USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1011 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 25 LYS NZ :NH3+ 172:sc= 0.0388 (180deg=0) USER MOD Set 1.2: A 111 HIS : no HE2:sc= -0.0284 K(o=0.01,f=-5.1!) USER MOD Set 2.1: A 11 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 15 MET CE :methyl 168:sc= -0.134 (180deg=-0.398) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN :FLIP amide:sc= 0 F(o=-0.85,f=0) USER MOD Single : A 29 SER OG : rot 66:sc= 0.79 USER MOD Single : A 30 GLN : amide:sc= 0.73 K(o=0.73,f=-0.04) USER MOD Single : A 36 TYR OH : rot 132:sc= -0.662 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -2.51 K(o=-2.5,f=-5!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.437 USER MOD Single : A 49 LYS NZ :NH3+ -135:sc= -0.11 (180deg=-1.04) USER MOD Single : A 53 SER OG : rot 73:sc= 0.48 USER MOD Single : A 60 SER OG : rot 65:sc= 0.474 USER MOD Single : A 63 SER OG : rot 61:sc= 0.198 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -109:sc= 0.72 USER MOD Single : A 67 THR OG1 : rot 180:sc=0.000772 USER MOD Single : A 72 THR OG1 : rot 57:sc= 1.13 USER MOD Single : A 73 GLN : amide:sc= -5.62 K(o=-5.6,f=-8.3!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -0.0629 X(o=-0.063,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0952 F(o=-1.3,f=-0.095) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl -162:sc= -2.31 (180deg=-2.73) USER MOD Single : A 91 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 92 GLN :FLIP amide:sc= -1.07 F(o=-2,f=-1.1) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.159 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.354 X(o=-0.35,f=-0.35) USER MOD Single : A 106 MET CE :methyl 155:sc= -0.068 (180deg=-0.911) USER MOD Single : A 108 THR OG1 : rot 62:sc= 1.3 USER MOD Single : A 110 SER OG : rot -90:sc= -0.977 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0463 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 126 GLN : amide:sc= -0.396 X(o=-0.4,f=-0.089) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.311 -9.407 -8.834 1.00 63.22 N ATOM 107 CA ASP A 8 18.060 -10.658 -8.851 1.00 23.35 C ATOM 108 C ASP A 8 17.522 -11.600 -9.923 1.00 33.11 C ATOM 109 O ASP A 8 16.685 -12.461 -9.645 1.00 41.45 O ATOM 110 CB ASP A 8 17.995 -11.335 -7.480 1.00 54.24 C ATOM 111 CG ASP A 8 18.895 -10.666 -6.461 1.00 10.35 C ATOM 112 OD1 ASP A 8 19.069 -9.432 -6.542 1.00 4.53 O ATOM 113 OD2 ASP A 8 19.424 -11.376 -5.581 1.00 5.03 O ATOM 0 HA ASP A 8 19.099 -10.427 -9.085 1.00 23.35 H new ATOM 0 HB2 ASP A 8 16.967 -11.319 -7.118 1.00 54.24 H new ATOM 0 HB3 ASP A 8 18.281 -12.382 -7.581 1.00 54.24 H new ATOM 118 N LEU A 9 18.006 -11.431 -11.149 1.00 35.15 N ATOM 119 CA LEU A 9 17.572 -12.265 -12.264 1.00 22.50 C ATOM 120 C LEU A 9 17.704 -13.746 -11.920 1.00 45.34 C ATOM 121 O LEU A 9 16.937 -14.577 -12.405 1.00 62.42 O ATOM 122 CB LEU A 9 18.392 -11.945 -13.515 1.00 24.22 C ATOM 123 CG LEU A 9 19.825 -12.479 -13.533 1.00 22.03 C ATOM 124 CD1 LEU A 9 20.403 -12.410 -14.938 1.00 20.12 C ATOM 125 CD2 LEU A 9 20.696 -11.701 -12.557 1.00 63.30 C ATOM 0 H LEU A 9 18.699 -10.724 -11.396 1.00 35.15 H new ATOM 0 HA LEU A 9 16.522 -12.049 -12.460 1.00 22.50 H new ATOM 0 HB2 LEU A 9 17.866 -12.344 -14.382 1.00 24.22 H new ATOM 0 HB3 LEU A 9 18.427 -10.862 -13.635 1.00 24.22 H new ATOM 0 HG LEU A 9 19.807 -13.523 -13.221 1.00 22.03 H new ATOM 0 HD11 LEU A 9 21.423 -12.794 -14.931 1.00 20.12 H new ATOM 0 HD12 LEU A 9 19.793 -13.012 -15.612 1.00 20.12 H new ATOM 0 HD13 LEU A 9 20.407 -11.375 -15.279 1.00 20.12 H new ATOM 0 HD21 LEU A 9 21.712 -12.094 -12.583 1.00 63.30 H new ATOM 0 HD22 LEU A 9 20.707 -10.648 -12.839 1.00 63.30 H new ATOM 0 HD23 LEU A 9 20.293 -11.803 -11.549 1.00 63.30 H new ATOM 137 N VAL A 10 18.682 -14.068 -11.079 1.00 11.51 N ATOM 138 CA VAL A 10 18.913 -15.447 -10.667 1.00 71.02 C ATOM 139 C VAL A 10 17.674 -16.038 -10.004 1.00 55.43 C ATOM 140 O VAL A 10 17.363 -17.216 -10.183 1.00 11.41 O ATOM 141 CB VAL A 10 20.101 -15.550 -9.693 1.00 23.42 C ATOM 142 CG1 VAL A 10 20.288 -16.987 -9.229 1.00 44.11 C ATOM 143 CG2 VAL A 10 21.371 -15.022 -10.343 1.00 53.14 C ATOM 0 H VAL A 10 19.327 -13.392 -10.670 1.00 11.51 H new ATOM 0 HA VAL A 10 19.143 -16.012 -11.570 1.00 71.02 H new ATOM 0 HB VAL A 10 19.885 -14.936 -8.819 1.00 23.42 H new ATOM 0 HG11 VAL A 10 21.132 -17.040 -8.541 1.00 44.11 H new ATOM 0 HG12 VAL A 10 19.385 -17.326 -8.722 1.00 44.11 H new ATOM 0 HG13 VAL A 10 20.481 -17.625 -10.091 1.00 44.11 H new ATOM 0 HG21 VAL A 10 22.200 -15.103 -9.640 1.00 53.14 H new ATOM 0 HG22 VAL A 10 21.594 -15.607 -11.235 1.00 53.14 H new ATOM 0 HG23 VAL A 10 21.231 -13.977 -10.620 1.00 53.14 H new ATOM 153 N TYR A 11 16.969 -15.212 -9.239 1.00 55.22 N ATOM 154 CA TYR A 11 15.763 -15.653 -8.547 1.00 40.54 C ATOM 155 C TYR A 11 14.571 -15.689 -9.499 1.00 41.41 C ATOM 156 O TYR A 11 13.562 -16.340 -9.225 1.00 62.14 O ATOM 157 CB TYR A 11 15.460 -14.728 -7.367 1.00 51.34 C ATOM 158 CG TYR A 11 14.041 -14.206 -7.356 1.00 33.33 C ATOM 159 CD1 TYR A 11 13.023 -14.921 -6.736 1.00 14.51 C ATOM 160 CD2 TYR A 11 13.717 -13.000 -7.965 1.00 65.31 C ATOM 161 CE1 TYR A 11 11.724 -14.449 -6.723 1.00 43.42 C ATOM 162 CE2 TYR A 11 12.422 -12.520 -7.956 1.00 43.11 C ATOM 163 CZ TYR A 11 11.429 -13.248 -7.334 1.00 43.32 C ATOM 164 OH TYR A 11 10.138 -12.773 -7.324 1.00 74.32 O ATOM 0 H TYR A 11 17.211 -14.234 -9.082 1.00 55.22 H new ATOM 0 HA TYR A 11 15.937 -16.662 -8.174 1.00 40.54 H new ATOM 0 HB2 TYR A 11 15.648 -15.265 -6.437 1.00 51.34 H new ATOM 0 HB3 TYR A 11 16.149 -13.884 -7.392 1.00 51.34 H new ATOM 0 HD1 TYR A 11 13.251 -15.861 -6.256 1.00 14.51 H new ATOM 0 HD2 TYR A 11 14.491 -12.428 -8.454 1.00 65.31 H new ATOM 0 HE1 TYR A 11 10.944 -15.017 -6.237 1.00 43.42 H new ATOM 0 HE2 TYR A 11 12.188 -11.580 -8.433 1.00 43.11 H new ATOM 0 HH TYR A 11 10.101 -11.915 -7.796 1.00 74.32 H new ATOM 174 N LEU A 12 14.695 -14.984 -10.619 1.00 21.34 N ATOM 175 CA LEU A 12 13.629 -14.935 -11.613 1.00 42.14 C ATOM 176 C LEU A 12 13.524 -16.258 -12.365 1.00 62.01 C ATOM 177 O LEU A 12 12.507 -16.547 -12.993 1.00 34.31 O ATOM 178 CB LEU A 12 13.878 -13.793 -12.600 1.00 63.03 C ATOM 179 CG LEU A 12 13.018 -12.543 -12.412 1.00 31.24 C ATOM 180 CD1 LEU A 12 11.544 -12.879 -12.581 1.00 23.14 C ATOM 181 CD2 LEU A 12 13.272 -11.922 -11.046 1.00 0.11 C ATOM 0 H LEU A 12 15.523 -14.439 -10.861 1.00 21.34 H new ATOM 0 HA LEU A 12 12.688 -14.759 -11.092 1.00 42.14 H new ATOM 0 HB2 LEU A 12 14.926 -13.502 -12.531 1.00 63.03 H new ATOM 0 HB3 LEU A 12 13.718 -14.171 -13.610 1.00 63.03 H new ATOM 0 HG LEU A 12 13.294 -11.817 -13.176 1.00 31.24 H new ATOM 0 HD11 LEU A 12 10.947 -11.977 -12.444 1.00 23.14 H new ATOM 0 HD12 LEU A 12 11.374 -13.278 -13.581 1.00 23.14 H new ATOM 0 HD13 LEU A 12 11.253 -13.623 -11.839 1.00 23.14 H new ATOM 0 HD21 LEU A 12 12.652 -11.033 -10.929 1.00 0.11 H new ATOM 0 HD22 LEU A 12 13.024 -12.643 -10.267 1.00 0.11 H new ATOM 0 HD23 LEU A 12 14.323 -11.644 -10.962 1.00 0.11 H new ATOM 193 N ASN A 13 14.583 -17.059 -12.294 1.00 52.55 N ATOM 194 CA ASN A 13 14.609 -18.352 -12.967 1.00 60.31 C ATOM 195 C ASN A 13 14.319 -19.482 -11.984 1.00 70.40 C ATOM 196 O ASN A 13 13.500 -20.361 -12.255 1.00 65.13 O ATOM 197 CB ASN A 13 15.968 -18.577 -13.633 1.00 41.21 C ATOM 198 CG ASN A 13 16.074 -17.884 -14.978 1.00 5.12 C ATOM 199 OD1 ASN A 13 15.613 -18.403 -15.994 1.00 40.13 O ATOM 200 ND2 ASN A 13 16.685 -16.705 -14.989 1.00 3.21 N ATOM 0 H ASN A 13 15.434 -16.835 -11.777 1.00 52.55 H new ATOM 0 HA ASN A 13 13.833 -18.351 -13.732 1.00 60.31 H new ATOM 0 HB2 ASN A 13 16.757 -18.211 -12.976 1.00 41.21 H new ATOM 0 HB3 ASN A 13 16.133 -19.646 -13.764 1.00 41.21 H new ATOM 0 HD21 ASN A 13 16.787 -16.192 -15.864 1.00 3.21 H new ATOM 0 HD22 ASN A 13 17.052 -16.313 -14.122 1.00 3.21 H new ATOM 207 N VAL A 14 14.996 -19.453 -10.840 1.00 54.32 N ATOM 208 CA VAL A 14 14.810 -20.473 -9.815 1.00 52.04 C ATOM 209 C VAL A 14 13.334 -20.651 -9.478 1.00 53.21 C ATOM 210 O VAL A 14 12.901 -21.737 -9.094 1.00 50.11 O ATOM 211 CB VAL A 14 15.581 -20.123 -8.529 1.00 14.14 C ATOM 212 CG1 VAL A 14 17.034 -19.806 -8.846 1.00 51.41 C ATOM 213 CG2 VAL A 14 14.916 -18.958 -7.811 1.00 5.34 C ATOM 0 H VAL A 14 15.678 -18.734 -10.600 1.00 54.32 H new ATOM 0 HA VAL A 14 15.201 -21.406 -10.222 1.00 52.04 H new ATOM 0 HB VAL A 14 15.560 -20.988 -7.867 1.00 14.14 H new ATOM 0 HG11 VAL A 14 17.562 -19.561 -7.925 1.00 51.41 H new ATOM 0 HG12 VAL A 14 17.502 -20.673 -9.313 1.00 51.41 H new ATOM 0 HG13 VAL A 14 17.081 -18.957 -9.528 1.00 51.41 H new ATOM 0 HG21 VAL A 14 15.473 -18.723 -6.904 1.00 5.34 H new ATOM 0 HG22 VAL A 14 14.904 -18.086 -8.465 1.00 5.34 H new ATOM 0 HG23 VAL A 14 13.893 -19.228 -7.548 1.00 5.34 H new ATOM 223 N MET A 15 12.565 -19.576 -9.625 1.00 23.41 N ATOM 224 CA MET A 15 11.136 -19.614 -9.337 1.00 61.53 C ATOM 225 C MET A 15 10.429 -20.632 -10.227 1.00 65.20 C ATOM 226 O MET A 15 9.802 -21.569 -9.735 1.00 62.51 O ATOM 227 CB MET A 15 10.517 -18.229 -9.536 1.00 22.54 C ATOM 228 CG MET A 15 8.999 -18.226 -9.461 1.00 50.00 C ATOM 229 SD MET A 15 8.359 -16.924 -8.390 1.00 22.32 S ATOM 230 CE MET A 15 9.094 -15.475 -9.143 1.00 0.34 C ATOM 0 H MET A 15 12.908 -18.669 -9.942 1.00 23.41 H new ATOM 0 HA MET A 15 11.008 -19.915 -8.297 1.00 61.53 H new ATOM 0 HB2 MET A 15 10.911 -17.551 -8.779 1.00 22.54 H new ATOM 0 HB3 MET A 15 10.826 -17.838 -10.505 1.00 22.54 H new ATOM 0 HG2 MET A 15 8.590 -18.100 -10.463 1.00 50.00 H new ATOM 0 HG3 MET A 15 8.655 -19.194 -9.095 1.00 50.00 H new ATOM 0 HE1 MET A 15 8.630 -14.577 -8.734 1.00 0.34 H new ATOM 0 HE2 MET A 15 10.163 -15.459 -8.933 1.00 0.34 H new ATOM 0 HE3 MET A 15 8.936 -15.506 -10.221 1.00 0.34 H new ATOM 240 N GLU A 16 10.536 -20.440 -11.538 1.00 73.22 N ATOM 241 CA GLU A 16 9.905 -21.342 -12.495 1.00 41.21 C ATOM 242 C GLU A 16 10.277 -22.793 -12.202 1.00 42.45 C ATOM 243 O GLU A 16 9.458 -23.699 -12.358 1.00 32.12 O ATOM 244 CB GLU A 16 10.318 -20.976 -13.922 1.00 74.05 C ATOM 245 CG GLU A 16 9.545 -19.801 -14.497 1.00 52.30 C ATOM 246 CD GLU A 16 10.199 -19.222 -15.736 1.00 63.15 C ATOM 247 OE1 GLU A 16 11.446 -19.146 -15.768 1.00 15.33 O ATOM 248 OE2 GLU A 16 9.466 -18.846 -16.675 1.00 1.35 O ATOM 0 H GLU A 16 11.053 -19.669 -11.961 1.00 73.22 H new ATOM 0 HA GLU A 16 8.825 -21.236 -12.398 1.00 41.21 H new ATOM 0 HB2 GLU A 16 11.382 -20.741 -13.934 1.00 74.05 H new ATOM 0 HB3 GLU A 16 10.176 -21.844 -14.566 1.00 74.05 H new ATOM 0 HG2 GLU A 16 8.532 -20.122 -14.742 1.00 52.30 H new ATOM 0 HG3 GLU A 16 9.458 -19.022 -13.739 1.00 52.30 H new ATOM 255 N LEU A 17 11.518 -23.005 -11.779 1.00 2.22 N ATOM 256 CA LEU A 17 12.001 -24.345 -11.464 1.00 73.15 C ATOM 257 C LEU A 17 11.195 -24.961 -10.325 1.00 11.51 C ATOM 258 O LEU A 17 10.786 -26.120 -10.395 1.00 12.50 O ATOM 259 CB LEU A 17 13.483 -24.300 -11.090 1.00 21.11 C ATOM 260 CG LEU A 17 14.068 -25.588 -10.510 1.00 22.23 C ATOM 261 CD1 LEU A 17 14.215 -26.644 -11.595 1.00 13.14 C ATOM 262 CD2 LEU A 17 15.410 -25.313 -9.846 1.00 53.01 C ATOM 0 H LEU A 17 12.208 -22.266 -11.646 1.00 2.22 H new ATOM 0 HA LEU A 17 11.876 -24.967 -12.350 1.00 73.15 H new ATOM 0 HB2 LEU A 17 14.054 -24.034 -11.980 1.00 21.11 H new ATOM 0 HB3 LEU A 17 13.630 -23.499 -10.365 1.00 21.11 H new ATOM 0 HG LEU A 17 13.381 -25.967 -9.753 1.00 22.23 H new ATOM 0 HD11 LEU A 17 14.633 -27.553 -11.163 1.00 13.14 H new ATOM 0 HD12 LEU A 17 13.238 -26.862 -12.025 1.00 13.14 H new ATOM 0 HD13 LEU A 17 14.880 -26.274 -12.375 1.00 13.14 H new ATOM 0 HD21 LEU A 17 15.811 -26.241 -9.439 1.00 53.01 H new ATOM 0 HD22 LEU A 17 16.105 -24.910 -10.583 1.00 53.01 H new ATOM 0 HD23 LEU A 17 15.276 -24.591 -9.040 1.00 53.01 H new ATOM 274 N VAL A 18 10.969 -24.176 -9.276 1.00 14.00 N ATOM 275 CA VAL A 18 10.209 -24.642 -8.122 1.00 73.33 C ATOM 276 C VAL A 18 8.743 -24.860 -8.481 1.00 40.12 C ATOM 277 O VAL A 18 8.026 -25.585 -7.792 1.00 14.45 O ATOM 278 CB VAL A 18 10.297 -23.645 -6.952 1.00 14.11 C ATOM 279 CG1 VAL A 18 9.505 -24.153 -5.756 1.00 61.15 C ATOM 280 CG2 VAL A 18 11.749 -23.395 -6.573 1.00 74.22 C ATOM 0 H VAL A 18 11.301 -23.215 -9.202 1.00 14.00 H new ATOM 0 HA VAL A 18 10.650 -25.590 -7.815 1.00 73.33 H new ATOM 0 HB VAL A 18 9.860 -22.698 -7.271 1.00 14.11 H new ATOM 0 HG11 VAL A 18 9.579 -23.435 -4.939 1.00 61.15 H new ATOM 0 HG12 VAL A 18 8.459 -24.276 -6.038 1.00 61.15 H new ATOM 0 HG13 VAL A 18 9.909 -25.113 -5.433 1.00 61.15 H new ATOM 0 HG21 VAL A 18 11.792 -22.688 -5.745 1.00 74.22 H new ATOM 0 HG22 VAL A 18 12.214 -24.334 -6.273 1.00 74.22 H new ATOM 0 HG23 VAL A 18 12.283 -22.983 -7.429 1.00 74.22 H new ATOM 290 N ARG A 19 8.305 -24.228 -9.565 1.00 72.01 N ATOM 291 CA ARG A 19 6.924 -24.352 -10.016 1.00 11.12 C ATOM 292 C ARG A 19 6.748 -25.586 -10.896 1.00 12.02 C ATOM 293 O ARG A 19 5.844 -26.392 -10.678 1.00 32.00 O ATOM 294 CB ARG A 19 6.502 -23.099 -10.785 1.00 72.05 C ATOM 295 CG ARG A 19 5.082 -23.164 -11.324 1.00 32.34 C ATOM 296 CD ARG A 19 4.058 -23.123 -10.200 1.00 51.40 C ATOM 297 NE ARG A 19 2.792 -23.738 -10.590 1.00 1.11 N ATOM 298 CZ ARG A 19 1.921 -23.168 -11.416 1.00 25.04 C ATOM 299 NH1 ARG A 19 2.179 -21.976 -11.936 1.00 13.01 N ATOM 300 NH2 ARG A 19 0.791 -23.791 -11.723 1.00 31.02 N ATOM 0 H ARG A 19 8.886 -23.625 -10.147 1.00 72.01 H new ATOM 0 HA ARG A 19 6.289 -24.461 -9.137 1.00 11.12 H new ATOM 0 HB2 ARG A 19 6.593 -22.233 -10.130 1.00 72.05 H new ATOM 0 HB3 ARG A 19 7.190 -22.944 -11.616 1.00 72.05 H new ATOM 0 HG2 ARG A 19 4.911 -22.330 -12.004 1.00 32.34 H new ATOM 0 HG3 ARG A 19 4.953 -24.079 -11.903 1.00 32.34 H new ATOM 0 HD2 ARG A 19 4.458 -23.639 -9.327 1.00 51.40 H new ATOM 0 HD3 ARG A 19 3.883 -22.088 -9.907 1.00 51.40 H new ATOM 0 HE ARG A 19 2.564 -24.656 -10.207 1.00 1.11 H new ATOM 0 HH11 ARG A 19 3.047 -21.495 -11.702 1.00 13.01 H new ATOM 0 HH12 ARG A 19 1.509 -21.540 -12.570 1.00 13.01 H new ATOM 0 HH21 ARG A 19 0.590 -24.708 -11.325 1.00 31.02 H new ATOM 0 HH22 ARG A 19 0.123 -23.353 -12.357 1.00 31.02 H new ATOM 314 N ALA A 20 7.618 -25.726 -11.891 1.00 12.13 N ATOM 315 CA ALA A 20 7.559 -26.862 -12.802 1.00 45.45 C ATOM 316 C ALA A 20 7.670 -28.180 -12.045 1.00 32.34 C ATOM 317 O ALA A 20 7.210 -29.220 -12.517 1.00 43.02 O ATOM 318 CB ALA A 20 8.661 -26.757 -13.847 1.00 30.11 C ATOM 0 H ALA A 20 8.372 -25.067 -12.086 1.00 12.13 H new ATOM 0 HA ALA A 20 6.592 -26.843 -13.305 1.00 45.45 H new ATOM 0 HB1 ALA A 20 8.606 -27.612 -14.521 1.00 30.11 H new ATOM 0 HB2 ALA A 20 8.535 -25.836 -14.417 1.00 30.11 H new ATOM 0 HB3 ALA A 20 9.632 -26.748 -13.352 1.00 30.11 H new ATOM 324 N VAL A 21 8.283 -28.131 -10.866 1.00 51.31 N ATOM 325 CA VAL A 21 8.453 -29.322 -10.042 1.00 43.44 C ATOM 326 C VAL A 21 7.313 -29.465 -9.041 1.00 12.11 C ATOM 327 O VAL A 21 7.188 -30.489 -8.368 1.00 74.11 O ATOM 328 CB VAL A 21 9.791 -29.290 -9.279 1.00 51.44 C ATOM 329 CG1 VAL A 21 9.782 -28.187 -8.232 1.00 0.31 C ATOM 330 CG2 VAL A 21 10.072 -30.641 -8.640 1.00 74.11 C ATOM 0 H VAL A 21 8.670 -27.279 -10.460 1.00 51.31 H new ATOM 0 HA VAL A 21 8.449 -30.178 -10.717 1.00 43.44 H new ATOM 0 HB VAL A 21 10.590 -29.077 -9.989 1.00 51.44 H new ATOM 0 HG11 VAL A 21 10.735 -28.180 -7.703 1.00 0.31 H new ATOM 0 HG12 VAL A 21 9.630 -27.224 -8.719 1.00 0.31 H new ATOM 0 HG13 VAL A 21 8.975 -28.366 -7.522 1.00 0.31 H new ATOM 0 HG21 VAL A 21 11.021 -30.600 -8.105 1.00 74.11 H new ATOM 0 HG22 VAL A 21 9.272 -30.887 -7.941 1.00 74.11 H new ATOM 0 HG23 VAL A 21 10.125 -31.406 -9.415 1.00 74.11 H new ATOM 340 N LEU A 22 6.482 -28.432 -8.947 1.00 24.32 N ATOM 341 CA LEU A 22 5.350 -28.443 -8.027 1.00 50.52 C ATOM 342 C LEU A 22 4.127 -29.084 -8.676 1.00 4.21 C ATOM 343 O LEU A 22 3.264 -29.630 -7.990 1.00 2.12 O ATOM 344 CB LEU A 22 5.017 -27.018 -7.582 1.00 13.43 C ATOM 345 CG LEU A 22 4.597 -26.852 -6.121 1.00 35.12 C ATOM 346 CD1 LEU A 22 4.299 -25.393 -5.813 1.00 3.21 C ATOM 347 CD2 LEU A 22 3.386 -27.721 -5.812 1.00 63.41 C ATOM 0 H LEU A 22 6.571 -27.577 -9.496 1.00 24.32 H new ATOM 0 HA LEU A 22 5.627 -29.035 -7.155 1.00 50.52 H new ATOM 0 HB2 LEU A 22 5.889 -26.389 -7.762 1.00 13.43 H new ATOM 0 HB3 LEU A 22 4.215 -26.639 -8.215 1.00 13.43 H new ATOM 0 HG LEU A 22 5.423 -27.175 -5.487 1.00 35.12 H new ATOM 0 HD11 LEU A 22 4.002 -25.295 -4.769 1.00 3.21 H new ATOM 0 HD12 LEU A 22 5.191 -24.793 -5.994 1.00 3.21 H new ATOM 0 HD13 LEU A 22 3.490 -25.043 -6.455 1.00 3.21 H new ATOM 0 HD21 LEU A 22 3.101 -27.590 -4.768 1.00 63.41 H new ATOM 0 HD22 LEU A 22 2.555 -27.429 -6.454 1.00 63.41 H new ATOM 0 HD23 LEU A 22 3.633 -28.767 -5.992 1.00 63.41 H new ATOM 359 N GLU A 23 4.063 -29.015 -10.002 1.00 12.21 N ATOM 360 CA GLU A 23 2.946 -29.590 -10.743 1.00 23.35 C ATOM 361 C GLU A 23 3.046 -31.113 -10.782 1.00 2.54 C ATOM 362 O GLU A 23 2.033 -31.812 -10.832 1.00 43.54 O ATOM 363 CB GLU A 23 2.910 -29.034 -12.167 1.00 52.14 C ATOM 364 CG GLU A 23 4.194 -29.268 -12.945 1.00 73.35 C ATOM 365 CD GLU A 23 4.030 -29.014 -14.431 1.00 42.43 C ATOM 366 OE1 GLU A 23 3.568 -29.930 -15.142 1.00 71.54 O ATOM 367 OE2 GLU A 23 4.364 -27.899 -14.883 1.00 44.41 O ATOM 0 H GLU A 23 4.770 -28.567 -10.585 1.00 12.21 H new ATOM 0 HA GLU A 23 2.024 -29.316 -10.231 1.00 23.35 H new ATOM 0 HB2 GLU A 23 2.080 -29.492 -12.706 1.00 52.14 H new ATOM 0 HB3 GLU A 23 2.711 -27.963 -12.125 1.00 52.14 H new ATOM 0 HG2 GLU A 23 4.976 -28.617 -12.553 1.00 73.35 H new ATOM 0 HG3 GLU A 23 4.526 -30.294 -12.790 1.00 73.35 H new ATOM 374 N LEU A 24 4.274 -31.620 -10.758 1.00 52.51 N ATOM 375 CA LEU A 24 4.508 -33.059 -10.791 1.00 72.13 C ATOM 376 C LEU A 24 4.392 -33.662 -9.395 1.00 4.11 C ATOM 377 O LEU A 24 4.505 -34.875 -9.219 1.00 72.32 O ATOM 378 CB LEU A 24 5.890 -33.358 -11.375 1.00 53.34 C ATOM 379 CG LEU A 24 7.069 -33.221 -10.412 1.00 63.42 C ATOM 380 CD1 LEU A 24 7.339 -34.542 -9.709 1.00 25.33 C ATOM 381 CD2 LEU A 24 8.311 -32.746 -11.153 1.00 14.00 C ATOM 0 H LEU A 24 5.123 -31.056 -10.716 1.00 52.51 H new ATOM 0 HA LEU A 24 3.746 -33.511 -11.426 1.00 72.13 H new ATOM 0 HB2 LEU A 24 5.884 -34.375 -11.768 1.00 53.34 H new ATOM 0 HB3 LEU A 24 6.057 -32.690 -12.220 1.00 53.34 H new ATOM 0 HG LEU A 24 6.813 -32.476 -9.658 1.00 63.42 H new ATOM 0 HD11 LEU A 24 8.182 -34.426 -9.027 1.00 25.33 H new ATOM 0 HD12 LEU A 24 6.455 -34.842 -9.146 1.00 25.33 H new ATOM 0 HD13 LEU A 24 7.574 -35.307 -10.449 1.00 25.33 H new ATOM 0 HD21 LEU A 24 9.140 -32.654 -10.452 1.00 14.00 H new ATOM 0 HD22 LEU A 24 8.570 -33.467 -11.929 1.00 14.00 H new ATOM 0 HD23 LEU A 24 8.113 -31.776 -11.610 1.00 14.00 H new ATOM 393 N LYS A 25 4.165 -32.807 -8.404 1.00 0.51 N ATOM 394 CA LYS A 25 4.030 -33.253 -7.023 1.00 23.54 C ATOM 395 C LYS A 25 2.619 -33.765 -6.751 1.00 41.04 C ATOM 396 O LYS A 25 2.427 -34.931 -6.408 1.00 52.51 O ATOM 397 CB LYS A 25 4.364 -32.111 -6.060 1.00 73.04 C ATOM 398 CG LYS A 25 5.804 -32.124 -5.577 1.00 15.40 C ATOM 399 CD LYS A 25 6.016 -31.148 -4.431 1.00 74.51 C ATOM 400 CE LYS A 25 7.415 -30.554 -4.457 1.00 42.43 C ATOM 401 NZ LYS A 25 7.478 -29.250 -3.739 1.00 75.52 N ATOM 0 H LYS A 25 4.071 -31.799 -8.532 1.00 0.51 H new ATOM 0 HA LYS A 25 4.732 -34.072 -6.863 1.00 23.54 H new ATOM 0 HB2 LYS A 25 4.164 -31.160 -6.554 1.00 73.04 H new ATOM 0 HB3 LYS A 25 3.700 -32.168 -5.198 1.00 73.04 H new ATOM 0 HG2 LYS A 25 6.071 -33.130 -5.254 1.00 15.40 H new ATOM 0 HG3 LYS A 25 6.468 -31.867 -6.402 1.00 15.40 H new ATOM 0 HD2 LYS A 25 5.279 -30.348 -4.492 1.00 74.51 H new ATOM 0 HD3 LYS A 25 5.854 -31.659 -3.482 1.00 74.51 H new ATOM 0 HE2 LYS A 25 8.115 -31.254 -4.001 1.00 42.43 H new ATOM 0 HE3 LYS A 25 7.731 -30.415 -5.491 1.00 42.43 H new ATOM 0 HZ1 LYS A 25 8.469 -28.944 -3.661 1.00 75.52 H new ATOM 0 HZ2 LYS A 25 6.936 -28.537 -4.267 1.00 75.52 H new ATOM 0 HZ3 LYS A 25 7.074 -29.358 -2.787 1.00 75.52 H new ATOM 415 N ASN A 26 1.635 -32.886 -6.909 1.00 42.55 N ATOM 416 CA ASN A 26 0.241 -33.249 -6.682 1.00 62.25 C ATOM 417 C ASN A 26 -0.271 -34.160 -7.794 1.00 54.21 C ATOM 418 O ASN A 26 -1.234 -34.903 -7.606 1.00 52.42 O ATOM 419 CB ASN A 26 -0.628 -31.993 -6.596 1.00 3.24 C ATOM 420 CG ASN A 26 -0.603 -31.367 -5.214 1.00 71.24 C ATOM 421 OD1 ASN A 26 0.589 -31.239 -4.644 1.00 51.02 O flip ATOM 422 ND2 ASN A 26 -1.644 -31.003 -4.667 1.00 63.51 N flip ATOM 0 H ASN A 26 1.777 -31.917 -7.193 1.00 42.55 H new ATOM 0 HA ASN A 26 0.181 -33.789 -5.737 1.00 62.25 H new ATOM 0 HB2 ASN A 26 -0.282 -31.264 -7.329 1.00 3.24 H new ATOM 0 HB3 ASN A 26 -1.655 -32.246 -6.859 1.00 3.24 H new ATOM 0 HD21 ASN A 26 -2.538 -31.121 -5.143 1.00 63.51 H new ATOM 0 HD22 ASN A 26 -1.612 -30.583 -3.738 1.00 63.51 H new ATOM 429 N GLU A 27 0.380 -34.096 -8.951 1.00 73.13 N ATOM 430 CA GLU A 27 -0.011 -34.915 -10.093 1.00 21.01 C ATOM 431 C GLU A 27 0.725 -36.252 -10.081 1.00 13.05 C ATOM 432 O GLU A 27 0.700 -36.996 -11.062 1.00 33.44 O ATOM 433 CB GLU A 27 0.275 -34.175 -11.401 1.00 63.13 C ATOM 434 CG GLU A 27 -0.544 -32.907 -11.575 1.00 64.12 C ATOM 435 CD GLU A 27 -2.033 -33.181 -11.657 1.00 62.13 C ATOM 436 OE1 GLU A 27 -2.531 -33.427 -12.776 1.00 4.23 O ATOM 437 OE2 GLU A 27 -2.700 -33.150 -10.602 1.00 52.11 O ATOM 0 H GLU A 27 1.180 -33.486 -9.123 1.00 73.13 H new ATOM 0 HA GLU A 27 -1.081 -35.108 -10.020 1.00 21.01 H new ATOM 0 HB2 GLU A 27 1.334 -33.921 -11.441 1.00 63.13 H new ATOM 0 HB3 GLU A 27 0.076 -34.844 -12.238 1.00 63.13 H new ATOM 0 HG2 GLU A 27 -0.348 -32.235 -10.740 1.00 64.12 H new ATOM 0 HG3 GLU A 27 -0.223 -32.393 -12.481 1.00 64.12 H new ATOM 444 N LEU A 28 1.379 -36.550 -8.964 1.00 3.23 N ATOM 445 CA LEU A 28 2.123 -37.797 -8.822 1.00 42.22 C ATOM 446 C LEU A 28 1.177 -38.974 -8.611 1.00 30.32 C ATOM 447 O LEU A 28 1.512 -40.117 -8.924 1.00 52.44 O ATOM 448 CB LEU A 28 3.103 -37.699 -7.652 1.00 3.12 C ATOM 449 CG LEU A 28 4.006 -38.913 -7.429 1.00 11.11 C ATOM 450 CD1 LEU A 28 3.273 -39.985 -6.638 1.00 74.33 C ATOM 451 CD2 LEU A 28 4.492 -39.468 -8.760 1.00 10.41 C ATOM 0 H LEU A 28 1.409 -35.945 -8.143 1.00 3.23 H new ATOM 0 HA LEU A 28 2.682 -37.965 -9.743 1.00 42.22 H new ATOM 0 HB2 LEU A 28 3.735 -36.825 -7.806 1.00 3.12 H new ATOM 0 HB3 LEU A 28 2.532 -37.523 -6.740 1.00 3.12 H new ATOM 0 HG LEU A 28 4.874 -38.595 -6.852 1.00 11.11 H new ATOM 0 HD11 LEU A 28 3.931 -40.841 -6.489 1.00 74.33 H new ATOM 0 HD12 LEU A 28 2.976 -39.583 -5.669 1.00 74.33 H new ATOM 0 HD13 LEU A 28 2.386 -40.300 -7.188 1.00 74.33 H new ATOM 0 HD21 LEU A 28 5.133 -40.331 -8.582 1.00 10.41 H new ATOM 0 HD22 LEU A 28 3.636 -39.770 -9.363 1.00 10.41 H new ATOM 0 HD23 LEU A 28 5.056 -38.700 -9.290 1.00 10.41 H new ATOM 463 N SER A 29 -0.007 -38.687 -8.079 1.00 70.41 N ATOM 464 CA SER A 29 -1.002 -39.723 -7.824 1.00 43.14 C ATOM 465 C SER A 29 -2.176 -39.598 -8.791 1.00 4.22 C ATOM 466 O SER A 29 -3.335 -39.699 -8.391 1.00 11.11 O ATOM 467 CB SER A 29 -1.503 -39.635 -6.382 1.00 4.25 C ATOM 468 OG SER A 29 -2.453 -38.594 -6.234 1.00 41.03 O ATOM 0 H SER A 29 -0.301 -37.746 -7.816 1.00 70.41 H new ATOM 0 HA SER A 29 -0.528 -40.693 -7.978 1.00 43.14 H new ATOM 0 HB2 SER A 29 -1.952 -40.585 -6.091 1.00 4.25 H new ATOM 0 HB3 SER A 29 -0.661 -39.461 -5.711 1.00 4.25 H new ATOM 0 HG SER A 29 -3.258 -38.810 -6.750 1.00 41.03 H new ATOM 474 N GLN A 30 -1.865 -39.377 -10.064 1.00 61.21 N ATOM 475 CA GLN A 30 -2.894 -39.238 -11.088 1.00 3.52 C ATOM 476 C GLN A 30 -2.527 -40.027 -12.340 1.00 25.11 C ATOM 477 O GLN A 30 -3.323 -40.821 -12.842 1.00 54.00 O ATOM 478 CB GLN A 30 -3.094 -37.763 -11.441 1.00 54.22 C ATOM 479 CG GLN A 30 -3.662 -36.935 -10.299 1.00 73.53 C ATOM 480 CD GLN A 30 -5.146 -37.168 -10.092 1.00 0.30 C ATOM 481 OE1 GLN A 30 -5.978 -36.377 -10.537 1.00 51.14 O ATOM 482 NE2 GLN A 30 -5.486 -38.257 -9.413 1.00 23.02 N ATOM 0 H GLN A 30 -0.910 -39.290 -10.411 1.00 61.21 H new ATOM 0 HA GLN A 30 -3.825 -39.639 -10.689 1.00 3.52 H new ATOM 0 HB2 GLN A 30 -2.138 -37.338 -11.746 1.00 54.22 H new ATOM 0 HB3 GLN A 30 -3.763 -37.691 -12.299 1.00 54.22 H new ATOM 0 HG2 GLN A 30 -3.128 -37.176 -9.380 1.00 73.53 H new ATOM 0 HG3 GLN A 30 -3.488 -35.878 -10.500 1.00 73.53 H new ATOM 0 HE21 GLN A 30 -4.763 -38.886 -9.062 1.00 23.02 H new ATOM 0 HE22 GLN A 30 -6.470 -38.465 -9.242 1.00 23.02 H new ATOM 491 N LEU A 31 -1.316 -39.804 -12.840 1.00 32.30 N ATOM 492 CA LEU A 31 -0.843 -40.495 -14.035 1.00 22.05 C ATOM 493 C LEU A 31 0.276 -41.473 -13.691 1.00 20.13 C ATOM 494 O LEU A 31 0.919 -41.376 -12.645 1.00 71.32 O ATOM 495 CB LEU A 31 -0.351 -39.484 -15.071 1.00 42.42 C ATOM 496 CG LEU A 31 0.263 -38.198 -14.516 1.00 10.12 C ATOM 497 CD1 LEU A 31 1.365 -37.692 -15.434 1.00 75.13 C ATOM 498 CD2 LEU A 31 -0.808 -37.133 -14.328 1.00 71.41 C ATOM 0 H LEU A 31 -0.644 -39.151 -12.437 1.00 32.30 H new ATOM 0 HA LEU A 31 -1.677 -41.058 -14.453 1.00 22.05 H new ATOM 0 HB2 LEU A 31 0.390 -39.973 -15.703 1.00 42.42 H new ATOM 0 HB3 LEU A 31 -1.190 -39.215 -15.713 1.00 42.42 H new ATOM 0 HG LEU A 31 0.702 -38.419 -13.543 1.00 10.12 H new ATOM 0 HD11 LEU A 31 1.790 -36.776 -15.022 1.00 75.13 H new ATOM 0 HD12 LEU A 31 2.145 -38.449 -15.517 1.00 75.13 H new ATOM 0 HD13 LEU A 31 0.951 -37.488 -16.421 1.00 75.13 H new ATOM 0 HD21 LEU A 31 -0.353 -36.225 -13.932 1.00 71.41 H new ATOM 0 HD22 LEU A 31 -1.277 -36.915 -15.288 1.00 71.41 H new ATOM 0 HD23 LEU A 31 -1.562 -37.495 -13.629 1.00 71.41 H new ATOM 510 N PRO A 32 0.517 -42.437 -14.591 1.00 70.43 N ATOM 511 CA PRO A 32 1.561 -43.450 -14.407 1.00 34.23 C ATOM 512 C PRO A 32 2.964 -42.863 -14.515 1.00 33.15 C ATOM 513 O PRO A 32 3.153 -41.717 -14.922 1.00 65.04 O ATOM 514 CB PRO A 32 1.304 -44.436 -15.549 1.00 61.12 C ATOM 515 CG PRO A 32 0.615 -43.631 -16.596 1.00 73.43 C ATOM 516 CD PRO A 32 -0.210 -42.613 -15.860 1.00 15.15 C ATOM 0 HA PRO A 32 1.519 -43.904 -13.417 1.00 34.23 H new ATOM 0 HB2 PRO A 32 2.236 -44.859 -15.924 1.00 61.12 H new ATOM 0 HB3 PRO A 32 0.685 -45.271 -15.220 1.00 61.12 H new ATOM 0 HG2 PRO A 32 1.337 -43.147 -17.254 1.00 73.43 H new ATOM 0 HG3 PRO A 32 -0.014 -44.263 -17.223 1.00 73.43 H new ATOM 0 HD2 PRO A 32 -0.282 -41.677 -16.415 1.00 15.15 H new ATOM 0 HD3 PRO A 32 -1.228 -42.965 -15.694 1.00 15.15 H new ATOM 524 N PRO A 33 3.972 -43.665 -14.141 1.00 70.13 N ATOM 525 CA PRO A 33 5.376 -43.246 -14.188 1.00 51.14 C ATOM 526 C PRO A 33 5.890 -43.101 -15.617 1.00 20.04 C ATOM 527 O PRO A 33 6.994 -42.607 -15.841 1.00 4.24 O ATOM 528 CB PRO A 33 6.109 -44.381 -13.469 1.00 1.44 C ATOM 529 CG PRO A 33 5.228 -45.569 -13.639 1.00 74.41 C ATOM 530 CD PRO A 33 3.819 -45.043 -13.645 1.00 61.11 C ATOM 0 HA PRO A 33 5.525 -42.267 -13.732 1.00 51.14 H new ATOM 0 HB2 PRO A 33 7.094 -44.553 -13.903 1.00 1.44 H new ATOM 0 HB3 PRO A 33 6.261 -44.149 -12.415 1.00 1.44 H new ATOM 0 HG2 PRO A 33 5.453 -46.092 -14.569 1.00 74.41 H new ATOM 0 HG3 PRO A 33 5.375 -46.283 -12.828 1.00 74.41 H new ATOM 0 HD2 PRO A 33 3.172 -45.634 -14.293 1.00 61.11 H new ATOM 0 HD3 PRO A 33 3.378 -45.065 -12.649 1.00 61.11 H new ATOM 538 N GLU A 34 5.082 -43.535 -16.579 1.00 14.23 N ATOM 539 CA GLU A 34 5.457 -43.453 -17.985 1.00 53.14 C ATOM 540 C GLU A 34 5.267 -42.035 -18.517 1.00 64.13 C ATOM 541 O GLU A 34 5.590 -41.744 -19.668 1.00 42.12 O ATOM 542 CB GLU A 34 4.628 -44.436 -18.815 1.00 52.52 C ATOM 543 CG GLU A 34 3.140 -44.125 -18.819 1.00 64.25 C ATOM 544 CD GLU A 34 2.410 -44.787 -19.972 1.00 13.42 C ATOM 545 OE1 GLU A 34 2.983 -44.853 -21.079 1.00 2.20 O ATOM 546 OE2 GLU A 34 1.264 -45.238 -19.766 1.00 32.54 O ATOM 0 H GLU A 34 4.164 -43.947 -16.410 1.00 14.23 H new ATOM 0 HA GLU A 34 6.511 -43.716 -18.069 1.00 53.14 H new ATOM 0 HB2 GLU A 34 4.994 -44.431 -19.842 1.00 52.52 H new ATOM 0 HB3 GLU A 34 4.779 -45.443 -18.427 1.00 52.52 H new ATOM 0 HG2 GLU A 34 2.701 -44.456 -17.878 1.00 64.25 H new ATOM 0 HG3 GLU A 34 2.998 -43.046 -18.875 1.00 64.25 H new ATOM 553 N GLY A 35 4.741 -41.157 -17.670 1.00 14.54 N ATOM 554 CA GLY A 35 4.516 -39.780 -18.072 1.00 23.33 C ATOM 555 C GLY A 35 5.516 -38.825 -17.451 1.00 40.33 C ATOM 556 O GLY A 35 6.085 -37.977 -18.140 1.00 32.12 O ATOM 0 H GLY A 35 4.466 -41.374 -16.712 1.00 14.54 H new ATOM 0 HA2 GLY A 35 4.575 -39.707 -19.158 1.00 23.33 H new ATOM 0 HA3 GLY A 35 3.507 -39.481 -17.787 1.00 23.33 H new ATOM 560 N TYR A 36 5.730 -38.959 -16.147 1.00 70.53 N ATOM 561 CA TYR A 36 6.665 -38.098 -15.433 1.00 71.21 C ATOM 562 C TYR A 36 8.034 -38.104 -16.106 1.00 21.31 C ATOM 563 O TYR A 36 8.766 -37.116 -16.059 1.00 44.23 O ATOM 564 CB TYR A 36 6.797 -38.550 -13.978 1.00 3.13 C ATOM 565 CG TYR A 36 5.469 -38.755 -13.284 1.00 45.31 C ATOM 566 CD1 TYR A 36 4.465 -37.798 -13.368 1.00 72.55 C ATOM 567 CD2 TYR A 36 5.220 -39.903 -12.544 1.00 32.44 C ATOM 568 CE1 TYR A 36 3.250 -37.981 -12.736 1.00 2.32 C ATOM 569 CE2 TYR A 36 4.008 -40.095 -11.909 1.00 52.20 C ATOM 570 CZ TYR A 36 3.026 -39.131 -12.008 1.00 4.32 C ATOM 571 OH TYR A 36 1.818 -39.317 -11.376 1.00 3.11 O ATOM 0 H TYR A 36 5.268 -39.656 -15.563 1.00 70.53 H new ATOM 0 HA TYR A 36 6.274 -37.081 -15.456 1.00 71.21 H new ATOM 0 HB2 TYR A 36 7.362 -39.482 -13.946 1.00 3.13 H new ATOM 0 HB3 TYR A 36 7.375 -37.808 -13.427 1.00 3.13 H new ATOM 0 HD1 TYR A 36 4.637 -36.896 -13.937 1.00 72.55 H new ATOM 0 HD2 TYR A 36 5.987 -40.659 -12.463 1.00 32.44 H new ATOM 0 HE1 TYR A 36 2.480 -37.228 -12.812 1.00 2.32 H new ATOM 0 HE2 TYR A 36 3.830 -40.995 -11.338 1.00 52.20 H new ATOM 0 HH TYR A 36 1.477 -40.213 -11.579 1.00 3.11 H new ATOM 581 N VAL A 37 8.373 -39.227 -16.732 1.00 43.44 N ATOM 582 CA VAL A 37 9.653 -39.363 -17.417 1.00 63.01 C ATOM 583 C VAL A 37 9.889 -38.203 -18.377 1.00 43.33 C ATOM 584 O VAL A 37 11.031 -37.860 -18.686 1.00 31.21 O ATOM 585 CB VAL A 37 9.733 -40.687 -18.200 1.00 32.11 C ATOM 586 CG1 VAL A 37 8.739 -40.687 -19.352 1.00 21.24 C ATOM 587 CG2 VAL A 37 11.148 -40.922 -18.706 1.00 31.31 C ATOM 0 H VAL A 37 7.779 -40.055 -16.779 1.00 43.44 H new ATOM 0 HA VAL A 37 10.425 -39.357 -16.648 1.00 63.01 H new ATOM 0 HB VAL A 37 9.472 -41.504 -17.527 1.00 32.11 H new ATOM 0 HG11 VAL A 37 8.810 -41.630 -19.894 1.00 21.24 H new ATOM 0 HG12 VAL A 37 7.729 -40.568 -18.961 1.00 21.24 H new ATOM 0 HG13 VAL A 37 8.965 -39.862 -20.028 1.00 21.24 H new ATOM 0 HG21 VAL A 37 11.186 -41.862 -19.257 1.00 31.31 H new ATOM 0 HG22 VAL A 37 11.440 -40.104 -19.364 1.00 31.31 H new ATOM 0 HG23 VAL A 37 11.834 -40.969 -17.860 1.00 31.31 H new ATOM 597 N VAL A 38 8.802 -37.600 -18.847 1.00 53.21 N ATOM 598 CA VAL A 38 8.890 -36.476 -19.772 1.00 14.13 C ATOM 599 C VAL A 38 8.863 -35.147 -19.025 1.00 40.12 C ATOM 600 O VAL A 38 9.433 -34.155 -19.481 1.00 34.13 O ATOM 601 CB VAL A 38 7.739 -36.500 -20.796 1.00 22.14 C ATOM 602 CG1 VAL A 38 7.839 -35.311 -21.739 1.00 71.22 C ATOM 603 CG2 VAL A 38 7.744 -37.809 -21.571 1.00 44.33 C ATOM 0 H VAL A 38 7.850 -37.871 -18.602 1.00 53.21 H new ATOM 0 HA VAL A 38 9.838 -36.574 -20.300 1.00 14.13 H new ATOM 0 HB VAL A 38 6.794 -36.427 -20.258 1.00 22.14 H new ATOM 0 HG11 VAL A 38 7.018 -35.345 -22.455 1.00 71.22 H new ATOM 0 HG12 VAL A 38 7.783 -34.386 -21.165 1.00 71.22 H new ATOM 0 HG13 VAL A 38 8.788 -35.349 -22.273 1.00 71.22 H new ATOM 0 HG21 VAL A 38 6.925 -37.809 -22.290 1.00 44.33 H new ATOM 0 HG22 VAL A 38 8.691 -37.915 -22.100 1.00 44.33 H new ATOM 0 HG23 VAL A 38 7.620 -38.642 -20.879 1.00 44.33 H new ATOM 613 N VAL A 39 8.198 -35.134 -17.874 1.00 52.15 N ATOM 614 CA VAL A 39 8.098 -33.927 -17.063 1.00 11.13 C ATOM 615 C VAL A 39 9.397 -33.662 -16.309 1.00 75.24 C ATOM 616 O VAL A 39 9.700 -32.523 -15.955 1.00 21.14 O ATOM 617 CB VAL A 39 6.941 -34.025 -16.051 1.00 30.44 C ATOM 618 CG1 VAL A 39 7.451 -34.511 -14.702 1.00 73.34 C ATOM 619 CG2 VAL A 39 6.239 -32.683 -15.912 1.00 41.12 C ATOM 0 H VAL A 39 7.721 -35.946 -17.482 1.00 52.15 H new ATOM 0 HA VAL A 39 7.903 -33.101 -17.747 1.00 11.13 H new ATOM 0 HB VAL A 39 6.218 -34.751 -16.422 1.00 30.44 H new ATOM 0 HG11 VAL A 39 6.620 -34.574 -14.000 1.00 73.34 H new ATOM 0 HG12 VAL A 39 7.904 -35.496 -14.817 1.00 73.34 H new ATOM 0 HG13 VAL A 39 8.195 -33.812 -14.321 1.00 73.34 H new ATOM 0 HG21 VAL A 39 5.424 -32.771 -15.193 1.00 41.12 H new ATOM 0 HG22 VAL A 39 6.951 -31.934 -15.564 1.00 41.12 H new ATOM 0 HG23 VAL A 39 5.838 -32.380 -16.879 1.00 41.12 H new ATOM 629 N VAL A 40 10.161 -34.723 -16.068 1.00 40.41 N ATOM 630 CA VAL A 40 11.429 -34.605 -15.358 1.00 30.30 C ATOM 631 C VAL A 40 12.443 -33.809 -16.171 1.00 52.35 C ATOM 632 O VAL A 40 13.445 -33.332 -15.640 1.00 4.45 O ATOM 633 CB VAL A 40 12.021 -35.990 -15.034 1.00 41.22 C ATOM 634 CG1 VAL A 40 13.313 -35.847 -14.244 1.00 12.33 C ATOM 635 CG2 VAL A 40 11.012 -36.836 -14.273 1.00 54.22 C ATOM 0 H VAL A 40 9.924 -35.673 -16.354 1.00 40.41 H new ATOM 0 HA VAL A 40 11.222 -34.079 -14.426 1.00 30.30 H new ATOM 0 HB VAL A 40 12.251 -36.496 -15.972 1.00 41.22 H new ATOM 0 HG11 VAL A 40 13.716 -36.835 -14.024 1.00 12.33 H new ATOM 0 HG12 VAL A 40 14.037 -35.282 -14.830 1.00 12.33 H new ATOM 0 HG13 VAL A 40 13.112 -35.321 -13.310 1.00 12.33 H new ATOM 0 HG21 VAL A 40 11.447 -37.811 -14.053 1.00 54.22 H new ATOM 0 HG22 VAL A 40 10.749 -36.337 -13.340 1.00 54.22 H new ATOM 0 HG23 VAL A 40 10.116 -36.967 -14.880 1.00 54.22 H new ATOM 645 N LYS A 41 12.175 -33.668 -17.465 1.00 42.33 N ATOM 646 CA LYS A 41 13.062 -32.927 -18.354 1.00 64.23 C ATOM 647 C LYS A 41 12.938 -31.425 -18.119 1.00 63.24 C ATOM 648 O LYS A 41 13.930 -30.743 -17.866 1.00 23.20 O ATOM 649 CB LYS A 41 12.743 -33.254 -19.815 1.00 1.30 C ATOM 650 CG LYS A 41 13.936 -33.778 -20.596 1.00 12.12 C ATOM 651 CD LYS A 41 13.990 -35.296 -20.579 1.00 32.44 C ATOM 652 CE LYS A 41 14.113 -35.834 -19.161 1.00 50.30 C ATOM 653 NZ LYS A 41 14.839 -37.133 -19.122 1.00 25.14 N ATOM 0 H LYS A 41 11.350 -34.057 -17.921 1.00 42.33 H new ATOM 0 HA LYS A 41 14.087 -33.227 -18.136 1.00 64.23 H new ATOM 0 HB2 LYS A 41 11.945 -33.996 -19.847 1.00 1.30 H new ATOM 0 HB3 LYS A 41 12.364 -32.357 -20.305 1.00 1.30 H new ATOM 0 HG2 LYS A 41 13.880 -33.426 -21.626 1.00 12.12 H new ATOM 0 HG3 LYS A 41 14.856 -33.375 -20.171 1.00 12.12 H new ATOM 0 HD2 LYS A 41 13.091 -35.698 -21.045 1.00 32.44 H new ATOM 0 HD3 LYS A 41 14.837 -35.638 -21.174 1.00 32.44 H new ATOM 0 HE2 LYS A 41 14.637 -35.107 -18.541 1.00 50.30 H new ATOM 0 HE3 LYS A 41 13.119 -35.961 -18.733 1.00 50.30 H new ATOM 0 HZ1 LYS A 41 14.902 -37.466 -18.139 1.00 25.14 H new ATOM 0 HZ2 LYS A 41 14.326 -37.835 -19.693 1.00 25.14 H new ATOM 0 HZ3 LYS A 41 15.797 -37.007 -19.507 1.00 25.14 H new ATOM 667 N ASN A 42 11.713 -30.917 -18.204 1.00 2.21 N ATOM 668 CA ASN A 42 11.460 -29.495 -17.999 1.00 72.24 C ATOM 669 C ASN A 42 11.697 -29.104 -16.544 1.00 21.21 C ATOM 670 O ASN A 42 11.969 -27.943 -16.238 1.00 31.20 O ATOM 671 CB ASN A 42 10.026 -29.148 -18.405 1.00 40.12 C ATOM 672 CG ASN A 42 9.019 -30.158 -17.891 1.00 72.21 C ATOM 673 OD1 ASN A 42 8.705 -31.138 -18.567 1.00 62.03 O ATOM 674 ND2 ASN A 42 8.506 -29.923 -16.689 1.00 23.33 N ATOM 0 H ASN A 42 10.881 -31.468 -18.413 1.00 2.21 H new ATOM 0 HA ASN A 42 12.154 -28.934 -18.625 1.00 72.24 H new ATOM 0 HB2 ASN A 42 9.772 -28.159 -18.023 1.00 40.12 H new ATOM 0 HB3 ASN A 42 9.962 -29.096 -19.492 1.00 40.12 H new ATOM 0 HD21 ASN A 42 7.823 -30.568 -16.291 1.00 23.33 H new ATOM 0 HD22 ASN A 42 8.795 -29.098 -16.164 1.00 23.33 H new ATOM 681 N VAL A 43 11.593 -30.082 -15.650 1.00 32.24 N ATOM 682 CA VAL A 43 11.798 -29.842 -14.226 1.00 54.42 C ATOM 683 C VAL A 43 13.283 -29.801 -13.884 1.00 34.02 C ATOM 684 O VAL A 43 13.690 -29.163 -12.914 1.00 34.23 O ATOM 685 CB VAL A 43 11.114 -30.924 -13.370 1.00 31.01 C ATOM 686 CG1 VAL A 43 11.461 -30.741 -11.900 1.00 41.24 C ATOM 687 CG2 VAL A 43 9.607 -30.894 -13.578 1.00 23.50 C ATOM 0 H VAL A 43 11.368 -31.048 -15.886 1.00 32.24 H new ATOM 0 HA VAL A 43 11.350 -28.874 -14.000 1.00 54.42 H new ATOM 0 HB VAL A 43 11.482 -31.900 -13.687 1.00 31.01 H new ATOM 0 HG11 VAL A 43 10.969 -31.515 -11.311 1.00 41.24 H new ATOM 0 HG12 VAL A 43 12.540 -30.817 -11.769 1.00 41.24 H new ATOM 0 HG13 VAL A 43 11.123 -29.760 -11.566 1.00 41.24 H new ATOM 0 HG21 VAL A 43 9.140 -31.665 -12.966 1.00 23.50 H new ATOM 0 HG22 VAL A 43 9.219 -29.917 -13.290 1.00 23.50 H new ATOM 0 HG23 VAL A 43 9.381 -31.078 -14.628 1.00 23.50 H new ATOM 697 N GLY A 44 14.089 -30.487 -14.688 1.00 40.25 N ATOM 698 CA GLY A 44 15.521 -30.516 -14.454 1.00 51.05 C ATOM 699 C GLY A 44 16.289 -29.671 -15.452 1.00 33.22 C ATOM 700 O GLY A 44 17.507 -29.524 -15.345 1.00 31.15 O ATOM 0 H GLY A 44 13.776 -31.023 -15.497 1.00 40.25 H new ATOM 0 HA2 GLY A 44 15.728 -30.159 -13.445 1.00 51.05 H new ATOM 0 HA3 GLY A 44 15.874 -31.546 -14.507 1.00 51.05 H new ATOM 704 N LEU A 45 15.577 -29.116 -16.426 1.00 14.41 N ATOM 705 CA LEU A 45 16.199 -28.282 -17.449 1.00 11.24 C ATOM 706 C LEU A 45 16.173 -26.812 -17.043 1.00 11.24 C ATOM 707 O LEU A 45 16.757 -25.960 -17.713 1.00 65.23 O ATOM 708 CB LEU A 45 15.484 -28.465 -18.789 1.00 22.44 C ATOM 709 CG LEU A 45 15.971 -29.627 -19.655 1.00 43.05 C ATOM 710 CD1 LEU A 45 14.848 -30.138 -20.544 1.00 53.51 C ATOM 711 CD2 LEU A 45 17.166 -29.201 -20.496 1.00 5.05 C ATOM 0 H LEU A 45 14.568 -29.228 -16.529 1.00 14.41 H new ATOM 0 HA LEU A 45 17.238 -28.593 -17.553 1.00 11.24 H new ATOM 0 HB2 LEU A 45 14.420 -28.603 -18.595 1.00 22.44 H new ATOM 0 HB3 LEU A 45 15.586 -27.543 -19.362 1.00 22.44 H new ATOM 0 HG LEU A 45 16.284 -30.438 -18.998 1.00 43.05 H new ATOM 0 HD11 LEU A 45 15.214 -30.965 -21.153 1.00 53.51 H new ATOM 0 HD12 LEU A 45 14.021 -30.482 -19.923 1.00 53.51 H new ATOM 0 HD13 LEU A 45 14.504 -29.333 -21.194 1.00 53.51 H new ATOM 0 HD21 LEU A 45 17.499 -30.041 -21.106 1.00 5.05 H new ATOM 0 HD22 LEU A 45 16.878 -28.373 -21.144 1.00 5.05 H new ATOM 0 HD23 LEU A 45 17.977 -28.884 -19.841 1.00 5.05 H new ATOM 723 N THR A 46 15.493 -26.520 -15.938 1.00 53.12 N ATOM 724 CA THR A 46 15.391 -25.153 -15.442 1.00 23.53 C ATOM 725 C THR A 46 16.529 -24.833 -14.479 1.00 13.51 C ATOM 726 O THR A 46 16.941 -23.679 -14.351 1.00 50.23 O ATOM 727 CB THR A 46 14.047 -24.913 -14.729 1.00 22.12 C ATOM 728 OG1 THR A 46 13.056 -25.813 -15.236 1.00 73.21 O ATOM 729 CG2 THR A 46 13.582 -23.478 -14.921 1.00 11.52 C ATOM 0 H THR A 46 15.005 -27.212 -15.370 1.00 53.12 H new ATOM 0 HA THR A 46 15.456 -24.495 -16.309 1.00 23.53 H new ATOM 0 HB THR A 46 14.189 -25.093 -13.663 1.00 22.12 H new ATOM 0 HG1 THR A 46 12.205 -25.655 -14.776 1.00 73.21 H new ATOM 0 HG21 THR A 46 12.631 -23.332 -14.409 1.00 11.52 H new ATOM 0 HG22 THR A 46 14.325 -22.796 -14.508 1.00 11.52 H new ATOM 0 HG23 THR A 46 13.456 -23.276 -15.985 1.00 11.52 H new ATOM 737 N LEU A 47 17.033 -25.859 -13.803 1.00 61.14 N ATOM 738 CA LEU A 47 18.125 -25.686 -12.852 1.00 21.44 C ATOM 739 C LEU A 47 19.476 -25.742 -13.557 1.00 43.41 C ATOM 740 O LEU A 47 20.428 -25.075 -13.150 1.00 30.21 O ATOM 741 CB LEU A 47 18.058 -26.764 -11.768 1.00 4.22 C ATOM 742 CG LEU A 47 18.201 -28.209 -12.248 1.00 13.50 C ATOM 743 CD1 LEU A 47 19.668 -28.586 -12.377 1.00 22.11 C ATOM 744 CD2 LEU A 47 17.485 -29.159 -11.299 1.00 50.21 C ATOM 0 H LEU A 47 16.703 -26.820 -13.896 1.00 61.14 H new ATOM 0 HA LEU A 47 18.018 -24.705 -12.389 1.00 21.44 H new ATOM 0 HB2 LEU A 47 18.842 -26.566 -11.038 1.00 4.22 H new ATOM 0 HB3 LEU A 47 17.106 -26.668 -11.247 1.00 4.22 H new ATOM 0 HG LEU A 47 17.738 -28.293 -13.231 1.00 13.50 H new ATOM 0 HD11 LEU A 47 19.750 -29.618 -12.720 1.00 22.11 H new ATOM 0 HD12 LEU A 47 20.152 -27.925 -13.096 1.00 22.11 H new ATOM 0 HD13 LEU A 47 20.156 -28.486 -11.407 1.00 22.11 H new ATOM 0 HD21 LEU A 47 17.597 -30.183 -11.656 1.00 50.21 H new ATOM 0 HD22 LEU A 47 17.918 -29.073 -10.302 1.00 50.21 H new ATOM 0 HD23 LEU A 47 16.426 -28.903 -11.258 1.00 50.21 H new ATOM 756 N ARG A 48 19.552 -26.539 -14.618 1.00 0.41 N ATOM 757 CA ARG A 48 20.786 -26.680 -15.381 1.00 3.21 C ATOM 758 C ARG A 48 20.996 -25.481 -16.302 1.00 25.34 C ATOM 759 O ARG A 48 22.091 -25.271 -16.826 1.00 34.23 O ATOM 760 CB ARG A 48 20.758 -27.969 -16.203 1.00 71.42 C ATOM 761 CG ARG A 48 19.913 -27.870 -17.463 1.00 33.24 C ATOM 762 CD ARG A 48 19.863 -29.196 -18.206 1.00 41.32 C ATOM 763 NE ARG A 48 19.114 -30.209 -17.469 1.00 32.43 N ATOM 764 CZ ARG A 48 18.959 -31.460 -17.889 1.00 51.23 C ATOM 765 NH1 ARG A 48 19.499 -31.849 -19.036 1.00 0.30 N ATOM 766 NH2 ARG A 48 18.263 -32.324 -17.162 1.00 60.40 N ATOM 0 H ARG A 48 18.773 -27.097 -14.969 1.00 0.41 H new ATOM 0 HA ARG A 48 21.616 -26.725 -14.676 1.00 3.21 H new ATOM 0 HB2 ARG A 48 21.778 -28.236 -16.480 1.00 71.42 H new ATOM 0 HB3 ARG A 48 20.375 -28.778 -15.581 1.00 71.42 H new ATOM 0 HG2 ARG A 48 18.901 -27.560 -17.201 1.00 33.24 H new ATOM 0 HG3 ARG A 48 20.322 -27.100 -18.117 1.00 33.24 H new ATOM 0 HD2 ARG A 48 19.405 -29.046 -19.184 1.00 41.32 H new ATOM 0 HD3 ARG A 48 20.878 -29.552 -18.381 1.00 41.32 H new ATOM 0 HE ARG A 48 18.686 -29.942 -16.583 1.00 32.43 H new ATOM 0 HH11 ARG A 48 20.035 -31.187 -19.598 1.00 0.30 H new ATOM 0 HH12 ARG A 48 19.379 -32.810 -19.356 1.00 0.30 H new ATOM 0 HH21 ARG A 48 17.846 -32.028 -16.279 1.00 60.40 H new ATOM 0 HH22 ARG A 48 18.145 -33.284 -17.486 1.00 60.40 H new ATOM 780 N LYS A 49 19.941 -24.698 -16.495 1.00 13.12 N ATOM 781 CA LYS A 49 20.008 -23.520 -17.351 1.00 41.22 C ATOM 782 C LYS A 49 20.250 -22.260 -16.526 1.00 24.22 C ATOM 783 O LYS A 49 20.943 -21.342 -16.965 1.00 45.41 O ATOM 784 CB LYS A 49 18.714 -23.374 -18.156 1.00 23.14 C ATOM 785 CG LYS A 49 17.505 -23.025 -17.305 1.00 63.30 C ATOM 786 CD LYS A 49 16.262 -22.828 -18.157 1.00 24.43 C ATOM 787 CE LYS A 49 16.321 -21.523 -18.935 1.00 11.34 C ATOM 788 NZ LYS A 49 16.829 -21.725 -20.320 1.00 3.53 N ATOM 0 H LYS A 49 19.028 -24.858 -16.070 1.00 13.12 H new ATOM 0 HA LYS A 49 20.844 -23.649 -18.038 1.00 41.22 H new ATOM 0 HB2 LYS A 49 18.851 -22.601 -18.912 1.00 23.14 H new ATOM 0 HB3 LYS A 49 18.518 -24.306 -18.686 1.00 23.14 H new ATOM 0 HG2 LYS A 49 17.328 -23.819 -16.580 1.00 63.30 H new ATOM 0 HG3 LYS A 49 17.707 -22.116 -16.739 1.00 63.30 H new ATOM 0 HD2 LYS A 49 16.159 -23.662 -18.851 1.00 24.43 H new ATOM 0 HD3 LYS A 49 15.378 -22.833 -17.519 1.00 24.43 H new ATOM 0 HE2 LYS A 49 15.327 -21.078 -18.974 1.00 11.34 H new ATOM 0 HE3 LYS A 49 16.965 -20.817 -18.411 1.00 11.34 H new ATOM 0 HZ1 LYS A 49 17.530 -20.990 -20.543 1.00 3.53 H new ATOM 0 HZ2 LYS A 49 17.275 -22.662 -20.393 1.00 3.53 H new ATOM 0 HZ3 LYS A 49 16.038 -21.665 -20.992 1.00 3.53 H new ATOM 802 N LEU A 50 19.677 -22.224 -15.328 1.00 21.10 N ATOM 803 CA LEU A 50 19.832 -21.077 -14.440 1.00 23.22 C ATOM 804 C LEU A 50 21.258 -20.993 -13.903 1.00 35.31 C ATOM 805 O LEU A 50 21.724 -19.921 -13.519 1.00 2.54 O ATOM 806 CB LEU A 50 18.842 -21.170 -13.278 1.00 10.43 C ATOM 807 CG LEU A 50 19.395 -21.732 -11.968 1.00 0.55 C ATOM 808 CD1 LEU A 50 20.008 -20.622 -11.127 1.00 54.12 C ATOM 809 CD2 LEU A 50 18.301 -22.449 -11.191 1.00 14.02 C ATOM 0 H LEU A 50 19.101 -22.976 -14.949 1.00 21.10 H new ATOM 0 HA LEU A 50 19.626 -20.173 -15.014 1.00 23.22 H new ATOM 0 HB2 LEU A 50 18.446 -20.173 -13.084 1.00 10.43 H new ATOM 0 HB3 LEU A 50 18.003 -21.791 -13.591 1.00 10.43 H new ATOM 0 HG LEU A 50 20.177 -22.453 -12.206 1.00 0.55 H new ATOM 0 HD11 LEU A 50 20.396 -21.041 -10.199 1.00 54.12 H new ATOM 0 HD12 LEU A 50 20.821 -20.152 -11.681 1.00 54.12 H new ATOM 0 HD13 LEU A 50 19.247 -19.876 -10.898 1.00 54.12 H new ATOM 0 HD21 LEU A 50 18.713 -22.842 -10.262 1.00 14.02 H new ATOM 0 HD22 LEU A 50 17.497 -21.749 -10.964 1.00 14.02 H new ATOM 0 HD23 LEU A 50 17.908 -23.270 -11.790 1.00 14.02 H new ATOM 821 N ILE A 51 21.944 -22.131 -13.881 1.00 41.34 N ATOM 822 CA ILE A 51 23.317 -22.185 -13.395 1.00 1.40 C ATOM 823 C ILE A 51 24.225 -21.268 -14.208 1.00 13.41 C ATOM 824 O ILE A 51 25.232 -20.771 -13.706 1.00 42.45 O ATOM 825 CB ILE A 51 23.877 -23.619 -13.446 1.00 15.41 C ATOM 826 CG1 ILE A 51 23.239 -24.477 -12.352 1.00 31.33 C ATOM 827 CG2 ILE A 51 25.391 -23.602 -13.299 1.00 13.12 C ATOM 828 CD1 ILE A 51 23.152 -25.945 -12.709 1.00 51.50 C ATOM 0 H ILE A 51 21.571 -23.027 -14.194 1.00 41.34 H new ATOM 0 HA ILE A 51 23.298 -21.848 -12.359 1.00 1.40 H new ATOM 0 HB ILE A 51 23.631 -24.056 -14.414 1.00 15.41 H new ATOM 0 HG12 ILE A 51 23.816 -24.368 -11.434 1.00 31.33 H new ATOM 0 HG13 ILE A 51 22.237 -24.102 -12.145 1.00 31.33 H new ATOM 0 HG21 ILE A 51 25.772 -24.623 -13.337 1.00 13.12 H new ATOM 0 HG22 ILE A 51 25.829 -23.021 -14.111 1.00 13.12 H new ATOM 0 HG23 ILE A 51 25.659 -23.150 -12.344 1.00 13.12 H new ATOM 0 HD11 ILE A 51 22.689 -26.492 -11.888 1.00 51.50 H new ATOM 0 HD12 ILE A 51 22.550 -26.065 -13.610 1.00 51.50 H new ATOM 0 HD13 ILE A 51 24.154 -26.336 -12.887 1.00 51.50 H new ATOM 840 N GLY A 52 23.859 -21.046 -15.467 1.00 32.31 N ATOM 841 CA GLY A 52 24.650 -20.188 -16.329 1.00 54.32 C ATOM 842 C GLY A 52 24.402 -18.716 -16.066 1.00 50.43 C ATOM 843 O GLY A 52 24.974 -17.854 -16.734 1.00 4.04 O ATOM 0 H GLY A 52 23.029 -21.445 -15.905 1.00 32.31 H new ATOM 0 HA2 GLY A 52 25.708 -20.407 -16.183 1.00 54.32 H new ATOM 0 HA3 GLY A 52 24.419 -20.412 -17.370 1.00 54.32 H new ATOM 847 N SER A 53 23.545 -18.426 -15.092 1.00 43.12 N ATOM 848 CA SER A 53 23.219 -17.047 -14.746 1.00 74.44 C ATOM 849 C SER A 53 23.984 -16.603 -13.504 1.00 23.01 C ATOM 850 O SER A 53 24.269 -15.418 -13.326 1.00 70.54 O ATOM 851 CB SER A 53 21.714 -16.901 -14.512 1.00 31.15 C ATOM 852 OG SER A 53 20.987 -17.871 -15.246 1.00 14.24 O ATOM 0 H SER A 53 23.064 -19.127 -14.529 1.00 43.12 H new ATOM 0 HA SER A 53 23.514 -16.409 -15.579 1.00 74.44 H new ATOM 0 HB2 SER A 53 21.496 -17.006 -13.449 1.00 31.15 H new ATOM 0 HB3 SER A 53 21.392 -15.902 -14.806 1.00 31.15 H new ATOM 0 HG SER A 53 21.101 -18.750 -14.829 1.00 14.24 H new ATOM 858 N VAL A 54 24.315 -17.563 -12.646 1.00 1.45 N ATOM 859 CA VAL A 54 25.049 -17.272 -11.420 1.00 32.15 C ATOM 860 C VAL A 54 26.539 -17.542 -11.594 1.00 20.12 C ATOM 861 O VAL A 54 27.370 -16.977 -10.882 1.00 61.33 O ATOM 862 CB VAL A 54 24.521 -18.108 -10.238 1.00 64.34 C ATOM 863 CG1 VAL A 54 24.933 -17.482 -8.915 1.00 21.13 C ATOM 864 CG2 VAL A 54 23.009 -18.253 -10.322 1.00 24.13 C ATOM 0 H VAL A 54 24.087 -18.548 -12.777 1.00 1.45 H new ATOM 0 HA VAL A 54 24.898 -16.214 -11.204 1.00 32.15 H new ATOM 0 HB VAL A 54 24.962 -19.103 -10.293 1.00 64.34 H new ATOM 0 HG11 VAL A 54 24.551 -18.086 -8.092 1.00 21.13 H new ATOM 0 HG12 VAL A 54 26.020 -17.436 -8.857 1.00 21.13 H new ATOM 0 HG13 VAL A 54 24.523 -16.474 -8.846 1.00 21.13 H new ATOM 0 HG21 VAL A 54 22.653 -18.846 -9.480 1.00 24.13 H new ATOM 0 HG22 VAL A 54 22.547 -17.266 -10.292 1.00 24.13 H new ATOM 0 HG23 VAL A 54 22.742 -18.751 -11.254 1.00 24.13 H new ATOM 874 N ASP A 55 26.870 -18.408 -12.545 1.00 23.53 N ATOM 875 CA ASP A 55 28.261 -18.753 -12.814 1.00 45.24 C ATOM 876 C ASP A 55 28.979 -17.605 -13.519 1.00 74.51 C ATOM 877 O ASP A 55 30.207 -17.522 -13.499 1.00 73.31 O ATOM 878 CB ASP A 55 28.339 -20.020 -13.668 1.00 3.15 C ATOM 879 CG ASP A 55 29.765 -20.490 -13.877 1.00 63.01 C ATOM 880 OD1 ASP A 55 30.488 -19.857 -14.676 1.00 33.41 O ATOM 881 OD2 ASP A 55 30.159 -21.490 -13.242 1.00 23.13 O ATOM 0 H ASP A 55 26.194 -18.884 -13.143 1.00 23.53 H new ATOM 0 HA ASP A 55 28.755 -18.936 -11.860 1.00 45.24 H new ATOM 0 HB2 ASP A 55 27.765 -20.813 -13.190 1.00 3.15 H new ATOM 0 HB3 ASP A 55 27.876 -19.831 -14.637 1.00 3.15 H new ATOM 886 N ASP A 56 28.204 -16.724 -14.142 1.00 31.13 N ATOM 887 CA ASP A 56 28.765 -15.581 -14.853 1.00 32.20 C ATOM 888 C ASP A 56 29.280 -14.531 -13.874 1.00 14.04 C ATOM 889 O ASP A 56 29.984 -13.597 -14.261 1.00 74.41 O ATOM 890 CB ASP A 56 27.715 -14.963 -15.777 1.00 74.23 C ATOM 891 CG ASP A 56 28.289 -13.871 -16.658 1.00 62.21 C ATOM 892 OD1 ASP A 56 29.354 -14.101 -17.270 1.00 54.32 O ATOM 893 OD2 ASP A 56 27.674 -12.787 -16.736 1.00 22.30 O ATOM 0 H ASP A 56 27.186 -16.779 -14.169 1.00 31.13 H new ATOM 0 HA ASP A 56 29.604 -15.934 -15.453 1.00 32.20 H new ATOM 0 HB2 ASP A 56 27.284 -15.743 -16.405 1.00 74.23 H new ATOM 0 HB3 ASP A 56 26.904 -14.552 -15.176 1.00 74.23 H new ATOM 898 N LEU A 57 28.923 -14.689 -12.604 1.00 4.23 N ATOM 899 CA LEU A 57 29.348 -13.754 -11.568 1.00 4.41 C ATOM 900 C LEU A 57 30.343 -14.411 -10.616 1.00 13.52 C ATOM 901 O LEU A 57 30.860 -13.768 -9.701 1.00 45.13 O ATOM 902 CB LEU A 57 28.137 -13.243 -10.786 1.00 30.02 C ATOM 903 CG LEU A 57 27.315 -12.146 -11.463 1.00 10.43 C ATOM 904 CD1 LEU A 57 26.011 -12.712 -12.004 1.00 4.03 C ATOM 905 CD2 LEU A 57 27.041 -11.008 -10.490 1.00 43.31 C ATOM 0 H LEU A 57 28.340 -15.456 -12.267 1.00 4.23 H new ATOM 0 HA LEU A 57 29.840 -12.912 -12.054 1.00 4.41 H new ATOM 0 HB2 LEU A 57 27.479 -14.088 -10.581 1.00 30.02 H new ATOM 0 HB3 LEU A 57 28.484 -12.868 -9.823 1.00 30.02 H new ATOM 0 HG LEU A 57 27.891 -11.752 -12.300 1.00 10.43 H new ATOM 0 HD11 LEU A 57 25.440 -11.916 -12.482 1.00 4.03 H new ATOM 0 HD12 LEU A 57 26.228 -13.492 -12.734 1.00 4.03 H new ATOM 0 HD13 LEU A 57 25.430 -13.134 -11.184 1.00 4.03 H new ATOM 0 HD21 LEU A 57 26.455 -10.236 -10.989 1.00 43.31 H new ATOM 0 HD22 LEU A 57 26.486 -11.388 -9.633 1.00 43.31 H new ATOM 0 HD23 LEU A 57 27.986 -10.584 -10.151 1.00 43.31 H new ATOM 917 N LEU A 58 30.607 -15.693 -10.837 1.00 72.44 N ATOM 918 CA LEU A 58 31.541 -16.438 -10.001 1.00 5.25 C ATOM 919 C LEU A 58 32.851 -15.674 -9.834 1.00 40.41 C ATOM 920 O LEU A 58 33.261 -15.329 -8.725 1.00 74.13 O ATOM 921 CB LEU A 58 31.815 -17.815 -10.608 1.00 0.12 C ATOM 922 CG LEU A 58 31.054 -18.986 -9.986 1.00 14.02 C ATOM 923 CD1 LEU A 58 31.368 -20.279 -10.723 1.00 14.40 C ATOM 924 CD2 LEU A 58 31.392 -19.117 -8.508 1.00 34.11 C ATOM 0 H LEU A 58 30.187 -16.239 -11.589 1.00 72.44 H new ATOM 0 HA LEU A 58 31.087 -16.565 -9.018 1.00 5.25 H new ATOM 0 HB2 LEU A 58 31.576 -17.776 -11.671 1.00 0.12 H new ATOM 0 HB3 LEU A 58 32.883 -18.019 -10.529 1.00 0.12 H new ATOM 0 HG LEU A 58 29.986 -18.790 -10.078 1.00 14.02 H new ATOM 0 HD11 LEU A 58 30.817 -21.101 -10.266 1.00 14.40 H new ATOM 0 HD12 LEU A 58 31.075 -20.182 -11.768 1.00 14.40 H new ATOM 0 HD13 LEU A 58 32.437 -20.481 -10.663 1.00 14.40 H new ATOM 0 HD21 LEU A 58 30.841 -19.956 -8.082 1.00 34.11 H new ATOM 0 HD22 LEU A 58 32.462 -19.290 -8.393 1.00 34.11 H new ATOM 0 HD23 LEU A 58 31.115 -18.200 -7.989 1.00 34.11 H new ATOM 936 N PRO A 59 33.524 -15.399 -10.962 1.00 32.44 N ATOM 937 CA PRO A 59 34.796 -14.670 -10.967 1.00 74.31 C ATOM 938 C PRO A 59 34.623 -13.201 -10.597 1.00 21.24 C ATOM 939 O PRO A 59 35.602 -12.478 -10.416 1.00 45.43 O ATOM 940 CB PRO A 59 35.275 -14.804 -12.415 1.00 31.03 C ATOM 941 CG PRO A 59 34.031 -15.010 -13.208 1.00 71.01 C ATOM 942 CD PRO A 59 33.095 -15.780 -12.318 1.00 14.41 C ATOM 0 HA PRO A 59 35.497 -15.067 -10.233 1.00 74.31 H new ATOM 0 HB2 PRO A 59 35.808 -13.911 -12.740 1.00 31.03 H new ATOM 0 HB3 PRO A 59 35.961 -15.644 -12.529 1.00 31.03 H new ATOM 0 HG2 PRO A 59 33.593 -14.056 -13.502 1.00 71.01 H new ATOM 0 HG3 PRO A 59 34.240 -15.561 -14.125 1.00 71.01 H new ATOM 0 HD2 PRO A 59 32.055 -15.511 -12.501 1.00 14.41 H new ATOM 0 HD3 PRO A 59 33.180 -16.855 -12.479 1.00 14.41 H new ATOM 950 N SER A 60 33.372 -12.767 -10.484 1.00 51.13 N ATOM 951 CA SER A 60 33.071 -11.383 -10.138 1.00 45.54 C ATOM 952 C SER A 60 32.404 -11.297 -8.769 1.00 70.31 C ATOM 953 O SER A 60 31.670 -10.351 -8.481 1.00 2.22 O ATOM 954 CB SER A 60 32.166 -10.754 -11.200 1.00 21.43 C ATOM 955 OG SER A 60 30.799 -10.926 -10.870 1.00 73.41 O ATOM 0 H SER A 60 32.550 -13.354 -10.627 1.00 51.13 H new ATOM 0 HA SER A 60 34.011 -10.832 -10.100 1.00 45.54 H new ATOM 0 HB2 SER A 60 32.391 -9.691 -11.291 1.00 21.43 H new ATOM 0 HB3 SER A 60 32.369 -11.207 -12.170 1.00 21.43 H new ATOM 0 HG SER A 60 30.595 -10.428 -10.051 1.00 73.41 H new ATOM 961 N LEU A 61 32.664 -12.293 -7.929 1.00 15.23 N ATOM 962 CA LEU A 61 32.089 -12.332 -6.588 1.00 73.25 C ATOM 963 C LEU A 61 33.181 -12.282 -5.526 1.00 5.44 C ATOM 964 O LEU A 61 34.344 -12.596 -5.780 1.00 62.40 O ATOM 965 CB LEU A 61 31.246 -13.597 -6.410 1.00 43.55 C ATOM 966 CG LEU A 61 29.818 -13.534 -6.954 1.00 4.33 C ATOM 967 CD1 LEU A 61 29.318 -14.927 -7.303 1.00 44.21 C ATOM 968 CD2 LEU A 61 28.893 -12.870 -5.945 1.00 35.34 C ATOM 0 H LEU A 61 33.269 -13.084 -8.152 1.00 15.23 H new ATOM 0 HA LEU A 61 31.450 -11.457 -6.467 1.00 73.25 H new ATOM 0 HB2 LEU A 61 31.762 -14.425 -6.896 1.00 43.55 H new ATOM 0 HB3 LEU A 61 31.198 -13.831 -5.347 1.00 43.55 H new ATOM 0 HG LEU A 61 29.822 -12.934 -7.864 1.00 4.33 H new ATOM 0 HD11 LEU A 61 28.300 -14.862 -7.688 1.00 44.21 H new ATOM 0 HD12 LEU A 61 29.966 -15.367 -8.061 1.00 44.21 H new ATOM 0 HD13 LEU A 61 29.329 -15.552 -6.410 1.00 44.21 H new ATOM 0 HD21 LEU A 61 27.881 -12.833 -6.348 1.00 35.34 H new ATOM 0 HD22 LEU A 61 28.894 -13.444 -5.018 1.00 35.34 H new ATOM 0 HD23 LEU A 61 29.241 -11.857 -5.745 1.00 35.34 H new ATOM 980 N PRO A 62 32.801 -11.878 -4.304 1.00 62.02 N ATOM 981 CA PRO A 62 33.733 -11.780 -3.177 1.00 43.52 C ATOM 982 C PRO A 62 34.198 -13.147 -2.688 1.00 12.02 C ATOM 983 O PRO A 62 33.870 -14.174 -3.282 1.00 50.23 O ATOM 984 CB PRO A 62 32.909 -11.076 -2.096 1.00 22.22 C ATOM 985 CG PRO A 62 31.493 -11.397 -2.430 1.00 23.33 C ATOM 986 CD PRO A 62 31.432 -11.487 -3.929 1.00 73.44 C ATOM 0 HA PRO A 62 34.646 -11.251 -3.448 1.00 43.52 H new ATOM 0 HB2 PRO A 62 33.172 -11.435 -1.101 1.00 22.22 H new ATOM 0 HB3 PRO A 62 33.083 -10.000 -2.103 1.00 22.22 H new ATOM 0 HG2 PRO A 62 31.187 -12.336 -1.970 1.00 23.33 H new ATOM 0 HG3 PRO A 62 30.819 -10.625 -2.058 1.00 23.33 H new ATOM 0 HD2 PRO A 62 30.699 -12.224 -4.258 1.00 73.44 H new ATOM 0 HD3 PRO A 62 31.149 -10.535 -4.377 1.00 73.44 H new ATOM 994 N SER A 63 34.963 -13.153 -1.601 1.00 35.03 N ATOM 995 CA SER A 63 35.475 -14.395 -1.033 1.00 51.24 C ATOM 996 C SER A 63 34.527 -14.937 0.032 1.00 71.21 C ATOM 997 O SER A 63 34.940 -15.235 1.153 1.00 71.15 O ATOM 998 CB SER A 63 36.863 -14.170 -0.430 1.00 71.34 C ATOM 999 OG SER A 63 36.810 -13.244 0.641 1.00 72.12 O ATOM 0 H SER A 63 35.242 -12.312 -1.096 1.00 35.03 H new ATOM 0 HA SER A 63 35.550 -15.129 -1.835 1.00 51.24 H new ATOM 0 HB2 SER A 63 37.267 -15.118 -0.075 1.00 71.34 H new ATOM 0 HB3 SER A 63 37.542 -13.802 -1.199 1.00 71.34 H new ATOM 0 HG SER A 63 36.229 -13.594 1.348 1.00 72.12 H new ATOM 1005 N SER A 64 33.253 -15.063 -0.327 1.00 2.40 N ATOM 1006 CA SER A 64 32.244 -15.565 0.598 1.00 23.32 C ATOM 1007 C SER A 64 31.101 -16.236 -0.157 1.00 52.00 C ATOM 1008 O SER A 64 30.674 -17.337 0.191 1.00 14.31 O ATOM 1009 CB SER A 64 31.701 -14.426 1.462 1.00 11.40 C ATOM 1010 OG SER A 64 30.528 -14.823 2.152 1.00 43.35 O ATOM 0 H SER A 64 32.895 -14.824 -1.252 1.00 2.40 H new ATOM 0 HA SER A 64 32.715 -16.307 1.243 1.00 23.32 H new ATOM 0 HB2 SER A 64 32.461 -14.115 2.179 1.00 11.40 H new ATOM 0 HB3 SER A 64 31.483 -13.562 0.835 1.00 11.40 H new ATOM 0 HG SER A 64 30.202 -14.078 2.698 1.00 43.35 H new ATOM 1016 N SER A 65 30.610 -15.564 -1.193 1.00 53.32 N ATOM 1017 CA SER A 65 29.513 -16.092 -1.996 1.00 41.44 C ATOM 1018 C SER A 65 30.044 -16.868 -3.197 1.00 62.24 C ATOM 1019 O SER A 65 29.454 -17.864 -3.617 1.00 11.20 O ATOM 1020 CB SER A 65 28.607 -14.954 -2.471 1.00 13.14 C ATOM 1021 OG SER A 65 27.731 -14.536 -1.438 1.00 54.33 O ATOM 0 H SER A 65 30.954 -14.653 -1.496 1.00 53.32 H new ATOM 0 HA SER A 65 28.934 -16.773 -1.372 1.00 41.44 H new ATOM 0 HB2 SER A 65 29.217 -14.112 -2.798 1.00 13.14 H new ATOM 0 HB3 SER A 65 28.027 -15.282 -3.334 1.00 13.14 H new ATOM 0 HG SER A 65 26.816 -14.816 -1.651 1.00 54.33 H new ATOM 1027 N ARG A 66 31.163 -16.405 -3.746 1.00 34.11 N ATOM 1028 CA ARG A 66 31.774 -17.055 -4.899 1.00 53.53 C ATOM 1029 C ARG A 66 31.979 -18.544 -4.639 1.00 72.02 C ATOM 1030 O ARG A 66 31.684 -19.381 -5.493 1.00 23.30 O ATOM 1031 CB ARG A 66 33.113 -16.395 -5.233 1.00 1.15 C ATOM 1032 CG ARG A 66 33.912 -17.138 -6.291 1.00 34.43 C ATOM 1033 CD ARG A 66 35.280 -16.510 -6.500 1.00 3.50 C ATOM 1034 NE ARG A 66 36.309 -17.512 -6.765 1.00 75.14 N ATOM 1035 CZ ARG A 66 37.611 -17.273 -6.664 1.00 63.40 C ATOM 1036 NH1 ARG A 66 38.043 -16.072 -6.305 1.00 35.24 N ATOM 1037 NH2 ARG A 66 38.486 -18.237 -6.922 1.00 32.40 N ATOM 0 H ARG A 66 31.664 -15.582 -3.411 1.00 34.11 H new ATOM 0 HA ARG A 66 31.099 -16.942 -5.748 1.00 53.53 H new ATOM 0 HB2 ARG A 66 32.931 -15.377 -5.576 1.00 1.15 H new ATOM 0 HB3 ARG A 66 33.710 -16.323 -4.324 1.00 1.15 H new ATOM 0 HG2 ARG A 66 34.031 -18.180 -5.994 1.00 34.43 H new ATOM 0 HG3 ARG A 66 33.362 -17.136 -7.232 1.00 34.43 H new ATOM 0 HD2 ARG A 66 35.233 -15.809 -7.334 1.00 3.50 H new ATOM 0 HD3 ARG A 66 35.554 -15.935 -5.615 1.00 3.50 H new ATOM 0 HE ARG A 66 36.011 -18.447 -7.043 1.00 75.14 H new ATOM 0 HH11 ARG A 66 37.374 -15.328 -6.105 1.00 35.24 H new ATOM 0 HH12 ARG A 66 39.044 -15.892 -6.228 1.00 35.24 H new ATOM 0 HH21 ARG A 66 38.158 -19.163 -7.198 1.00 32.40 H new ATOM 0 HH22 ARG A 66 39.486 -18.052 -6.844 1.00 32.40 H new ATOM 1051 N THR A 67 32.487 -18.868 -3.454 1.00 74.31 N ATOM 1052 CA THR A 67 32.733 -20.256 -3.082 1.00 11.42 C ATOM 1053 C THR A 67 31.425 -20.998 -2.831 1.00 64.11 C ATOM 1054 O THR A 67 31.384 -22.227 -2.864 1.00 33.44 O ATOM 1055 CB THR A 67 33.614 -20.351 -1.822 1.00 62.31 C ATOM 1056 OG1 THR A 67 34.601 -19.313 -1.834 1.00 75.32 O ATOM 1057 CG2 THR A 67 34.299 -21.707 -1.742 1.00 72.43 C ATOM 0 H THR A 67 32.736 -18.188 -2.736 1.00 74.31 H new ATOM 0 HA THR A 67 33.256 -20.720 -3.918 1.00 11.42 H new ATOM 0 HB THR A 67 32.973 -20.232 -0.948 1.00 62.31 H new ATOM 0 HG1 THR A 67 35.156 -19.380 -1.029 1.00 75.32 H new ATOM 0 HG21 THR A 67 34.916 -21.751 -0.844 1.00 72.43 H new ATOM 0 HG22 THR A 67 33.545 -22.494 -1.703 1.00 72.43 H new ATOM 0 HG23 THR A 67 34.927 -21.850 -2.621 1.00 72.43 H new ATOM 1065 N GLU A 68 30.360 -20.243 -2.582 1.00 31.23 N ATOM 1066 CA GLU A 68 29.051 -20.832 -2.325 1.00 53.23 C ATOM 1067 C GLU A 68 28.409 -21.318 -3.622 1.00 3.21 C ATOM 1068 O GLU A 68 28.125 -22.506 -3.779 1.00 4.31 O ATOM 1069 CB GLU A 68 28.135 -19.815 -1.640 1.00 60.14 C ATOM 1070 CG GLU A 68 27.848 -20.139 -0.184 1.00 11.21 C ATOM 1071 CD GLU A 68 29.102 -20.487 0.594 1.00 32.15 C ATOM 1072 OE1 GLU A 68 30.170 -19.921 0.281 1.00 21.02 O ATOM 1073 OE2 GLU A 68 29.015 -21.325 1.516 1.00 62.20 O ATOM 0 H GLU A 68 30.378 -19.224 -2.553 1.00 31.23 H new ATOM 0 HA GLU A 68 29.190 -21.688 -1.665 1.00 53.23 H new ATOM 0 HB2 GLU A 68 28.593 -18.828 -1.700 1.00 60.14 H new ATOM 0 HB3 GLU A 68 27.192 -19.763 -2.185 1.00 60.14 H new ATOM 0 HG2 GLU A 68 27.359 -19.285 0.285 1.00 11.21 H new ATOM 0 HG3 GLU A 68 27.149 -20.974 -0.132 1.00 11.21 H new ATOM 1080 N ILE A 69 28.184 -20.391 -4.547 1.00 33.10 N ATOM 1081 CA ILE A 69 27.577 -20.725 -5.830 1.00 13.55 C ATOM 1082 C ILE A 69 28.352 -21.834 -6.533 1.00 12.43 C ATOM 1083 O ILE A 69 27.762 -22.741 -7.118 1.00 52.11 O ATOM 1084 CB ILE A 69 27.507 -19.496 -6.756 1.00 15.14 C ATOM 1085 CG1 ILE A 69 26.670 -18.390 -6.109 1.00 73.02 C ATOM 1086 CG2 ILE A 69 26.927 -19.884 -8.108 1.00 24.33 C ATOM 1087 CD1 ILE A 69 27.063 -16.998 -6.551 1.00 44.11 C ATOM 0 H ILE A 69 28.413 -19.404 -4.432 1.00 33.10 H new ATOM 0 HA ILE A 69 26.565 -21.070 -5.620 1.00 13.55 H new ATOM 0 HB ILE A 69 28.518 -19.118 -6.911 1.00 15.14 H new ATOM 0 HG12 ILE A 69 25.619 -18.555 -6.347 1.00 73.02 H new ATOM 0 HG13 ILE A 69 26.766 -18.459 -5.025 1.00 73.02 H new ATOM 0 HG21 ILE A 69 26.884 -19.005 -8.751 1.00 24.33 H new ATOM 0 HG22 ILE A 69 27.559 -20.642 -8.571 1.00 24.33 H new ATOM 0 HG23 ILE A 69 25.922 -20.283 -7.972 1.00 24.33 H new ATOM 0 HD11 ILE A 69 26.428 -16.265 -6.053 1.00 44.11 H new ATOM 0 HD12 ILE A 69 28.105 -16.814 -6.289 1.00 44.11 H new ATOM 0 HD13 ILE A 69 26.940 -16.911 -7.630 1.00 44.11 H new ATOM 1099 N GLU A 70 29.677 -21.754 -6.469 1.00 3.01 N ATOM 1100 CA GLU A 70 30.533 -22.752 -7.099 1.00 61.32 C ATOM 1101 C GLU A 70 30.238 -24.146 -6.552 1.00 13.22 C ATOM 1102 O GLU A 70 30.304 -25.137 -7.278 1.00 11.32 O ATOM 1103 CB GLU A 70 32.007 -22.407 -6.876 1.00 51.24 C ATOM 1104 CG GLU A 70 32.910 -22.822 -8.026 1.00 52.50 C ATOM 1105 CD GLU A 70 33.463 -24.223 -7.857 1.00 24.13 C ATOM 1106 OE1 GLU A 70 33.919 -24.549 -6.741 1.00 24.33 O ATOM 1107 OE2 GLU A 70 33.441 -24.993 -8.839 1.00 61.13 O ATOM 0 H GLU A 70 30.181 -21.009 -5.988 1.00 3.01 H new ATOM 0 HA GLU A 70 30.324 -22.748 -8.169 1.00 61.32 H new ATOM 0 HB2 GLU A 70 32.100 -21.332 -6.721 1.00 51.24 H new ATOM 0 HB3 GLU A 70 32.351 -22.892 -5.962 1.00 51.24 H new ATOM 0 HG2 GLU A 70 32.351 -22.766 -8.960 1.00 52.50 H new ATOM 0 HG3 GLU A 70 33.737 -22.116 -8.107 1.00 52.50 H new ATOM 1114 N GLY A 71 29.912 -24.213 -5.264 1.00 53.24 N ATOM 1115 CA GLY A 71 29.612 -25.488 -4.641 1.00 32.34 C ATOM 1116 C GLY A 71 28.127 -25.794 -4.630 1.00 0.42 C ATOM 1117 O GLY A 71 27.715 -26.901 -4.284 1.00 21.43 O ATOM 0 H GLY A 71 29.851 -23.407 -4.642 1.00 53.24 H new ATOM 0 HA2 GLY A 71 30.139 -26.281 -5.172 1.00 32.34 H new ATOM 0 HA3 GLY A 71 29.987 -25.486 -3.617 1.00 32.34 H new ATOM 1121 N THR A 72 27.319 -24.808 -5.008 1.00 71.03 N ATOM 1122 CA THR A 72 25.871 -24.975 -5.038 1.00 65.31 C ATOM 1123 C THR A 72 25.397 -25.409 -6.420 1.00 75.31 C ATOM 1124 O THR A 72 24.633 -26.366 -6.551 1.00 41.53 O ATOM 1125 CB THR A 72 25.147 -23.674 -4.644 1.00 63.11 C ATOM 1126 OG1 THR A 72 25.656 -23.189 -3.397 1.00 1.24 O ATOM 1127 CG2 THR A 72 23.648 -23.902 -4.532 1.00 35.24 C ATOM 0 H THR A 72 27.643 -23.885 -5.298 1.00 71.03 H new ATOM 0 HA THR A 72 25.627 -25.751 -4.313 1.00 65.31 H new ATOM 0 HB THR A 72 25.328 -22.933 -5.422 1.00 63.11 H new ATOM 0 HG1 THR A 72 26.625 -23.058 -3.468 1.00 1.24 H new ATOM 0 HG21 THR A 72 23.158 -22.969 -4.253 1.00 35.24 H new ATOM 0 HG22 THR A 72 23.259 -24.243 -5.491 1.00 35.24 H new ATOM 0 HG23 THR A 72 23.451 -24.657 -3.771 1.00 35.24 H new ATOM 1135 N GLN A 73 25.854 -24.701 -7.447 1.00 52.24 N ATOM 1136 CA GLN A 73 25.475 -25.014 -8.820 1.00 75.10 C ATOM 1137 C GLN A 73 25.746 -26.481 -9.139 1.00 3.35 C ATOM 1138 O GLN A 73 25.026 -27.101 -9.921 1.00 32.35 O ATOM 1139 CB GLN A 73 26.235 -24.118 -9.799 1.00 0.11 C ATOM 1140 CG GLN A 73 26.073 -22.633 -9.516 1.00 22.11 C ATOM 1141 CD GLN A 73 24.911 -22.018 -10.271 1.00 21.43 C ATOM 1142 OE1 GLN A 73 25.103 -21.184 -11.156 1.00 34.11 O ATOM 1143 NE2 GLN A 73 23.697 -22.428 -9.924 1.00 74.33 N ATOM 0 H GLN A 73 26.487 -23.907 -7.355 1.00 52.24 H new ATOM 0 HA GLN A 73 24.406 -24.830 -8.926 1.00 75.10 H new ATOM 0 HB2 GLN A 73 27.294 -24.373 -9.764 1.00 0.11 H new ATOM 0 HB3 GLN A 73 25.890 -24.326 -10.812 1.00 0.11 H new ATOM 0 HG2 GLN A 73 25.925 -22.485 -8.446 1.00 22.11 H new ATOM 0 HG3 GLN A 73 26.992 -22.113 -9.786 1.00 22.11 H new ATOM 0 HE21 GLN A 73 23.585 -23.121 -9.184 1.00 74.33 H new ATOM 0 HE22 GLN A 73 22.876 -22.050 -10.397 1.00 74.33 H new ATOM 1152 N LYS A 74 26.791 -27.030 -8.528 1.00 50.31 N ATOM 1153 CA LYS A 74 27.159 -28.424 -8.745 1.00 52.11 C ATOM 1154 C LYS A 74 26.137 -29.361 -8.110 1.00 73.41 C ATOM 1155 O LYS A 74 25.727 -30.352 -8.717 1.00 30.15 O ATOM 1156 CB LYS A 74 28.549 -28.702 -8.168 1.00 51.34 C ATOM 1157 CG LYS A 74 28.683 -28.334 -6.701 1.00 43.40 C ATOM 1158 CD LYS A 74 28.525 -29.550 -5.804 1.00 43.02 C ATOM 1159 CE LYS A 74 29.692 -29.685 -4.837 1.00 72.05 C ATOM 1160 NZ LYS A 74 29.389 -30.635 -3.732 1.00 34.33 N ATOM 0 H LYS A 74 27.398 -26.530 -7.878 1.00 50.31 H new ATOM 0 HA LYS A 74 27.175 -28.607 -9.819 1.00 52.11 H new ATOM 0 HB2 LYS A 74 28.779 -29.760 -8.291 1.00 51.34 H new ATOM 0 HB3 LYS A 74 29.290 -28.146 -8.743 1.00 51.34 H new ATOM 0 HG2 LYS A 74 29.657 -27.877 -6.527 1.00 43.40 H new ATOM 0 HG3 LYS A 74 27.931 -27.589 -6.442 1.00 43.40 H new ATOM 0 HD2 LYS A 74 27.594 -29.471 -5.243 1.00 43.02 H new ATOM 0 HD3 LYS A 74 28.453 -30.449 -6.417 1.00 43.02 H new ATOM 0 HE2 LYS A 74 30.574 -30.027 -5.378 1.00 72.05 H new ATOM 0 HE3 LYS A 74 29.933 -28.707 -4.420 1.00 72.05 H new ATOM 0 HZ1 LYS A 74 30.209 -30.699 -3.095 1.00 34.33 H new ATOM 0 HZ2 LYS A 74 28.562 -30.296 -3.200 1.00 34.33 H new ATOM 0 HZ3 LYS A 74 29.184 -31.574 -4.128 1.00 34.33 H new ATOM 1174 N LEU A 75 25.728 -29.042 -6.887 1.00 73.12 N ATOM 1175 CA LEU A 75 24.752 -29.855 -6.170 1.00 74.43 C ATOM 1176 C LEU A 75 23.383 -29.780 -6.840 1.00 22.10 C ATOM 1177 O LEU A 75 22.534 -30.650 -6.641 1.00 12.44 O ATOM 1178 CB LEU A 75 24.646 -29.396 -4.715 1.00 52.31 C ATOM 1179 CG LEU A 75 23.538 -28.387 -4.409 1.00 32.54 C ATOM 1180 CD1 LEU A 75 22.247 -29.106 -4.047 1.00 62.13 C ATOM 1181 CD2 LEU A 75 23.963 -27.453 -3.285 1.00 33.30 C ATOM 0 H LEU A 75 26.057 -28.226 -6.371 1.00 73.12 H new ATOM 0 HA LEU A 75 25.092 -30.890 -6.194 1.00 74.43 H new ATOM 0 HB2 LEU A 75 24.493 -30.274 -4.088 1.00 52.31 H new ATOM 0 HB3 LEU A 75 25.600 -28.958 -4.423 1.00 52.31 H new ATOM 0 HG LEU A 75 23.359 -27.790 -5.303 1.00 32.54 H new ATOM 0 HD11 LEU A 75 21.470 -28.372 -3.832 1.00 62.13 H new ATOM 0 HD12 LEU A 75 21.934 -29.733 -4.882 1.00 62.13 H new ATOM 0 HD13 LEU A 75 22.411 -29.728 -3.167 1.00 62.13 H new ATOM 0 HD21 LEU A 75 23.163 -26.742 -3.081 1.00 33.30 H new ATOM 0 HD22 LEU A 75 24.169 -28.035 -2.387 1.00 33.30 H new ATOM 0 HD23 LEU A 75 24.862 -26.912 -3.581 1.00 33.30 H new ATOM 1193 N LEU A 76 23.177 -28.737 -7.636 1.00 72.14 N ATOM 1194 CA LEU A 76 21.912 -28.549 -8.338 1.00 71.15 C ATOM 1195 C LEU A 76 21.635 -29.714 -9.283 1.00 61.03 C ATOM 1196 O LEU A 76 20.496 -29.941 -9.687 1.00 54.25 O ATOM 1197 CB LEU A 76 21.931 -27.235 -9.122 1.00 64.51 C ATOM 1198 CG LEU A 76 20.880 -26.199 -8.722 1.00 24.53 C ATOM 1199 CD1 LEU A 76 20.967 -25.899 -7.234 1.00 3.45 C ATOM 1200 CD2 LEU A 76 21.050 -24.925 -9.536 1.00 63.31 C ATOM 0 H LEU A 76 23.869 -28.009 -7.812 1.00 72.14 H new ATOM 0 HA LEU A 76 21.115 -28.510 -7.595 1.00 71.15 H new ATOM 0 HB2 LEU A 76 22.917 -26.784 -9.012 1.00 64.51 H new ATOM 0 HB3 LEU A 76 21.802 -27.464 -10.180 1.00 64.51 H new ATOM 0 HG LEU A 76 19.893 -26.611 -8.932 1.00 24.53 H new ATOM 0 HD11 LEU A 76 20.212 -25.160 -6.967 1.00 3.45 H new ATOM 0 HD12 LEU A 76 20.795 -26.814 -6.668 1.00 3.45 H new ATOM 0 HD13 LEU A 76 21.957 -25.508 -6.999 1.00 3.45 H new ATOM 0 HD21 LEU A 76 20.294 -24.199 -9.238 1.00 63.31 H new ATOM 0 HD22 LEU A 76 22.042 -24.509 -9.358 1.00 63.31 H new ATOM 0 HD23 LEU A 76 20.937 -25.153 -10.596 1.00 63.31 H new ATOM 1212 N ASN A 77 22.686 -30.451 -9.630 1.00 13.14 N ATOM 1213 CA ASN A 77 22.555 -31.594 -10.526 1.00 24.13 C ATOM 1214 C ASN A 77 22.397 -32.889 -9.735 1.00 72.44 C ATOM 1215 O ASN A 77 22.355 -33.978 -10.308 1.00 75.43 O ATOM 1216 CB ASN A 77 23.775 -31.690 -11.444 1.00 63.13 C ATOM 1217 CG ASN A 77 23.888 -30.504 -12.382 1.00 53.31 C ATOM 1218 OD1 ASN A 77 23.521 -30.588 -13.554 1.00 51.22 O ATOM 1219 ND2 ASN A 77 24.397 -29.390 -11.869 1.00 23.15 N ATOM 0 H ASN A 77 23.637 -30.277 -9.304 1.00 13.14 H new ATOM 0 HA ASN A 77 21.662 -31.448 -11.133 1.00 24.13 H new ATOM 0 HB2 ASN A 77 24.678 -31.757 -10.837 1.00 63.13 H new ATOM 0 HB3 ASN A 77 23.715 -32.608 -12.029 1.00 63.13 H new ATOM 0 HD21 ASN A 77 24.497 -28.559 -12.452 1.00 23.15 H new ATOM 0 HD22 ASN A 77 24.688 -29.365 -10.892 1.00 23.15 H new ATOM 1226 N LYS A 78 22.309 -32.764 -8.416 1.00 13.34 N ATOM 1227 CA LYS A 78 22.153 -33.923 -7.545 1.00 14.21 C ATOM 1228 C LYS A 78 20.712 -34.048 -7.059 1.00 22.21 C ATOM 1229 O LYS A 78 20.256 -35.138 -6.713 1.00 64.45 O ATOM 1230 CB LYS A 78 23.099 -33.818 -6.347 1.00 11.52 C ATOM 1231 CG LYS A 78 24.481 -34.388 -6.612 1.00 24.13 C ATOM 1232 CD LYS A 78 25.139 -33.724 -7.810 1.00 14.10 C ATOM 1233 CE LYS A 78 26.644 -33.610 -7.628 1.00 3.23 C ATOM 1234 NZ LYS A 78 27.361 -33.585 -8.933 1.00 53.10 N ATOM 0 H LYS A 78 22.343 -31.870 -7.926 1.00 13.34 H new ATOM 0 HA LYS A 78 22.403 -34.815 -8.120 1.00 14.21 H new ATOM 0 HB2 LYS A 78 23.196 -32.770 -6.062 1.00 11.52 H new ATOM 0 HB3 LYS A 78 22.657 -34.340 -5.498 1.00 11.52 H new ATOM 0 HG2 LYS A 78 25.107 -34.251 -5.730 1.00 24.13 H new ATOM 0 HG3 LYS A 78 24.405 -35.461 -6.786 1.00 24.13 H new ATOM 0 HD2 LYS A 78 24.923 -34.299 -8.710 1.00 14.10 H new ATOM 0 HD3 LYS A 78 24.713 -32.731 -7.956 1.00 14.10 H new ATOM 0 HE2 LYS A 78 26.874 -32.703 -7.070 1.00 3.23 H new ATOM 0 HE3 LYS A 78 27.002 -34.450 -7.033 1.00 3.23 H new ATOM 0 HZ1 LYS A 78 28.384 -33.507 -8.765 1.00 53.10 H new ATOM 0 HZ2 LYS A 78 27.162 -34.462 -9.455 1.00 53.10 H new ATOM 0 HZ3 LYS A 78 27.038 -32.769 -9.491 1.00 53.10 H new ATOM 1248 N ASP A 79 20.001 -32.927 -7.036 1.00 53.42 N ATOM 1249 CA ASP A 79 18.611 -32.912 -6.595 1.00 52.31 C ATOM 1250 C ASP A 79 17.730 -33.716 -7.546 1.00 40.24 C ATOM 1251 O ASP A 79 16.669 -34.207 -7.161 1.00 35.42 O ATOM 1252 CB ASP A 79 18.099 -31.474 -6.499 1.00 42.53 C ATOM 1253 CG ASP A 79 19.012 -30.588 -5.674 1.00 31.12 C ATOM 1254 OD1 ASP A 79 18.922 -30.640 -4.429 1.00 41.51 O ATOM 1255 OD2 ASP A 79 19.817 -29.844 -6.272 1.00 74.55 O ATOM 0 H ASP A 79 20.364 -32.016 -7.318 1.00 53.42 H new ATOM 0 HA ASP A 79 18.564 -33.373 -5.608 1.00 52.31 H new ATOM 0 HB2 ASP A 79 18.003 -31.058 -7.502 1.00 42.53 H new ATOM 0 HB3 ASP A 79 17.102 -31.475 -6.057 1.00 42.53 H new ATOM 1260 N LEU A 80 18.176 -33.845 -8.791 1.00 5.11 N ATOM 1261 CA LEU A 80 17.429 -34.589 -9.799 1.00 14.43 C ATOM 1262 C LEU A 80 18.096 -35.928 -10.094 1.00 1.01 C ATOM 1263 O LEU A 80 17.511 -36.795 -10.742 1.00 14.10 O ATOM 1264 CB LEU A 80 17.314 -33.769 -11.085 1.00 54.30 C ATOM 1265 CG LEU A 80 18.472 -32.815 -11.379 1.00 1.02 C ATOM 1266 CD1 LEU A 80 19.772 -33.588 -11.543 1.00 15.03 C ATOM 1267 CD2 LEU A 80 18.180 -31.989 -12.623 1.00 44.21 C ATOM 0 H LEU A 80 19.052 -33.444 -9.127 1.00 5.11 H new ATOM 0 HA LEU A 80 16.430 -34.781 -9.407 1.00 14.43 H new ATOM 0 HB2 LEU A 80 17.215 -34.458 -11.924 1.00 54.30 H new ATOM 0 HB3 LEU A 80 16.393 -33.188 -11.040 1.00 54.30 H new ATOM 0 HG LEU A 80 18.581 -32.136 -10.534 1.00 1.02 H new ATOM 0 HD11 LEU A 80 20.585 -32.893 -11.752 1.00 15.03 H new ATOM 0 HD12 LEU A 80 19.989 -34.135 -10.625 1.00 15.03 H new ATOM 0 HD13 LEU A 80 19.675 -34.292 -12.370 1.00 15.03 H new ATOM 0 HD21 LEU A 80 19.015 -31.316 -12.817 1.00 44.21 H new ATOM 0 HD22 LEU A 80 18.043 -32.653 -13.477 1.00 44.21 H new ATOM 0 HD23 LEU A 80 17.272 -31.406 -12.468 1.00 44.21 H new ATOM 1279 N ALA A 81 19.324 -36.090 -9.612 1.00 31.31 N ATOM 1280 CA ALA A 81 20.069 -37.325 -9.820 1.00 62.53 C ATOM 1281 C ALA A 81 19.380 -38.504 -9.141 1.00 2.25 C ATOM 1282 O ALA A 81 19.447 -39.634 -9.621 1.00 73.45 O ATOM 1283 CB ALA A 81 21.493 -37.176 -9.306 1.00 2.23 C ATOM 0 H ALA A 81 19.824 -35.381 -9.075 1.00 31.31 H new ATOM 0 HA ALA A 81 20.100 -37.524 -10.891 1.00 62.53 H new ATOM 0 HB1 ALA A 81 22.038 -38.106 -9.468 1.00 2.23 H new ATOM 0 HB2 ALA A 81 21.990 -36.367 -9.841 1.00 2.23 H new ATOM 0 HB3 ALA A 81 21.473 -36.948 -8.240 1.00 2.23 H new ATOM 1289 N GLU A 82 18.720 -38.231 -8.020 1.00 13.15 N ATOM 1290 CA GLU A 82 18.020 -39.270 -7.274 1.00 20.34 C ATOM 1291 C GLU A 82 16.587 -39.429 -7.775 1.00 4.23 C ATOM 1292 O GLU A 82 16.027 -40.525 -7.751 1.00 70.42 O ATOM 1293 CB GLU A 82 18.016 -38.942 -5.779 1.00 51.32 C ATOM 1294 CG GLU A 82 19.398 -38.661 -5.214 1.00 50.40 C ATOM 1295 CD GLU A 82 19.402 -38.571 -3.700 1.00 61.33 C ATOM 1296 OE1 GLU A 82 18.508 -39.171 -3.068 1.00 1.25 O ATOM 1297 OE2 GLU A 82 20.300 -37.901 -3.149 1.00 24.44 O ATOM 0 H GLU A 82 18.655 -37.300 -7.609 1.00 13.15 H new ATOM 0 HA GLU A 82 18.548 -40.211 -7.431 1.00 20.34 H new ATOM 0 HB2 GLU A 82 17.379 -38.074 -5.608 1.00 51.32 H new ATOM 0 HB3 GLU A 82 17.572 -39.775 -5.234 1.00 51.32 H new ATOM 0 HG2 GLU A 82 20.082 -39.449 -5.529 1.00 50.40 H new ATOM 0 HG3 GLU A 82 19.774 -37.727 -5.631 1.00 50.40 H new ATOM 1304 N LEU A 83 16.000 -38.327 -8.227 1.00 40.51 N ATOM 1305 CA LEU A 83 14.632 -38.341 -8.734 1.00 21.31 C ATOM 1306 C LEU A 83 14.533 -39.173 -10.009 1.00 13.32 C ATOM 1307 O LEU A 83 13.711 -40.085 -10.104 1.00 53.42 O ATOM 1308 CB LEU A 83 14.152 -36.914 -9.003 1.00 74.32 C ATOM 1309 CG LEU A 83 12.973 -36.774 -9.967 1.00 52.30 C ATOM 1310 CD1 LEU A 83 11.793 -37.608 -9.493 1.00 0.24 C ATOM 1311 CD2 LEU A 83 12.572 -35.313 -10.110 1.00 2.40 C ATOM 0 H LEU A 83 16.450 -37.412 -8.253 1.00 40.51 H new ATOM 0 HA LEU A 83 13.994 -38.795 -7.976 1.00 21.31 H new ATOM 0 HB2 LEU A 83 13.874 -36.460 -8.052 1.00 74.32 H new ATOM 0 HB3 LEU A 83 14.989 -36.339 -9.398 1.00 74.32 H new ATOM 0 HG LEU A 83 13.283 -37.143 -10.945 1.00 52.30 H new ATOM 0 HD11 LEU A 83 10.964 -37.495 -10.192 1.00 0.24 H new ATOM 0 HD12 LEU A 83 12.086 -38.657 -9.443 1.00 0.24 H new ATOM 0 HD13 LEU A 83 11.483 -37.270 -8.504 1.00 0.24 H new ATOM 0 HD21 LEU A 83 11.732 -35.232 -10.800 1.00 2.40 H new ATOM 0 HD22 LEU A 83 12.282 -34.918 -9.136 1.00 2.40 H new ATOM 0 HD23 LEU A 83 13.415 -34.740 -10.497 1.00 2.40 H new ATOM 1323 N ILE A 84 15.376 -38.853 -10.985 1.00 21.24 N ATOM 1324 CA ILE A 84 15.385 -39.573 -12.252 1.00 41.10 C ATOM 1325 C ILE A 84 15.734 -41.043 -12.047 1.00 32.11 C ATOM 1326 O ILE A 84 15.118 -41.926 -12.642 1.00 64.34 O ATOM 1327 CB ILE A 84 16.387 -38.953 -13.244 1.00 54.03 C ATOM 1328 CG1 ILE A 84 16.029 -37.490 -13.517 1.00 22.44 C ATOM 1329 CG2 ILE A 84 16.409 -39.749 -14.541 1.00 11.41 C ATOM 1330 CD1 ILE A 84 17.229 -36.623 -13.828 1.00 72.10 C ATOM 0 H ILE A 84 16.061 -38.100 -10.922 1.00 21.24 H new ATOM 0 HA ILE A 84 14.380 -39.495 -12.666 1.00 41.10 H new ATOM 0 HB ILE A 84 17.383 -38.988 -12.802 1.00 54.03 H new ATOM 0 HG12 ILE A 84 15.332 -37.445 -14.353 1.00 22.44 H new ATOM 0 HG13 ILE A 84 15.512 -37.083 -12.648 1.00 22.44 H new ATOM 0 HG21 ILE A 84 17.122 -39.299 -15.232 1.00 11.41 H new ATOM 0 HG22 ILE A 84 16.706 -40.777 -14.332 1.00 11.41 H new ATOM 0 HG23 ILE A 84 15.415 -39.742 -14.989 1.00 11.41 H new ATOM 0 HD11 ILE A 84 16.901 -35.600 -14.011 1.00 72.10 H new ATOM 0 HD12 ILE A 84 17.917 -36.638 -12.983 1.00 72.10 H new ATOM 0 HD13 ILE A 84 17.734 -37.006 -14.715 1.00 72.10 H new ATOM 1342 N ASN A 85 16.725 -41.298 -11.198 1.00 55.23 N ATOM 1343 CA ASN A 85 17.155 -42.662 -10.913 1.00 12.20 C ATOM 1344 C ASN A 85 16.019 -43.473 -10.296 1.00 2.41 C ATOM 1345 O ASN A 85 15.943 -44.689 -10.471 1.00 3.12 O ATOM 1346 CB ASN A 85 18.360 -42.652 -9.970 1.00 41.15 C ATOM 1347 CG ASN A 85 19.669 -42.446 -10.708 1.00 0.00 C ATOM 1348 OD1 ASN A 85 19.684 -41.493 -11.632 1.00 43.13 O flip ATOM 1349 ND2 ASN A 85 20.655 -43.136 -10.449 1.00 55.43 N flip ATOM 0 H ASN A 85 17.245 -40.578 -10.696 1.00 55.23 H new ATOM 0 HA ASN A 85 17.442 -43.130 -11.854 1.00 12.20 H new ATOM 0 HB2 ASN A 85 18.234 -41.860 -9.232 1.00 41.15 H new ATOM 0 HB3 ASN A 85 18.398 -43.594 -9.424 1.00 41.15 H new ATOM 0 HD21 ASN A 85 20.598 -43.858 -9.730 1.00 55.43 H new ATOM 0 HD22 ASN A 85 21.529 -42.986 -10.953 1.00 55.43 H new ATOM 1356 N LYS A 86 15.137 -42.790 -9.573 1.00 62.34 N ATOM 1357 CA LYS A 86 14.004 -43.445 -8.931 1.00 54.21 C ATOM 1358 C LYS A 86 12.919 -43.779 -9.950 1.00 63.15 C ATOM 1359 O LYS A 86 12.115 -44.686 -9.739 1.00 73.05 O ATOM 1360 CB LYS A 86 13.427 -42.549 -7.832 1.00 72.33 C ATOM 1361 CG LYS A 86 12.657 -43.312 -6.768 1.00 54.22 C ATOM 1362 CD LYS A 86 13.592 -43.992 -5.783 1.00 31.32 C ATOM 1363 CE LYS A 86 12.992 -45.282 -5.244 1.00 54.20 C ATOM 1364 NZ LYS A 86 13.984 -46.072 -4.463 1.00 52.34 N ATOM 0 H LYS A 86 15.186 -41.783 -9.417 1.00 62.34 H new ATOM 0 HA LYS A 86 14.358 -44.375 -8.486 1.00 54.21 H new ATOM 0 HB2 LYS A 86 14.241 -42.001 -7.357 1.00 72.33 H new ATOM 0 HB3 LYS A 86 12.767 -41.810 -8.286 1.00 72.33 H new ATOM 0 HG2 LYS A 86 11.999 -42.628 -6.233 1.00 54.22 H new ATOM 0 HG3 LYS A 86 12.022 -44.059 -7.243 1.00 54.22 H new ATOM 0 HD2 LYS A 86 14.542 -44.208 -6.271 1.00 31.32 H new ATOM 0 HD3 LYS A 86 13.805 -43.315 -4.956 1.00 31.32 H new ATOM 0 HE2 LYS A 86 12.136 -45.048 -4.612 1.00 54.20 H new ATOM 0 HE3 LYS A 86 12.621 -45.884 -6.073 1.00 54.20 H new ATOM 0 HZ1 LYS A 86 13.536 -46.943 -4.113 1.00 52.34 H new ATOM 0 HZ2 LYS A 86 14.790 -46.318 -5.073 1.00 52.34 H new ATOM 0 HZ3 LYS A 86 14.320 -45.508 -3.657 1.00 52.34 H new ATOM 1378 N MET A 87 12.905 -43.042 -11.056 1.00 43.21 N ATOM 1379 CA MET A 87 11.921 -43.263 -12.109 1.00 50.12 C ATOM 1380 C MET A 87 12.221 -44.549 -12.872 1.00 71.13 C ATOM 1381 O MET A 87 11.379 -45.444 -12.954 1.00 24.13 O ATOM 1382 CB MET A 87 11.900 -42.076 -13.075 1.00 23.33 C ATOM 1383 CG MET A 87 11.276 -42.400 -14.422 1.00 74.01 C ATOM 1384 SD MET A 87 9.616 -43.089 -14.271 1.00 24.41 S ATOM 1385 CE MET A 87 8.705 -41.656 -13.703 1.00 53.02 C ATOM 0 H MET A 87 13.564 -42.287 -11.246 1.00 43.21 H new ATOM 0 HA MET A 87 10.941 -43.359 -11.642 1.00 50.12 H new ATOM 0 HB2 MET A 87 11.349 -41.255 -12.617 1.00 23.33 H new ATOM 0 HB3 MET A 87 12.921 -41.727 -13.231 1.00 23.33 H new ATOM 0 HG2 MET A 87 11.235 -41.494 -15.027 1.00 74.01 H new ATOM 0 HG3 MET A 87 11.913 -43.109 -14.952 1.00 74.01 H new ATOM 0 HE1 MET A 87 7.761 -41.976 -13.263 1.00 53.02 H new ATOM 0 HE2 MET A 87 9.293 -41.125 -12.954 1.00 53.02 H new ATOM 0 HE3 MET A 87 8.506 -40.994 -14.546 1.00 53.02 H new ATOM 1395 N ARG A 88 13.424 -44.634 -13.430 1.00 22.21 N ATOM 1396 CA ARG A 88 13.834 -45.811 -14.188 1.00 13.54 C ATOM 1397 C ARG A 88 13.807 -47.059 -13.310 1.00 54.25 C ATOM 1398 O ARG A 88 13.782 -48.183 -13.813 1.00 23.32 O ATOM 1399 CB ARG A 88 15.237 -45.609 -14.764 1.00 35.52 C ATOM 1400 CG ARG A 88 16.265 -45.184 -13.729 1.00 30.45 C ATOM 1401 CD ARG A 88 17.664 -45.132 -14.322 1.00 21.40 C ATOM 1402 NE ARG A 88 17.692 -44.420 -15.596 1.00 50.15 N ATOM 1403 CZ ARG A 88 18.743 -44.407 -16.408 1.00 62.14 C ATOM 1404 NH1 ARG A 88 19.847 -45.065 -16.080 1.00 75.13 N ATOM 1405 NH2 ARG A 88 18.692 -43.735 -17.552 1.00 31.53 N ATOM 0 H ARG A 88 14.132 -43.902 -13.372 1.00 22.21 H new ATOM 0 HA ARG A 88 13.129 -45.949 -15.008 1.00 13.54 H new ATOM 0 HB2 ARG A 88 15.566 -46.538 -15.231 1.00 35.52 H new ATOM 0 HB3 ARG A 88 15.193 -44.855 -15.550 1.00 35.52 H new ATOM 0 HG2 ARG A 88 16.000 -44.204 -13.333 1.00 30.45 H new ATOM 0 HG3 ARG A 88 16.249 -45.881 -12.891 1.00 30.45 H new ATOM 0 HD2 ARG A 88 18.338 -44.643 -13.619 1.00 21.40 H new ATOM 0 HD3 ARG A 88 18.035 -46.147 -14.466 1.00 21.40 H new ATOM 0 HE ARG A 88 16.859 -43.904 -15.878 1.00 50.15 H new ATOM 0 HH11 ARG A 88 19.890 -45.583 -15.202 1.00 75.13 H new ATOM 0 HH12 ARG A 88 20.653 -45.053 -16.706 1.00 75.13 H new ATOM 0 HH21 ARG A 88 17.845 -43.228 -17.808 1.00 31.53 H new ATOM 0 HH22 ARG A 88 19.500 -43.726 -18.175 1.00 31.53 H new ATOM 1419 N LEU A 89 13.811 -46.853 -11.998 1.00 64.41 N ATOM 1420 CA LEU A 89 13.788 -47.962 -11.050 1.00 52.00 C ATOM 1421 C LEU A 89 12.372 -48.213 -10.541 1.00 70.55 C ATOM 1422 O LEU A 89 12.060 -49.301 -10.057 1.00 11.21 O ATOM 1423 CB LEU A 89 14.721 -47.672 -9.873 1.00 32.20 C ATOM 1424 CG LEU A 89 14.513 -48.530 -8.625 1.00 33.15 C ATOM 1425 CD1 LEU A 89 14.890 -49.977 -8.902 1.00 74.12 C ATOM 1426 CD2 LEU A 89 15.322 -47.981 -7.459 1.00 11.42 C ATOM 0 H LEU A 89 13.830 -45.929 -11.566 1.00 64.41 H new ATOM 0 HA LEU A 89 14.133 -48.857 -11.567 1.00 52.00 H new ATOM 0 HB2 LEU A 89 15.750 -47.800 -10.210 1.00 32.20 H new ATOM 0 HB3 LEU A 89 14.606 -46.625 -9.593 1.00 32.20 H new ATOM 0 HG LEU A 89 13.457 -48.496 -8.357 1.00 33.15 H new ATOM 0 HD11 LEU A 89 14.735 -50.572 -8.002 1.00 74.12 H new ATOM 0 HD12 LEU A 89 14.267 -50.368 -9.707 1.00 74.12 H new ATOM 0 HD13 LEU A 89 15.938 -50.030 -9.196 1.00 74.12 H new ATOM 0 HD21 LEU A 89 15.162 -48.604 -6.579 1.00 11.42 H new ATOM 0 HD22 LEU A 89 16.381 -47.984 -7.718 1.00 11.42 H new ATOM 0 HD23 LEU A 89 15.004 -46.961 -7.244 1.00 11.42 H new ATOM 1438 N ALA A 90 11.519 -47.201 -10.657 1.00 74.34 N ATOM 1439 CA ALA A 90 10.135 -47.314 -10.213 1.00 72.14 C ATOM 1440 C ALA A 90 9.308 -48.136 -11.197 1.00 1.24 C ATOM 1441 O ALA A 90 8.717 -49.150 -10.827 1.00 54.23 O ATOM 1442 CB ALA A 90 9.524 -45.932 -10.033 1.00 61.23 C ATOM 0 H ALA A 90 11.762 -46.294 -11.055 1.00 74.34 H new ATOM 0 HA ALA A 90 10.128 -47.830 -9.253 1.00 72.14 H new ATOM 0 HB1 ALA A 90 8.490 -46.032 -9.701 1.00 61.23 H new ATOM 0 HB2 ALA A 90 10.093 -45.377 -9.287 1.00 61.23 H new ATOM 0 HB3 ALA A 90 9.551 -45.396 -10.982 1.00 61.23 H new ATOM 1448 N GLN A 91 9.272 -47.691 -12.448 1.00 54.15 N ATOM 1449 CA GLN A 91 8.516 -48.386 -13.484 1.00 15.42 C ATOM 1450 C GLN A 91 9.283 -49.600 -13.996 1.00 34.33 C ATOM 1451 O GLN A 91 8.793 -50.341 -14.848 1.00 51.51 O ATOM 1452 CB GLN A 91 8.207 -47.437 -14.643 1.00 41.42 C ATOM 1453 CG GLN A 91 9.394 -47.190 -15.560 1.00 25.01 C ATOM 1454 CD GLN A 91 9.054 -46.281 -16.724 1.00 50.21 C ATOM 1455 OE1 GLN A 91 8.359 -45.186 -16.437 1.00 42.02 O flip ATOM 1456 NE2 GLN A 91 9.411 -46.559 -17.869 1.00 62.12 N flip ATOM 0 H GLN A 91 9.757 -46.853 -12.769 1.00 54.15 H new ATOM 0 HA GLN A 91 7.579 -48.730 -13.046 1.00 15.42 H new ATOM 0 HB2 GLN A 91 7.385 -47.848 -15.229 1.00 41.42 H new ATOM 0 HB3 GLN A 91 7.865 -46.484 -14.240 1.00 41.42 H new ATOM 0 HG2 GLN A 91 10.207 -46.748 -14.984 1.00 25.01 H new ATOM 0 HG3 GLN A 91 9.757 -48.144 -15.943 1.00 25.01 H new ATOM 0 HE21 GLN A 91 9.944 -47.411 -18.044 1.00 62.12 H new ATOM 0 HE22 GLN A 91 9.174 -45.937 -18.642 1.00 62.12 H new ATOM 1465 N GLN A 92 10.487 -49.798 -13.470 1.00 2.11 N ATOM 1466 CA GLN A 92 11.322 -50.923 -13.875 1.00 51.43 C ATOM 1467 C GLN A 92 10.544 -52.232 -13.801 1.00 22.44 C ATOM 1468 O GLN A 92 9.588 -52.355 -13.036 1.00 62.02 O ATOM 1469 CB GLN A 92 12.568 -51.005 -12.992 1.00 1.41 C ATOM 1470 CG GLN A 92 13.734 -51.723 -13.651 1.00 24.44 C ATOM 1471 CD GLN A 92 14.846 -50.778 -14.061 1.00 51.21 C ATOM 1472 OE1 GLN A 92 15.512 -50.185 -13.078 1.00 71.14 O flip ATOM 1473 NE2 GLN A 92 15.103 -50.582 -15.249 1.00 5.34 N flip ATOM 0 H GLN A 92 10.906 -49.194 -12.763 1.00 2.11 H new ATOM 0 HA GLN A 92 11.629 -50.762 -14.908 1.00 51.43 H new ATOM 0 HB2 GLN A 92 12.879 -49.996 -12.722 1.00 1.41 H new ATOM 0 HB3 GLN A 92 12.313 -51.518 -12.065 1.00 1.41 H new ATOM 0 HG2 GLN A 92 14.132 -52.469 -12.963 1.00 24.44 H new ATOM 0 HG3 GLN A 92 13.376 -52.259 -14.530 1.00 24.44 H new ATOM 0 HE21 GLN A 92 14.565 -51.059 -15.973 1.00 5.34 H new ATOM 0 HE22 GLN A 92 15.854 -49.942 -15.510 1.00 5.34 H new ATOM 1482 N ASN A 93 10.961 -53.209 -14.600 1.00 40.23 N ATOM 1483 CA ASN A 93 10.303 -54.510 -14.625 1.00 55.13 C ATOM 1484 C ASN A 93 10.652 -55.321 -13.381 1.00 42.41 C ATOM 1485 O ASN A 93 11.552 -56.159 -13.407 1.00 64.21 O ATOM 1486 CB ASN A 93 10.705 -55.284 -15.882 1.00 71.31 C ATOM 1487 CG ASN A 93 9.909 -54.861 -17.101 1.00 74.45 C ATOM 1488 OD1 ASN A 93 9.043 -55.596 -17.576 1.00 75.14 O ATOM 1489 ND2 ASN A 93 10.200 -53.672 -17.614 1.00 54.44 N ATOM 0 H ASN A 93 11.752 -53.124 -15.239 1.00 40.23 H new ATOM 0 HA ASN A 93 9.226 -54.344 -14.638 1.00 55.13 H new ATOM 0 HB2 ASN A 93 11.767 -55.132 -16.075 1.00 71.31 H new ATOM 0 HB3 ASN A 93 10.561 -56.351 -15.710 1.00 71.31 H new ATOM 0 HD21 ASN A 93 9.698 -53.334 -18.435 1.00 54.44 H new ATOM 0 HD22 ASN A 93 10.926 -53.096 -17.187 1.00 54.44 H new ATOM 1496 N ALA A 94 9.933 -55.064 -12.293 1.00 62.32 N ATOM 1497 CA ALA A 94 10.165 -55.772 -11.040 1.00 3.40 C ATOM 1498 C ALA A 94 9.135 -56.877 -10.835 1.00 23.32 C ATOM 1499 O ALA A 94 8.152 -56.968 -11.570 1.00 41.01 O ATOM 1500 CB ALA A 94 10.137 -54.798 -9.871 1.00 50.23 C ATOM 0 H ALA A 94 9.185 -54.371 -12.254 1.00 62.32 H new ATOM 0 HA ALA A 94 11.151 -56.235 -11.090 1.00 3.40 H new ATOM 0 HB1 ALA A 94 10.312 -55.340 -8.942 1.00 50.23 H new ATOM 0 HB2 ALA A 94 10.915 -54.047 -10.005 1.00 50.23 H new ATOM 0 HB3 ALA A 94 9.164 -54.309 -9.828 1.00 50.23 H new ATOM 1506 N VAL A 95 9.368 -57.717 -9.831 1.00 74.20 N ATOM 1507 CA VAL A 95 8.459 -58.817 -9.529 1.00 25.11 C ATOM 1508 C VAL A 95 8.073 -58.821 -8.054 1.00 74.23 C ATOM 1509 O VAL A 95 7.819 -59.875 -7.470 1.00 22.13 O ATOM 1510 CB VAL A 95 9.087 -60.177 -9.887 1.00 73.45 C ATOM 1511 CG1 VAL A 95 9.407 -60.243 -11.373 1.00 40.10 C ATOM 1512 CG2 VAL A 95 10.334 -60.425 -9.053 1.00 44.22 C ATOM 0 H VAL A 95 10.178 -57.657 -9.214 1.00 74.20 H new ATOM 0 HA VAL A 95 7.566 -58.666 -10.135 1.00 25.11 H new ATOM 0 HB VAL A 95 8.365 -60.961 -9.660 1.00 73.45 H new ATOM 0 HG11 VAL A 95 9.850 -61.211 -11.607 1.00 40.10 H new ATOM 0 HG12 VAL A 95 8.490 -60.115 -11.949 1.00 40.10 H new ATOM 0 HG13 VAL A 95 10.110 -59.451 -11.629 1.00 40.10 H new ATOM 0 HG21 VAL A 95 10.764 -61.390 -9.320 1.00 44.22 H new ATOM 0 HG22 VAL A 95 11.063 -59.638 -9.245 1.00 44.22 H new ATOM 0 HG23 VAL A 95 10.070 -60.425 -7.995 1.00 44.22 H new ATOM 1522 N THR A 96 8.028 -57.635 -7.456 1.00 41.54 N ATOM 1523 CA THR A 96 7.673 -57.500 -6.049 1.00 73.44 C ATOM 1524 C THR A 96 6.972 -56.173 -5.783 1.00 71.05 C ATOM 1525 O THR A 96 6.925 -55.300 -6.650 1.00 70.43 O ATOM 1526 CB THR A 96 8.915 -57.603 -5.144 1.00 54.30 C ATOM 1527 OG1 THR A 96 8.516 -57.650 -3.769 1.00 62.35 O ATOM 1528 CG2 THR A 96 9.846 -56.420 -5.367 1.00 34.32 C ATOM 0 H THR A 96 8.233 -56.753 -7.925 1.00 41.54 H new ATOM 0 HA THR A 96 6.993 -58.319 -5.815 1.00 73.44 H new ATOM 0 HB THR A 96 9.449 -58.519 -5.399 1.00 54.30 H new ATOM 0 HG1 THR A 96 9.311 -57.717 -3.200 1.00 62.35 H new ATOM 0 HG21 THR A 96 10.716 -56.514 -4.717 1.00 34.32 H new ATOM 0 HG22 THR A 96 10.170 -56.403 -6.408 1.00 34.32 H new ATOM 0 HG23 THR A 96 9.319 -55.494 -5.136 1.00 34.32 H new ATOM 1536 N SER A 97 6.429 -56.027 -4.579 1.00 53.22 N ATOM 1537 CA SER A 97 5.727 -54.806 -4.200 1.00 42.22 C ATOM 1538 C SER A 97 6.715 -53.681 -3.906 1.00 11.10 C ATOM 1539 O SER A 97 6.926 -53.310 -2.750 1.00 75.04 O ATOM 1540 CB SER A 97 4.845 -55.058 -2.976 1.00 70.41 C ATOM 1541 OG SER A 97 4.213 -56.324 -3.055 1.00 62.42 O ATOM 0 H SER A 97 6.461 -56.739 -3.849 1.00 53.22 H new ATOM 0 HA SER A 97 5.097 -54.504 -5.037 1.00 42.22 H new ATOM 0 HB2 SER A 97 5.450 -55.006 -2.071 1.00 70.41 H new ATOM 0 HB3 SER A 97 4.090 -54.275 -2.900 1.00 70.41 H new ATOM 0 HG SER A 97 3.656 -56.462 -2.260 1.00 62.42 H new ATOM 1547 N LEU A 98 7.318 -53.142 -4.959 1.00 42.54 N ATOM 1548 CA LEU A 98 8.285 -52.058 -4.816 1.00 75.11 C ATOM 1549 C LEU A 98 7.752 -50.769 -5.433 1.00 44.41 C ATOM 1550 O LEU A 98 8.149 -49.671 -5.041 1.00 34.24 O ATOM 1551 CB LEU A 98 9.612 -52.442 -5.473 1.00 54.42 C ATOM 1552 CG LEU A 98 10.808 -51.551 -5.139 1.00 4.33 C ATOM 1553 CD1 LEU A 98 11.210 -51.721 -3.682 1.00 23.40 C ATOM 1554 CD2 LEU A 98 11.980 -51.865 -6.057 1.00 42.45 C ATOM 0 H LEU A 98 7.155 -53.437 -5.922 1.00 42.54 H new ATOM 0 HA LEU A 98 8.450 -51.888 -3.752 1.00 75.11 H new ATOM 0 HB2 LEU A 98 9.855 -53.465 -5.185 1.00 54.42 H new ATOM 0 HB3 LEU A 98 9.473 -52.440 -6.554 1.00 54.42 H new ATOM 0 HG LEU A 98 10.517 -50.512 -5.296 1.00 4.33 H new ATOM 0 HD11 LEU A 98 12.063 -51.079 -3.463 1.00 23.40 H new ATOM 0 HD12 LEU A 98 10.374 -51.446 -3.039 1.00 23.40 H new ATOM 0 HD13 LEU A 98 11.482 -52.761 -3.498 1.00 23.40 H new ATOM 0 HD21 LEU A 98 12.822 -51.221 -5.805 1.00 42.45 H new ATOM 0 HD22 LEU A 98 12.270 -52.908 -5.932 1.00 42.45 H new ATOM 0 HD23 LEU A 98 11.688 -51.691 -7.093 1.00 42.45 H new ATOM 1566 N SER A 99 6.851 -50.909 -6.400 1.00 31.23 N ATOM 1567 CA SER A 99 6.265 -49.756 -7.072 1.00 41.43 C ATOM 1568 C SER A 99 5.704 -48.763 -6.059 1.00 2.23 C ATOM 1569 O SER A 99 5.885 -47.553 -6.194 1.00 60.21 O ATOM 1570 CB SER A 99 5.159 -50.204 -8.030 1.00 23.02 C ATOM 1571 OG SER A 99 4.158 -49.209 -8.154 1.00 71.11 O ATOM 0 H SER A 99 6.511 -51.810 -6.736 1.00 31.23 H new ATOM 0 HA SER A 99 7.051 -49.262 -7.642 1.00 41.43 H new ATOM 0 HB2 SER A 99 5.587 -50.418 -9.009 1.00 23.02 H new ATOM 0 HB3 SER A 99 4.713 -51.130 -7.668 1.00 23.02 H new ATOM 0 HG SER A 99 3.464 -49.519 -8.773 1.00 71.11 H new ATOM 1577 N GLU A 100 5.023 -49.284 -5.044 1.00 34.54 N ATOM 1578 CA GLU A 100 4.434 -48.444 -4.007 1.00 62.13 C ATOM 1579 C GLU A 100 5.518 -47.730 -3.205 1.00 24.41 C ATOM 1580 O GLU A 100 5.369 -46.565 -2.841 1.00 51.50 O ATOM 1581 CB GLU A 100 3.562 -49.284 -3.072 1.00 61.52 C ATOM 1582 CG GLU A 100 2.198 -49.621 -3.651 1.00 21.02 C ATOM 1583 CD GLU A 100 1.361 -50.472 -2.715 1.00 65.24 C ATOM 1584 OE1 GLU A 100 1.937 -51.074 -1.785 1.00 43.12 O ATOM 1585 OE2 GLU A 100 0.130 -50.536 -2.914 1.00 41.02 O ATOM 0 H GLU A 100 4.865 -50.284 -4.917 1.00 34.54 H new ATOM 0 HA GLU A 100 3.812 -47.693 -4.494 1.00 62.13 H new ATOM 0 HB2 GLU A 100 4.086 -50.210 -2.835 1.00 61.52 H new ATOM 0 HB3 GLU A 100 3.426 -48.746 -2.134 1.00 61.52 H new ATOM 0 HG2 GLU A 100 1.663 -48.697 -3.872 1.00 21.02 H new ATOM 0 HG3 GLU A 100 2.329 -50.148 -4.596 1.00 21.02 H new ATOM 1592 N GLU A 101 6.609 -48.440 -2.933 1.00 21.21 N ATOM 1593 CA GLU A 101 7.717 -47.875 -2.172 1.00 45.04 C ATOM 1594 C GLU A 101 8.413 -46.771 -2.963 1.00 52.34 C ATOM 1595 O GLU A 101 8.622 -45.668 -2.458 1.00 64.41 O ATOM 1596 CB GLU A 101 8.725 -48.968 -1.808 1.00 14.33 C ATOM 1597 CG GLU A 101 9.955 -48.445 -1.086 1.00 42.11 C ATOM 1598 CD GLU A 101 11.030 -49.502 -0.925 1.00 30.45 C ATOM 1599 OE1 GLU A 101 10.802 -50.468 -0.166 1.00 72.21 O ATOM 1600 OE2 GLU A 101 12.099 -49.364 -1.556 1.00 35.44 O ATOM 0 H GLU A 101 6.749 -49.406 -3.228 1.00 21.21 H new ATOM 0 HA GLU A 101 7.312 -47.444 -1.256 1.00 45.04 H new ATOM 0 HB2 GLU A 101 8.233 -49.710 -1.179 1.00 14.33 H new ATOM 0 HB3 GLU A 101 9.038 -49.479 -2.718 1.00 14.33 H new ATOM 0 HG2 GLU A 101 10.363 -47.598 -1.638 1.00 42.11 H new ATOM 0 HG3 GLU A 101 9.665 -48.075 -0.103 1.00 42.11 H new ATOM 1607 N ALA A 102 8.768 -47.076 -4.207 1.00 45.11 N ATOM 1608 CA ALA A 102 9.439 -46.110 -5.069 1.00 34.02 C ATOM 1609 C ALA A 102 8.494 -44.980 -5.465 1.00 64.23 C ATOM 1610 O ALA A 102 8.933 -43.881 -5.805 1.00 73.15 O ATOM 1611 CB ALA A 102 9.988 -46.801 -6.308 1.00 42.32 C ATOM 0 H ALA A 102 8.602 -47.984 -4.640 1.00 45.11 H new ATOM 0 HA ALA A 102 10.269 -45.676 -4.511 1.00 34.02 H new ATOM 0 HB1 ALA A 102 10.486 -46.068 -6.943 1.00 42.32 H new ATOM 0 HB2 ALA A 102 10.702 -47.569 -6.010 1.00 42.32 H new ATOM 0 HB3 ALA A 102 9.169 -47.262 -6.860 1.00 42.32 H new ATOM 1617 N LYS A 103 7.196 -45.257 -5.420 1.00 72.42 N ATOM 1618 CA LYS A 103 6.188 -44.265 -5.774 1.00 42.41 C ATOM 1619 C LYS A 103 6.318 -43.022 -4.899 1.00 35.33 C ATOM 1620 O LYS A 103 6.339 -41.898 -5.400 1.00 14.13 O ATOM 1621 CB LYS A 103 4.785 -44.859 -5.631 1.00 41.51 C ATOM 1622 CG LYS A 103 3.673 -43.834 -5.776 1.00 3.25 C ATOM 1623 CD LYS A 103 2.949 -43.608 -4.459 1.00 52.31 C ATOM 1624 CE LYS A 103 2.469 -42.170 -4.327 1.00 30.53 C ATOM 1625 NZ LYS A 103 1.461 -42.020 -3.241 1.00 30.11 N ATOM 0 H LYS A 103 6.817 -46.162 -5.141 1.00 72.42 H new ATOM 0 HA LYS A 103 6.348 -43.975 -6.813 1.00 42.41 H new ATOM 0 HB2 LYS A 103 4.651 -45.637 -6.382 1.00 41.51 H new ATOM 0 HB3 LYS A 103 4.700 -45.339 -4.656 1.00 41.51 H new ATOM 0 HG2 LYS A 103 4.090 -42.891 -6.130 1.00 3.25 H new ATOM 0 HG3 LYS A 103 2.962 -44.171 -6.530 1.00 3.25 H new ATOM 0 HD2 LYS A 103 2.097 -44.285 -4.390 1.00 52.31 H new ATOM 0 HD3 LYS A 103 3.615 -43.848 -3.630 1.00 52.31 H new ATOM 0 HE2 LYS A 103 3.320 -41.520 -4.125 1.00 30.53 H new ATOM 0 HE3 LYS A 103 2.036 -41.843 -5.272 1.00 30.53 H new ATOM 0 HZ1 LYS A 103 1.159 -41.027 -3.183 1.00 30.11 H new ATOM 0 HZ2 LYS A 103 0.637 -42.621 -3.446 1.00 30.11 H new ATOM 0 HZ3 LYS A 103 1.882 -42.308 -2.335 1.00 30.11 H new ATOM 1639 N ARG A 104 6.405 -43.233 -3.589 1.00 62.04 N ATOM 1640 CA ARG A 104 6.533 -42.130 -2.645 1.00 11.22 C ATOM 1641 C ARG A 104 7.963 -41.598 -2.621 1.00 12.44 C ATOM 1642 O ARG A 104 8.184 -40.390 -2.540 1.00 54.32 O ATOM 1643 CB ARG A 104 6.121 -42.581 -1.242 1.00 64.12 C ATOM 1644 CG ARG A 104 6.969 -43.718 -0.695 1.00 41.10 C ATOM 1645 CD ARG A 104 6.471 -44.179 0.666 1.00 43.21 C ATOM 1646 NE ARG A 104 6.810 -43.229 1.723 1.00 71.42 N ATOM 1647 CZ ARG A 104 6.628 -43.473 3.016 1.00 74.42 C ATOM 1648 NH1 ARG A 104 6.113 -44.630 3.410 1.00 62.25 N ATOM 1649 NH2 ARG A 104 6.961 -42.559 3.918 1.00 32.21 N ATOM 0 H ARG A 104 6.389 -44.157 -3.158 1.00 62.04 H new ATOM 0 HA ARG A 104 5.871 -41.328 -2.970 1.00 11.22 H new ATOM 0 HB2 ARG A 104 6.186 -41.731 -0.563 1.00 64.12 H new ATOM 0 HB3 ARG A 104 5.077 -42.894 -1.262 1.00 64.12 H new ATOM 0 HG2 ARG A 104 6.951 -44.555 -1.393 1.00 41.10 H new ATOM 0 HG3 ARG A 104 8.006 -43.393 -0.613 1.00 41.10 H new ATOM 0 HD2 ARG A 104 5.390 -44.311 0.631 1.00 43.21 H new ATOM 0 HD3 ARG A 104 6.904 -45.152 0.900 1.00 43.21 H new ATOM 0 HE ARG A 104 7.208 -42.329 1.453 1.00 71.42 H new ATOM 0 HH11 ARG A 104 5.856 -45.335 2.719 1.00 62.25 H new ATOM 0 HH12 ARG A 104 5.974 -44.815 4.404 1.00 62.25 H new ATOM 0 HH21 ARG A 104 7.357 -41.668 3.619 1.00 32.21 H new ATOM 0 HH22 ARG A 104 6.821 -42.747 4.911 1.00 32.21 H new ATOM 1663 N GLN A 105 8.929 -42.508 -2.690 1.00 53.10 N ATOM 1664 CA GLN A 105 10.337 -42.129 -2.675 1.00 32.53 C ATOM 1665 C GLN A 105 10.684 -41.274 -3.889 1.00 12.14 C ATOM 1666 O GLN A 105 11.616 -40.471 -3.848 1.00 73.11 O ATOM 1667 CB GLN A 105 11.222 -43.377 -2.645 1.00 54.14 C ATOM 1668 CG GLN A 105 11.339 -44.007 -1.267 1.00 22.10 C ATOM 1669 CD GLN A 105 11.792 -43.019 -0.210 1.00 70.02 C ATOM 1670 OE1 GLN A 105 12.960 -42.633 -0.164 1.00 64.25 O ATOM 1671 NE2 GLN A 105 10.867 -42.603 0.647 1.00 71.30 N ATOM 0 H GLN A 105 8.763 -43.512 -2.757 1.00 53.10 H new ATOM 0 HA GLN A 105 10.519 -41.541 -1.776 1.00 32.53 H new ATOM 0 HB2 GLN A 105 10.819 -44.114 -3.339 1.00 54.14 H new ATOM 0 HB3 GLN A 105 12.218 -43.114 -3.001 1.00 54.14 H new ATOM 0 HG2 GLN A 105 10.374 -44.424 -0.979 1.00 22.10 H new ATOM 0 HG3 GLN A 105 12.045 -44.837 -1.310 1.00 22.10 H new ATOM 0 HE21 GLN A 105 9.910 -42.949 0.572 1.00 71.30 H new ATOM 0 HE22 GLN A 105 11.113 -41.938 1.380 1.00 71.30 H new ATOM 1680 N MET A 106 9.928 -41.452 -4.967 1.00 41.22 N ATOM 1681 CA MET A 106 10.156 -40.695 -6.193 1.00 11.23 C ATOM 1682 C MET A 106 9.889 -39.209 -5.972 1.00 35.41 C ATOM 1683 O MET A 106 10.783 -38.377 -6.127 1.00 64.32 O ATOM 1684 CB MET A 106 9.264 -41.224 -7.317 1.00 51.25 C ATOM 1685 CG MET A 106 9.540 -40.579 -8.666 1.00 71.11 C ATOM 1686 SD MET A 106 9.332 -41.728 -10.041 1.00 1.45 S ATOM 1687 CE MET A 106 7.808 -42.544 -9.572 1.00 42.12 C ATOM 0 H MET A 106 9.153 -42.113 -5.017 1.00 41.22 H new ATOM 0 HA MET A 106 11.200 -40.820 -6.479 1.00 11.23 H new ATOM 0 HB2 MET A 106 9.403 -42.302 -7.403 1.00 51.25 H new ATOM 0 HB3 MET A 106 8.220 -41.057 -7.050 1.00 51.25 H new ATOM 0 HG2 MET A 106 8.870 -39.730 -8.802 1.00 71.11 H new ATOM 0 HG3 MET A 106 10.557 -40.187 -8.676 1.00 71.11 H new ATOM 0 HE1 MET A 106 7.314 -42.932 -10.463 1.00 42.12 H new ATOM 0 HE2 MET A 106 8.030 -43.367 -8.893 1.00 42.12 H new ATOM 0 HE3 MET A 106 7.151 -41.830 -9.075 1.00 42.12 H new ATOM 1697 N LEU A 107 8.653 -38.883 -5.609 1.00 50.13 N ATOM 1698 CA LEU A 107 8.268 -37.497 -5.367 1.00 53.22 C ATOM 1699 C LEU A 107 9.142 -36.869 -4.287 1.00 24.34 C ATOM 1700 O LEU A 107 9.306 -35.650 -4.235 1.00 11.34 O ATOM 1701 CB LEU A 107 6.796 -37.420 -4.957 1.00 22.14 C ATOM 1702 CG LEU A 107 6.366 -36.142 -4.235 1.00 64.21 C ATOM 1703 CD1 LEU A 107 4.967 -35.731 -4.665 1.00 72.42 C ATOM 1704 CD2 LEU A 107 6.428 -36.335 -2.727 1.00 11.11 C ATOM 0 H LEU A 107 7.901 -39.559 -5.476 1.00 50.13 H new ATOM 0 HA LEU A 107 8.411 -36.940 -6.293 1.00 53.22 H new ATOM 0 HB2 LEU A 107 6.184 -37.531 -5.852 1.00 22.14 H new ATOM 0 HB3 LEU A 107 6.574 -38.270 -4.312 1.00 22.14 H new ATOM 0 HG LEU A 107 7.056 -35.344 -4.507 1.00 64.21 H new ATOM 0 HD11 LEU A 107 4.678 -34.820 -4.141 1.00 72.42 H new ATOM 0 HD12 LEU A 107 4.955 -35.551 -5.740 1.00 72.42 H new ATOM 0 HD13 LEU A 107 4.263 -36.527 -4.423 1.00 72.42 H new ATOM 0 HD21 LEU A 107 6.119 -35.416 -2.230 1.00 11.11 H new ATOM 0 HD22 LEU A 107 5.761 -37.147 -2.436 1.00 11.11 H new ATOM 0 HD23 LEU A 107 7.448 -36.581 -2.433 1.00 11.11 H new ATOM 1716 N THR A 108 9.705 -37.711 -3.425 1.00 63.11 N ATOM 1717 CA THR A 108 10.564 -37.240 -2.346 1.00 44.33 C ATOM 1718 C THR A 108 11.815 -36.563 -2.895 1.00 64.42 C ATOM 1719 O THR A 108 12.426 -35.731 -2.226 1.00 45.32 O ATOM 1720 CB THR A 108 10.985 -38.394 -1.417 1.00 75.44 C ATOM 1721 OG1 THR A 108 9.824 -39.040 -0.882 1.00 53.14 O ATOM 1722 CG2 THR A 108 11.857 -37.884 -0.280 1.00 73.23 C ATOM 0 H THR A 108 9.581 -38.723 -3.454 1.00 63.11 H new ATOM 0 HA THR A 108 9.983 -36.517 -1.774 1.00 44.33 H new ATOM 0 HB THR A 108 11.562 -39.110 -2.002 1.00 75.44 H new ATOM 0 HG1 THR A 108 9.300 -39.429 -1.613 1.00 53.14 H new ATOM 0 HG21 THR A 108 12.141 -38.717 0.362 1.00 73.23 H new ATOM 0 HG22 THR A 108 12.754 -37.419 -0.690 1.00 73.23 H new ATOM 0 HG23 THR A 108 11.302 -37.150 0.303 1.00 73.23 H new ATOM 1730 N ALA A 109 12.191 -36.926 -4.117 1.00 73.24 N ATOM 1731 CA ALA A 109 13.368 -36.352 -4.757 1.00 52.21 C ATOM 1732 C ALA A 109 13.000 -35.123 -5.581 1.00 51.41 C ATOM 1733 O ALA A 109 13.820 -34.225 -5.775 1.00 61.41 O ATOM 1734 CB ALA A 109 14.053 -37.391 -5.632 1.00 54.15 C ATOM 0 H ALA A 109 11.697 -37.615 -4.684 1.00 73.24 H new ATOM 0 HA ALA A 109 14.060 -36.039 -3.975 1.00 52.21 H new ATOM 0 HB1 ALA A 109 14.930 -36.948 -6.104 1.00 54.15 H new ATOM 0 HB2 ALA A 109 14.360 -38.238 -5.019 1.00 54.15 H new ATOM 0 HB3 ALA A 109 13.361 -37.732 -6.402 1.00 54.15 H new ATOM 1740 N SER A 110 11.762 -35.089 -6.064 1.00 42.54 N ATOM 1741 CA SER A 110 11.287 -33.971 -6.872 1.00 3.02 C ATOM 1742 C SER A 110 11.344 -32.667 -6.082 1.00 24.13 C ATOM 1743 O SER A 110 11.868 -31.660 -6.560 1.00 23.32 O ATOM 1744 CB SER A 110 9.857 -34.230 -7.348 1.00 14.11 C ATOM 1745 OG SER A 110 9.664 -35.598 -7.665 1.00 43.51 O ATOM 0 H SER A 110 11.070 -35.822 -5.910 1.00 42.54 H new ATOM 0 HA SER A 110 11.940 -33.879 -7.740 1.00 3.02 H new ATOM 0 HB2 SER A 110 9.152 -33.931 -6.572 1.00 14.11 H new ATOM 0 HB3 SER A 110 9.646 -33.617 -8.224 1.00 14.11 H new ATOM 0 HG SER A 110 9.878 -35.748 -8.610 1.00 43.51 H new ATOM 1751 N HIS A 111 10.801 -32.693 -4.869 1.00 22.22 N ATOM 1752 CA HIS A 111 10.790 -31.514 -4.011 1.00 1.15 C ATOM 1753 C HIS A 111 12.188 -30.913 -3.894 1.00 72.34 C ATOM 1754 O HIS A 111 12.347 -29.696 -3.801 1.00 53.54 O ATOM 1755 CB HIS A 111 10.260 -31.872 -2.622 1.00 74.51 C ATOM 1756 CG HIS A 111 9.680 -30.706 -1.883 1.00 3.04 C ATOM 1757 ND1 HIS A 111 10.149 -29.417 -2.024 1.00 42.03 N ATOM 1758 CD2 HIS A 111 8.663 -30.639 -0.992 1.00 3.01 C ATOM 1759 CE1 HIS A 111 9.447 -28.608 -1.251 1.00 52.15 C ATOM 1760 NE2 HIS A 111 8.538 -29.325 -0.615 1.00 3.54 N ATOM 0 H HIS A 111 10.363 -33.518 -4.458 1.00 22.22 H new ATOM 0 HA HIS A 111 10.131 -30.773 -4.464 1.00 1.15 H new ATOM 0 HB2 HIS A 111 9.497 -32.644 -2.721 1.00 74.51 H new ATOM 0 HB3 HIS A 111 11.071 -32.299 -2.032 1.00 74.51 H new ATOM 0 HD1 HIS A 111 10.918 -29.133 -2.631 1.00 42.03 H new ATOM 0 HD2 HIS A 111 8.062 -31.466 -0.643 1.00 3.01 H new ATOM 0 HE1 HIS A 111 9.592 -27.542 -1.155 1.00 52.15 H new ATOM 1768 N THR A 112 13.200 -31.776 -3.900 1.00 12.42 N ATOM 1769 CA THR A 112 14.584 -31.331 -3.793 1.00 55.21 C ATOM 1770 C THR A 112 14.915 -30.302 -4.868 1.00 71.44 C ATOM 1771 O THR A 112 15.600 -29.313 -4.606 1.00 24.22 O ATOM 1772 CB THR A 112 15.564 -32.513 -3.910 1.00 1.11 C ATOM 1773 OG1 THR A 112 14.962 -33.702 -3.388 1.00 32.53 O ATOM 1774 CG2 THR A 112 16.855 -32.221 -3.160 1.00 63.02 C ATOM 0 H THR A 112 13.087 -32.787 -3.978 1.00 12.42 H new ATOM 0 HA THR A 112 14.694 -30.873 -2.810 1.00 55.21 H new ATOM 0 HB THR A 112 15.799 -32.658 -4.964 1.00 1.11 H new ATOM 0 HG1 THR A 112 15.591 -34.449 -3.468 1.00 32.53 H new ATOM 0 HG21 THR A 112 17.532 -33.070 -3.257 1.00 63.02 H new ATOM 0 HG22 THR A 112 17.326 -31.332 -3.579 1.00 63.02 H new ATOM 0 HG23 THR A 112 16.633 -32.052 -2.106 1.00 63.02 H new ATOM 1782 N LEU A 113 14.424 -30.541 -6.080 1.00 2.24 N ATOM 1783 CA LEU A 113 14.668 -29.634 -7.196 1.00 13.20 C ATOM 1784 C LEU A 113 14.080 -28.254 -6.915 1.00 62.51 C ATOM 1785 O LEU A 113 14.452 -27.269 -7.552 1.00 72.30 O ATOM 1786 CB LEU A 113 14.068 -30.204 -8.482 1.00 75.13 C ATOM 1787 CG LEU A 113 14.857 -31.331 -9.150 1.00 3.44 C ATOM 1788 CD1 LEU A 113 14.410 -32.683 -8.618 1.00 71.55 C ATOM 1789 CD2 LEU A 113 14.698 -31.270 -10.662 1.00 24.12 C ATOM 0 H LEU A 113 13.855 -31.355 -6.314 1.00 2.24 H new ATOM 0 HA LEU A 113 15.746 -29.531 -7.320 1.00 13.20 H new ATOM 0 HB2 LEU A 113 13.066 -30.571 -8.260 1.00 75.13 H new ATOM 0 HB3 LEU A 113 13.957 -29.391 -9.199 1.00 75.13 H new ATOM 0 HG LEU A 113 15.913 -31.201 -8.911 1.00 3.44 H new ATOM 0 HD11 LEU A 113 14.982 -33.473 -9.105 1.00 71.55 H new ATOM 0 HD12 LEU A 113 14.578 -32.724 -7.542 1.00 71.55 H new ATOM 0 HD13 LEU A 113 13.349 -32.823 -8.826 1.00 71.55 H new ATOM 0 HD21 LEU A 113 15.266 -32.079 -11.121 1.00 24.12 H new ATOM 0 HD22 LEU A 113 13.644 -31.374 -10.922 1.00 24.12 H new ATOM 0 HD23 LEU A 113 15.069 -30.313 -11.029 1.00 24.12 H new ATOM 1801 N ALA A 114 13.162 -28.192 -5.956 1.00 25.01 N ATOM 1802 CA ALA A 114 12.527 -26.933 -5.588 1.00 31.15 C ATOM 1803 C ALA A 114 13.207 -26.310 -4.373 1.00 54.42 C ATOM 1804 O ALA A 114 13.275 -25.087 -4.247 1.00 12.02 O ATOM 1805 CB ALA A 114 11.046 -27.150 -5.313 1.00 2.04 C ATOM 0 H ALA A 114 12.842 -28.999 -5.420 1.00 25.01 H new ATOM 0 HA ALA A 114 12.633 -26.242 -6.425 1.00 31.15 H new ATOM 0 HB1 ALA A 114 10.584 -26.201 -5.039 1.00 2.04 H new ATOM 0 HB2 ALA A 114 10.564 -27.544 -6.208 1.00 2.04 H new ATOM 0 HB3 ALA A 114 10.928 -27.860 -4.495 1.00 2.04 H new ATOM 1811 N VAL A 115 13.708 -27.158 -3.481 1.00 10.11 N ATOM 1812 CA VAL A 115 14.383 -26.690 -2.276 1.00 51.13 C ATOM 1813 C VAL A 115 15.823 -26.289 -2.574 1.00 24.21 C ATOM 1814 O VAL A 115 16.412 -25.475 -1.862 1.00 30.42 O ATOM 1815 CB VAL A 115 14.378 -27.767 -1.176 1.00 22.43 C ATOM 1816 CG1 VAL A 115 14.743 -27.158 0.170 1.00 61.54 C ATOM 1817 CG2 VAL A 115 13.023 -28.454 -1.109 1.00 74.51 C ATOM 0 H VAL A 115 13.659 -28.173 -3.570 1.00 10.11 H new ATOM 0 HA VAL A 115 13.832 -25.818 -1.922 1.00 51.13 H new ATOM 0 HB VAL A 115 15.129 -28.518 -1.424 1.00 22.43 H new ATOM 0 HG11 VAL A 115 14.734 -27.934 0.935 1.00 61.54 H new ATOM 0 HG12 VAL A 115 15.738 -26.717 0.112 1.00 61.54 H new ATOM 0 HG13 VAL A 115 14.018 -26.386 0.428 1.00 61.54 H new ATOM 0 HG21 VAL A 115 13.038 -29.212 -0.326 1.00 74.51 H new ATOM 0 HG22 VAL A 115 12.252 -27.717 -0.886 1.00 74.51 H new ATOM 0 HG23 VAL A 115 12.807 -28.926 -2.067 1.00 74.51 H new ATOM 1827 N ASP A 116 16.386 -26.866 -3.630 1.00 54.34 N ATOM 1828 CA ASP A 116 17.758 -26.568 -4.024 1.00 52.22 C ATOM 1829 C ASP A 116 17.846 -25.201 -4.696 1.00 32.00 C ATOM 1830 O ASP A 116 18.936 -24.667 -4.897 1.00 52.45 O ATOM 1831 CB ASP A 116 18.286 -27.649 -4.968 1.00 42.12 C ATOM 1832 CG ASP A 116 17.912 -27.389 -6.414 1.00 53.50 C ATOM 1833 OD1 ASP A 116 16.810 -26.853 -6.654 1.00 14.23 O ATOM 1834 OD2 ASP A 116 18.720 -27.721 -7.306 1.00 23.30 O ATOM 0 H ASP A 116 15.913 -27.543 -4.229 1.00 54.34 H new ATOM 0 HA ASP A 116 18.373 -26.550 -3.124 1.00 52.22 H new ATOM 0 HB2 ASP A 116 19.371 -27.705 -4.881 1.00 42.12 H new ATOM 0 HB3 ASP A 116 17.892 -28.618 -4.662 1.00 42.12 H new ATOM 1839 N ALA A 117 16.691 -24.642 -5.041 1.00 52.43 N ATOM 1840 CA ALA A 117 16.637 -23.337 -5.690 1.00 23.25 C ATOM 1841 C ALA A 117 16.575 -22.214 -4.660 1.00 31.45 C ATOM 1842 O ALA A 117 16.910 -21.067 -4.955 1.00 24.21 O ATOM 1843 CB ALA A 117 15.442 -23.263 -6.628 1.00 13.44 C ATOM 0 H ALA A 117 15.780 -25.072 -4.882 1.00 52.43 H new ATOM 0 HA ALA A 117 17.550 -23.210 -6.272 1.00 23.25 H new ATOM 0 HB1 ALA A 117 15.414 -22.283 -7.105 1.00 13.44 H new ATOM 0 HB2 ALA A 117 15.530 -24.036 -7.391 1.00 13.44 H new ATOM 0 HB3 ALA A 117 14.524 -23.416 -6.061 1.00 13.44 H new ATOM 1849 N LYS A 118 16.143 -22.552 -3.449 1.00 54.42 N ATOM 1850 CA LYS A 118 16.036 -21.573 -2.374 1.00 2.50 C ATOM 1851 C LYS A 118 17.351 -21.460 -1.609 1.00 10.41 C ATOM 1852 O LYS A 118 17.732 -20.376 -1.168 1.00 61.22 O ATOM 1853 CB LYS A 118 14.907 -21.958 -1.415 1.00 65.12 C ATOM 1854 CG LYS A 118 13.522 -21.627 -1.942 1.00 70.35 C ATOM 1855 CD LYS A 118 13.345 -20.132 -2.146 1.00 42.02 C ATOM 1856 CE LYS A 118 12.120 -19.610 -1.411 1.00 21.30 C ATOM 1857 NZ LYS A 118 12.487 -18.910 -0.149 1.00 41.43 N ATOM 0 H LYS A 118 15.861 -23.497 -3.188 1.00 54.42 H new ATOM 0 HA LYS A 118 15.810 -20.604 -2.820 1.00 2.50 H new ATOM 0 HB2 LYS A 118 14.963 -23.027 -1.212 1.00 65.12 H new ATOM 0 HB3 LYS A 118 15.057 -21.445 -0.465 1.00 65.12 H new ATOM 0 HG2 LYS A 118 13.358 -22.146 -2.886 1.00 70.35 H new ATOM 0 HG3 LYS A 118 12.769 -21.991 -1.243 1.00 70.35 H new ATOM 0 HD2 LYS A 118 14.233 -19.608 -1.793 1.00 42.02 H new ATOM 0 HD3 LYS A 118 13.251 -19.918 -3.211 1.00 42.02 H new ATOM 0 HE2 LYS A 118 11.571 -18.927 -2.059 1.00 21.30 H new ATOM 0 HE3 LYS A 118 11.451 -20.440 -1.184 1.00 21.30 H new ATOM 0 HZ1 LYS A 118 11.625 -18.569 0.322 1.00 41.43 H new ATOM 0 HZ2 LYS A 118 12.988 -19.569 0.480 1.00 41.43 H new ATOM 0 HZ3 LYS A 118 13.105 -18.102 -0.367 1.00 41.43 H new ATOM 1871 N ASN A 119 18.040 -22.586 -1.456 1.00 43.35 N ATOM 1872 CA ASN A 119 19.313 -22.612 -0.745 1.00 64.23 C ATOM 1873 C ASN A 119 20.347 -21.738 -1.448 1.00 3.50 C ATOM 1874 O ASN A 119 21.186 -21.108 -0.802 1.00 1.10 O ATOM 1875 CB ASN A 119 19.832 -24.048 -0.638 1.00 54.21 C ATOM 1876 CG ASN A 119 18.907 -24.938 0.170 1.00 53.53 C ATOM 1877 OD1 ASN A 119 18.114 -24.456 0.979 1.00 4.45 O ATOM 1878 ND2 ASN A 119 19.004 -26.244 -0.048 1.00 11.05 N ATOM 0 H ASN A 119 17.738 -23.492 -1.815 1.00 43.35 H new ATOM 0 HA ASN A 119 19.149 -22.216 0.257 1.00 64.23 H new ATOM 0 HB2 ASN A 119 19.950 -24.464 -1.638 1.00 54.21 H new ATOM 0 HB3 ASN A 119 20.820 -24.041 -0.177 1.00 54.21 H new ATOM 0 HD21 ASN A 119 18.407 -26.892 0.465 1.00 11.05 H new ATOM 0 HD22 ASN A 119 19.676 -26.599 -0.728 1.00 11.05 H new ATOM 1885 N LEU A 120 20.281 -21.703 -2.774 1.00 41.43 N ATOM 1886 CA LEU A 120 21.211 -20.905 -3.566 1.00 11.50 C ATOM 1887 C LEU A 120 20.862 -19.422 -3.484 1.00 4.21 C ATOM 1888 O LEU A 120 21.726 -18.584 -3.219 1.00 54.11 O ATOM 1889 CB LEU A 120 21.194 -21.364 -5.025 1.00 20.11 C ATOM 1890 CG LEU A 120 22.253 -20.743 -5.937 1.00 14.44 C ATOM 1891 CD1 LEU A 120 22.946 -21.817 -6.760 1.00 35.31 C ATOM 1892 CD2 LEU A 120 21.626 -19.694 -6.844 1.00 71.11 C ATOM 0 H LEU A 120 19.593 -22.218 -3.324 1.00 41.43 H new ATOM 0 HA LEU A 120 22.212 -21.048 -3.158 1.00 11.50 H new ATOM 0 HB2 LEU A 120 21.316 -22.447 -5.046 1.00 20.11 H new ATOM 0 HB3 LEU A 120 20.211 -21.146 -5.442 1.00 20.11 H new ATOM 0 HG LEU A 120 23.001 -20.255 -5.313 1.00 14.44 H new ATOM 0 HD11 LEU A 120 23.696 -21.356 -7.403 1.00 35.31 H new ATOM 0 HD12 LEU A 120 23.429 -22.531 -6.093 1.00 35.31 H new ATOM 0 HD13 LEU A 120 22.210 -22.335 -7.375 1.00 35.31 H new ATOM 0 HD21 LEU A 120 22.394 -19.262 -7.486 1.00 71.11 H new ATOM 0 HD22 LEU A 120 20.857 -20.159 -7.460 1.00 71.11 H new ATOM 0 HD23 LEU A 120 21.178 -18.908 -6.236 1.00 71.11 H new ATOM 1904 N LEU A 121 19.592 -19.105 -3.710 1.00 45.45 N ATOM 1905 CA LEU A 121 19.128 -17.722 -3.660 1.00 24.40 C ATOM 1906 C LEU A 121 19.615 -17.031 -2.391 1.00 3.43 C ATOM 1907 O LEU A 121 19.889 -15.830 -2.392 1.00 64.41 O ATOM 1908 CB LEU A 121 17.601 -17.674 -3.727 1.00 50.21 C ATOM 1909 CG LEU A 121 16.947 -16.393 -3.208 1.00 52.12 C ATOM 1910 CD1 LEU A 121 15.679 -16.086 -3.990 1.00 71.51 C ATOM 1911 CD2 LEU A 121 16.643 -16.514 -1.722 1.00 11.41 C ATOM 0 H LEU A 121 18.865 -19.786 -3.930 1.00 45.45 H new ATOM 0 HA LEU A 121 19.540 -17.194 -4.520 1.00 24.40 H new ATOM 0 HB2 LEU A 121 17.298 -17.819 -4.764 1.00 50.21 H new ATOM 0 HB3 LEU A 121 17.206 -18.516 -3.159 1.00 50.21 H new ATOM 0 HG LEU A 121 17.645 -15.568 -3.350 1.00 52.12 H new ATOM 0 HD11 LEU A 121 15.228 -15.171 -3.606 1.00 71.51 H new ATOM 0 HD12 LEU A 121 15.924 -15.956 -5.044 1.00 71.51 H new ATOM 0 HD13 LEU A 121 14.975 -16.911 -3.881 1.00 71.51 H new ATOM 0 HD21 LEU A 121 16.178 -15.593 -1.370 1.00 11.41 H new ATOM 0 HD22 LEU A 121 15.964 -17.350 -1.557 1.00 11.41 H new ATOM 0 HD23 LEU A 121 17.569 -16.685 -1.174 1.00 11.41 H new ATOM 1923 N ASP A 122 19.722 -17.796 -1.310 1.00 43.21 N ATOM 1924 CA ASP A 122 20.180 -17.257 -0.034 1.00 74.43 C ATOM 1925 C ASP A 122 21.617 -16.757 -0.139 1.00 70.53 C ATOM 1926 O ASP A 122 21.951 -15.688 0.370 1.00 64.21 O ATOM 1927 CB ASP A 122 20.075 -18.322 1.059 1.00 2.54 C ATOM 1928 CG ASP A 122 20.145 -17.728 2.453 1.00 74.32 C ATOM 1929 OD1 ASP A 122 19.493 -16.689 2.688 1.00 65.21 O ATOM 1930 OD2 ASP A 122 20.851 -18.303 3.308 1.00 11.31 O ATOM 0 H ASP A 122 19.498 -18.791 -1.292 1.00 43.21 H new ATOM 0 HA ASP A 122 19.541 -16.414 0.228 1.00 74.43 H new ATOM 0 HB2 ASP A 122 19.137 -18.865 0.945 1.00 2.54 H new ATOM 0 HB3 ASP A 122 20.880 -19.047 0.935 1.00 2.54 H new ATOM 1935 N ALA A 123 22.463 -17.539 -0.802 1.00 70.13 N ATOM 1936 CA ALA A 123 23.864 -17.175 -0.975 1.00 31.32 C ATOM 1937 C ALA A 123 24.025 -16.108 -2.052 1.00 23.00 C ATOM 1938 O ALA A 123 25.011 -15.370 -2.066 1.00 54.01 O ATOM 1939 CB ALA A 123 24.690 -18.406 -1.320 1.00 50.51 C ATOM 0 H ALA A 123 22.203 -18.428 -1.228 1.00 70.13 H new ATOM 0 HA ALA A 123 24.225 -16.761 -0.034 1.00 31.32 H new ATOM 0 HB1 ALA A 123 25.734 -18.120 -1.446 1.00 50.51 H new ATOM 0 HB2 ALA A 123 24.609 -19.136 -0.515 1.00 50.51 H new ATOM 0 HB3 ALA A 123 24.319 -18.845 -2.246 1.00 50.51 H new ATOM 1945 N VAL A 124 23.052 -16.032 -2.954 1.00 12.01 N ATOM 1946 CA VAL A 124 23.086 -15.054 -4.035 1.00 71.41 C ATOM 1947 C VAL A 124 22.596 -13.691 -3.559 1.00 72.43 C ATOM 1948 O VAL A 124 23.113 -12.654 -3.975 1.00 72.53 O ATOM 1949 CB VAL A 124 22.226 -15.509 -5.230 1.00 3.53 C ATOM 1950 CG1 VAL A 124 22.356 -14.527 -6.385 1.00 33.15 C ATOM 1951 CG2 VAL A 124 22.619 -16.912 -5.665 1.00 43.04 C ATOM 0 H VAL A 124 22.230 -16.636 -2.958 1.00 12.01 H new ATOM 0 HA VAL A 124 24.125 -14.971 -4.355 1.00 71.41 H new ATOM 0 HB VAL A 124 21.182 -15.530 -4.918 1.00 3.53 H new ATOM 0 HG11 VAL A 124 21.742 -14.864 -7.220 1.00 33.15 H new ATOM 0 HG12 VAL A 124 22.021 -13.541 -6.063 1.00 33.15 H new ATOM 0 HG13 VAL A 124 23.398 -14.472 -6.700 1.00 33.15 H new ATOM 0 HG21 VAL A 124 22.002 -17.217 -6.510 1.00 43.04 H new ATOM 0 HG22 VAL A 124 23.668 -16.921 -5.960 1.00 43.04 H new ATOM 0 HG23 VAL A 124 22.469 -17.605 -4.837 1.00 43.04 H new ATOM 1961 N ASP A 125 21.596 -13.701 -2.685 1.00 11.12 N ATOM 1962 CA ASP A 125 21.036 -12.465 -2.150 1.00 41.02 C ATOM 1963 C ASP A 125 22.137 -11.562 -1.603 1.00 10.21 C ATOM 1964 O ASP A 125 22.212 -10.382 -1.946 1.00 62.41 O ATOM 1965 CB ASP A 125 20.019 -12.774 -1.050 1.00 64.52 C ATOM 1966 CG ASP A 125 19.398 -11.521 -0.467 1.00 12.21 C ATOM 1967 OD1 ASP A 125 19.960 -10.977 0.507 1.00 30.32 O ATOM 1968 OD2 ASP A 125 18.350 -11.082 -0.985 1.00 72.40 O ATOM 0 H ASP A 125 21.156 -14.551 -2.332 1.00 11.12 H new ATOM 0 HA ASP A 125 20.532 -11.942 -2.963 1.00 41.02 H new ATOM 0 HB2 ASP A 125 19.233 -13.411 -1.455 1.00 64.52 H new ATOM 0 HB3 ASP A 125 20.508 -13.337 -0.255 1.00 64.52 H new ATOM 1973 N GLN A 126 22.987 -12.124 -0.750 1.00 22.01 N ATOM 1974 CA GLN A 126 24.083 -11.368 -0.154 1.00 74.21 C ATOM 1975 C GLN A 126 25.141 -11.029 -1.198 1.00 41.04 C ATOM 1976 O GLN A 126 25.857 -10.036 -1.071 1.00 55.11 O ATOM 1977 CB GLN A 126 24.714 -12.162 0.991 1.00 65.04 C ATOM 1978 CG GLN A 126 23.700 -12.725 1.973 1.00 62.10 C ATOM 1979 CD GLN A 126 22.795 -11.657 2.553 1.00 15.13 C ATOM 1980 OE1 GLN A 126 23.256 -10.591 2.963 1.00 54.04 O ATOM 1981 NE2 GLN A 126 21.497 -11.937 2.592 1.00 61.23 N ATOM 0 H GLN A 126 22.938 -13.099 -0.456 1.00 22.01 H new ATOM 0 HA GLN A 126 23.677 -10.436 0.240 1.00 74.21 H new ATOM 0 HB2 GLN A 126 25.298 -12.983 0.574 1.00 65.04 H new ATOM 0 HB3 GLN A 126 25.409 -11.517 1.529 1.00 65.04 H new ATOM 0 HG2 GLN A 126 23.092 -13.477 1.470 1.00 62.10 H new ATOM 0 HG3 GLN A 126 24.226 -13.230 2.783 1.00 62.10 H new ATOM 0 HE21 GLN A 126 21.158 -12.833 2.241 1.00 61.23 H new ATOM 0 HE22 GLN A 126 20.840 -11.256 2.972 1.00 61.23 H new ATOM 1990 N ALA A 127 25.235 -11.861 -2.230 1.00 40.05 N ATOM 1991 CA ALA A 127 26.205 -11.648 -3.297 1.00 70.15 C ATOM 1992 C ALA A 127 25.899 -10.370 -4.071 1.00 34.10 C ATOM 1993 O ALA A 127 26.774 -9.528 -4.271 1.00 41.02 O ATOM 1994 CB ALA A 127 26.226 -12.844 -4.238 1.00 23.13 C ATOM 0 H ALA A 127 24.651 -12.689 -2.350 1.00 40.05 H new ATOM 0 HA ALA A 127 27.190 -11.539 -2.842 1.00 70.15 H new ATOM 0 HB1 ALA A 127 26.955 -12.671 -5.030 1.00 23.13 H new ATOM 0 HB2 ALA A 127 26.501 -13.740 -3.681 1.00 23.13 H new ATOM 0 HB3 ALA A 127 25.238 -12.979 -4.678 1.00 23.13 H new ATOM 2000 N LYS A 128 24.650 -10.232 -4.505 1.00 4.53 N ATOM 2001 CA LYS A 128 24.227 -9.056 -5.256 1.00 41.03 C ATOM 2002 C LYS A 128 24.497 -7.779 -4.467 1.00 32.14 C ATOM 2003 O LYS A 128 24.631 -6.699 -5.041 1.00 15.50 O ATOM 2004 CB LYS A 128 22.738 -9.152 -5.598 1.00 25.32 C ATOM 2005 CG LYS A 128 22.234 -7.999 -6.448 1.00 35.14 C ATOM 2006 CD LYS A 128 22.747 -8.092 -7.875 1.00 14.21 C ATOM 2007 CE LYS A 128 22.162 -9.294 -8.601 1.00 13.35 C ATOM 2008 NZ LYS A 128 22.453 -9.256 -10.060 1.00 63.24 N ATOM 0 H LYS A 128 23.913 -10.920 -4.349 1.00 4.53 H new ATOM 0 HA LYS A 128 24.804 -9.019 -6.180 1.00 41.03 H new ATOM 0 HB2 LYS A 128 22.554 -10.088 -6.125 1.00 25.32 H new ATOM 0 HB3 LYS A 128 22.163 -9.189 -4.673 1.00 25.32 H new ATOM 0 HG2 LYS A 128 21.144 -7.998 -6.452 1.00 35.14 H new ATOM 0 HG3 LYS A 128 22.552 -7.054 -6.007 1.00 35.14 H new ATOM 0 HD2 LYS A 128 22.492 -7.180 -8.415 1.00 14.21 H new ATOM 0 HD3 LYS A 128 23.835 -8.164 -7.868 1.00 14.21 H new ATOM 0 HE2 LYS A 128 22.569 -10.210 -8.173 1.00 13.35 H new ATOM 0 HE3 LYS A 128 21.083 -9.322 -8.446 1.00 13.35 H new ATOM 0 HZ1 LYS A 128 22.038 -10.092 -10.519 1.00 63.24 H new ATOM 0 HZ2 LYS A 128 22.043 -8.394 -10.474 1.00 63.24 H new ATOM 0 HZ3 LYS A 128 23.482 -9.255 -10.209 1.00 63.24 H new ATOM 2022 N VAL A 129 24.577 -7.911 -3.146 1.00 71.02 N ATOM 2023 CA VAL A 129 24.833 -6.768 -2.278 1.00 24.21 C ATOM 2024 C VAL A 129 26.320 -6.435 -2.233 1.00 24.33 C ATOM 2025 O VAL A 129 26.706 -5.265 -2.232 1.00 63.52 O ATOM 2026 CB VAL A 129 24.333 -7.029 -0.845 1.00 0.23 C ATOM 2027 CG1 VAL A 129 24.658 -5.848 0.057 1.00 11.04 C ATOM 2028 CG2 VAL A 129 22.839 -7.314 -0.846 1.00 53.12 C ATOM 0 H VAL A 129 24.468 -8.798 -2.654 1.00 71.02 H new ATOM 0 HA VAL A 129 24.287 -5.923 -2.697 1.00 24.21 H new ATOM 0 HB VAL A 129 24.847 -7.907 -0.454 1.00 0.23 H new ATOM 0 HG11 VAL A 129 24.297 -6.050 1.065 1.00 11.04 H new ATOM 0 HG12 VAL A 129 25.737 -5.695 0.081 1.00 11.04 H new ATOM 0 HG13 VAL A 129 24.173 -4.951 -0.329 1.00 11.04 H new ATOM 0 HG21 VAL A 129 22.503 -7.496 0.175 1.00 53.12 H new ATOM 0 HG22 VAL A 129 22.305 -6.457 -1.256 1.00 53.12 H new ATOM 0 HG23 VAL A 129 22.637 -8.194 -1.457 1.00 53.12 H new ATOM 2038 N LEU A 130 27.152 -7.471 -2.195 1.00 52.42 N ATOM 2039 CA LEU A 130 28.599 -7.289 -2.150 1.00 54.14 C ATOM 2040 C LEU A 130 29.146 -6.937 -3.530 1.00 22.21 C ATOM 2041 O LEU A 130 30.190 -6.297 -3.649 1.00 43.13 O ATOM 2042 CB LEU A 130 29.276 -8.557 -1.628 1.00 72.34 C ATOM 2043 CG LEU A 130 28.912 -8.975 -0.203 1.00 53.32 C ATOM 2044 CD1 LEU A 130 29.756 -10.161 0.238 1.00 55.42 C ATOM 2045 CD2 LEU A 130 29.088 -7.807 0.756 1.00 14.50 C ATOM 0 H LEU A 130 26.849 -8.445 -2.194 1.00 52.42 H new ATOM 0 HA LEU A 130 28.816 -6.464 -1.472 1.00 54.14 H new ATOM 0 HB2 LEU A 130 29.030 -9.379 -2.300 1.00 72.34 H new ATOM 0 HB3 LEU A 130 30.356 -8.416 -1.679 1.00 72.34 H new ATOM 0 HG LEU A 130 27.865 -9.276 -0.189 1.00 53.32 H new ATOM 0 HD11 LEU A 130 29.483 -10.444 1.255 1.00 55.42 H new ATOM 0 HD12 LEU A 130 29.580 -11.002 -0.433 1.00 55.42 H new ATOM 0 HD13 LEU A 130 30.811 -9.888 0.209 1.00 55.42 H new ATOM 0 HD21 LEU A 130 28.825 -8.122 1.766 1.00 14.50 H new ATOM 0 HD22 LEU A 130 30.126 -7.475 0.739 1.00 14.50 H new ATOM 0 HD23 LEU A 130 28.440 -6.985 0.452 1.00 14.50 H new ATOM 2057 N ALA A 131 28.433 -7.359 -4.569 1.00 50.30 N ATOM 2058 CA ALA A 131 28.845 -7.085 -5.940 1.00 41.40 C ATOM 2059 C ALA A 131 29.061 -5.591 -6.160 1.00 60.23 C ATOM 2060 O ALA A 131 30.033 -5.182 -6.793 1.00 5.12 O ATOM 2061 CB ALA A 131 27.811 -7.620 -6.919 1.00 60.41 C ATOM 0 H ALA A 131 27.567 -7.892 -4.487 1.00 50.30 H new ATOM 0 HA ALA A 131 29.793 -7.593 -6.117 1.00 41.40 H new ATOM 0 HB1 ALA A 131 28.132 -7.408 -7.939 1.00 60.41 H new ATOM 0 HB2 ALA A 131 27.708 -8.697 -6.787 1.00 60.41 H new ATOM 0 HB3 ALA A 131 26.851 -7.139 -6.733 1.00 60.41 H new