.837 6.916 1.00 24.32 H new ATOM 0 HB3 LEU A 349 10.425 31.392 7.015 1.00 24.32 H new ATOM 0 HG LEU A 349 10.796 29.512 5.161 1.00 5.13 H new ATOM 0 HD11 LEU A 349 8.876 29.430 3.620 1.00 0.23 H new ATOM 0 HD12 LEU A 349 8.486 28.708 5.199 1.00 0.23 H new ATOM 0 HD13 LEU A 349 7.898 30.339 4.796 1.00 0.23 H new ATOM 0 HD21 LEU A 349 10.511 31.269 3.458 1.00 55.22 H new ATOM 0 HD22 LEU A 349 9.597 32.250 4.629 1.00 55.22 H new ATOM 0 HD23 LEU A 349 11.315 31.890 4.919 1.00 55.22 H new ATOM 727 N SER A 350 9.272 27.383 6.660 1.00 73.34 N ATOM 728 CA SER A 350 8.334 26.287 6.446 1.00 32.33 C ATOM 729 C SER A 350 8.222 25.417 7.693 1.00 42.41 C ATOM 730 O SER A 350 7.147 24.912 8.017 1.00 22.13 O ATOM 731 CB SER A 350 8.777 25.436 5.254 1.00 35.25 C ATOM 732 OG SER A 350 8.624 26.143 4.036 1.00 54.44 O ATOM 0 H SER A 350 10.078 27.377 6.034 1.00 73.34 H new ATOM 0 HA SER A 350 7.354 26.715 6.234 1.00 32.33 H new ATOM 0 HB2 SER A 350 9.820 25.144 5.380 1.00 35.25 H new ATOM 0 HB3 SER A 350 8.190 24.518 5.221 1.00 35.25 H new ATOM 0 HG SER A 350 9.468 26.585 3.806 1.00 54.44 H new ATOM 738 N GLY A 351 9.341 25.246 8.391 1.00 33.35 N ATOM 739 CA GLY A 351 9.347 24.436 9.595 1.00 12.41 C ATOM 740 C GLY A 351 8.910 23.009 9.336 1.00 22.05 C ATOM 741 O GLY A 351 8.227 22.403 10.162 1.00 70.33 O ATOM 0 H GLY A 351 10.243 25.654 8.144 1.00 33.35 H new ATOM 0 HA2 GLY A 351 10.350 24.434 10.022 1.00 12.41 H new ATOM 0 HA3 GLY A 351 8.686 24.886 10.335 1.00 12.41 H new ATOM 745 N GLU A 352 9.302 22.470 8.186 1.00 5.11 N ATOM 746 CA GLU A 352 8.943 21.105 7.821 1.00 73.30 C ATOM 747 C GLU A 352 10.178 20.308 7.411 1.00 52.43 C ATOM 748 O GLU A 352 10.441 19.230 7.945 1.00 30.44 O ATOM 749 CB GLU A 352 7.924 21.110 6.678 1.00 65.40 C ATOM 750 CG GLU A 352 6.631 21.832 7.019 1.00 74.50 C ATOM 751 CD GLU A 352 5.583 20.907 7.604 1.00 64.11 C ATOM 752 OE1 GLU A 352 4.398 21.302 7.641 1.00 63.12 O ATOM 753 OE2 GLU A 352 5.946 19.788 8.024 1.00 61.14 O1- ATOM 0 H GLU A 352 9.868 22.958 7.491 1.00 5.11 H new ATOM 0 HA GLU A 352 8.498 20.629 8.694 1.00 73.30 H new ATOM 0 HB2 GLU A 352 8.374 21.581 5.804 1.00 65.40 H new ATOM 0 HB3 GLU A 352 7.694 20.081 6.403 1.00 65.40 H new ATOM 0 HG2 GLU A 352 6.842 22.631 7.730 1.00 74.50 H new ATOM 0 HG3 GLU A 352 6.234 22.302 6.119 1.00 74.50 H new ATOM 760 N LEU A 353 10.933 20.846 6.460 1.00 71.34 N ATOM 761 CA LEU A 353 12.142 20.187 5.977 1.00 3.31 C ATOM 762 C LEU A 353 13.285 20.349 6.973 1.00 44.20 C ATOM 763 O LEU A 353 13.634 21.465 7.359 1.00 31.23 O ATOM 764 CB LEU A 353 12.549 20.758 4.618 1.00 32.25 C ATOM 765 CG LEU A 353 11.575 20.510 3.466 1.00 32.11 C ATOM 766 CD1 LEU A 353 12.043 21.226 2.208 1.00 53.54 C ATOM 767 CD2 LEU A 353 11.424 19.019 3.206 1.00 3.24 C ATOM 0 H LEU A 353 10.730 21.737 6.008 1.00 71.34 H new ATOM 0 HA LEU A 353 11.928 19.124 5.868 1.00 3.31 H new ATOM 0 HB2 LEU A 353 12.687 21.834 4.725 1.00 32.25 H new ATOM 0 HB3 LEU A 353 13.517 20.338 4.345 1.00 32.25 H new ATOM 0 HG LEU A 353 10.601 20.910 3.748 1.00 32.11 H new ATOM 0 HD11 LEU A 353 11.338 21.038 1.399 1.00 53.54 H new ATOM 0 HD12 LEU A 353 12.099 22.298 2.399 1.00 53.54 H new ATOM 0 HD13 LEU A 353 13.028 20.856 1.924 1.00 53.54 H new ATOM 0 HD21 LEU A 353 10.727 18.862 2.383 1.00 3.24 H new ATOM 0 HD22 LEU A 353 12.394 18.595 2.946 1.00 3.24 H new ATOM 0 HD23 LEU A 353 11.043 18.530 4.102 1.00 3.24 H new ATOM 779 N ARG A 354 13.867 19.227 7.386 1.00 42.35 N ATOM 780 CA ARG A 354 14.972 19.243 8.336 1.00 70.32 C ATOM 781 C ARG A 354 15.927 18.081 8.081 1.00 34.00 C ATOM 782 O ARG A 354 15.583 17.121 7.391 1.00 74.12 O ATOM 783 CB ARG A 354 14.441 19.178 9.769 1.00 52.13 C ATOM 784 CG ARG A 354 13.907 17.809 10.157 1.00 45.24 C ATOM 785 CD ARG A 354 13.448 17.781 11.608 1.00 4.20 C ATOM 786 NE ARG A 354 12.273 18.618 11.826 1.00 4.34 N ATOM 787 CZ ARG A 354 11.786 18.903 13.029 1.00 3.31 C ATOM 788 NH1 ARG A 354 12.372 18.419 14.115 1.00 70.32 N1+ ATOM 789 NH2 ARG A 354 10.712 19.673 13.146 1.00 4.21 N ATOM 0 H ARG A 354 13.591 18.295 7.077 1.00 42.35 H new ATOM 0 HA ARG A 354 15.520 20.175 8.201 1.00 70.32 H new ATOM 0 HB2 ARG A 354 15.240 19.456 10.457 1.00 52.13 H new ATOM 0 HB3 ARG A 354 13.647 19.916 9.888 1.00 52.13 H new ATOM 0 HG2 ARG A 354 13.074 17.544 9.506 1.00 45.24 H new ATOM 0 HG3 ARG A 354 14.682 17.058 10.005 1.00 45.24 H new ATOM 0 HD2 ARG A 354 13.221 16.755 11.897 1.00 4.20 H new ATOM 0 HD3 ARG A 354 14.260 18.121 12.252 1.00 4.20 H new ATOM 0 HE ARG A 354 11.799 19.006 11.010 1.00 4.34 H new ATOM 0 HH11 ARG A 354 13.198 17.827 14.028 1.00 70.32 H new ATOM 0 HH12 ARG A 354 11.997 18.639 15.038 1.00 70.32 H new ATOM 0 HH21 ARG A 354 10.259 20.047 12.312 1.00 4.21 H new ATOM 0 HH22 ARG A 354 10.339 19.891 14.070 1.00 4.21 H new ATOM 803 N LYS A 355 17.127 18.174 8.642 1.00 33.30 N ATOM 804 CA LYS A 355 18.132 17.130 8.477 1.00 21.22 C ATOM 805 C LYS A 355 17.559 15.761 8.832 1.00 34.13 C ATOM 806 O LYS A 355 16.875 15.608 9.842 1.00 60.32 O ATOM 807 CB LYS A 355 19.352 17.426 9.353 1.00 63.32 C ATOM 808 CG LYS A 355 20.452 16.385 9.235 1.00 32.14 C ATOM 809 CD LYS A 355 21.029 16.026 10.594 1.00 71.43 C ATOM 810 CE LYS A 355 20.039 15.225 11.425 1.00 20.31 C ATOM 811 NZ LYS A 355 20.261 13.759 11.292 1.00 41.04 N1+ ATOM 0 H LYS A 355 17.428 18.962 9.215 1.00 33.30 H new ATOM 0 HA LYS A 355 18.437 17.116 7.431 1.00 21.22 H new ATOM 0 HB2 LYS A 355 19.756 18.401 9.082 1.00 63.32 H new ATOM 0 HB3 LYS A 355 19.035 17.491 10.394 1.00 63.32 H new ATOM 0 HG2 LYS A 355 20.056 15.488 8.759 1.00 32.14 H new ATOM 0 HG3 LYS A 355 21.245 16.764 8.591 1.00 32.14 H new ATOM 0 HD2 LYS A 355 21.945 15.450 10.461 1.00 71.43 H new ATOM 0 HD3 LYS A 355 21.300 16.937 11.127 1.00 71.43 H new ATOM 0 HE2 LYS A 355 20.128 15.512 12.473 1.00 20.31 H new ATOM 0 HE3 LYS A 355 19.023 15.468 11.113 1.00 20.31 H new ATOM 0 HZ1 LYS A 355 19.389 13.252 11.544 1.00 41.04 H new ATOM 0 HZ2 LYS A 355 20.521 13.535 10.310 1.00 41.04 H new ATOM 0 HZ3 LYS A 355 21.029 13.465 11.929 1.00 41.04 H new ATOM 825 N GLY A 356 17.844 14.770 7.992 1.00 41.20 N ATOM 826 CA GLY A 356 17.350 13.428 8.236 1.00 2.44 C ATOM 827 C GLY A 356 16.175 13.073 7.345 1.00 13.01 C ATOM 828 O GLY A 356 15.967 11.904 7.017 1.00 31.51 O ATOM 0 H GLY A 356 18.408 14.873 7.148 1.00 41.20 H new ATOM 0 HA2 GLY A 356 18.156 12.712 8.073 1.00 2.44 H new ATOM 0 HA3 GLY A 356 17.051 13.338 9.280 1.00 2.44 H new ATOM 832 N ASP A 357 15.403 14.081 6.955 1.00 2.03 N ATOM 833 CA ASP A 357 14.243 13.870 6.099 1.00 31.34 C ATOM 834 C ASP A 357 14.667 13.352 4.727 1.00 35.53 C ATOM 835 O ASP A 357 15.661 13.808 4.162 1.00 32.25 O ATOM 836 CB ASP A 357 13.452 15.170 5.945 1.00 54.11 C ATOM 837 CG ASP A 357 12.814 15.617 7.245 1.00 42.24 C ATOM 838 OD1 ASP A 357 13.482 15.522 8.297 1.00 42.23 O ATOM 839 OD2 ASP A 357 11.647 16.060 7.212 1.00 21.32 O1- ATOM 0 H ASP A 357 15.560 15.054 7.219 1.00 2.03 H new ATOM 0 HA ASP A 357 13.607 13.121 6.570 1.00 31.34 H new ATOM 0 HB2 ASP A 357 14.115 15.954 5.581 1.00 54.11 H new ATOM 0 HB3 ASP A 357 12.676 15.033 5.191 1.00 54.11 H new ATOM 844 N GLN A 358 13.907 12.398 4.201 1.00 31.32 N ATOM 845 CA GLN A 358 14.206 11.818 2.896 1.00 14.41 C ATOM 846 C GLN A 358 13.248 12.345 1.834 1.00 33.14 C ATOM 847 O GLN A 358 12.067 12.566 2.103 1.00 13.50 O ATOM 848 CB GLN A 358 14.122 10.291 2.963 1.00 63.45 C ATOM 849 CG GLN A 358 12.757 9.775 3.389 1.00 21.21 C ATOM 850 CD GLN A 358 12.414 8.440 2.756 1.00 43.34 C ATOM 851 OE1 GLN A 358 12.626 8.235 1.560 1.00 0.51 O ATOM 852 NE2 GLN A 358 11.883 7.525 3.556 1.00 15.43 N ATOM 0 H GLN A 358 13.081 12.010 4.657 1.00 31.32 H new ATOM 0 HA GLN A 358 15.220 12.108 2.620 1.00 14.41 H new ATOM 0 HB2 GLN A 358 14.368 9.879 1.984 1.00 63.45 H new ATOM 0 HB3 GLN A 358 14.874 9.924 3.662 1.00 63.45 H new ATOM 0 HG2 GLN A 358 12.733 9.675 4.474 1.00 21.21 H new ATOM 0 HG3 GLN A 358 11.996 10.507 3.119 1.00 21.21 H new ATOM 0 HE21 GLN A 358 11.725 7.738 4.541 1.00 15.43 H new ATOM 0 HE22 GLN A 358 11.633 6.608 3.186 1.00 15.43 H new ATOM 861 N ILE A 359 13.765 12.545 0.626 1.00 3.42 N ATOM 862 CA ILE A 359 12.955 13.047 -0.478 1.00 53.21 C ATOM 863 C ILE A 359 12.500 11.909 -1.386 1.00 34.53 C ATOM 864 O ILE A 359 13.315 11.124 -1.872 1.00 54.41 O ATOM 865 CB ILE A 359 13.725 14.082 -1.317 1.00 64.42 C ATOM 866 CG1 ILE A 359 14.322 15.162 -0.412 1.00 65.31 C ATOM 867 CG2 ILE A 359 12.811 14.704 -2.362 1.00 45.52 C ATOM 868 CD1 ILE A 359 13.291 15.887 0.425 1.00 15.24 C ATOM 0 H ILE A 359 14.741 12.367 0.387 1.00 3.42 H new ATOM 0 HA ILE A 359 12.082 13.528 -0.036 1.00 53.21 H new ATOM 0 HB ILE A 359 14.541 13.575 -1.833 1.00 64.42 H new ATOM 0 HG12 ILE A 359 15.058 14.705 0.249 1.00 65.31 H new ATOM 0 HG13 ILE A 359 14.854 15.887 -1.028 1.00 65.31 H new ATOM 0 HG21 ILE A 359 13.371 15.434 -2.947 1.00 45.52 H new ATOM 0 HG22 ILE A 359 12.430 13.925 -3.022 1.00 45.52 H new ATOM 0 HG23 ILE A 359 11.976 15.200 -1.866 1.00 45.52 H new ATOM 0 HD11 ILE A 359 13.785 16.638 1.041 1.00 15.24 H new ATOM 0 HD12 ILE A 359 12.568 16.374 -0.230 1.00 15.24 H new ATOM 0 HD13 ILE A 359 12.776 15.172 1.067 1.00 15.24 H new ATOM 880 N LEU A 360 11.194 11.827 -1.614 1.00 42.11 N ATOM 881 CA LEU A 360 10.629 10.788 -2.467 1.00 24.30 C ATOM 882 C LEU A 360 10.361 11.320 -3.871 1.00 30.12 C ATOM 883 O LEU A 360 10.652 10.653 -4.864 1.00 64.33 O ATOM 884 CB LEU A 360 9.333 10.249 -1.858 1.00 10.42 C ATOM 885 CG LEU A 360 9.487 9.098 -0.863 1.00 64.12 C ATOM 886 CD1 LEU A 360 8.149 8.767 -0.219 1.00 41.24 C ATOM 887 CD2 LEU A 360 10.067 7.871 -1.552 1.00 13.33 C ATOM 0 H LEU A 360 10.506 12.468 -1.220 1.00 42.11 H new ATOM 0 HA LEU A 360 11.355 9.978 -2.538 1.00 24.30 H new ATOM 0 HB2 LEU A 360 8.822 11.071 -1.356 1.00 10.42 H new ATOM 0 HB3 LEU A 360 8.684 9.918 -2.669 1.00 10.42 H new ATOM 0 HG LEU A 360 10.177 9.410 -0.079 1.00 64.12 H new ATOM 0 HD11 LEU A 360 8.278 7.946 0.486 1.00 41.24 H new ATOM 0 HD12 LEU A 360 7.773 9.643 0.309 1.00 41.24 H new ATOM 0 HD13 LEU A 360 7.436 8.475 -0.990 1.00 41.24 H new ATOM 0 HD21 LEU A 360 10.170 7.062 -0.829 1.00 13.33 H new ATOM 0 HD22 LEU A 360 9.402 7.557 -2.356 1.00 13.33 H new ATOM 0 HD23 LEU A 360 11.046 8.114 -1.965 1.00 13.33 H new ATOM 899 N SER A 361 9.810 12.527 -3.945 1.00 73.14 N ATOM 900 CA SER A 361 9.501 13.149 -5.227 1.00 44.34 C ATOM 901 C SER A 361 9.318 14.655 -5.071 1.00 14.03 C ATOM 902 O SER A 361 9.083 15.152 -3.969 1.00 33.25 O ATOM 903 CB SER A 361 8.239 12.529 -5.829 1.00 63.41 C ATOM 904 OG SER A 361 8.220 11.125 -5.642 1.00 41.10 O ATOM 0 H SER A 361 9.568 13.094 -3.132 1.00 73.14 H new ATOM 0 HA SER A 361 10.340 12.971 -5.900 1.00 44.34 H new ATOM 0 HB2 SER A 361 7.357 12.972 -5.367 1.00 63.41 H new ATOM 0 HB3 SER A 361 8.190 12.758 -6.894 1.00 63.41 H new ATOM 0 HG SER A 361 9.131 10.772 -5.723 1.00 41.10 H new ATOM 910 N VAL A 362 9.427 15.378 -6.182 1.00 44.44 N ATOM 911 CA VAL A 362 9.272 16.828 -6.169 1.00 13.10 C ATOM 912 C VAL A 362 8.454 17.302 -7.364 1.00 35.44 C ATOM 913 O VAL A 362 8.779 17.000 -8.512 1.00 52.21 O ATOM 914 CB VAL A 362 10.638 17.538 -6.180 1.00 42.40 C ATOM 915 CG1 VAL A 362 11.371 17.308 -4.867 1.00 40.30 C ATOM 916 CG2 VAL A 362 11.476 17.063 -7.358 1.00 70.40 C ATOM 0 H VAL A 362 9.622 14.983 -7.102 1.00 44.44 H new ATOM 0 HA VAL A 362 8.747 17.083 -5.249 1.00 13.10 H new ATOM 0 HB VAL A 362 10.470 18.609 -6.291 1.00 42.40 H new ATOM 0 HG11 VAL A 362 12.334 17.817 -4.894 1.00 40.30 H new ATOM 0 HG12 VAL A 362 10.775 17.702 -4.044 1.00 40.30 H new ATOM 0 HG13 VAL A 362 11.530 16.240 -4.721 1.00 40.30 H new ATOM 0 HG21 VAL A 362 12.438 17.575 -7.350 1.00 70.40 H new ATOM 0 HG22 VAL A 362 11.637 15.988 -7.280 1.00 70.40 H new ATOM 0 HG23 VAL A 362 10.954 17.285 -8.289 1.00 70.40 H new ATOM 926 N ASN A 363 7.390 18.051 -7.087 1.00 72.14 N ATOM 927 CA ASN A 363 6.525 18.568 -8.141 1.00 0.44 C ATOM 928 C ASN A 363 6.241 17.495 -9.188 1.00 33.34 C ATOM 929 O ASN A 363 6.111 17.791 -10.376 1.00 75.01 O ATOM 930 CB ASN A 363 7.168 19.788 -8.804 1.00 61.50 C ATOM 931 CG ASN A 363 8.476 19.448 -9.494 1.00 70.41 C ATOM 932 OD1 ASN A 363 9.535 19.430 -8.865 1.00 34.34 O ATOM 933 ND2 ASN A 363 8.408 19.178 -10.792 1.00 52.13 N ATOM 0 H ASN A 363 7.107 18.313 -6.143 1.00 72.14 H new ATOM 0 HA ASN A 363 5.580 18.866 -7.688 1.00 0.44 H new ATOM 0 HB2 ASN A 363 6.475 20.210 -9.532 1.00 61.50 H new ATOM 0 HB3 ASN A 363 7.346 20.556 -8.051 1.00 61.50 H new ATOM 0 HD21 ASN A 363 9.255 18.944 -11.309 1.00 52.13 H new ATOM 0 HD22 ASN A 363 7.508 19.205 -11.272 1.00 52.13 H new ATOM 940 N GLY A 364 6.146 16.248 -8.739 1.00 23.21 N ATOM 941 CA GLY A 364 5.877 15.150 -9.650 1.00 2.53 C ATOM 942 C GLY A 364 7.076 14.240 -9.830 1.00 24.34 C ATOM 943 O GLY A 364 7.083 13.107 -9.349 1.00 32.33 O ATOM 0 H GLY A 364 6.250 15.978 -7.761 1.00 23.21 H new ATOM 0 HA2 GLY A 364 5.036 14.568 -9.274 1.00 2.53 H new ATOM 0 HA3 GLY A 364 5.580 15.550 -10.619 1.00 2.53 H new ATOM 947 N VAL A 365 8.093 14.736 -10.528 1.00 54.34 N ATOM 948 CA VAL A 365 9.303 13.959 -10.772 1.00 44.21 C ATOM 949 C VAL A 365 9.818 13.326 -9.484 1.00 0.31 C ATOM 950 O VAL A 365 10.047 14.015 -8.489 1.00 64.42 O ATOM 951 CB VAL A 365 10.416 14.832 -11.382 1.00 22.21 C ATOM 952 CG1 VAL A 365 10.110 15.145 -12.838 1.00 2.33 C ATOM 953 CG2 VAL A 365 10.592 16.111 -10.579 1.00 41.10 C ATOM 0 H VAL A 365 8.103 15.672 -10.934 1.00 54.34 H new ATOM 0 HA VAL A 365 9.038 13.173 -11.479 1.00 44.21 H new ATOM 0 HB VAL A 365 11.352 14.275 -11.343 1.00 22.21 H new ATOM 0 HG11 VAL A 365 10.907 15.762 -13.253 1.00 2.33 H new ATOM 0 HG12 VAL A 365 10.040 14.216 -13.403 1.00 2.33 H new ATOM 0 HG13 VAL A 365 9.164 15.682 -12.904 1.00 2.33 H new ATOM 0 HG21 VAL A 365 11.382 16.715 -11.025 1.00 41.10 H new ATOM 0 HG22 VAL A 365 9.659 16.674 -10.583 1.00 41.10 H new ATOM 0 HG23 VAL A 365 10.861 15.862 -9.552 1.00 41.10 H new ATOM 963 N ASP A 366 9.999 12.010 -9.510 1.00 45.41 N ATOM 964 CA ASP A 366 10.488 11.282 -8.345 1.00 55.34 C ATOM 965 C ASP A 366 12.012 11.333 -8.274 1.00 23.21 C ATOM 966 O ASP A 366 12.699 11.081 -9.264 1.00 43.44 O ATOM 967 CB ASP A 366 10.015 9.829 -8.389 1.00 11.51 C ATOM 968 CG ASP A 366 10.268 9.178 -9.735 1.00 42.00 C ATOM 969 OD1 ASP A 366 9.362 9.219 -10.593 1.00 64.02 O ATOM 970 OD2 ASP A 366 11.372 8.629 -9.930 1.00 61.22 O1- ATOM 0 H ASP A 366 9.814 11.426 -10.325 1.00 45.41 H new ATOM 0 HA ASP A 366 10.084 11.759 -7.452 1.00 55.34 H new ATOM 0 HB2 ASP A 366 10.525 9.260 -7.612 1.00 11.51 H new ATOM 0 HB3 ASP A 366 8.949 9.790 -8.164 1.00 11.51 H new ATOM 975 N LEU A 367 12.533 11.661 -7.096 1.00 23.41 N ATOM 976 CA LEU A 367 13.975 11.746 -6.896 1.00 3.23 C ATOM 977 C LEU A 367 14.494 10.521 -6.151 1.00 43.21 C ATOM 978 O LEU A 367 15.479 10.599 -5.415 1.00 4.41 O ATOM 979 CB LEU A 367 14.329 13.016 -6.119 1.00 71.32 C ATOM 980 CG LEU A 367 13.750 14.320 -6.668 1.00 54.14 C ATOM 981 CD1 LEU A 367 14.047 15.475 -5.723 1.00 61.24 C ATOM 982 CD2 LEU A 367 14.305 14.608 -8.056 1.00 25.52 C ATOM 0 H LEU A 367 11.979 11.872 -6.266 1.00 23.41 H new ATOM 0 HA LEU A 367 14.451 11.782 -7.876 1.00 3.23 H new ATOM 0 HB2 LEU A 367 13.989 12.895 -5.090 1.00 71.32 H new ATOM 0 HB3 LEU A 367 15.415 13.108 -6.088 1.00 71.32 H new ATOM 0 HG LEU A 367 12.668 14.210 -6.747 1.00 54.14 H new ATOM 0 HD11 LEU A 367 13.627 16.395 -6.130 1.00 61.24 H new ATOM 0 HD12 LEU A 367 13.601 15.272 -4.749 1.00 61.24 H new ATOM 0 HD13 LEU A 367 15.126 15.586 -5.612 1.00 61.24 H new ATOM 0 HD21 LEU A 367 13.882 15.540 -8.431 1.00 25.52 H new ATOM 0 HD22 LEU A 367 15.390 14.698 -8.003 1.00 25.52 H new ATOM 0 HD23 LEU A 367 14.041 13.793 -8.730 1.00 25.52 H new ATOM 994 N ARG A 368 13.828 9.388 -6.349 1.00 1.50 N ATOM 995 CA ARG A 368 14.223 8.145 -5.697 1.00 24.01 C ATOM 996 C ARG A 368 15.507 7.594 -6.309 1.00 51.02 C ATOM 997 O ARG A 368 16.330 6.996 -5.616 1.00 12.14 O ATOM 998 CB ARG A 368 13.104 7.107 -5.812 1.00 72.51 C ATOM 999 CG ARG A 368 12.926 6.558 -7.217 1.00 14.40 C ATOM 1000 CD ARG A 368 11.828 5.507 -7.270 1.00 25.41 C ATOM 1001 NE ARG A 368 12.113 4.463 -8.251 1.00 72.33 N ATOM 1002 CZ ARG A 368 11.511 3.279 -8.262 1.00 42.12 C ATOM 1003 NH1 ARG A 368 10.592 2.991 -7.350 1.00 61.33 N1+ ATOM 1004 NH2 ARG A 368 11.826 2.382 -9.187 1.00 65.51 N ATOM 0 H ARG A 368 13.012 9.305 -6.956 1.00 1.50 H new ATOM 0 HA ARG A 368 14.406 8.358 -4.644 1.00 24.01 H new ATOM 0 HB2 ARG A 368 13.314 6.281 -5.132 1.00 72.51 H new ATOM 0 HB3 ARG A 368 12.167 7.558 -5.486 1.00 72.51 H new ATOM 0 HG2 ARG A 368 12.684 7.373 -7.899 1.00 14.40 H new ATOM 0 HG3 ARG A 368 13.865 6.123 -7.560 1.00 14.40 H new ATOM 0 HD2 ARG A 368 11.711 5.056 -6.285 1.00 25.41 H new ATOM 0 HD3 ARG A 368 10.880 5.986 -7.516 1.00 25.41 H new ATOM 0 HE ARG A 368 12.813 4.654 -8.968 1.00 72.33 H new ATOM 0 HH11 ARG A 368 10.346 3.679 -6.638 1.00 61.33 H new ATOM 0 HH12 ARG A 368 10.131 2.081 -7.360 1.00 61.33 H new ATOM 0 HH21 ARG A 368 12.531 2.601 -9.891 1.00 65.51 H new ATOM 0 HH22 ARG A 368 11.363 1.473 -9.195 1.00 65.51 H new ATOM 1018 N ASN A 369 15.671 7.800 -7.611 1.00 74.53 N ATOM 1019 CA ASN A 369 16.856 7.323 -8.317 1.00 42.03 C ATOM 1020 C ASN A 369 17.614 8.484 -8.953 1.00 1.52 C ATOM 1021 O ASN A 369 18.292 8.315 -9.967 1.00 2.15 O ATOM 1022 CB ASN A 369 16.461 6.308 -9.392 1.00 63.03 C ATOM 1023 CG ASN A 369 16.201 4.929 -8.818 1.00 51.31 C ATOM 1024 OD1 ASN A 369 16.652 4.607 -7.718 1.00 4.11 O ATOM 1025 ND2 ASN A 369 15.469 4.107 -9.560 1.00 23.10 N ATOM 0 H ASN A 369 14.999 8.294 -8.199 1.00 74.53 H new ATOM 0 HA ASN A 369 17.510 6.839 -7.592 1.00 42.03 H new ATOM 0 HB2 ASN A 369 15.567 6.658 -9.907 1.00 63.03 H new ATOM 0 HB3 ASN A 369 17.254 6.245 -10.137 1.00 63.03 H new ATOM 0 HD21 ASN A 369 15.260 3.167 -9.224 1.00 23.10 H new ATOM 0 HD22 ASN A 369 15.116 4.416 -10.466 1.00 23.10 H new ATOM 1032 N ALA A 370 17.496 9.663 -8.349 1.00 31.21 N ATOM 1033 CA ALA A 370 18.173 10.850 -8.854 1.00 64.50 C ATOM 1034 C ALA A 370 19.523 11.045 -8.171 1.00 70.32 C ATOM 1035 O ALA A 370 19.614 11.043 -6.944 1.00 51.14 O ATOM 1036 CB ALA A 370 17.298 12.079 -8.658 1.00 32.21 C ATOM 0 H ALA A 370 16.938 9.820 -7.510 1.00 31.21 H new ATOM 0 HA ALA A 370 18.352 10.710 -9.920 1.00 64.50 H new ATOM 0 HB1 ALA A 370 17.816 12.959 -9.040 1.00 32.21 H new ATOM 0 HB2 ALA A 370 16.360 11.948 -9.197 1.00 32.21 H new ATOM 0 HB3 ALA A 370 17.090 12.212 -7.596 1.00 32.21 H new ATOM 1042 N SER A 371 20.568 11.215 -8.975 1.00 31.44 N ATOM 1043 CA SER A 371 21.914 11.407 -8.448 1.00 64.13 C ATOM 1044 C SER A 371 21.971 12.630 -7.537 1.00 2.51 C ATOM 1045 O SER A 371 20.990 13.361 -7.398 1.00 64.12 O ATOM 1046 CB SER A 371 22.916 11.562 -9.594 1.00 43.24 C ATOM 1047 OG SER A 371 23.099 12.926 -9.928 1.00 14.45 O ATOM 0 H SER A 371 20.508 11.224 -9.993 1.00 31.44 H new ATOM 0 HA SER A 371 22.178 10.527 -7.862 1.00 64.13 H new ATOM 0 HB2 SER A 371 23.872 11.123 -9.308 1.00 43.24 H new ATOM 0 HB3 SER A 371 22.562 11.014 -10.468 1.00 43.24 H new ATOM 0 HG SER A 371 23.745 12.999 -10.662 1.00 14.45 H new ATOM 1053 N HIS A 372 23.128 12.846 -6.918 1.00 13.42 N ATOM 1054 CA HIS A 372 23.315 13.981 -6.021 1.00 72.30 C ATOM 1055 C HIS A 372 23.146 15.298 -6.770 1.00 51.12 C ATOM 1056 O HIS A 372 22.346 16.147 -6.377 1.00 25.34 O ATOM 1057 CB HIS A 372 24.699 13.922 -5.373 1.00 62.22 C ATOM 1058 CG HIS A 372 24.936 15.007 -4.368 1.00 12.23 C ATOM 1059 ND1 HIS A 372 26.140 15.182 -3.720 1.00 21.24 N ATOM 1060 CD2 HIS A 372 24.115 15.979 -3.905 1.00 43.11 C ATOM 1061 CE1 HIS A 372 26.049 16.213 -2.898 1.00 65.31 C ATOM 1062 NE2 HIS A 372 24.830 16.714 -2.992 1.00 11.35 N ATOM 0 H HIS A 372 23.949 12.250 -7.021 1.00 13.42 H new ATOM 0 HA HIS A 372 22.555 13.927 -5.242 1.00 72.30 H new ATOM 0 HB2 HIS A 372 24.823 12.954 -4.887 1.00 62.22 H new ATOM 0 HB3 HIS A 372 25.459 13.987 -6.152 1.00 62.22 H new ATOM 0 HD2 HIS A 372 23.089 16.145 -4.199 1.00 43.11 H new ATOM 0 HE1 HIS A 372 26.837 16.583 -2.258 1.00 65.31 H new ATOM 0 HE2 HIS A 372 24.477 17.517 -2.471 1.00 11.35 H new ATOM 1070 N GLU A 373 23.905 15.462 -7.849 1.00 22.51 N ATOM 1071 CA GLU A 373 23.840 16.679 -8.650 1.00 2.13 C ATOM 1072 C GLU A 373 22.532 16.742 -9.437 1.00 53.21 C ATOM 1073 O GLU A 373 21.982 17.820 -9.657 1.00 42.43 O ATOM 1074 CB GLU A 373 25.029 16.747 -9.612 1.00 65.41 C ATOM 1075 CG GLU A 373 25.204 15.495 -10.453 1.00 44.41 C ATOM 1076 CD GLU A 373 26.186 15.691 -11.591 1.00 74.21 C ATOM 1077 OE1 GLU A 373 26.261 16.817 -12.125 1.00 34.15 O ATOM 1078 OE2 GLU A 373 26.881 14.715 -11.949 1.00 3.22 O1- ATOM 0 H GLU A 373 24.571 14.768 -8.188 1.00 22.51 H new ATOM 0 HA GLU A 373 23.880 17.532 -7.973 1.00 2.13 H new ATOM 0 HB2 GLU A 373 24.902 17.604 -10.274 1.00 65.41 H new ATOM 0 HB3 GLU A 373 25.940 16.920 -9.039 1.00 65.41 H new ATOM 0 HG2 GLU A 373 25.548 14.680 -9.817 1.00 44.41 H new ATOM 0 HG3 GLU A 373 24.238 15.196 -10.859 1.00 44.41 H new ATOM 1085 N GLN A 374 22.044 15.580 -9.855 1.00 71.21 N ATOM 1086 CA GLN A 374 20.803 15.504 -10.617 1.00 65.41 C ATOM 1087 C GLN A 374 19.661 16.183 -9.867 1.00 42.21 C ATOM 1088 O GLN A 374 18.872 16.922 -10.456 1.00 30.25 O ATOM 1089 CB GLN A 374 20.443 14.045 -10.903 1.00 11.04 C ATOM 1090 CG GLN A 374 20.958 13.543 -12.242 1.00 24.33 C ATOM 1091 CD GLN A 374 21.126 12.037 -12.276 1.00 24.55 C ATOM 1092 OE1 GLN A 374 20.277 11.294 -11.780 1.00 13.43 O ATOM 1093 NE2 GLN A 374 22.225 11.576 -12.861 1.00 72.25 N ATOM 0 H GLN A 374 22.488 14.679 -9.680 1.00 71.21 H new ATOM 0 HA GLN A 374 20.955 16.026 -11.562 1.00 65.41 H new ATOM 0 HB2 GLN A 374 20.847 13.417 -10.109 1.00 11.04 H new ATOM 0 HB3 GLN A 374 19.359 13.935 -10.876 1.00 11.04 H new ATOM 0 HG2 GLN A 374 20.267 13.845 -13.029 1.00 24.33 H new ATOM 0 HG3 GLN A 374 21.916 14.016 -12.459 1.00 24.33 H new ATOM 0 HE21 GLN A 374 22.902 12.227 -13.259 1.00 72.25 H new ATOM 0 HE22 GLN A 374 22.392 10.571 -12.913 1.00 72.25 H new ATOM 1102 N ALA A 375 19.580 15.927 -8.566 1.00 54.24 N ATOM 1103 CA ALA A 375 18.536 16.515 -7.735 1.00 42.42 C ATOM 1104 C ALA A 375 18.594 18.040 -7.778 1.00 35.42 C ATOM 1105 O ALA A 375 17.563 18.710 -7.741 1.00 11.04 O ATOM 1106 CB ALA A 375 18.660 16.021 -6.302 1.00 54.24 C ATOM 0 H ALA A 375 20.225 15.316 -8.064 1.00 54.24 H new ATOM 0 HA ALA A 375 17.571 16.202 -8.133 1.00 42.42 H new ATOM 0 HB1 ALA A 375 17.874 16.468 -5.694 1.00 54.24 H new ATOM 0 HB2 ALA A 375 18.561 14.936 -6.281 1.00 54.24 H new ATOM 0 HB3 ALA A 375 19.634 16.304 -5.902 1.00 54.24 H new ATOM 1112 N ALA A 376 19.806 18.578 -7.855 1.00 12.04 N ATOM 1113 CA ALA A 376 19.997 20.023 -7.904 1.00 21.41 C ATOM 1114 C ALA A 376 19.471 20.602 -9.213 1.00 60.15 C ATOM 1115 O ALA A 376 18.962 21.723 -9.245 1.00 2.42 O ATOM 1116 CB ALA A 376 21.469 20.366 -7.727 1.00 73.42 C ATOM 0 H ALA A 376 20.670 18.036 -7.885 1.00 12.04 H new ATOM 0 HA ALA A 376 19.430 20.468 -7.086 1.00 21.41 H new ATOM 0 HB1 ALA A 376 21.598 21.448 -7.766 1.00 73.42 H new ATOM 0 HB2 ALA A 376 21.816 19.993 -6.763 1.00 73.42 H new ATOM 0 HB3 ALA A 376 22.049 19.903 -8.525 1.00 73.42 H new ATOM 1122 N ILE A 377 19.599 19.834 -10.289 1.00 13.30 N ATOM 1123 CA ILE A 377 19.136 20.272 -11.600 1.00 53.01 C ATOM 1124 C ILE A 377 17.644 20.587 -11.578 1.00 53.41 C ATOM 1125 O ILE A 377 17.211 21.624 -12.082 1.00 0.34 O ATOM 1126 CB ILE A 377 19.408 19.206 -12.678 1.00 1.12 C ATOM 1127 CG1 ILE A 377 20.883 18.800 -12.665 1.00 51.02 C ATOM 1128 CG2 ILE A 377 19.009 19.727 -14.051 1.00 35.03 C ATOM 1129 CD1 ILE A 377 21.235 17.768 -13.713 1.00 10.32 C ATOM 0 H ILE A 377 20.020 18.905 -10.279 1.00 13.30 H new ATOM 0 HA ILE A 377 19.693 21.176 -11.846 1.00 53.01 H new ATOM 0 HB ILE A 377 18.806 18.325 -12.456 1.00 1.12 H new ATOM 0 HG12 ILE A 377 21.497 19.687 -12.820 1.00 51.02 H new ATOM 0 HG13 ILE A 377 21.134 18.406 -11.680 1.00 51.02 H new ATOM 0 HG21 ILE A 377 19.207 18.962 -14.802 1.00 35.03 H new ATOM 0 HG22 ILE A 377 17.947 19.971 -14.053 1.00 35.03 H new ATOM 0 HG23 ILE A 377 19.587 20.622 -14.283 1.00 35.03 H new ATOM 0 HD11 ILE A 377 22.296 17.528 -13.645 1.00 10.32 H new ATOM 0 HD12 ILE A 377 20.647 16.865 -13.546 1.00 10.32 H new ATOM 0 HD13 ILE A 377 21.016 18.166 -14.704 1.00 10.32 H new ATOM 1141 N ALA A 378 16.863 19.688 -10.990 1.00 23.43 N ATOM 1142 CA ALA A 378 15.420 19.873 -10.899 1.00 51.44 C ATOM 1143 C ALA A 378 15.070 20.991 -9.923 1.00 52.25 C ATOM 1144 O ALA A 378 14.101 21.724 -10.125 1.00 11.13 O ATOM 1145 CB ALA A 378 14.747 18.574 -10.479 1.00 31.34 C ATOM 0 H ALA A 378 17.205 18.824 -10.569 1.00 23.43 H new ATOM 0 HA ALA A 378 15.052 20.158 -11.885 1.00 51.44 H new ATOM 0 HB1 ALA A 378 13.670 18.727 -10.415 1.00 31.34 H new ATOM 0 HB2 ALA A 378 14.961 17.799 -11.215 1.00 31.34 H new ATOM 0 HB3 ALA A 378 15.128 18.265 -9.506 1.00 31.34 H new ATOM 1151 N LEU A 379 15.863 21.115 -8.865 1.00 14.45 N ATOM 1152 CA LEU A 379 15.636 22.145 -7.856 1.00 25.33 C ATOM 1153 C LEU A 379 15.758 23.539 -8.464 1.00 24.21 C ATOM 1154 O LEU A 379 14.995 24.444 -8.126 1.00 40.23 O ATOM 1155 CB LEU A 379 16.633 21.988 -6.706 1.00 74.04 C ATOM 1156 CG LEU A 379 16.140 22.424 -5.326 1.00 71.11 C ATOM 1157 CD1 LEU A 379 15.479 21.259 -4.603 1.00 65.34 C ATOM 1158 CD2 LEU A 379 17.288 22.984 -4.501 1.00 64.42 C ATOM 0 H LEU A 379 16.668 20.516 -8.683 1.00 14.45 H new ATOM 0 HA LEU A 379 14.624 22.025 -7.470 1.00 25.33 H new ATOM 0 HB2 LEU A 379 16.930 20.941 -6.649 1.00 74.04 H new ATOM 0 HB3 LEU A 379 17.529 22.561 -6.947 1.00 74.04 H new ATOM 0 HG LEU A 379 15.398 23.211 -5.459 1.00 71.11 H new ATOM 0 HD11 LEU A 379 15.134 21.588 -3.623 1.00 65.34 H new ATOM 0 HD12 LEU A 379 14.629 20.904 -5.186 1.00 65.34 H new ATOM 0 HD13 LEU A 379 16.199 20.450 -4.482 1.00 65.34 H new ATOM 0 HD21 LEU A 379 16.918 23.289 -3.522 1.00 64.42 H new ATOM 0 HD22 LEU A 379 18.054 22.219 -4.377 1.00 64.42 H new ATOM 0 HD23 LEU A 379 17.716 23.846 -5.012 1.00 64.42 H new ATOM 1170 N LYS A 380 16.723 23.704 -9.363 1.00 52.32 N ATOM 1171 CA LYS A 380 16.944 24.986 -10.022 1.00 51.01 C ATOM 1172 C LYS A 380 15.796 25.316 -10.970 1.00 22.42 C ATOM 1173 O LYS A 380 15.418 26.477 -11.121 1.00 72.12 O ATOM 1174 CB LYS A 380 18.266 24.965 -10.792 1.00 71.44 C ATOM 1175 CG LYS A 380 18.472 26.181 -11.679 1.00 11.03 C ATOM 1176 CD LYS A 380 19.805 26.122 -12.406 1.00 42.12 C ATOM 1177 CE LYS A 380 19.893 24.902 -13.311 1.00 13.01 C ATOM 1178 NZ LYS A 380 18.791 24.873 -14.311 1.00 32.14 N1+ ATOM 0 H LYS A 380 17.365 22.966 -9.652 1.00 52.32 H new ATOM 0 HA LYS A 380 16.990 25.758 -9.254 1.00 51.01 H new ATOM 0 HB2 LYS A 380 19.090 24.900 -10.081 1.00 71.44 H new ATOM 0 HB3 LYS A 380 18.304 24.066 -11.407 1.00 71.44 H new ATOM 0 HG2 LYS A 380 17.662 26.243 -12.406 1.00 11.03 H new ATOM 0 HG3 LYS A 380 18.427 27.086 -11.073 1.00 11.03 H new ATOM 0 HD2 LYS A 380 19.937 27.027 -12.999 1.00 42.12 H new ATOM 0 HD3 LYS A 380 20.616 26.096 -11.679 1.00 42.12 H new ATOM 0 HE2 LYS A 380 20.853 24.902 -13.828 1.00 13.01 H new ATOM 0 HE3 LYS A 380 19.857 23.997 -12.705 1.00 13.01 H new ATOM 0 HZ1 LYS A 380 18.986 24.139 -15.021 1.00 32.14 H new ATOM 0 HZ2 LYS A 380 17.893 24.661 -13.832 1.00 32.14 H new ATOM 0 HZ3 LYS A 380 18.723 25.799 -14.780 1.00 32.14 H new ATOM 1192 N ASN A 381 15.244 24.286 -11.605 1.00 71.53 N ATOM 1193 CA ASN A 381 14.138 24.469 -12.536 1.00 61.53 C ATOM 1194 C ASN A 381 12.808 24.115 -11.878 1.00 53.30 C ATOM 1195 O ASN A 381 11.813 23.867 -12.559 1.00 24.44 O ATOM 1196 CB ASN A 381 14.348 23.606 -13.784 1.00 43.53 C ATOM 1197 CG ASN A 381 15.047 24.361 -14.898 1.00 21.05 C ATOM 1198 OD1 ASN A 381 15.291 25.563 -14.790 1.00 71.43 O ATOM 1199 ND2 ASN A 381 15.374 23.658 -15.974 1.00 43.54 N ATOM 0 H ASN A 381 15.545 23.318 -11.491 1.00 71.53 H new ATOM 0 HA ASN A 381 14.110 25.519 -12.827 1.00 61.53 H new ATOM 0 HB2 ASN A 381 14.936 22.727 -13.520 1.00 43.53 H new ATOM 0 HB3 ASN A 381 13.383 23.248 -14.142 1.00 43.53 H new ATOM 0 HD21 ASN A 381 15.847 24.112 -16.755 1.00 43.54 H new ATOM 0 HD22 ASN A 381 15.152 22.663 -16.020 1.00 43.54 H new ATOM 1206 N ALA A 382 12.798 24.095 -10.549 1.00 14.22 N ATOM 1207 CA ALA A 382 11.590 23.775 -9.799 1.00 5.40 C ATOM 1208 C ALA A 382 10.406 24.604 -10.284 1.00 61.32 C ATOM 1209 O ALA A 382 9.395 24.061 -10.726 1.00 52.51 O ATOM 1210 CB ALA A 382 11.819 23.997 -8.312 1.00 75.24 C ATOM 0 H ALA A 382 13.613 24.297 -9.970 1.00 14.22 H new ATOM 0 HA ALA A 382 11.356 22.724 -9.967 1.00 5.40 H new ATOM 0 HB1 ALA A 382 10.909 23.754 -7.763 1.00 75.24 H new ATOM 0 HB2 ALA A 382 12.631 23.356 -7.969 1.00 75.24 H new ATOM 0 HB3 ALA A 382 12.081 25.040 -8.136 1.00 75.24 H new ATOM 1216 N GLY A 383 10.539 25.924 -10.199 1.00 51.03 N ATOM 1217 CA GLY A 383 9.472 26.806 -10.633 1.00 61.22 C ATOM 1218 C GLY A 383 9.097 27.825 -9.574 1.00 61.51 C ATOM 1219 O GLY A 383 9.968 28.435 -8.954 1.00 44.22 O ATOM 0 H GLY A 383 11.367 26.398 -9.837 1.00 51.03 H new ATOM 0 HA2 GLY A 383 9.780 27.326 -11.540 1.00 61.22 H new ATOM 0 HA3 GLY A 383 8.595 26.212 -10.888 1.00 61.22 H new ATOM 1223 N GLN A 384 7.796 28.012 -9.369 1.00 54.13 N ATOM 1224 CA GLN A 384 7.309 28.966 -8.381 1.00 12.05 C ATOM 1225 C GLN A 384 6.922 28.258 -7.086 1.00 51.43 C ATOM 1226 O GLN A 384 6.946 28.855 -6.009 1.00 12.44 O ATOM 1227 CB GLN A 384 6.109 29.737 -8.934 1.00 0.14 C ATOM 1228 CG GLN A 384 6.011 31.163 -8.416 1.00 50.22 C ATOM 1229 CD GLN A 384 6.773 32.150 -9.276 1.00 33.10 C ATOM 1230 OE1 GLN A 384 8.002 32.220 -9.219 1.00 1.44 O ATOM 1231 NE2 GLN A 384 6.049 32.920 -10.079 1.00 74.34 N ATOM 0 H GLN A 384 7.062 27.515 -9.874 1.00 54.13 H new ATOM 0 HA GLN A 384 8.113 29.669 -8.163 1.00 12.05 H new ATOM 0 HB2 GLN A 384 6.171 29.758 -10.022 1.00 0.14 H new ATOM 0 HB3 GLN A 384 5.194 29.202 -8.677 1.00 0.14 H new ATOM 0 HG2 GLN A 384 4.963 31.458 -8.373 1.00 50.22 H new ATOM 0 HG3 GLN A 384 6.396 31.202 -7.397 1.00 50.22 H new ATOM 0 HE21 GLN A 384 5.033 32.828 -10.094 1.00 74.34 H new ATOM 0 HE22 GLN A 384 6.508 33.603 -10.681 1.00 74.34 H new ATOM 1240 N THR A 385 6.563 26.983 -7.198 1.00 2.34 N ATOM 1241 CA THR A 385 6.169 26.195 -6.038 1.00 2.15 C ATOM 1242 C THR A 385 6.262 24.702 -6.330 1.00 62.43 C ATOM 1243 O THR A 385 5.533 24.177 -7.171 1.00 3.14 O ATOM 1244 CB THR A 385 4.733 26.531 -5.592 1.00 3.33 C ATOM 1245 OG1 THR A 385 4.407 27.875 -5.963 1.00 13.00 O ATOM 1246 CG2 THR A 385 4.581 26.364 -4.088 1.00 52.23 C ATOM 0 H THR A 385 6.537 26.474 -8.082 1.00 2.34 H new ATOM 0 HA THR A 385 6.860 26.449 -5.234 1.00 2.15 H new ATOM 0 HB THR A 385 4.051 25.842 -6.089 1.00 3.33 H new ATOM 0 HG1 THR A 385 3.492 28.080 -5.677 1.00 13.00 H new ATOM 0 HG21 THR A 385 3.559 26.607 -3.796 1.00 52.23 H new ATOM 0 HG22 THR A 385 4.802 25.333 -3.812 1.00 52.23 H new ATOM 0 HG23 THR A 385 5.273 27.033 -3.576 1.00 52.23 H new ATOM 1254 N VAL A 386 7.164 24.022 -5.630 1.00 15.40 N ATOM 1255 CA VAL A 386 7.350 22.587 -5.813 1.00 22.21 C ATOM 1256 C VAL A 386 7.069 21.827 -4.522 1.00 3.40 C ATOM 1257 O VAL A 386 7.632 22.134 -3.471 1.00 54.32 O ATOM 1258 CB VAL A 386 8.781 22.263 -6.284 1.00 1.11 C ATOM 1259 CG1 VAL A 386 9.076 20.781 -6.116 1.00 31.41 C ATOM 1260 CG2 VAL A 386 8.975 22.693 -7.731 1.00 71.42 C ATOM 0 H VAL A 386 7.777 24.441 -4.931 1.00 15.40 H new ATOM 0 HA VAL A 386 6.642 22.271 -6.579 1.00 22.21 H new ATOM 0 HB VAL A 386 9.484 22.821 -5.665 1.00 1.11 H new ATOM 0 HG11 VAL A 386 10.091 20.571 -6.454 1.00 31.41 H new ATOM 0 HG12 VAL A 386 8.980 20.508 -5.065 1.00 31.41 H new ATOM 0 HG13 VAL A 386 8.369 20.200 -6.708 1.00 31.41 H new ATOM 0 HG21 VAL A 386 9.991 22.457 -8.048 1.00 71.42 H new ATOM 0 HG22 VAL A 386 8.265 22.164 -8.366 1.00 71.42 H new ATOM 0 HG23 VAL A 386 8.808 23.767 -7.817 1.00 71.42 H new ATOM 1270 N THR A 387 6.193 20.830 -4.608 1.00 33.22 N ATOM 1271 CA THR A 387 5.834 20.025 -3.447 1.00 41.44 C ATOM 1272 C THR A 387 6.844 18.907 -3.220 1.00 42.03 C ATOM 1273 O THR A 387 6.970 17.996 -4.039 1.00 22.24 O ATOM 1274 CB THR A 387 4.430 19.410 -3.602 1.00 55.24 C ATOM 1275 OG1 THR A 387 4.081 19.329 -4.988 1.00 41.04 O ATOM 1276 CG2 THR A 387 3.392 20.238 -2.860 1.00 53.15 C ATOM 0 H THR A 387 5.719 20.561 -5.470 1.00 33.22 H new ATOM 0 HA THR A 387 5.837 20.693 -2.586 1.00 41.44 H new ATOM 0 HB THR A 387 4.447 18.408 -3.173 1.00 55.24 H new ATOM 0 HG1 THR A 387 3.188 18.935 -5.078 1.00 41.04 H new ATOM 0 HG21 THR A 387 2.409 19.784 -2.984 1.00 53.15 H new ATOM 0 HG22 THR A 387 3.645 20.273 -1.800 1.00 53.15 H new ATOM 0 HG23 THR A 387 3.378 21.250 -3.264 1.00 53.15 H new ATOM 1284 N ILE A 388 7.563 18.982 -2.105 1.00 62.03 N ATOM 1285 CA ILE A 388 8.561 17.974 -1.771 1.00 34.34 C ATOM 1286 C ILE A 388 8.040 17.016 -0.705 1.00 20.33 C ATOM 1287 O ILE A 388 7.472 17.442 0.302 1.00 65.41 O ATOM 1288 CB ILE A 388 9.868 18.619 -1.272 1.00 21.21 C ATOM 1289 CG1 ILE A 388 10.495 19.472 -2.376 1.00 72.43 C ATOM 1290 CG2 ILE A 388 10.842 17.548 -0.804 1.00 21.25 C ATOM 1291 CD1 ILE A 388 11.058 20.785 -1.879 1.00 51.22 C ATOM 0 H ILE A 388 7.473 19.730 -1.418 1.00 62.03 H new ATOM 0 HA ILE A 388 8.766 17.418 -2.686 1.00 34.34 H new ATOM 0 HB ILE A 388 9.637 19.266 -0.426 1.00 21.21 H new ATOM 0 HG12 ILE A 388 11.291 18.903 -2.856 1.00 72.43 H new ATOM 0 HG13 ILE A 388 9.743 19.674 -3.139 1.00 72.43 H new ATOM 0 HG21 ILE A 388 11.761 18.019 -0.454 1.00 21.25 H new ATOM 0 HG22 ILE A 388 10.393 16.979 0.010 1.00 21.25 H new ATOM 0 HG23 ILE A 388 11.071 16.877 -1.632 1.00 21.25 H new ATOM 0 HD11 ILE A 388 11.486 21.337 -2.716 1.00 51.22 H new ATOM 0 HD12 ILE A 388 10.261 21.374 -1.425 1.00 51.22 H new ATOM 0 HD13 ILE A 388 11.833 20.591 -1.137 1.00 51.22 H new ATOM 1303 N ILE A 389 8.239 15.723 -0.931 1.00 72.12 N ATOM 1304 CA ILE A 389 7.792 14.705 0.012 1.00 73.10 C ATOM 1305 C ILE A 389 8.837 14.463 1.096 1.00 74.25 C ATOM 1306 O ILE A 389 9.999 14.185 0.801 1.00 21.12 O ATOM 1307 CB ILE A 389 7.487 13.373 -0.698 1.00 64.04 C ATOM 1308 CG1 ILE A 389 6.457 13.587 -1.809 1.00 14.22 C ATOM 1309 CG2 ILE A 389 6.990 12.340 0.301 1.00 24.01 C ATOM 1310 CD1 ILE A 389 5.144 14.154 -1.315 1.00 73.34 C ATOM 0 H ILE A 389 8.707 15.355 -1.759 1.00 72.12 H new ATOM 0 HA ILE A 389 6.877 15.080 0.470 1.00 73.10 H new ATOM 0 HB ILE A 389 8.407 13.000 -1.148 1.00 64.04 H new ATOM 0 HG12 ILE A 389 6.876 14.260 -2.557 1.00 14.22 H new ATOM 0 HG13 ILE A 389 6.268 12.636 -2.307 1.00 14.22 H new ATOM 0 HG21 ILE A 389 6.779 11.405 -0.217 1.00 24.01 H new ATOM 0 HG22 ILE A 389 7.754 12.170 1.059 1.00 24.01 H new ATOM 0 HG23 ILE A 389 6.080 12.704 0.778 1.00 24.01 H new ATOM 0 HD11 ILE A 389 4.462 14.279 -2.156 1.00 73.34 H new ATOM 0 HD12 ILE A 389 4.703 13.471 -0.589 1.00 73.34 H new ATOM 0 HD13 ILE A 389 5.320 15.121 -0.843 1.00 73.34 H new ATOM 1322 N ALA A 390 8.415 14.568 2.351 1.00 44.01 N ATOM 1323 CA ALA A 390 9.313 14.357 3.481 1.00 3.23 C ATOM 1324 C ALA A 390 8.882 13.150 4.306 1.00 33.33 C ATOM 1325 O ALA A 390 7.717 13.031 4.686 1.00 24.21 O ATOM 1326 CB ALA A 390 9.369 15.603 4.351 1.00 22.20 C ATOM 0 H ALA A 390 7.456 14.798 2.612 1.00 44.01 H new ATOM 0 HA ALA A 390 10.310 14.158 3.089 1.00 3.23 H new ATOM 0 HB1 ALA A 390 10.043 15.431 5.190 1.00 22.20 H new ATOM 0 HB2 ALA A 390 9.733 16.443 3.760 1.00 22.20 H new ATOM 0 HB3 ALA A 390 8.371 15.829 4.727 1.00 22.20 H new ATOM 1332 N GLN A 391 9.828 12.257 4.579 1.00 24.04 N ATOM 1333 CA GLN A 391 9.544 11.059 5.360 1.00 51.04 C ATOM 1334 C GLN A 391 10.647 10.799 6.381 1.00 24.21 C ATOM 1335 O GLN A 391 11.828 10.997 6.096 1.00 14.23 O ATOM 1336 CB GLN A 391 9.392 9.848 4.437 1.00 75.00 C ATOM 1337 CG GLN A 391 8.365 8.837 4.924 1.00 12.34 C ATOM 1338 CD GLN A 391 8.414 7.536 4.149 1.00 71.13 C ATOM 1339 OE1 GLN A 391 7.900 7.445 3.034 1.00 12.24 O ATOM 1340 NE2 GLN A 391 9.036 6.520 4.735 1.00 32.13 N ATOM 0 H GLN A 391 10.797 12.340 4.271 1.00 24.04 H new ATOM 0 HA GLN A 391 8.609 11.219 5.896 1.00 51.04 H new ATOM 0 HB2 GLN A 391 9.107 10.193 3.443 1.00 75.00 H new ATOM 0 HB3 GLN A 391 10.358 9.353 4.338 1.00 75.00 H new ATOM 0 HG2 GLN A 391 8.535 8.632 5.981 1.00 12.34 H new ATOM 0 HG3 GLN A 391 7.368 9.268 4.839 1.00 12.34 H new ATOM 0 HE21 GLN A 391 9.448 6.640 5.660 1.00 32.13 H new ATOM 0 HE22 GLN A 391 9.102 5.620 4.260 1.00 32.13 H new ATOM 1349 N TYR A 392 10.254 10.357 7.570 1.00 2.00 N ATOM 1350 CA TYR A 392 11.209 10.073 8.634 1.00 4.12 C ATOM 1351 C TYR A 392 12.095 8.886 8.269 1.00 31.32 C ATOM 1352 O TYR A 392 11.633 7.748 8.199 1.00 41.02 O ATOM 1353 CB TYR A 392 10.475 9.790 9.946 1.00 2.34 C ATOM 1354 CG TYR A 392 11.361 9.879 11.167 1.00 20.34 C ATOM 1355 CD1 TYR A 392 12.113 11.018 11.423 1.00 14.34 C ATOM 1356 CD2 TYR A 392 11.445 8.823 12.067 1.00 52.40 C ATOM 1357 CE1 TYR A 392 12.925 11.103 12.537 1.00 64.44 C ATOM 1358 CE2 TYR A 392 12.253 8.900 13.184 1.00 12.22 C ATOM 1359 CZ TYR A 392 12.991 10.042 13.415 1.00 44.04 C ATOM 1360 OH TYR A 392 13.797 10.122 14.528 1.00 14.22 O ATOM 0 H TYR A 392 9.280 10.188 7.821 1.00 2.00 H new ATOM 0 HA TYR A 392 11.842 10.951 8.761 1.00 4.12 H new ATOM 0 HB2 TYR A 392 9.652 10.497 10.052 1.00 2.34 H new ATOM 0 HB3 TYR A 392 10.035 8.794 9.899 1.00 2.34 H new ATOM 0 HD1 TYR A 392 12.062 11.852 10.739 1.00 14.34 H new ATOM 0 HD2 TYR A 392 10.869 7.927 11.890 1.00 52.40 H new ATOM 0 HE1 TYR A 392 13.505 11.996 12.719 1.00 64.44 H new ATOM 0 HE2 TYR A 392 12.307 8.070 13.873 1.00 12.22 H new ATOM 0 HH TYR A 392 13.728 9.291 15.042 1.00 14.22 H new ATOM 1370 N LYS A 393 13.375 9.161 8.035 1.00 43.50 N ATOM 1371 CA LYS A 393 14.330 8.119 7.679 1.00 75.02 C ATOM 1372 C LYS A 393 15.730 8.473 8.168 1.00 21.04 C ATOM 1373 O LYS A 393 16.646 8.713 7.380 1.00 23.45 O ATOM 1374 CB LYS A 393 14.344 7.909 6.163 1.00 53.43 C ATOM 1375 CG LYS A 393 14.599 6.470 5.751 1.00 34.22 C ATOM 1376 CD LYS A 393 13.409 5.580 6.066 1.00 11.43 C ATOM 1377 CE LYS A 393 13.838 4.142 6.315 1.00 61.24 C ATOM 1378 NZ LYS A 393 14.719 4.025 7.510 1.00 24.44 N1+ ATOM 0 H LYS A 393 13.774 10.098 8.086 1.00 43.50 H new ATOM 0 HA LYS A 393 14.019 7.194 8.165 1.00 75.02 H new ATOM 0 HB2 LYS A 393 13.388 8.232 5.751 1.00 53.43 H new ATOM 0 HB3 LYS A 393 15.112 8.546 5.723 1.00 53.43 H new ATOM 0 HG2 LYS A 393 14.812 6.429 4.683 1.00 34.22 H new ATOM 0 HG3 LYS A 393 15.482 6.094 6.267 1.00 34.22 H new ATOM 0 HD2 LYS A 393 12.889 5.963 6.944 1.00 11.43 H new ATOM 0 HD3 LYS A 393 12.701 5.611 5.238 1.00 11.43 H new ATOM 0 HE2 LYS A 393 12.955 3.518 6.452 1.00 61.24 H new ATOM 0 HE3 LYS A 393 14.363 3.763 5.438 1.00 61.24 H new ATOM 0 HZ1 LYS A 393 15.651 3.664 7.221 1.00 24.44 H new ATOM 0 HZ2 LYS A 393 14.832 4.960 7.951 1.00 24.44 H new ATOM 0 HZ3 LYS A 393 14.291 3.369 8.194 1.00 24.44 H new ATOM 1392 N PRO A 394 15.903 8.506 9.497 1.00 42.31 N ATOM 1393 CA PRO A 394 17.191 8.828 10.119 1.00 61.10 C ATOM 1394 C PRO A 394 18.226 7.728 9.914 1.00 41.21 C ATOM 1395 O PRO A 394 19.423 7.999 9.820 1.00 42.30 O ATOM 1396 CB PRO A 394 16.843 8.964 11.604 1.00 52.41 C ATOM 1397 CG PRO A 394 15.623 8.129 11.784 1.00 73.53 C ATOM 1398 CD PRO A 394 14.856 8.231 10.495 1.00 35.43 C ATOM 0 HA PRO A 394 17.639 9.723 9.687 1.00 61.10 H new ATOM 0 HB2 PRO A 394 17.659 8.614 12.236 1.00 52.41 H new ATOM 0 HB3 PRO A 394 16.655 10.003 11.873 1.00 52.41 H new ATOM 0 HG2 PRO A 394 15.887 7.094 12.000 1.00 73.53 H new ATOM 0 HG3 PRO A 394 15.026 8.487 12.623 1.00 73.53 H new ATOM 0 HD2 PRO A 394 14.320 7.308 10.272 1.00 35.43 H new ATOM 0 HD3 PRO A 394 14.115 9.029 10.530 1.00 35.43 H new ATOM 1406 N GLU A 395 17.757 6.486 9.843 1.00 14.25 N ATOM 1407 CA GLU A 395 18.644 5.345 9.648 1.00 61.24 C ATOM 1408 C GLU A 395 19.286 5.385 8.265 1.00 13.51 C ATOM 1409 O GLU A 395 20.439 4.993 8.092 1.00 53.42 O ATOM 1410 CB GLU A 395 17.874 4.035 9.828 1.00 45.31 C ATOM 1411 CG GLU A 395 17.718 3.614 11.279 1.00 42.34 C ATOM 1412 CD GLU A 395 19.039 3.232 11.921 1.00 3.54 C ATOM 1413 OE1 GLU A 395 20.078 3.319 11.233 1.00 45.14 O ATOM 1414 OE2 GLU A 395 19.033 2.848 13.108 1.00 11.43 O1- ATOM 0 H GLU A 395 16.769 6.245 9.918 1.00 14.25 H new ATOM 0 HA GLU A 395 19.434 5.399 10.397 1.00 61.24 H new ATOM 0 HB2 GLU A 395 16.885 4.140 9.381 1.00 45.31 H new ATOM 0 HB3 GLU A 395 18.388 3.244 9.282 1.00 45.31 H new ATOM 0 HG2 GLU A 395 17.266 4.430 11.844 1.00 42.34 H new ATOM 0 HG3 GLU A 395 17.032 2.769 11.336 1.00 42.34 H new ATOM 1421 N GLU A 396 18.528 5.861 7.280 1.00 2.44 N ATOM 1422 CA GLU A 396 19.022 5.950 5.912 1.00 54.14 C ATOM 1423 C GLU A 396 19.992 7.118 5.759 1.00 52.41 C ATOM 1424 O GLU A 396 21.078 6.969 5.197 1.00 11.52 O ATOM 1425 CB GLU A 396 17.856 6.109 4.934 1.00 12.42 C ATOM 1426 CG GLU A 396 17.149 4.804 4.611 1.00 33.21 C ATOM 1427 CD GLU A 396 17.964 3.912 3.694 1.00 11.11 C ATOM 1428 OE1 GLU A 396 18.052 2.698 3.974 1.00 41.00 O ATOM 1429 OE2 GLU A 396 18.511 4.427 2.697 1.00 41.42 O1- ATOM 0 H GLU A 396 17.571 6.190 7.405 1.00 2.44 H new ATOM 0 HA GLU A 396 19.554 5.026 5.684 1.00 54.14 H new ATOM 0 HB2 GLU A 396 17.134 6.809 5.354 1.00 12.42 H new ATOM 0 HB3 GLU A 396 18.227 6.550 4.009 1.00 12.42 H new ATOM 0 HG2 GLU A 396 16.938 4.270 5.538 1.00 33.21 H new ATOM 0 HG3 GLU A 396 16.189 5.021 4.142 1.00 33.21 H new ATOM 1436 N TYR A 397 19.592 8.281 6.261 1.00 20.30 N ATOM 1437 CA TYR A 397 20.424 9.476 6.178 1.00 75.01 C ATOM 1438 C TYR A 397 21.660 9.341 7.061 1.00 10.42 C ATOM 1439 O TYR A 397 22.713 9.906 6.765 1.00 41.34 O ATOM 1440 CB TYR A 397 19.620 10.710 6.589 1.00 75.24 C ATOM 1441 CG TYR A 397 20.466 11.950 6.770 1.00 45.10 C ATOM 1442 CD1 TYR A 397 20.839 12.727 5.680 1.00 44.40 C ATOM 1443 CD2 TYR A 397 20.893 12.347 8.032 1.00 32.42 C ATOM 1444 CE1 TYR A 397 21.613 13.861 5.841 1.00 13.04 C ATOM 1445 CE2 TYR A 397 21.666 13.478 8.203 1.00 21.33 C ATOM 1446 CZ TYR A 397 22.024 14.232 7.104 1.00 53.25 C ATOM 1447 OH TYR A 397 22.793 15.360 7.268 1.00 53.31 O ATOM 0 H TYR A 397 18.697 8.422 6.730 1.00 20.30 H new ATOM 0 HA TYR A 397 20.750 9.591 5.144 1.00 75.01 H new ATOM 0 HB2 TYR A 397 18.859 10.906 5.833 1.00 75.24 H new ATOM 0 HB3 TYR A 397 19.096 10.498 7.521 1.00 75.24 H new ATOM 0 HD1 TYR A 397 20.518 12.440 4.689 1.00 44.40 H new ATOM 0 HD2 TYR A 397 20.615 11.760 8.895 1.00 32.42 H new ATOM 0 HE1 TYR A 397 21.894 14.453 4.983 1.00 13.04 H new ATOM 0 HE2 TYR A 397 21.989 13.771 9.191 1.00 21.33 H new ATOM 0 HH TYR A 397 22.997 15.482 8.219 1.00 53.31 H new ATOM 1457 N SER A 398 21.523 8.589 8.149 1.00 61.04 N ATOM 1458 CA SER A 398 22.628 8.382 9.079 1.00 1.35 C ATOM 1459 C SER A 398 23.868 7.881 8.346 1.00 32.04 C ATOM 1460 O SER A 398 24.994 8.087 8.798 1.00 50.11 O ATOM 1461 CB SER A 398 22.226 7.384 10.167 1.00 14.33 C ATOM 1462 OG SER A 398 23.367 6.837 10.803 1.00 1.04 O ATOM 0 H SER A 398 20.659 8.113 8.408 1.00 61.04 H new ATOM 0 HA SER A 398 22.864 9.339 9.543 1.00 1.35 H new ATOM 0 HB2 SER A 398 21.597 7.880 10.906 1.00 14.33 H new ATOM 0 HB3 SER A 398 21.631 6.583 9.728 1.00 14.33 H new ATOM 0 HG SER A 398 23.084 6.204 11.495 1.00 1.04 H new ATOM 1468 N ARG A 399 23.653 7.222 7.212 1.00 63.33 N ATOM 1469 CA ARG A 399 24.752 6.690 6.417 1.00 24.30 C ATOM 1470 C ARG A 399 25.630 7.817 5.881 1.00 72.24 C ATOM 1471 O ARG A 399 26.846 7.667 5.760 1.00 44.15 O ATOM 1472 CB ARG A 399 24.211 5.853 5.255 1.00 24.15 C ATOM 1473 CG ARG A 399 23.725 6.686 4.080 1.00 54.32 C ATOM 1474 CD ARG A 399 22.820 5.878 3.162 1.00 34.13 C ATOM 1475 NE ARG A 399 23.533 4.774 2.525 1.00 61.24 N ATOM 1476 CZ ARG A 399 22.925 3.741 1.954 1.00 41.35 C ATOM 1477 NH1 ARG A 399 21.600 3.670 1.939 1.00 11.31 N1+ ATOM 1478 NH2 ARG A 399 23.641 2.774 1.394 1.00 3.10 N ATOM 0 H ARG A 399 22.727 7.044 6.823 1.00 63.33 H new ATOM 0 HA ARG A 399 25.359 6.054 7.061 1.00 24.30 H new ATOM 0 HB2 ARG A 399 24.993 5.176 4.911 1.00 24.15 H new ATOM 0 HB3 ARG A 399 23.389 5.234 5.616 1.00 24.15 H new ATOM 0 HG2 ARG A 399 23.186 7.558 4.449 1.00 54.32 H new ATOM 0 HG3 ARG A 399 24.581 7.056 3.516 1.00 54.32 H new ATOM 0 HD2 ARG A 399 21.980 5.485 3.735 1.00 34.13 H new ATOM 0 HD3 ARG A 399 22.404 6.532 2.395 1.00 34.13 H new ATOM 0 HE ARG A 399 24.553 4.798 2.518 1.00 61.24 H new ATOM 0 HH11 ARG A 399 21.045 4.411 2.367 1.00 11.31 H new ATOM 0 HH12 ARG A 399 21.137 2.875 1.499 1.00 11.31 H new ATOM 0 HH21 ARG A 399 24.660 2.824 1.402 1.00 3.10 H new ATOM 0 HH22 ARG A 399 23.173 1.981 0.956 1.00 3.10 H new ATOM 1492 N PHE A 400 25.005 8.945 5.560 1.00 45.45 N ATOM 1493 CA PHE A 400 25.730 10.097 5.034 1.00 3.02 C ATOM 1494 C PHE A 400 26.577 10.749 6.123 1.00 32.14 C ATOM 1495 O PHE A 400 27.695 11.196 5.869 1.00 44.42 O ATOM 1496 CB PHE A 400 24.751 11.120 4.454 1.00 62.21 C ATOM 1497 CG PHE A 400 24.327 10.812 3.047 1.00 24.03 C ATOM 1498 CD1 PHE A 400 23.037 10.383 2.776 1.00 2.32 C ATOM 1499 CD2 PHE A 400 25.217 10.951 1.994 1.00 3.43 C ATOM 1500 CE1 PHE A 400 22.644 10.098 1.482 1.00 75.53 C ATOM 1501 CE2 PHE A 400 24.829 10.669 0.698 1.00 13.35 C ATOM 1502 CZ PHE A 400 23.541 10.240 0.442 1.00 64.05 C ATOM 0 H PHE A 400 23.999 9.086 5.655 1.00 45.45 H new ATOM 0 HA PHE A 400 26.393 9.748 4.242 1.00 3.02 H new ATOM 0 HB2 PHE A 400 23.867 11.166 5.090 1.00 62.21 H new ATOM 0 HB3 PHE A 400 25.213 12.107 4.478 1.00 62.21 H new ATOM 0 HD1 PHE A 400 22.331 10.270 3.585 1.00 2.32 H new ATOM 0 HD2 PHE A 400 26.226 11.284 2.188 1.00 3.43 H new ATOM 0 HE1 PHE A 400 21.636 9.764 1.284 1.00 75.53 H new ATOM 0 HE2 PHE A 400 25.532 10.784 -0.114 1.00 13.35 H new ATOM 0 HZ PHE A 400 23.236 10.016 -0.570 1.00 64.05 H new ATOM 1512 N GLU A 401 26.036 10.799 7.336 1.00 2.42 N ATOM 1513 CA GLU A 401 26.742 11.397 8.463 1.00 63.41 C ATOM 1514 C GLU A 401 27.629 10.368 9.157 1.00 54.33 C ATOM 1515 O GLU A 401 27.143 9.505 9.887 1.00 13.24 O ATOM 1516 CB GLU A 401 25.745 11.985 9.464 1.00 30.12 C ATOM 1517 CG GLU A 401 25.962 13.463 9.742 1.00 73.34 C ATOM 1518 CD GLU A 401 27.339 13.754 10.305 1.00 22.14 C ATOM 1519 OE1 GLU A 401 27.850 14.871 10.074 1.00 44.41 O ATOM 1520 OE2 GLU A 401 27.906 12.867 10.976 1.00 43.43 O1- ATOM 0 H GLU A 401 25.112 10.433 7.563 1.00 2.42 H new ATOM 0 HA GLU A 401 27.375 12.197 8.079 1.00 63.41 H new ATOM 0 HB2 GLU A 401 24.734 11.840 9.084 1.00 30.12 H new ATOM 0 HB3 GLU A 401 25.816 11.433 10.401 1.00 30.12 H new ATOM 0 HG2 GLU A 401 25.824 14.027 8.819 1.00 73.34 H new ATOM 0 HG3 GLU A 401 25.205 13.812 10.445 1.00 73.34 H new ATOM 1527 N ALA A 402 28.934 10.466 8.922 1.00 74.34 N ATOM 1528 CA ALA A 402 29.890 9.546 9.525 1.00 11.33 C ATOM 1529 C ALA A 402 30.202 9.943 10.964 1.00 52.51 C ATOM 1530 O ALA A 402 30.064 11.108 11.340 1.00 24.04 O ATOM 1531 CB ALA A 402 31.168 9.497 8.700 1.00 70.13 C ATOM 0 H ALA A 402 29.353 11.173 8.318 1.00 74.34 H new ATOM 0 HA ALA A 402 29.441 8.553 9.539 1.00 11.33 H new ATOM 0 HB1 ALA A 402 31.873 8.806 9.162 1.00 70.13 H new ATOM 0 HB2 ALA A 402 30.936 9.158 7.690 1.00 70.13 H new ATOM 0 HB3 ALA A 402 31.611 10.492 8.656 1.00 70.13 H new TER 1537 ALA A 402