USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 911 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 99 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 68 HIS : no HD1:sc= -0.556 K(o=-0.95,f=-0.31) USER MOD Set 2.2: A 77 MET CE :methyl 138:sc= -0.399 (180deg=-0.0193) USER MOD Set 3.1: A 8 ASN : amide:sc= -0.768 K(o=-0.96,f=-0.16!) USER MOD Set 3.2: A 10 TYR OH : rot 180:sc= -0.194 USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.1 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0591 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 31:sc= 0.38 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc=-0.00696 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.32) USER MOD Single : A 34 ASN : amide:sc= -0.673 K(o=-0.67,f=-2.7) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -3.94! C(o=-3.9!,f=-4!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= -0.0539 USER MOD Single : A 46 LYS NZ :NH3+ -158:sc= -0.0469 (180deg=-0.319) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -49:sc= 1.22 USER MOD Single : A 57 GLN : amide:sc= 0.0834 K(o=0.083,f=-0.62) USER MOD Single : A 58 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.2) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.0225 USER MOD Single : A 65 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0531) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.337 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= -0.368 X(o=-0.37,f=-0.019) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 64:sc= 0.142 USER MOD Single : A 97 GLN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -5.2! C(o=-5.2!,f=-3.2!) USER MOD Single : A 103 SER OG : rot 170:sc= -0.1 USER MOD Single : A 105 MET CE :methyl -112:sc= -4.7! (180deg=-7.26!) USER MOD Single : A 106 THR OG1 : rot 160:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -1.83 K(o=-1.8,f=-5.1!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 114 SER OG : rot -160:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.422 K(o=-0.42,f=-2.5) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -129:sc= 0.575 USER MOD Single : A 124 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.0085) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.296 45.800 44.435 1.00 0.00 N ATOM 2 CA GLY A 1 16.576 47.222 44.515 1.00 0.00 C ATOM 3 C GLY A 1 16.761 47.854 43.150 1.00 0.00 C ATOM 4 O GLY A 1 16.894 47.153 42.147 1.00 0.00 O ATOM 0 H1 GLY A 1 15.309 45.624 44.711 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.446 45.471 43.460 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.932 45.284 45.076 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.759 47.721 45.035 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.476 47.379 45.110 1.00 0.00 H new ATOM 8 N SER A 2 16.768 49.183 43.111 1.00 0.00 N ATOM 9 CA SER A 2 16.931 49.910 41.858 1.00 0.00 C ATOM 10 C SER A 2 18.305 49.642 41.250 1.00 0.00 C ATOM 11 O SER A 2 19.138 48.960 41.847 1.00 0.00 O ATOM 12 CB SER A 2 16.746 51.411 42.087 1.00 0.00 C ATOM 13 OG SER A 2 17.902 51.984 42.674 1.00 0.00 O ATOM 0 H SER A 2 16.663 49.778 43.933 1.00 0.00 H new ATOM 0 HA SER A 2 16.170 49.560 41.161 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.534 51.903 41.138 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.884 51.580 42.733 1.00 0.00 H new ATOM 0 HG SER A 2 17.759 52.944 42.808 1.00 0.00 H new ATOM 19 N SER A 3 18.534 50.185 40.058 1.00 0.00 N ATOM 20 CA SER A 3 19.804 50.002 39.366 1.00 0.00 C ATOM 21 C SER A 3 20.723 51.199 39.593 1.00 0.00 C ATOM 22 O SER A 3 20.263 52.303 39.882 1.00 0.00 O ATOM 23 CB SER A 3 19.569 49.802 37.868 1.00 0.00 C ATOM 24 OG SER A 3 20.769 49.979 37.135 1.00 0.00 O ATOM 0 H SER A 3 17.856 50.755 39.552 1.00 0.00 H new ATOM 0 HA SER A 3 20.286 49.113 39.772 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.174 48.802 37.689 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.817 50.509 37.517 1.00 0.00 H new ATOM 0 HG SER A 3 20.592 49.844 36.181 1.00 0.00 H new ATOM 30 N GLY A 4 22.026 50.971 39.459 1.00 0.00 N ATOM 31 CA GLY A 4 22.990 52.038 39.652 1.00 0.00 C ATOM 32 C GLY A 4 24.388 51.642 39.219 1.00 0.00 C ATOM 33 O GLY A 4 24.887 52.117 38.199 1.00 0.00 O ATOM 0 H GLY A 4 22.431 50.066 39.220 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.673 52.916 39.089 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.006 52.323 40.704 1.00 0.00 H new ATOM 37 N SER A 5 25.022 50.771 39.998 1.00 0.00 N ATOM 38 CA SER A 5 26.374 50.316 39.693 1.00 0.00 C ATOM 39 C SER A 5 26.472 48.797 39.796 1.00 0.00 C ATOM 40 O SER A 5 25.512 48.127 40.176 1.00 0.00 O ATOM 41 CB SER A 5 27.381 50.970 40.641 1.00 0.00 C ATOM 42 OG SER A 5 28.649 51.105 40.024 1.00 0.00 O ATOM 0 H SER A 5 24.622 50.366 40.844 1.00 0.00 H new ATOM 0 HA SER A 5 26.607 50.609 38.669 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.015 51.951 40.945 1.00 0.00 H new ATOM 0 HB3 SER A 5 27.476 50.370 41.546 1.00 0.00 H new ATOM 0 HG SER A 5 29.274 51.527 40.650 1.00 0.00 H new ATOM 48 N SER A 6 27.639 48.261 39.456 1.00 0.00 N ATOM 49 CA SER A 6 27.863 46.821 39.506 1.00 0.00 C ATOM 50 C SER A 6 29.346 46.508 39.683 1.00 0.00 C ATOM 51 O SER A 6 30.181 47.409 39.726 1.00 0.00 O ATOM 52 CB SER A 6 27.339 46.157 38.231 1.00 0.00 C ATOM 53 OG SER A 6 25.967 45.824 38.357 1.00 0.00 O ATOM 0 H SER A 6 28.445 48.802 39.143 1.00 0.00 H new ATOM 0 HA SER A 6 27.320 46.423 40.364 1.00 0.00 H new ATOM 0 HB2 SER A 6 27.477 46.829 37.384 1.00 0.00 H new ATOM 0 HB3 SER A 6 27.917 45.257 38.022 1.00 0.00 H new ATOM 0 HG SER A 6 25.528 46.467 38.952 1.00 0.00 H new ATOM 59 N GLY A 7 29.664 45.221 39.787 1.00 0.00 N ATOM 60 CA GLY A 7 31.045 44.810 39.959 1.00 0.00 C ATOM 61 C GLY A 7 31.196 43.696 40.975 1.00 0.00 C ATOM 62 O GLY A 7 30.977 43.901 42.168 1.00 0.00 O ATOM 0 H GLY A 7 28.990 44.456 39.755 1.00 0.00 H new ATOM 0 HA2 GLY A 7 31.445 44.480 39.000 1.00 0.00 H new ATOM 0 HA3 GLY A 7 31.640 45.668 40.274 1.00 0.00 H new ATOM 66 N ASN A 8 31.570 42.511 40.501 1.00 0.00 N ATOM 67 CA ASN A 8 31.748 41.359 41.377 1.00 0.00 C ATOM 68 C ASN A 8 32.336 40.178 40.611 1.00 0.00 C ATOM 69 O ASN A 8 31.852 39.818 39.538 1.00 0.00 O ATOM 70 CB ASN A 8 30.412 40.959 42.006 1.00 0.00 C ATOM 71 CG ASN A 8 30.582 40.330 43.375 1.00 0.00 C ATOM 72 OD1 ASN A 8 31.533 40.634 44.096 1.00 0.00 O ATOM 73 ND2 ASN A 8 29.658 39.449 43.740 1.00 0.00 N ATOM 0 H ASN A 8 31.755 42.324 39.516 1.00 0.00 H new ATOM 0 HA ASN A 8 32.445 41.639 42.167 1.00 0.00 H new ATOM 0 HB2 ASN A 8 29.775 41.840 42.091 1.00 0.00 H new ATOM 0 HB3 ASN A 8 29.900 40.257 41.348 1.00 0.00 H new ATOM 0 HD21 ASN A 8 29.719 38.994 44.651 1.00 0.00 H new ATOM 0 HD22 ASN A 8 28.887 39.228 43.110 1.00 0.00 H new ATOM 80 N ARG A 9 33.383 39.580 41.169 1.00 0.00 N ATOM 81 CA ARG A 9 34.038 38.440 40.539 1.00 0.00 C ATOM 82 C ARG A 9 33.282 37.148 40.833 1.00 0.00 C ATOM 83 O ARG A 9 32.524 37.066 41.800 1.00 0.00 O ATOM 84 CB ARG A 9 35.483 38.321 41.026 1.00 0.00 C ATOM 85 CG ARG A 9 36.467 39.160 40.226 1.00 0.00 C ATOM 86 CD ARG A 9 36.519 40.592 40.733 1.00 0.00 C ATOM 87 NE ARG A 9 37.474 40.751 41.827 1.00 0.00 N ATOM 88 CZ ARG A 9 37.650 41.889 42.489 1.00 0.00 C ATOM 89 NH1 ARG A 9 36.940 42.962 42.171 1.00 0.00 N ATOM 90 NH2 ARG A 9 38.538 41.954 43.473 1.00 0.00 N ATOM 0 H ARG A 9 33.796 39.866 42.057 1.00 0.00 H new ATOM 0 HA ARG A 9 34.038 38.603 39.461 1.00 0.00 H new ATOM 0 HB2 ARG A 9 35.530 38.621 42.073 1.00 0.00 H new ATOM 0 HB3 ARG A 9 35.788 37.276 40.979 1.00 0.00 H new ATOM 0 HG2 ARG A 9 37.460 38.715 40.287 1.00 0.00 H new ATOM 0 HG3 ARG A 9 36.180 39.155 39.174 1.00 0.00 H new ATOM 0 HD2 ARG A 9 36.792 41.257 39.914 1.00 0.00 H new ATOM 0 HD3 ARG A 9 35.527 40.893 41.071 1.00 0.00 H new ATOM 0 HE ARG A 9 38.036 39.944 42.097 1.00 0.00 H new ATOM 0 HH11 ARG A 9 36.256 42.915 41.416 1.00 0.00 H new ATOM 0 HH12 ARG A 9 37.078 43.834 42.681 1.00 0.00 H new ATOM 0 HH21 ARG A 9 39.086 41.130 43.721 1.00 0.00 H new ATOM 0 HH22 ARG A 9 38.673 42.828 43.981 1.00 0.00 H new ATOM 104 N TYR A 10 33.495 36.140 39.994 1.00 0.00 N ATOM 105 CA TYR A 10 32.832 34.852 40.162 1.00 0.00 C ATOM 106 C TYR A 10 33.539 33.766 39.357 1.00 0.00 C ATOM 107 O TYR A 10 34.388 34.055 38.515 1.00 0.00 O ATOM 108 CB TYR A 10 31.367 34.949 39.734 1.00 0.00 C ATOM 109 CG TYR A 10 30.466 35.553 40.787 1.00 0.00 C ATOM 110 CD1 TYR A 10 30.532 35.132 42.110 1.00 0.00 C ATOM 111 CD2 TYR A 10 29.550 36.545 40.461 1.00 0.00 C ATOM 112 CE1 TYR A 10 29.710 35.680 43.076 1.00 0.00 C ATOM 113 CE2 TYR A 10 28.726 37.100 41.420 1.00 0.00 C ATOM 114 CZ TYR A 10 28.809 36.664 42.726 1.00 0.00 C ATOM 115 OH TYR A 10 27.990 37.214 43.685 1.00 0.00 O ATOM 0 H TYR A 10 34.122 36.190 39.191 1.00 0.00 H new ATOM 0 HA TYR A 10 32.878 34.583 41.217 1.00 0.00 H new ATOM 0 HB2 TYR A 10 31.302 35.548 38.826 1.00 0.00 H new ATOM 0 HB3 TYR A 10 31.003 33.952 39.485 1.00 0.00 H new ATOM 0 HD1 TYR A 10 31.238 34.363 42.388 1.00 0.00 H new ATOM 0 HD2 TYR A 10 29.481 36.888 39.439 1.00 0.00 H new ATOM 0 HE1 TYR A 10 29.773 35.340 44.099 1.00 0.00 H new ATOM 0 HE2 TYR A 10 28.020 37.871 41.149 1.00 0.00 H new ATOM 0 HH TYR A 10 27.416 37.894 43.274 1.00 0.00 H new ATOM 125 N GLY A 11 33.179 32.514 39.621 1.00 0.00 N ATOM 126 CA GLY A 11 33.787 31.402 38.913 1.00 0.00 C ATOM 127 C GLY A 11 32.780 30.610 38.105 1.00 0.00 C ATOM 128 O GLY A 11 31.585 30.595 38.403 1.00 0.00 O ATOM 0 H GLY A 11 32.477 32.250 40.312 1.00 0.00 H new ATOM 0 HA2 GLY A 11 34.565 31.780 38.249 1.00 0.00 H new ATOM 0 HA3 GLY A 11 34.273 30.741 39.630 1.00 0.00 H new ATOM 132 N PRO A 12 33.261 29.932 37.052 1.00 0.00 N ATOM 133 CA PRO A 12 32.411 29.121 36.176 1.00 0.00 C ATOM 134 C PRO A 12 31.891 27.867 36.870 1.00 0.00 C ATOM 135 O PRO A 12 32.453 27.421 37.870 1.00 0.00 O ATOM 136 CB PRO A 12 33.345 28.746 35.023 1.00 0.00 C ATOM 137 CG PRO A 12 34.713 28.808 35.608 1.00 0.00 C ATOM 138 CD PRO A 12 34.674 29.904 36.637 1.00 0.00 C ATOM 0 HA PRO A 12 31.518 29.661 35.861 1.00 0.00 H new ATOM 0 HB2 PRO A 12 33.122 27.750 34.641 1.00 0.00 H new ATOM 0 HB3 PRO A 12 33.240 29.438 34.187 1.00 0.00 H new ATOM 0 HG2 PRO A 12 34.987 27.856 36.062 1.00 0.00 H new ATOM 0 HG3 PRO A 12 35.457 29.020 34.840 1.00 0.00 H new ATOM 0 HD2 PRO A 12 35.335 29.691 37.477 1.00 0.00 H new ATOM 0 HD3 PRO A 12 34.989 30.860 36.218 1.00 0.00 H new ATOM 146 N GLY A 13 30.814 27.301 36.333 1.00 0.00 N ATOM 147 CA GLY A 13 30.238 26.103 36.914 1.00 0.00 C ATOM 148 C GLY A 13 29.903 25.056 35.871 1.00 0.00 C ATOM 149 O GLY A 13 30.686 24.811 34.953 1.00 0.00 O ATOM 0 H GLY A 13 30.331 27.651 35.506 1.00 0.00 H new ATOM 0 HA2 GLY A 13 30.937 25.681 37.636 1.00 0.00 H new ATOM 0 HA3 GLY A 13 29.334 26.367 37.462 1.00 0.00 H new ATOM 153 N VAL A 14 28.737 24.433 36.012 1.00 0.00 N ATOM 154 CA VAL A 14 28.301 23.405 35.074 1.00 0.00 C ATOM 155 C VAL A 14 27.118 23.887 34.242 1.00 0.00 C ATOM 156 O VAL A 14 26.240 24.591 34.741 1.00 0.00 O ATOM 157 CB VAL A 14 27.905 22.109 35.807 1.00 0.00 C ATOM 158 CG1 VAL A 14 27.428 21.060 34.815 1.00 0.00 C ATOM 159 CG2 VAL A 14 29.072 21.585 36.629 1.00 0.00 C ATOM 0 H VAL A 14 28.077 24.622 36.767 1.00 0.00 H new ATOM 0 HA VAL A 14 29.145 23.198 34.415 1.00 0.00 H new ATOM 0 HB VAL A 14 27.083 22.333 36.487 1.00 0.00 H new ATOM 0 HG11 VAL A 14 27.153 20.151 35.351 1.00 0.00 H new ATOM 0 HG12 VAL A 14 26.561 21.439 34.273 1.00 0.00 H new ATOM 0 HG13 VAL A 14 28.228 20.837 34.109 1.00 0.00 H new ATOM 0 HG21 VAL A 14 28.775 20.669 37.140 1.00 0.00 H new ATOM 0 HG22 VAL A 14 29.916 21.376 35.971 1.00 0.00 H new ATOM 0 HG23 VAL A 14 29.363 22.334 37.366 1.00 0.00 H new ATOM 169 N SER A 15 27.101 23.503 32.970 1.00 0.00 N ATOM 170 CA SER A 15 26.028 23.898 32.066 1.00 0.00 C ATOM 171 C SER A 15 25.009 22.773 31.907 1.00 0.00 C ATOM 172 O SER A 15 25.209 21.663 32.402 1.00 0.00 O ATOM 173 CB SER A 15 26.598 24.281 30.699 1.00 0.00 C ATOM 174 OG SER A 15 27.181 23.159 30.057 1.00 0.00 O ATOM 0 H SER A 15 27.819 22.918 32.542 1.00 0.00 H new ATOM 0 HA SER A 15 25.524 24.763 32.497 1.00 0.00 H new ATOM 0 HB2 SER A 15 25.806 24.691 30.073 1.00 0.00 H new ATOM 0 HB3 SER A 15 27.346 25.064 30.820 1.00 0.00 H new ATOM 0 HG SER A 15 27.536 23.429 29.185 1.00 0.00 H new ATOM 180 N THR A 16 23.914 23.069 31.214 1.00 0.00 N ATOM 181 CA THR A 16 22.862 22.085 30.991 1.00 0.00 C ATOM 182 C THR A 16 22.411 22.083 29.535 1.00 0.00 C ATOM 183 O THR A 16 22.613 23.058 28.811 1.00 0.00 O ATOM 184 CB THR A 16 21.643 22.351 31.894 1.00 0.00 C ATOM 185 OG1 THR A 16 22.058 22.452 33.260 1.00 0.00 O ATOM 186 CG2 THR A 16 20.612 21.241 31.752 1.00 0.00 C ATOM 0 H THR A 16 23.733 23.982 30.798 1.00 0.00 H new ATOM 0 HA THR A 16 23.283 21.111 31.240 1.00 0.00 H new ATOM 0 HB THR A 16 21.187 23.291 31.583 1.00 0.00 H new ATOM 0 HG1 THR A 16 21.277 22.623 33.827 1.00 0.00 H new ATOM 0 HG21 THR A 16 19.760 21.451 32.399 1.00 0.00 H new ATOM 0 HG22 THR A 16 20.276 21.187 30.716 1.00 0.00 H new ATOM 0 HG23 THR A 16 21.060 20.290 32.039 1.00 0.00 H new ATOM 194 N ASP A 17 21.800 20.982 29.111 1.00 0.00 N ATOM 195 CA ASP A 17 21.319 20.854 27.740 1.00 0.00 C ATOM 196 C ASP A 17 19.796 20.934 27.690 1.00 0.00 C ATOM 197 O ASP A 17 19.113 20.572 28.648 1.00 0.00 O ATOM 198 CB ASP A 17 21.793 19.534 27.132 1.00 0.00 C ATOM 199 CG ASP A 17 21.337 18.330 27.932 1.00 0.00 C ATOM 200 OD1 ASP A 17 21.855 18.129 29.050 1.00 0.00 O ATOM 201 OD2 ASP A 17 20.460 17.589 27.440 1.00 0.00 O ATOM 0 H ASP A 17 21.626 20.165 29.697 1.00 0.00 H new ATOM 0 HA ASP A 17 21.728 21.680 27.158 1.00 0.00 H new ATOM 0 HB2 ASP A 17 21.418 19.452 26.112 1.00 0.00 H new ATOM 0 HB3 ASP A 17 22.881 19.535 27.072 1.00 0.00 H new ATOM 206 N ASP A 18 19.271 21.410 26.566 1.00 0.00 N ATOM 207 CA ASP A 18 17.829 21.537 26.390 1.00 0.00 C ATOM 208 C ASP A 18 17.363 20.776 25.153 1.00 0.00 C ATOM 209 O ASP A 18 18.168 20.165 24.449 1.00 0.00 O ATOM 210 CB ASP A 18 17.436 23.011 26.276 1.00 0.00 C ATOM 211 CG ASP A 18 18.320 23.772 25.308 1.00 0.00 C ATOM 212 OD1 ASP A 18 17.997 23.797 24.102 1.00 0.00 O ATOM 213 OD2 ASP A 18 19.334 24.345 25.757 1.00 0.00 O ATOM 0 H ASP A 18 19.822 21.714 25.764 1.00 0.00 H new ATOM 0 HA ASP A 18 17.342 21.105 27.264 1.00 0.00 H new ATOM 0 HB2 ASP A 18 16.398 23.083 25.950 1.00 0.00 H new ATOM 0 HB3 ASP A 18 17.494 23.477 27.260 1.00 0.00 H new ATOM 218 N ILE A 19 16.060 20.816 24.895 1.00 0.00 N ATOM 219 CA ILE A 19 15.488 20.131 23.743 1.00 0.00 C ATOM 220 C ILE A 19 14.594 21.065 22.935 1.00 0.00 C ATOM 221 O ILE A 19 13.873 21.891 23.495 1.00 0.00 O ATOM 222 CB ILE A 19 14.670 18.898 24.171 1.00 0.00 C ATOM 223 CG1 ILE A 19 13.448 19.327 24.985 1.00 0.00 C ATOM 224 CG2 ILE A 19 15.537 17.939 24.973 1.00 0.00 C ATOM 225 CD1 ILE A 19 12.231 19.623 24.137 1.00 0.00 C ATOM 0 H ILE A 19 15.381 21.316 25.469 1.00 0.00 H new ATOM 0 HA ILE A 19 16.323 19.806 23.123 1.00 0.00 H new ATOM 0 HB ILE A 19 14.324 18.382 23.276 1.00 0.00 H new ATOM 0 HG12 ILE A 19 13.202 18.540 25.698 1.00 0.00 H new ATOM 0 HG13 ILE A 19 13.701 20.214 25.565 1.00 0.00 H new ATOM 0 HG21 ILE A 19 14.945 17.073 25.268 1.00 0.00 H new ATOM 0 HG22 ILE A 19 16.379 17.612 24.362 1.00 0.00 H new ATOM 0 HG23 ILE A 19 15.910 18.444 25.864 1.00 0.00 H new ATOM 0 HD11 ILE A 19 11.403 19.921 24.780 1.00 0.00 H new ATOM 0 HD12 ILE A 19 12.460 20.431 23.442 1.00 0.00 H new ATOM 0 HD13 ILE A 19 11.952 18.731 23.577 1.00 0.00 H new ATOM 237 N THR A 20 14.644 20.928 21.614 1.00 0.00 N ATOM 238 CA THR A 20 13.839 21.759 20.728 1.00 0.00 C ATOM 239 C THR A 20 13.469 21.007 19.455 1.00 0.00 C ATOM 240 O THR A 20 14.270 20.241 18.919 1.00 0.00 O ATOM 241 CB THR A 20 14.577 23.056 20.349 1.00 0.00 C ATOM 242 OG1 THR A 20 15.899 22.751 19.890 1.00 0.00 O ATOM 243 CG2 THR A 20 14.653 24.003 21.537 1.00 0.00 C ATOM 0 H THR A 20 15.234 20.249 21.134 1.00 0.00 H new ATOM 0 HA THR A 20 12.930 22.014 21.273 1.00 0.00 H new ATOM 0 HB THR A 20 14.019 23.545 19.550 1.00 0.00 H new ATOM 0 HG1 THR A 20 16.361 23.581 19.649 1.00 0.00 H new ATOM 0 HG21 THR A 20 15.179 24.912 21.245 1.00 0.00 H new ATOM 0 HG22 THR A 20 13.645 24.256 21.865 1.00 0.00 H new ATOM 0 HG23 THR A 20 15.190 23.520 22.353 1.00 0.00 H new ATOM 251 N VAL A 21 12.250 21.232 18.973 1.00 0.00 N ATOM 252 CA VAL A 21 11.775 20.576 17.760 1.00 0.00 C ATOM 253 C VAL A 21 11.231 21.594 16.763 1.00 0.00 C ATOM 254 O VAL A 21 10.088 22.036 16.872 1.00 0.00 O ATOM 255 CB VAL A 21 10.676 19.544 18.074 1.00 0.00 C ATOM 256 CG1 VAL A 21 9.696 20.100 19.097 1.00 0.00 C ATOM 257 CG2 VAL A 21 9.953 19.132 16.801 1.00 0.00 C ATOM 0 H VAL A 21 11.574 21.863 19.404 1.00 0.00 H new ATOM 0 HA VAL A 21 12.630 20.062 17.321 1.00 0.00 H new ATOM 0 HB VAL A 21 11.146 18.658 18.501 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.927 19.356 19.306 1.00 0.00 H new ATOM 0 HG12 VAL A 21 10.228 20.340 20.018 1.00 0.00 H new ATOM 0 HG13 VAL A 21 9.230 21.002 18.701 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.180 18.402 17.042 1.00 0.00 H new ATOM 0 HG22 VAL A 21 9.495 20.009 16.343 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.665 18.689 16.105 1.00 0.00 H new ATOM 267 N VAL A 22 12.059 21.960 15.790 1.00 0.00 N ATOM 268 CA VAL A 22 11.661 22.924 14.771 1.00 0.00 C ATOM 269 C VAL A 22 11.141 22.221 13.522 1.00 0.00 C ATOM 270 O VAL A 22 11.325 22.700 12.403 1.00 0.00 O ATOM 271 CB VAL A 22 12.834 23.842 14.378 1.00 0.00 C ATOM 272 CG1 VAL A 22 13.817 23.100 13.485 1.00 0.00 C ATOM 273 CG2 VAL A 22 12.320 25.098 13.691 1.00 0.00 C ATOM 0 H VAL A 22 13.009 21.604 15.686 1.00 0.00 H new ATOM 0 HA VAL A 22 10.864 23.529 15.203 1.00 0.00 H new ATOM 0 HB VAL A 22 13.359 24.141 15.285 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.639 23.764 13.218 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.209 22.233 14.017 1.00 0.00 H new ATOM 0 HG13 VAL A 22 13.308 22.770 12.579 1.00 0.00 H new ATOM 0 HG21 VAL A 22 13.162 25.735 13.420 1.00 0.00 H new ATOM 0 HG22 VAL A 22 11.770 24.822 12.791 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.659 25.639 14.368 1.00 0.00 H new ATOM 283 N THR A 23 10.487 21.080 13.721 1.00 0.00 N ATOM 284 CA THR A 23 9.940 20.310 12.611 1.00 0.00 C ATOM 285 C THR A 23 8.611 20.891 12.141 1.00 0.00 C ATOM 286 O THR A 23 7.793 21.330 12.950 1.00 0.00 O ATOM 287 CB THR A 23 9.733 18.834 13.001 1.00 0.00 C ATOM 288 OG1 THR A 23 10.924 18.314 13.600 1.00 0.00 O ATOM 289 CG2 THR A 23 9.366 17.999 11.783 1.00 0.00 C ATOM 0 H THR A 23 10.324 20.669 14.640 1.00 0.00 H new ATOM 0 HA THR A 23 10.665 20.366 11.799 1.00 0.00 H new ATOM 0 HB THR A 23 8.914 18.782 13.718 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.784 17.376 13.847 1.00 0.00 H new ATOM 0 HG21 THR A 23 9.225 16.961 12.083 1.00 0.00 H new ATOM 0 HG22 THR A 23 8.443 18.379 11.346 1.00 0.00 H new ATOM 0 HG23 THR A 23 10.167 18.058 11.046 1.00 0.00 H new ATOM 297 N LEU A 24 8.402 20.890 10.830 1.00 0.00 N ATOM 298 CA LEU A 24 7.171 21.417 10.251 1.00 0.00 C ATOM 299 C LEU A 24 6.496 20.374 9.365 1.00 0.00 C ATOM 300 O LEU A 24 7.121 19.807 8.470 1.00 0.00 O ATOM 301 CB LEU A 24 7.465 22.679 9.439 1.00 0.00 C ATOM 302 CG LEU A 24 6.579 22.911 8.214 1.00 0.00 C ATOM 303 CD1 LEU A 24 5.132 23.117 8.634 1.00 0.00 C ATOM 304 CD2 LEU A 24 7.079 24.104 7.413 1.00 0.00 C ATOM 0 H LEU A 24 9.069 20.530 10.147 1.00 0.00 H new ATOM 0 HA LEU A 24 6.493 21.668 11.067 1.00 0.00 H new ATOM 0 HB2 LEU A 24 7.371 23.541 10.099 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.503 22.641 9.110 1.00 0.00 H new ATOM 0 HG LEU A 24 6.629 22.026 7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.516 23.281 7.750 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.778 22.233 9.164 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.063 23.985 9.289 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.437 24.254 6.545 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.059 24.996 8.038 1.00 0.00 H new ATOM 0 HD23 LEU A 24 8.100 23.917 7.081 1.00 0.00 H new ATOM 316 N SER A 25 5.215 20.128 9.621 1.00 0.00 N ATOM 317 CA SER A 25 4.454 19.153 8.848 1.00 0.00 C ATOM 318 C SER A 25 2.955 19.338 9.063 1.00 0.00 C ATOM 319 O SER A 25 2.530 20.179 9.855 1.00 0.00 O ATOM 320 CB SER A 25 4.865 17.731 9.236 1.00 0.00 C ATOM 321 OG SER A 25 4.850 17.562 10.643 1.00 0.00 O ATOM 0 H SER A 25 4.682 20.590 10.358 1.00 0.00 H new ATOM 0 HA SER A 25 4.673 19.312 7.792 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.187 17.014 8.773 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.863 17.520 8.852 1.00 0.00 H new ATOM 0 HG SER A 25 5.115 16.645 10.865 1.00 0.00 H new ATOM 327 N ASP A 26 2.160 18.547 8.352 1.00 0.00 N ATOM 328 CA ASP A 26 0.708 18.622 8.465 1.00 0.00 C ATOM 329 C ASP A 26 0.124 17.272 8.871 1.00 0.00 C ATOM 330 O ASP A 26 -1.091 17.124 9.005 1.00 0.00 O ATOM 331 CB ASP A 26 0.095 19.079 7.140 1.00 0.00 C ATOM 332 CG ASP A 26 0.766 20.323 6.591 1.00 0.00 C ATOM 333 OD1 ASP A 26 1.167 21.186 7.400 1.00 0.00 O ATOM 334 OD2 ASP A 26 0.887 20.434 5.353 1.00 0.00 O ATOM 0 H ASP A 26 2.496 17.846 7.691 1.00 0.00 H new ATOM 0 HA ASP A 26 0.466 19.350 9.239 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.175 18.274 6.409 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -0.968 19.276 7.283 1.00 0.00 H new ATOM 339 N VAL A 27 0.998 16.289 9.063 1.00 0.00 N ATOM 340 CA VAL A 27 0.569 14.951 9.453 1.00 0.00 C ATOM 341 C VAL A 27 -0.534 15.011 10.503 1.00 0.00 C ATOM 342 O VAL A 27 -0.626 15.954 11.290 1.00 0.00 O ATOM 343 CB VAL A 27 1.745 14.124 10.007 1.00 0.00 C ATOM 344 CG1 VAL A 27 2.877 14.059 8.993 1.00 0.00 C ATOM 345 CG2 VAL A 27 2.232 14.708 11.325 1.00 0.00 C ATOM 0 H VAL A 27 2.007 16.394 8.955 1.00 0.00 H new ATOM 0 HA VAL A 27 0.185 14.468 8.555 1.00 0.00 H new ATOM 0 HB VAL A 27 1.397 13.108 10.192 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.699 13.471 9.402 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.518 13.592 8.076 1.00 0.00 H new ATOM 0 HG13 VAL A 27 3.227 15.068 8.773 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.063 14.112 11.702 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.564 15.734 11.168 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.419 14.697 12.051 1.00 0.00 H new ATOM 355 N PRO A 28 -1.394 13.982 10.518 1.00 0.00 N ATOM 356 CA PRO A 28 -2.507 13.894 11.467 1.00 0.00 C ATOM 357 C PRO A 28 -2.033 13.646 12.895 1.00 0.00 C ATOM 358 O PRO A 28 -0.926 13.155 13.115 1.00 0.00 O ATOM 359 CB PRO A 28 -3.316 12.698 10.957 1.00 0.00 C ATOM 360 CG PRO A 28 -2.329 11.863 10.216 1.00 0.00 C ATOM 361 CD PRO A 28 -1.345 12.824 9.609 1.00 0.00 C ATOM 0 HA PRO A 28 -3.076 14.822 11.513 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.765 12.143 11.781 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.130 13.019 10.307 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.829 11.164 10.886 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.821 11.270 9.445 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.344 12.395 9.558 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.626 13.099 8.592 1.00 0.00 H new ATOM 369 N SER A 29 -2.879 13.987 13.862 1.00 0.00 N ATOM 370 CA SER A 29 -2.544 13.804 15.270 1.00 0.00 C ATOM 371 C SER A 29 -3.377 12.683 15.885 1.00 0.00 C ATOM 372 O SER A 29 -3.365 12.481 17.098 1.00 0.00 O ATOM 373 CB SER A 29 -2.769 15.105 16.043 1.00 0.00 C ATOM 374 OG SER A 29 -1.730 16.035 15.789 1.00 0.00 O ATOM 0 H SER A 29 -3.801 14.391 13.697 1.00 0.00 H new ATOM 0 HA SER A 29 -1.491 13.529 15.335 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.728 15.539 15.759 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.819 14.893 17.111 1.00 0.00 H new ATOM 0 HG SER A 29 -1.898 16.859 16.293 1.00 0.00 H new ATOM 380 N ALA A 30 -4.100 11.959 15.037 1.00 0.00 N ATOM 381 CA ALA A 30 -4.938 10.858 15.496 1.00 0.00 C ATOM 382 C ALA A 30 -4.942 9.714 14.487 1.00 0.00 C ATOM 383 O ALA A 30 -4.992 9.924 13.275 1.00 0.00 O ATOM 384 CB ALA A 30 -6.357 11.344 15.750 1.00 0.00 C ATOM 0 H ALA A 30 -4.122 12.115 14.029 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.522 10.483 16.431 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -6.971 10.511 16.092 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.344 12.123 16.513 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.774 11.747 14.827 1.00 0.00 H new ATOM 390 N PRO A 31 -4.888 8.474 14.996 1.00 0.00 N ATOM 391 CA PRO A 31 -4.884 7.273 14.156 1.00 0.00 C ATOM 392 C PRO A 31 -6.227 7.039 13.473 1.00 0.00 C ATOM 393 O PRO A 31 -7.233 7.672 13.794 1.00 0.00 O ATOM 394 CB PRO A 31 -4.586 6.147 15.150 1.00 0.00 C ATOM 395 CG PRO A 31 -5.060 6.665 16.463 1.00 0.00 C ATOM 396 CD PRO A 31 -4.826 8.150 16.431 1.00 0.00 C ATOM 0 HA PRO A 31 -4.161 7.346 13.343 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -5.106 5.229 14.876 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -3.521 5.915 15.177 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -6.116 6.439 16.613 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -4.515 6.202 17.285 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -5.585 8.689 16.998 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -3.860 8.414 16.861 1.00 0.00 H new ATOM 404 N PRO A 32 -6.246 6.107 12.508 1.00 0.00 N ATOM 405 CA PRO A 32 -7.460 5.768 11.760 1.00 0.00 C ATOM 406 C PRO A 32 -8.486 5.038 12.621 1.00 0.00 C ATOM 407 O PRO A 32 -8.399 5.049 13.848 1.00 0.00 O ATOM 408 CB PRO A 32 -6.947 4.851 10.647 1.00 0.00 C ATOM 409 CG PRO A 32 -5.694 4.258 11.193 1.00 0.00 C ATOM 410 CD PRO A 32 -5.085 5.314 12.073 1.00 0.00 C ATOM 0 HA PRO A 32 -7.975 6.656 11.395 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -7.677 4.079 10.402 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -6.754 5.410 9.731 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.906 3.352 11.761 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -5.012 3.979 10.390 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.558 4.876 12.920 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.363 5.923 11.529 1.00 0.00 H new ATOM 418 N GLN A 33 -9.456 4.405 11.968 1.00 0.00 N ATOM 419 CA GLN A 33 -10.498 3.670 12.675 1.00 0.00 C ATOM 420 C GLN A 33 -10.694 2.284 12.069 1.00 0.00 C ATOM 421 O GLN A 33 -10.270 2.023 10.944 1.00 0.00 O ATOM 422 CB GLN A 33 -11.815 4.447 12.638 1.00 0.00 C ATOM 423 CG GLN A 33 -11.893 5.562 13.669 1.00 0.00 C ATOM 424 CD GLN A 33 -13.248 6.240 13.693 1.00 0.00 C ATOM 425 OE1 GLN A 33 -14.287 5.580 13.649 1.00 0.00 O ATOM 426 NE2 GLN A 33 -13.246 7.566 13.764 1.00 0.00 N ATOM 0 H GLN A 33 -9.542 4.387 10.952 1.00 0.00 H new ATOM 0 HA GLN A 33 -10.184 3.552 13.712 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -11.948 4.873 11.644 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.641 3.754 12.801 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.677 5.154 14.657 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -11.123 6.304 13.455 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.362 8.074 13.799 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.129 8.077 13.784 1.00 0.00 H new ATOM 435 N ASN A 34 -11.340 1.400 12.822 1.00 0.00 N ATOM 436 CA ASN A 34 -11.591 0.040 12.359 1.00 0.00 C ATOM 437 C ASN A 34 -10.283 -0.678 12.044 1.00 0.00 C ATOM 438 O ASN A 34 -10.120 -1.251 10.967 1.00 0.00 O ATOM 439 CB ASN A 34 -12.487 0.060 11.118 1.00 0.00 C ATOM 440 CG ASN A 34 -12.886 -1.333 10.671 1.00 0.00 C ATOM 441 OD1 ASN A 34 -12.563 -2.324 11.327 1.00 0.00 O ATOM 442 ND2 ASN A 34 -13.591 -1.415 9.549 1.00 0.00 N ATOM 0 H ASN A 34 -11.699 1.601 13.755 1.00 0.00 H new ATOM 0 HA ASN A 34 -12.098 -0.502 13.157 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -13.384 0.641 11.330 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.965 0.564 10.305 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -13.887 -2.326 9.198 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -13.836 -0.567 9.038 1.00 0.00 H new ATOM 449 N VAL A 35 -9.352 -0.644 12.993 1.00 0.00 N ATOM 450 CA VAL A 35 -8.059 -1.293 12.818 1.00 0.00 C ATOM 451 C VAL A 35 -8.047 -2.676 13.459 1.00 0.00 C ATOM 452 O VAL A 35 -7.765 -2.818 14.649 1.00 0.00 O ATOM 453 CB VAL A 35 -6.921 -0.449 13.424 1.00 0.00 C ATOM 454 CG1 VAL A 35 -5.568 -1.060 13.092 1.00 0.00 C ATOM 455 CG2 VAL A 35 -7.003 0.987 12.930 1.00 0.00 C ATOM 0 H VAL A 35 -9.470 -0.174 13.890 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.897 -1.392 11.745 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.033 -0.443 14.508 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.777 -0.450 13.528 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.515 -2.070 13.500 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.442 -1.098 12.010 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.192 1.569 13.368 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.916 1.004 11.844 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.960 1.419 13.224 1.00 0.00 H new ATOM 465 N SER A 36 -8.355 -3.694 12.662 1.00 0.00 N ATOM 466 CA SER A 36 -8.383 -5.067 13.152 1.00 0.00 C ATOM 467 C SER A 36 -8.013 -6.048 12.043 1.00 0.00 C ATOM 468 O SER A 36 -8.027 -5.701 10.861 1.00 0.00 O ATOM 469 CB SER A 36 -9.769 -5.406 13.705 1.00 0.00 C ATOM 470 OG SER A 36 -10.732 -5.461 12.667 1.00 0.00 O ATOM 0 H SER A 36 -8.589 -3.594 11.674 1.00 0.00 H new ATOM 0 HA SER A 36 -7.648 -5.155 13.952 1.00 0.00 H new ATOM 0 HB2 SER A 36 -9.733 -6.364 14.223 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.064 -4.657 14.440 1.00 0.00 H new ATOM 0 HG SER A 36 -11.609 -5.681 13.046 1.00 0.00 H new ATOM 476 N LEU A 37 -7.680 -7.273 12.432 1.00 0.00 N ATOM 477 CA LEU A 37 -7.305 -8.306 11.473 1.00 0.00 C ATOM 478 C LEU A 37 -8.410 -9.348 11.334 1.00 0.00 C ATOM 479 O LEU A 37 -9.196 -9.559 12.257 1.00 0.00 O ATOM 480 CB LEU A 37 -6.002 -8.981 11.903 1.00 0.00 C ATOM 481 CG LEU A 37 -4.871 -8.046 12.332 1.00 0.00 C ATOM 482 CD1 LEU A 37 -3.764 -8.828 13.022 1.00 0.00 C ATOM 483 CD2 LEU A 37 -4.323 -7.287 11.132 1.00 0.00 C ATOM 0 H LEU A 37 -7.662 -7.576 13.406 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.157 -7.830 10.504 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.222 -9.656 12.730 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.645 -9.595 11.077 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.273 -7.323 13.042 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.968 -8.146 13.320 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.166 -9.325 13.905 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.364 -9.575 12.336 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.519 -6.626 11.456 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.938 -7.995 10.399 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.120 -6.695 10.681 1.00 0.00 H new ATOM 495 N GLU A 38 -8.461 -9.999 10.176 1.00 0.00 N ATOM 496 CA GLU A 38 -9.470 -11.020 9.918 1.00 0.00 C ATOM 497 C GLU A 38 -8.847 -12.242 9.250 1.00 0.00 C ATOM 498 O GLU A 38 -8.270 -12.145 8.167 1.00 0.00 O ATOM 499 CB GLU A 38 -10.586 -10.456 9.037 1.00 0.00 C ATOM 500 CG GLU A 38 -11.913 -11.177 9.200 1.00 0.00 C ATOM 501 CD GLU A 38 -13.055 -10.462 8.504 1.00 0.00 C ATOM 502 OE1 GLU A 38 -13.402 -9.341 8.930 1.00 0.00 O ATOM 503 OE2 GLU A 38 -13.601 -11.025 7.532 1.00 0.00 O ATOM 0 H GLU A 38 -7.816 -9.838 9.402 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.894 -11.326 10.875 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.724 -9.401 9.272 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.277 -10.513 7.993 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.825 -12.187 8.801 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.142 -11.273 10.261 1.00 0.00 H new ATOM 510 N VAL A 39 -8.968 -13.393 9.903 1.00 0.00 N ATOM 511 CA VAL A 39 -8.419 -14.635 9.373 1.00 0.00 C ATOM 512 C VAL A 39 -9.423 -15.337 8.465 1.00 0.00 C ATOM 513 O VAL A 39 -10.289 -16.075 8.933 1.00 0.00 O ATOM 514 CB VAL A 39 -8.008 -15.596 10.505 1.00 0.00 C ATOM 515 CG1 VAL A 39 -7.414 -16.874 9.932 1.00 0.00 C ATOM 516 CG2 VAL A 39 -7.026 -14.918 11.448 1.00 0.00 C ATOM 0 H VAL A 39 -9.442 -13.491 10.801 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.535 -14.368 8.794 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.899 -15.862 11.074 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.130 -17.540 10.747 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.153 -17.367 9.301 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.533 -16.631 9.338 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.746 -15.611 12.242 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.135 -14.622 10.894 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.492 -14.035 11.885 1.00 0.00 H new ATOM 526 N VAL A 40 -9.299 -15.102 7.162 1.00 0.00 N ATOM 527 CA VAL A 40 -10.195 -15.713 6.187 1.00 0.00 C ATOM 528 C VAL A 40 -9.851 -17.182 5.969 1.00 0.00 C ATOM 529 O VAL A 40 -10.735 -18.014 5.769 1.00 0.00 O ATOM 530 CB VAL A 40 -10.138 -14.977 4.835 1.00 0.00 C ATOM 531 CG1 VAL A 40 -11.139 -15.576 3.859 1.00 0.00 C ATOM 532 CG2 VAL A 40 -10.391 -13.490 5.027 1.00 0.00 C ATOM 0 H VAL A 40 -8.587 -14.493 6.758 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.204 -15.636 6.592 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.140 -15.100 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.085 -15.044 2.909 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.906 -16.629 3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -12.145 -15.486 4.268 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.347 -12.986 4.062 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.377 -13.343 5.469 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.631 -13.074 5.689 1.00 0.00 H new ATOM 542 N ASN A 41 -8.559 -17.494 6.010 1.00 0.00 N ATOM 543 CA ASN A 41 -8.097 -18.863 5.817 1.00 0.00 C ATOM 544 C ASN A 41 -6.700 -19.053 6.399 1.00 0.00 C ATOM 545 O ASN A 41 -6.147 -18.146 7.021 1.00 0.00 O ATOM 546 CB ASN A 41 -8.095 -19.218 4.329 1.00 0.00 C ATOM 547 CG ASN A 41 -9.486 -19.196 3.727 1.00 0.00 C ATOM 548 OD1 ASN A 41 -10.389 -19.890 4.195 1.00 0.00 O ATOM 549 ND2 ASN A 41 -9.666 -18.395 2.683 1.00 0.00 N ATOM 0 H ASN A 41 -7.814 -16.817 6.175 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.783 -19.529 6.341 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.458 -18.515 3.792 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.660 -20.208 4.195 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -10.581 -18.337 2.236 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.889 -17.837 2.328 1.00 0.00 H new ATOM 556 N SER A 42 -6.135 -20.239 6.193 1.00 0.00 N ATOM 557 CA SER A 42 -4.803 -20.549 6.700 1.00 0.00 C ATOM 558 C SER A 42 -3.731 -19.838 5.880 1.00 0.00 C ATOM 559 O SER A 42 -2.601 -19.661 6.336 1.00 0.00 O ATOM 560 CB SER A 42 -4.564 -22.060 6.673 1.00 0.00 C ATOM 561 OG SER A 42 -4.652 -22.567 5.352 1.00 0.00 O ATOM 0 H SER A 42 -6.579 -21.000 5.679 1.00 0.00 H new ATOM 0 HA SER A 42 -4.741 -20.197 7.730 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.581 -22.283 7.087 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.297 -22.559 7.307 1.00 0.00 H new ATOM 0 HG SER A 42 -4.494 -23.534 5.362 1.00 0.00 H new ATOM 567 N ARG A 43 -4.093 -19.433 4.667 1.00 0.00 N ATOM 568 CA ARG A 43 -3.163 -18.742 3.783 1.00 0.00 C ATOM 569 C ARG A 43 -3.794 -17.475 3.212 1.00 0.00 C ATOM 570 O ARG A 43 -3.407 -17.005 2.143 1.00 0.00 O ATOM 571 CB ARG A 43 -2.728 -19.666 2.643 1.00 0.00 C ATOM 572 CG ARG A 43 -3.820 -19.924 1.618 1.00 0.00 C ATOM 573 CD ARG A 43 -3.377 -20.938 0.575 1.00 0.00 C ATOM 574 NE ARG A 43 -3.036 -22.225 1.174 1.00 0.00 N ATOM 575 CZ ARG A 43 -1.840 -22.507 1.679 1.00 0.00 C ATOM 576 NH1 ARG A 43 -0.877 -21.597 1.659 1.00 0.00 N ATOM 577 NH2 ARG A 43 -1.607 -23.702 2.207 1.00 0.00 N ATOM 0 H ARG A 43 -5.024 -19.572 4.274 1.00 0.00 H new ATOM 0 HA ARG A 43 -2.287 -18.459 4.368 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -1.866 -19.228 2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -2.403 -20.618 3.062 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.716 -20.287 2.122 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -4.088 -18.989 1.127 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -4.173 -21.078 -0.156 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -2.514 -20.549 0.035 1.00 0.00 H new ATOM 0 HE ARG A 43 -3.755 -22.947 1.207 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -1.053 -20.677 1.255 1.00 0.00 H new ATOM 0 HH12 ARG A 43 0.040 -21.816 2.048 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -2.346 -24.404 2.225 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -0.689 -23.918 2.595 1.00 0.00 H new ATOM 591 N SER A 44 -4.768 -16.929 3.933 1.00 0.00 N ATOM 592 CA SER A 44 -5.456 -15.719 3.497 1.00 0.00 C ATOM 593 C SER A 44 -5.919 -14.896 4.695 1.00 0.00 C ATOM 594 O SER A 44 -6.526 -15.424 5.627 1.00 0.00 O ATOM 595 CB SER A 44 -6.654 -16.078 2.616 1.00 0.00 C ATOM 596 OG SER A 44 -6.270 -16.946 1.562 1.00 0.00 O ATOM 0 H SER A 44 -5.099 -17.305 4.822 1.00 0.00 H new ATOM 0 HA SER A 44 -4.754 -15.120 2.917 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.425 -16.555 3.221 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.091 -15.169 2.202 1.00 0.00 H new ATOM 0 HG SER A 44 -7.053 -17.162 1.014 1.00 0.00 H new ATOM 602 N ILE A 45 -5.629 -13.600 4.662 1.00 0.00 N ATOM 603 CA ILE A 45 -6.017 -12.703 5.743 1.00 0.00 C ATOM 604 C ILE A 45 -6.533 -11.376 5.198 1.00 0.00 C ATOM 605 O ILE A 45 -5.833 -10.678 4.465 1.00 0.00 O ATOM 606 CB ILE A 45 -4.839 -12.430 6.697 1.00 0.00 C ATOM 607 CG1 ILE A 45 -4.401 -13.724 7.386 1.00 0.00 C ATOM 608 CG2 ILE A 45 -5.225 -11.379 7.728 1.00 0.00 C ATOM 609 CD1 ILE A 45 -3.250 -13.536 8.350 1.00 0.00 C ATOM 0 H ILE A 45 -5.127 -13.148 3.898 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.814 -13.200 6.295 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.000 -12.049 6.115 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.250 -14.145 7.924 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.113 -14.451 6.627 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.382 -11.197 8.395 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -5.493 -10.452 7.220 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.077 -11.734 8.308 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.993 -14.494 8.801 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.386 -13.144 7.813 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.541 -12.834 9.131 1.00 0.00 H new ATOM 621 N LYS A 46 -7.764 -11.032 5.563 1.00 0.00 N ATOM 622 CA LYS A 46 -8.376 -9.787 5.114 1.00 0.00 C ATOM 623 C LYS A 46 -8.085 -8.654 6.093 1.00 0.00 C ATOM 624 O LYS A 46 -8.039 -8.864 7.305 1.00 0.00 O ATOM 625 CB LYS A 46 -9.888 -9.965 4.958 1.00 0.00 C ATOM 626 CG LYS A 46 -10.622 -8.674 4.638 1.00 0.00 C ATOM 627 CD LYS A 46 -10.617 -8.386 3.146 1.00 0.00 C ATOM 628 CE LYS A 46 -11.757 -7.458 2.754 1.00 0.00 C ATOM 629 NZ LYS A 46 -13.083 -8.124 2.883 1.00 0.00 N ATOM 0 H LYS A 46 -8.357 -11.599 6.169 1.00 0.00 H new ATOM 0 HA LYS A 46 -7.945 -9.528 4.147 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.081 -10.689 4.166 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.293 -10.385 5.879 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.650 -8.741 4.993 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -10.154 -7.846 5.171 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.666 -7.934 2.865 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.702 -9.322 2.593 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.734 -6.569 3.384 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -11.617 -7.124 1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -13.777 -7.635 2.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -13.003 -9.117 2.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -13.396 -8.085 3.874 1.00 0.00 H new ATOM 643 N VAL A 47 -7.889 -7.452 5.560 1.00 0.00 N ATOM 644 CA VAL A 47 -7.605 -6.285 6.386 1.00 0.00 C ATOM 645 C VAL A 47 -8.405 -5.074 5.920 1.00 0.00 C ATOM 646 O VAL A 47 -8.570 -4.850 4.721 1.00 0.00 O ATOM 647 CB VAL A 47 -6.106 -5.936 6.367 1.00 0.00 C ATOM 648 CG1 VAL A 47 -5.827 -4.731 7.254 1.00 0.00 C ATOM 649 CG2 VAL A 47 -5.274 -7.133 6.803 1.00 0.00 C ATOM 0 H VAL A 47 -7.922 -7.261 4.559 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.898 -6.539 7.405 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.824 -5.679 5.346 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.762 -4.499 7.228 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -6.394 -3.874 6.892 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -6.124 -4.956 8.278 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -4.217 -6.868 6.783 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.557 -7.423 7.815 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.452 -7.966 6.123 1.00 0.00 H new ATOM 659 N SER A 48 -8.899 -4.294 6.877 1.00 0.00 N ATOM 660 CA SER A 48 -9.684 -3.106 6.564 1.00 0.00 C ATOM 661 C SER A 48 -9.322 -1.955 7.498 1.00 0.00 C ATOM 662 O SER A 48 -8.584 -2.135 8.466 1.00 0.00 O ATOM 663 CB SER A 48 -11.179 -3.414 6.672 1.00 0.00 C ATOM 664 OG SER A 48 -11.489 -4.008 7.921 1.00 0.00 O ATOM 0 H SER A 48 -8.769 -4.464 7.874 1.00 0.00 H new ATOM 0 HA SER A 48 -9.455 -2.808 5.541 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.752 -2.495 6.551 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.475 -4.083 5.864 1.00 0.00 H new ATOM 0 HG SER A 48 -12.450 -4.193 7.965 1.00 0.00 H new ATOM 670 N TRP A 49 -9.847 -0.772 7.199 1.00 0.00 N ATOM 671 CA TRP A 49 -9.580 0.410 8.010 1.00 0.00 C ATOM 672 C TRP A 49 -10.532 1.545 7.649 1.00 0.00 C ATOM 673 O TRP A 49 -11.302 1.442 6.693 1.00 0.00 O ATOM 674 CB TRP A 49 -8.131 0.864 7.825 1.00 0.00 C ATOM 675 CG TRP A 49 -7.747 1.051 6.388 1.00 0.00 C ATOM 676 CD1 TRP A 49 -7.833 2.204 5.660 1.00 0.00 C ATOM 677 CD2 TRP A 49 -7.217 0.056 5.506 1.00 0.00 C ATOM 678 NE1 TRP A 49 -7.389 1.984 4.379 1.00 0.00 N ATOM 679 CE2 TRP A 49 -7.005 0.675 4.259 1.00 0.00 C ATOM 680 CE3 TRP A 49 -6.900 -1.297 5.649 1.00 0.00 C ATOM 681 CZ2 TRP A 49 -6.492 -0.014 3.164 1.00 0.00 C ATOM 682 CZ3 TRP A 49 -6.390 -1.980 4.561 1.00 0.00 C ATOM 683 CH2 TRP A 49 -6.190 -1.339 3.332 1.00 0.00 C ATOM 0 H TRP A 49 -10.460 -0.606 6.401 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.740 0.146 9.055 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -7.981 1.802 8.359 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -7.466 0.129 8.279 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -8.196 3.149 6.036 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -7.351 2.683 3.637 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -7.051 -1.800 6.593 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -6.338 0.479 2.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -6.141 -3.026 4.660 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -5.790 -1.901 2.501 1.00 0.00 H new ATOM 694 N LEU A 50 -10.474 2.626 8.418 1.00 0.00 N ATOM 695 CA LEU A 50 -11.332 3.782 8.179 1.00 0.00 C ATOM 696 C LEU A 50 -10.594 5.081 8.487 1.00 0.00 C ATOM 697 O LEU A 50 -9.612 5.105 9.230 1.00 0.00 O ATOM 698 CB LEU A 50 -12.599 3.687 9.031 1.00 0.00 C ATOM 699 CG LEU A 50 -13.740 2.854 8.446 1.00 0.00 C ATOM 700 CD1 LEU A 50 -14.623 2.305 9.556 1.00 0.00 C ATOM 701 CD2 LEU A 50 -14.560 3.684 7.469 1.00 0.00 C ATOM 0 H LEU A 50 -9.842 2.727 9.212 1.00 0.00 H new ATOM 0 HA LEU A 50 -11.610 3.785 7.125 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -12.330 3.268 10.001 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -12.968 4.697 9.211 1.00 0.00 H new ATOM 0 HG LEU A 50 -13.309 2.013 7.903 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -15.430 1.715 9.121 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.028 1.675 10.216 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -15.046 3.132 10.127 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -15.367 3.075 7.063 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -14.981 4.546 7.987 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -13.920 4.027 6.656 1.00 0.00 H new ATOM 713 N PRO A 51 -11.078 6.189 7.906 1.00 0.00 N ATOM 714 CA PRO A 51 -10.481 7.513 8.107 1.00 0.00 C ATOM 715 C PRO A 51 -10.701 8.040 9.521 1.00 0.00 C ATOM 716 O PRO A 51 -11.603 7.606 10.238 1.00 0.00 O ATOM 717 CB PRO A 51 -11.214 8.390 7.089 1.00 0.00 C ATOM 718 CG PRO A 51 -12.520 7.707 6.871 1.00 0.00 C ATOM 719 CD PRO A 51 -12.245 6.235 7.010 1.00 0.00 C ATOM 0 HA PRO A 51 -9.399 7.497 7.976 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.355 9.402 7.468 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.651 8.473 6.160 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -13.259 8.037 7.601 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -12.921 7.938 5.884 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -13.098 5.705 7.434 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -12.030 5.774 6.046 1.00 0.00 H new ATOM 727 N PRO A 52 -9.859 8.999 9.934 1.00 0.00 N ATOM 728 CA PRO A 52 -9.942 9.606 11.265 1.00 0.00 C ATOM 729 C PRO A 52 -11.177 10.486 11.424 1.00 0.00 C ATOM 730 O PRO A 52 -11.843 10.845 10.453 1.00 0.00 O ATOM 731 CB PRO A 52 -8.669 10.451 11.350 1.00 0.00 C ATOM 732 CG PRO A 52 -8.323 10.759 9.934 1.00 0.00 C ATOM 733 CD PRO A 52 -8.760 9.564 9.132 1.00 0.00 C ATOM 0 HA PRO A 52 -10.024 8.855 12.051 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -8.837 11.362 11.924 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.865 9.906 11.845 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.830 11.663 9.596 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.253 10.934 9.823 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -9.096 9.850 8.135 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.948 8.848 9.002 1.00 0.00 H new ATOM 741 N PRO A 53 -11.493 10.844 12.678 1.00 0.00 N ATOM 742 CA PRO A 53 -12.649 11.687 12.993 1.00 0.00 C ATOM 743 C PRO A 53 -12.462 13.127 12.526 1.00 0.00 C ATOM 744 O PRO A 53 -11.339 13.628 12.464 1.00 0.00 O ATOM 745 CB PRO A 53 -12.726 11.627 14.521 1.00 0.00 C ATOM 746 CG PRO A 53 -11.335 11.323 14.959 1.00 0.00 C ATOM 747 CD PRO A 53 -10.744 10.452 13.884 1.00 0.00 C ATOM 0 HA PRO A 53 -13.553 11.341 12.492 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -13.074 12.572 14.937 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.423 10.857 14.852 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.756 12.238 15.082 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.332 10.812 15.922 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.674 10.627 13.768 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -10.871 9.393 14.110 1.00 0.00 H new ATOM 755 N SER A 54 -13.568 13.787 12.198 1.00 0.00 N ATOM 756 CA SER A 54 -13.525 15.168 11.733 1.00 0.00 C ATOM 757 C SER A 54 -12.718 16.039 12.691 1.00 0.00 C ATOM 758 O SER A 54 -12.424 15.636 13.816 1.00 0.00 O ATOM 759 CB SER A 54 -14.943 15.725 11.591 1.00 0.00 C ATOM 760 OG SER A 54 -15.585 15.812 12.851 1.00 0.00 O ATOM 0 H SER A 54 -14.505 13.387 12.246 1.00 0.00 H new ATOM 0 HA SER A 54 -13.037 15.182 10.758 1.00 0.00 H new ATOM 0 HB2 SER A 54 -14.905 16.712 11.130 1.00 0.00 H new ATOM 0 HB3 SER A 54 -15.524 15.085 10.927 1.00 0.00 H new ATOM 0 HG SER A 54 -16.489 16.172 12.733 1.00 0.00 H new ATOM 766 N GLY A 55 -12.362 17.236 12.235 1.00 0.00 N ATOM 767 CA GLY A 55 -11.592 18.146 13.063 1.00 0.00 C ATOM 768 C GLY A 55 -10.113 17.813 13.070 1.00 0.00 C ATOM 769 O GLY A 55 -9.281 18.637 12.690 1.00 0.00 O ATOM 0 H GLY A 55 -12.593 17.592 11.307 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.730 19.165 12.703 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.973 18.114 14.084 1.00 0.00 H new ATOM 773 N THR A 56 -9.783 16.601 13.506 1.00 0.00 N ATOM 774 CA THR A 56 -8.395 16.162 13.565 1.00 0.00 C ATOM 775 C THR A 56 -7.783 16.085 12.171 1.00 0.00 C ATOM 776 O THR A 56 -6.582 16.286 11.999 1.00 0.00 O ATOM 777 CB THR A 56 -8.270 14.785 14.245 1.00 0.00 C ATOM 778 OG1 THR A 56 -8.887 13.780 13.433 1.00 0.00 O ATOM 779 CG2 THR A 56 -8.916 14.801 15.622 1.00 0.00 C ATOM 0 H THR A 56 -10.459 15.906 13.823 1.00 0.00 H new ATOM 0 HA THR A 56 -7.854 16.901 14.156 1.00 0.00 H new ATOM 0 HB THR A 56 -7.211 14.556 14.362 1.00 0.00 H new ATOM 0 HG1 THR A 56 -9.783 14.077 13.170 1.00 0.00 H new ATOM 0 HG21 THR A 56 -8.815 13.818 16.083 1.00 0.00 H new ATOM 0 HG22 THR A 56 -8.424 15.547 16.246 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.973 15.050 15.525 1.00 0.00 H new ATOM 787 N GLN A 57 -8.618 15.793 11.179 1.00 0.00 N ATOM 788 CA GLN A 57 -8.158 15.690 9.799 1.00 0.00 C ATOM 789 C GLN A 57 -7.402 16.947 9.382 1.00 0.00 C ATOM 790 O GLN A 57 -7.969 18.038 9.338 1.00 0.00 O ATOM 791 CB GLN A 57 -9.343 15.458 8.860 1.00 0.00 C ATOM 792 CG GLN A 57 -9.714 13.993 8.699 1.00 0.00 C ATOM 793 CD GLN A 57 -10.988 13.798 7.900 1.00 0.00 C ATOM 794 OE1 GLN A 57 -11.442 14.705 7.203 1.00 0.00 O ATOM 795 NE2 GLN A 57 -11.572 12.609 7.998 1.00 0.00 N ATOM 0 H GLN A 57 -9.616 15.624 11.305 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.479 14.840 9.732 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -10.208 16.004 9.238 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -9.107 15.874 7.881 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -8.896 13.467 8.206 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.835 13.542 9.684 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -11.161 11.886 8.588 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -12.432 12.419 7.483 1.00 0.00 H new ATOM 804 N ASN A 58 -6.118 16.786 9.077 1.00 0.00 N ATOM 805 CA ASN A 58 -5.284 17.908 8.665 1.00 0.00 C ATOM 806 C ASN A 58 -5.306 18.074 7.148 1.00 0.00 C ATOM 807 O ASN A 58 -5.104 19.172 6.630 1.00 0.00 O ATOM 808 CB ASN A 58 -3.845 17.705 9.146 1.00 0.00 C ATOM 809 CG ASN A 58 -3.118 19.018 9.364 1.00 0.00 C ATOM 810 OD1 ASN A 58 -2.614 19.288 10.454 1.00 0.00 O ATOM 811 ND2 ASN A 58 -3.060 19.842 8.324 1.00 0.00 N ATOM 0 H ASN A 58 -5.633 15.889 9.108 1.00 0.00 H new ATOM 0 HA ASN A 58 -5.687 18.814 9.118 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -3.852 17.138 10.077 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -3.301 17.109 8.414 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -2.583 20.740 8.411 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -3.492 19.577 7.439 1.00 0.00 H new ATOM 818 N GLY A 59 -5.554 16.975 6.442 1.00 0.00 N ATOM 819 CA GLY A 59 -5.598 17.020 4.992 1.00 0.00 C ATOM 820 C GLY A 59 -6.334 15.836 4.397 1.00 0.00 C ATOM 821 O GLY A 59 -6.367 14.756 4.988 1.00 0.00 O ATOM 0 H GLY A 59 -5.725 16.055 6.848 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -6.084 17.943 4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.581 17.045 4.601 1.00 0.00 H new ATOM 825 N PHE A 60 -6.928 16.038 3.226 1.00 0.00 N ATOM 826 CA PHE A 60 -7.670 14.978 2.552 1.00 0.00 C ATOM 827 C PHE A 60 -6.810 13.727 2.394 1.00 0.00 C ATOM 828 O PHE A 60 -5.790 13.746 1.704 1.00 0.00 O ATOM 829 CB PHE A 60 -8.151 15.456 1.181 1.00 0.00 C ATOM 830 CG PHE A 60 -8.805 14.377 0.366 1.00 0.00 C ATOM 831 CD1 PHE A 60 -10.088 13.947 0.662 1.00 0.00 C ATOM 832 CD2 PHE A 60 -8.135 13.791 -0.697 1.00 0.00 C ATOM 833 CE1 PHE A 60 -10.693 12.955 -0.087 1.00 0.00 C ATOM 834 CE2 PHE A 60 -8.735 12.799 -1.449 1.00 0.00 C ATOM 835 CZ PHE A 60 -10.014 12.379 -1.143 1.00 0.00 C ATOM 0 H PHE A 60 -6.910 16.926 2.724 1.00 0.00 H new ATOM 0 HA PHE A 60 -8.535 14.727 3.166 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -8.857 16.275 1.318 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -7.302 15.856 0.626 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.622 14.392 1.488 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -7.133 14.113 -0.940 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -11.695 12.631 0.153 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -8.203 12.352 -2.276 1.00 0.00 H new ATOM 0 HZ PHE A 60 -10.483 11.602 -1.728 1.00 0.00 H new ATOM 845 N ILE A 61 -7.228 12.644 3.040 1.00 0.00 N ATOM 846 CA ILE A 61 -6.496 11.385 2.971 1.00 0.00 C ATOM 847 C ILE A 61 -6.356 10.909 1.529 1.00 0.00 C ATOM 848 O ILE A 61 -7.298 10.372 0.946 1.00 0.00 O ATOM 849 CB ILE A 61 -7.189 10.285 3.798 1.00 0.00 C ATOM 850 CG1 ILE A 61 -7.031 10.566 5.293 1.00 0.00 C ATOM 851 CG2 ILE A 61 -6.619 8.920 3.446 1.00 0.00 C ATOM 852 CD1 ILE A 61 -7.828 11.759 5.772 1.00 0.00 C ATOM 0 H ILE A 61 -8.069 12.613 3.617 1.00 0.00 H new ATOM 0 HA ILE A 61 -5.506 11.572 3.387 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.252 10.285 3.558 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.340 9.684 5.855 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.977 10.732 5.514 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -7.119 8.153 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -6.779 8.721 2.386 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.550 8.906 3.661 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.668 11.898 6.841 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -7.504 12.652 5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.888 11.588 5.583 1.00 0.00 H new ATOM 864 N THR A 62 -5.172 11.107 0.958 1.00 0.00 N ATOM 865 CA THR A 62 -4.907 10.698 -0.415 1.00 0.00 C ATOM 866 C THR A 62 -4.934 9.180 -0.551 1.00 0.00 C ATOM 867 O THR A 62 -5.346 8.647 -1.580 1.00 0.00 O ATOM 868 CB THR A 62 -3.543 11.221 -0.904 1.00 0.00 C ATOM 869 OG1 THR A 62 -2.488 10.628 -0.139 1.00 0.00 O ATOM 870 CG2 THR A 62 -3.472 12.736 -0.788 1.00 0.00 C ATOM 0 H THR A 62 -4.381 11.549 1.426 1.00 0.00 H new ATOM 0 HA THR A 62 -5.696 11.130 -1.031 1.00 0.00 H new ATOM 0 HB THR A 62 -3.428 10.947 -1.953 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.624 10.964 -0.457 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.500 13.083 -1.139 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.258 13.185 -1.395 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.607 13.028 0.253 1.00 0.00 H new ATOM 878 N GLY A 63 -4.493 8.488 0.495 1.00 0.00 N ATOM 879 CA GLY A 63 -4.476 7.037 0.471 1.00 0.00 C ATOM 880 C GLY A 63 -4.222 6.438 1.840 1.00 0.00 C ATOM 881 O GLY A 63 -4.550 7.042 2.861 1.00 0.00 O ATOM 0 H GLY A 63 -4.147 8.906 1.359 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.429 6.672 0.089 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.705 6.697 -0.220 1.00 0.00 H new ATOM 885 N TYR A 64 -3.637 5.245 1.862 1.00 0.00 N ATOM 886 CA TYR A 64 -3.342 4.562 3.116 1.00 0.00 C ATOM 887 C TYR A 64 -2.110 3.673 2.976 1.00 0.00 C ATOM 888 O TYR A 64 -1.754 3.254 1.875 1.00 0.00 O ATOM 889 CB TYR A 64 -4.542 3.723 3.558 1.00 0.00 C ATOM 890 CG TYR A 64 -5.730 4.549 3.999 1.00 0.00 C ATOM 891 CD1 TYR A 64 -5.833 5.010 5.305 1.00 0.00 C ATOM 892 CD2 TYR A 64 -6.748 4.867 3.109 1.00 0.00 C ATOM 893 CE1 TYR A 64 -6.916 5.765 5.713 1.00 0.00 C ATOM 894 CE2 TYR A 64 -7.834 5.622 3.508 1.00 0.00 C ATOM 895 CZ TYR A 64 -7.914 6.068 4.810 1.00 0.00 C ATOM 896 OH TYR A 64 -8.995 6.820 5.211 1.00 0.00 O ATOM 0 H TYR A 64 -3.358 4.731 1.026 1.00 0.00 H new ATOM 0 HA TYR A 64 -3.137 5.319 3.873 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.845 3.076 2.735 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -4.238 3.073 4.378 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -5.053 4.774 6.014 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -6.690 4.518 2.088 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -6.981 6.116 6.732 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -8.617 5.862 2.803 1.00 0.00 H new ATOM 0 HH TYR A 64 -9.606 6.944 4.455 1.00 0.00 H new ATOM 906 N LYS A 65 -1.463 3.389 4.101 1.00 0.00 N ATOM 907 CA LYS A 65 -0.271 2.549 4.108 1.00 0.00 C ATOM 908 C LYS A 65 -0.426 1.392 5.090 1.00 0.00 C ATOM 909 O LYS A 65 -0.764 1.597 6.256 1.00 0.00 O ATOM 910 CB LYS A 65 0.962 3.379 4.472 1.00 0.00 C ATOM 911 CG LYS A 65 2.275 2.650 4.246 1.00 0.00 C ATOM 912 CD LYS A 65 3.467 3.567 4.466 1.00 0.00 C ATOM 913 CE LYS A 65 3.638 4.544 3.313 1.00 0.00 C ATOM 914 NZ LYS A 65 4.434 3.955 2.200 1.00 0.00 N ATOM 0 H LYS A 65 -1.744 3.729 5.021 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.142 2.138 3.107 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.959 4.296 3.883 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.895 3.673 5.519 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.340 1.798 4.923 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.302 2.254 3.231 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.336 4.120 5.396 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.372 2.969 4.575 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.658 4.841 2.941 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.130 5.448 3.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.442 4.612 1.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 5.409 3.788 2.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.007 3.053 1.907 1.00 0.00 H new ATOM 928 N ILE A 66 -0.176 0.178 4.611 1.00 0.00 N ATOM 929 CA ILE A 66 -0.285 -1.010 5.449 1.00 0.00 C ATOM 930 C ILE A 66 1.088 -1.610 5.733 1.00 0.00 C ATOM 931 O ILE A 66 1.794 -2.030 4.817 1.00 0.00 O ATOM 932 CB ILE A 66 -1.176 -2.081 4.792 1.00 0.00 C ATOM 933 CG1 ILE A 66 -2.543 -1.493 4.439 1.00 0.00 C ATOM 934 CG2 ILE A 66 -1.331 -3.280 5.716 1.00 0.00 C ATOM 935 CD1 ILE A 66 -3.245 -2.226 3.318 1.00 0.00 C ATOM 0 H ILE A 66 0.103 -0.009 3.648 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.742 -0.695 6.387 1.00 0.00 H new ATOM 0 HB ILE A 66 -0.698 -2.416 3.871 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.177 -1.510 5.326 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.418 -0.448 4.156 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.963 -4.028 5.238 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -0.351 -3.710 5.921 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.790 -2.961 6.652 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.208 -1.754 3.122 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.632 -2.187 2.418 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.402 -3.266 3.605 1.00 0.00 H new ATOM 947 N ARG A 67 1.458 -1.649 7.009 1.00 0.00 N ATOM 948 CA ARG A 67 2.745 -2.199 7.414 1.00 0.00 C ATOM 949 C ARG A 67 2.576 -3.588 8.023 1.00 0.00 C ATOM 950 O ARG A 67 1.833 -3.767 8.989 1.00 0.00 O ATOM 951 CB ARG A 67 3.427 -1.269 8.420 1.00 0.00 C ATOM 952 CG ARG A 67 3.960 0.013 7.800 1.00 0.00 C ATOM 953 CD ARG A 67 5.300 -0.213 7.118 1.00 0.00 C ATOM 954 NE ARG A 67 5.880 1.033 6.625 1.00 0.00 N ATOM 955 CZ ARG A 67 6.479 1.925 7.407 1.00 0.00 C ATOM 956 NH1 ARG A 67 6.577 1.708 8.711 1.00 0.00 N ATOM 957 NH2 ARG A 67 6.983 3.035 6.884 1.00 0.00 N ATOM 0 H ARG A 67 0.884 -1.306 7.780 1.00 0.00 H new ATOM 0 HA ARG A 67 3.371 -2.285 6.526 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.716 -1.014 9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.250 -1.803 8.895 1.00 0.00 H new ATOM 0 HG2 ARG A 67 3.241 0.394 7.075 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.068 0.775 8.572 1.00 0.00 H new ATOM 0 HD2 ARG A 67 5.990 -0.681 7.820 1.00 0.00 H new ATOM 0 HD3 ARG A 67 5.171 -0.907 6.287 1.00 0.00 H new ATOM 0 HE ARG A 67 5.822 1.230 5.626 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.192 0.855 9.116 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.037 2.394 9.309 1.00 0.00 H new ATOM 0 HH21 ARG A 67 6.911 3.204 5.881 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.443 3.719 7.485 1.00 0.00 H new ATOM 971 N HIS A 68 3.270 -4.567 7.453 1.00 0.00 N ATOM 972 CA HIS A 68 3.197 -5.940 7.939 1.00 0.00 C ATOM 973 C HIS A 68 4.576 -6.592 7.937 1.00 0.00 C ATOM 974 O HIS A 68 5.390 -6.342 7.048 1.00 0.00 O ATOM 975 CB HIS A 68 2.232 -6.758 7.079 1.00 0.00 C ATOM 976 CG HIS A 68 2.828 -7.220 5.785 1.00 0.00 C ATOM 977 ND1 HIS A 68 3.351 -6.356 4.847 1.00 0.00 N ATOM 978 CD2 HIS A 68 2.983 -8.464 5.277 1.00 0.00 C ATOM 979 CE1 HIS A 68 3.801 -7.049 3.816 1.00 0.00 C ATOM 980 NE2 HIS A 68 3.590 -8.331 4.052 1.00 0.00 N ATOM 0 H HIS A 68 3.890 -4.435 6.654 1.00 0.00 H new ATOM 0 HA HIS A 68 2.827 -5.916 8.964 1.00 0.00 H new ATOM 0 HB2 HIS A 68 1.899 -7.627 7.647 1.00 0.00 H new ATOM 0 HB3 HIS A 68 1.347 -6.157 6.868 1.00 0.00 H new ATOM 0 HD2 HIS A 68 2.685 -9.390 5.747 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.263 -6.637 2.931 1.00 0.00 H new ATOM 0 HE2 HIS A 68 3.837 -9.098 3.426 1.00 0.00 H new ATOM 989 N ARG A 69 4.832 -7.428 8.938 1.00 0.00 N ATOM 990 CA ARG A 69 6.114 -8.114 9.052 1.00 0.00 C ATOM 991 C ARG A 69 5.977 -9.386 9.884 1.00 0.00 C ATOM 992 O ARG A 69 5.148 -9.462 10.791 1.00 0.00 O ATOM 993 CB ARG A 69 7.157 -7.189 9.681 1.00 0.00 C ATOM 994 CG ARG A 69 6.947 -6.958 11.169 1.00 0.00 C ATOM 995 CD ARG A 69 8.240 -6.545 11.856 1.00 0.00 C ATOM 996 NE ARG A 69 8.010 -6.084 13.222 1.00 0.00 N ATOM 997 CZ ARG A 69 8.976 -5.943 14.123 1.00 0.00 C ATOM 998 NH1 ARG A 69 10.231 -6.227 13.803 1.00 0.00 N ATOM 999 NH2 ARG A 69 8.688 -5.517 15.346 1.00 0.00 N ATOM 0 H ARG A 69 4.169 -7.647 9.682 1.00 0.00 H new ATOM 0 HA ARG A 69 6.441 -8.390 8.050 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.149 -7.613 9.524 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.136 -6.228 9.166 1.00 0.00 H new ATOM 0 HG2 ARG A 69 6.193 -6.185 11.316 1.00 0.00 H new ATOM 0 HG3 ARG A 69 6.564 -7.869 11.629 1.00 0.00 H new ATOM 0 HD2 ARG A 69 8.929 -7.389 11.869 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.719 -5.752 11.281 1.00 0.00 H new ATOM 0 HE ARG A 69 7.055 -5.858 13.500 1.00 0.00 H new ATOM 0 HH11 ARG A 69 10.456 -6.554 12.864 1.00 0.00 H new ATOM 0 HH12 ARG A 69 10.971 -6.118 14.496 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.724 -5.297 15.596 1.00 0.00 H new ATOM 0 HH22 ARG A 69 9.431 -5.409 16.037 1.00 0.00 H new ATOM 1013 N LYS A 70 6.797 -10.383 9.569 1.00 0.00 N ATOM 1014 CA LYS A 70 6.769 -11.652 10.286 1.00 0.00 C ATOM 1015 C LYS A 70 7.623 -11.582 11.548 1.00 0.00 C ATOM 1016 O LYS A 70 8.562 -10.789 11.633 1.00 0.00 O ATOM 1017 CB LYS A 70 7.267 -12.783 9.384 1.00 0.00 C ATOM 1018 CG LYS A 70 6.656 -14.135 9.709 1.00 0.00 C ATOM 1019 CD LYS A 70 6.840 -15.120 8.567 1.00 0.00 C ATOM 1020 CE LYS A 70 6.709 -16.558 9.044 1.00 0.00 C ATOM 1021 NZ LYS A 70 7.251 -17.524 8.049 1.00 0.00 N ATOM 0 H LYS A 70 7.489 -10.336 8.821 1.00 0.00 H new ATOM 0 HA LYS A 70 5.738 -11.854 10.576 1.00 0.00 H new ATOM 0 HB2 LYS A 70 7.045 -12.533 8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.351 -12.854 9.470 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.115 -14.535 10.613 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.593 -14.014 9.918 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.098 -14.924 7.793 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.820 -14.974 8.114 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.237 -16.676 9.990 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.660 -16.783 9.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 7.143 -18.493 8.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.730 -17.429 7.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.259 -17.326 7.886 1.00 0.00 H new ATOM 1035 N THR A 71 7.293 -12.417 12.529 1.00 0.00 N ATOM 1036 CA THR A 71 8.029 -12.449 13.786 1.00 0.00 C ATOM 1037 C THR A 71 9.385 -13.124 13.612 1.00 0.00 C ATOM 1038 O THR A 71 9.605 -14.235 14.095 1.00 0.00 O ATOM 1039 CB THR A 71 7.238 -13.189 14.881 1.00 0.00 C ATOM 1040 OG1 THR A 71 7.986 -13.201 16.102 1.00 0.00 O ATOM 1041 CG2 THR A 71 6.929 -14.616 14.456 1.00 0.00 C ATOM 0 H THR A 71 6.520 -13.080 12.476 1.00 0.00 H new ATOM 0 HA THR A 71 8.178 -11.413 14.092 1.00 0.00 H new ATOM 0 HB THR A 71 6.297 -12.662 15.037 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.476 -13.672 16.794 1.00 0.00 H new ATOM 0 HG21 THR A 71 6.370 -15.118 15.246 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.334 -14.603 13.543 1.00 0.00 H new ATOM 0 HG23 THR A 71 7.861 -15.151 14.275 1.00 0.00 H new ATOM 1049 N THR A 72 10.294 -12.445 12.918 1.00 0.00 N ATOM 1050 CA THR A 72 11.629 -12.978 12.679 1.00 0.00 C ATOM 1051 C THR A 72 12.700 -11.942 13.000 1.00 0.00 C ATOM 1052 O THR A 72 12.411 -10.751 13.114 1.00 0.00 O ATOM 1053 CB THR A 72 11.797 -13.439 11.219 1.00 0.00 C ATOM 1054 OG1 THR A 72 10.727 -14.320 10.858 1.00 0.00 O ATOM 1055 CG2 THR A 72 13.130 -14.146 11.025 1.00 0.00 C ATOM 0 H THR A 72 10.129 -11.524 12.512 1.00 0.00 H new ATOM 0 HA THR A 72 11.749 -13.837 13.339 1.00 0.00 H new ATOM 0 HB THR A 72 11.774 -12.558 10.578 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.840 -14.608 9.928 1.00 0.00 H new ATOM 0 HG21 THR A 72 13.226 -14.462 9.986 1.00 0.00 H new ATOM 0 HG22 THR A 72 13.943 -13.464 11.273 1.00 0.00 H new ATOM 0 HG23 THR A 72 13.177 -15.019 11.676 1.00 0.00 H new ATOM 1063 N ARG A 73 13.938 -12.403 13.143 1.00 0.00 N ATOM 1064 CA ARG A 73 15.053 -11.516 13.451 1.00 0.00 C ATOM 1065 C ARG A 73 14.873 -10.161 12.773 1.00 0.00 C ATOM 1066 O ARG A 73 14.946 -9.117 13.421 1.00 0.00 O ATOM 1067 CB ARG A 73 16.374 -12.148 13.007 1.00 0.00 C ATOM 1068 CG ARG A 73 16.966 -13.104 14.029 1.00 0.00 C ATOM 1069 CD ARG A 73 16.150 -14.383 14.133 1.00 0.00 C ATOM 1070 NE ARG A 73 16.742 -15.335 15.070 1.00 0.00 N ATOM 1071 CZ ARG A 73 16.510 -16.642 15.034 1.00 0.00 C ATOM 1072 NH1 ARG A 73 15.704 -17.151 14.112 1.00 0.00 N ATOM 1073 NH2 ARG A 73 17.085 -17.444 15.921 1.00 0.00 N ATOM 0 H ARG A 73 14.194 -13.386 13.050 1.00 0.00 H new ATOM 0 HA ARG A 73 15.075 -11.364 14.530 1.00 0.00 H new ATOM 0 HB2 ARG A 73 16.214 -12.683 12.071 1.00 0.00 H new ATOM 0 HB3 ARG A 73 17.095 -11.356 12.802 1.00 0.00 H new ATOM 0 HG2 ARG A 73 17.991 -13.347 13.750 1.00 0.00 H new ATOM 0 HG3 ARG A 73 17.007 -12.617 15.003 1.00 0.00 H new ATOM 0 HD2 ARG A 73 15.137 -14.141 14.453 1.00 0.00 H new ATOM 0 HD3 ARG A 73 16.072 -14.844 13.148 1.00 0.00 H new ATOM 0 HE ARG A 73 17.368 -14.976 15.791 1.00 0.00 H new ATOM 0 HH11 ARG A 73 15.260 -16.538 13.428 1.00 0.00 H new ATOM 0 HH12 ARG A 73 15.528 -18.155 14.087 1.00 0.00 H new ATOM 0 HH21 ARG A 73 17.706 -17.057 16.632 1.00 0.00 H new ATOM 0 HH22 ARG A 73 16.906 -18.448 15.892 1.00 0.00 H new ATOM 1087 N ARG A 74 14.636 -10.186 11.465 1.00 0.00 N ATOM 1088 CA ARG A 74 14.447 -8.960 10.700 1.00 0.00 C ATOM 1089 C ARG A 74 13.802 -9.256 9.349 1.00 0.00 C ATOM 1090 O ARG A 74 14.148 -10.234 8.686 1.00 0.00 O ATOM 1091 CB ARG A 74 15.786 -8.250 10.493 1.00 0.00 C ATOM 1092 CG ARG A 74 16.851 -9.131 9.862 1.00 0.00 C ATOM 1093 CD ARG A 74 18.194 -8.420 9.794 1.00 0.00 C ATOM 1094 NE ARG A 74 19.027 -8.927 8.706 1.00 0.00 N ATOM 1095 CZ ARG A 74 18.826 -8.629 7.427 1.00 0.00 C ATOM 1096 NH1 ARG A 74 17.826 -7.831 7.077 1.00 0.00 N ATOM 1097 NH2 ARG A 74 19.627 -9.129 6.495 1.00 0.00 N ATOM 0 H ARG A 74 14.570 -11.042 10.914 1.00 0.00 H new ATOM 0 HA ARG A 74 13.782 -8.308 11.266 1.00 0.00 H new ATOM 0 HB2 ARG A 74 15.630 -7.375 9.862 1.00 0.00 H new ATOM 0 HB3 ARG A 74 16.149 -7.889 11.455 1.00 0.00 H new ATOM 0 HG2 ARG A 74 16.953 -10.050 10.439 1.00 0.00 H new ATOM 0 HG3 ARG A 74 16.539 -9.418 8.858 1.00 0.00 H new ATOM 0 HD2 ARG A 74 18.032 -7.351 9.658 1.00 0.00 H new ATOM 0 HD3 ARG A 74 18.719 -8.545 10.741 1.00 0.00 H new ATOM 0 HE ARG A 74 19.805 -9.543 8.941 1.00 0.00 H new ATOM 0 HH11 ARG A 74 17.209 -7.444 7.791 1.00 0.00 H new ATOM 0 HH12 ARG A 74 17.675 -7.604 6.094 1.00 0.00 H new ATOM 0 HH21 ARG A 74 20.397 -9.742 6.760 1.00 0.00 H new ATOM 0 HH22 ARG A 74 19.472 -8.900 5.513 1.00 0.00 H new ATOM 1111 N GLY A 75 12.863 -8.405 8.947 1.00 0.00 N ATOM 1112 CA GLY A 75 12.185 -8.594 7.677 1.00 0.00 C ATOM 1113 C GLY A 75 10.819 -7.938 7.646 1.00 0.00 C ATOM 1114 O GLY A 75 9.827 -8.537 8.058 1.00 0.00 O ATOM 0 H GLY A 75 12.560 -7.588 9.478 1.00 0.00 H new ATOM 0 HA2 GLY A 75 12.800 -8.184 6.876 1.00 0.00 H new ATOM 0 HA3 GLY A 75 12.077 -9.661 7.482 1.00 0.00 H new ATOM 1118 N GLU A 76 10.769 -6.702 7.158 1.00 0.00 N ATOM 1119 CA GLU A 76 9.514 -5.964 7.078 1.00 0.00 C ATOM 1120 C GLU A 76 9.310 -5.388 5.680 1.00 0.00 C ATOM 1121 O GLU A 76 10.249 -4.889 5.060 1.00 0.00 O ATOM 1122 CB GLU A 76 9.493 -4.838 8.114 1.00 0.00 C ATOM 1123 CG GLU A 76 8.425 -3.789 7.851 1.00 0.00 C ATOM 1124 CD GLU A 76 8.577 -2.567 8.735 1.00 0.00 C ATOM 1125 OE1 GLU A 76 9.598 -1.860 8.599 1.00 0.00 O ATOM 1126 OE2 GLU A 76 7.677 -2.317 9.563 1.00 0.00 O ATOM 0 H GLU A 76 11.582 -6.192 6.813 1.00 0.00 H new ATOM 0 HA GLU A 76 8.700 -6.657 7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.332 -5.268 9.103 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.469 -4.354 8.132 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.470 -3.484 6.805 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.441 -4.229 8.012 1.00 0.00 H new ATOM 1133 N MET A 77 8.077 -5.461 5.190 1.00 0.00 N ATOM 1134 CA MET A 77 7.749 -4.947 3.866 1.00 0.00 C ATOM 1135 C MET A 77 6.651 -3.891 3.949 1.00 0.00 C ATOM 1136 O MET A 77 5.937 -3.804 4.947 1.00 0.00 O ATOM 1137 CB MET A 77 7.307 -6.087 2.947 1.00 0.00 C ATOM 1138 CG MET A 77 7.056 -5.650 1.513 1.00 0.00 C ATOM 1139 SD MET A 77 6.709 -7.037 0.415 1.00 0.00 S ATOM 1140 CE MET A 77 4.922 -7.105 0.508 1.00 0.00 C ATOM 0 H MET A 77 7.288 -5.871 5.690 1.00 0.00 H new ATOM 0 HA MET A 77 8.645 -4.483 3.452 1.00 0.00 H new ATOM 0 HB2 MET A 77 8.071 -6.864 2.953 1.00 0.00 H new ATOM 0 HB3 MET A 77 6.396 -6.533 3.347 1.00 0.00 H new ATOM 0 HG2 MET A 77 6.216 -4.955 1.491 1.00 0.00 H new ATOM 0 HG3 MET A 77 7.927 -5.109 1.144 1.00 0.00 H new ATOM 0 HE1 MET A 77 4.512 -7.279 -0.487 1.00 0.00 H new ATOM 0 HE2 MET A 77 4.623 -7.917 1.171 1.00 0.00 H new ATOM 0 HE3 MET A 77 4.542 -6.160 0.897 1.00 0.00 H new ATOM 1150 N GLU A 78 6.524 -3.091 2.895 1.00 0.00 N ATOM 1151 CA GLU A 78 5.513 -2.041 2.851 1.00 0.00 C ATOM 1152 C GLU A 78 4.532 -2.278 1.706 1.00 0.00 C ATOM 1153 O GLU A 78 4.903 -2.792 0.651 1.00 0.00 O ATOM 1154 CB GLU A 78 6.176 -0.671 2.694 1.00 0.00 C ATOM 1155 CG GLU A 78 7.084 -0.298 3.854 1.00 0.00 C ATOM 1156 CD GLU A 78 8.496 -0.822 3.681 1.00 0.00 C ATOM 1157 OE1 GLU A 78 9.222 -0.295 2.812 1.00 0.00 O ATOM 1158 OE2 GLU A 78 8.876 -1.759 4.414 1.00 0.00 O ATOM 0 H GLU A 78 7.108 -3.150 2.061 1.00 0.00 H new ATOM 0 HA GLU A 78 4.960 -2.064 3.790 1.00 0.00 H new ATOM 0 HB2 GLU A 78 6.756 -0.661 1.771 1.00 0.00 H new ATOM 0 HB3 GLU A 78 5.401 0.089 2.591 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.113 0.787 3.954 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.665 -0.692 4.780 1.00 0.00 H new ATOM 1165 N THR A 79 3.276 -1.899 1.923 1.00 0.00 N ATOM 1166 CA THR A 79 2.240 -2.071 0.912 1.00 0.00 C ATOM 1167 C THR A 79 1.090 -1.096 1.133 1.00 0.00 C ATOM 1168 O THR A 79 0.588 -0.953 2.249 1.00 0.00 O ATOM 1169 CB THR A 79 1.688 -3.509 0.913 1.00 0.00 C ATOM 1170 OG1 THR A 79 2.764 -4.447 0.810 1.00 0.00 O ATOM 1171 CG2 THR A 79 0.716 -3.715 -0.239 1.00 0.00 C ATOM 0 H THR A 79 2.952 -1.471 2.790 1.00 0.00 H new ATOM 0 HA THR A 79 2.703 -1.869 -0.054 1.00 0.00 H new ATOM 0 HB THR A 79 1.156 -3.670 1.850 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.405 -5.359 0.813 1.00 0.00 H new ATOM 0 HG21 THR A 79 0.339 -4.737 -0.218 1.00 0.00 H new ATOM 0 HG22 THR A 79 -0.117 -3.019 -0.141 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.229 -3.536 -1.184 1.00 0.00 H new ATOM 1179 N LEU A 80 0.674 -0.427 0.063 1.00 0.00 N ATOM 1180 CA LEU A 80 -0.420 0.535 0.140 1.00 0.00 C ATOM 1181 C LEU A 80 -1.389 0.352 -1.024 1.00 0.00 C ATOM 1182 O LEU A 80 -0.976 0.075 -2.150 1.00 0.00 O ATOM 1183 CB LEU A 80 0.130 1.963 0.140 1.00 0.00 C ATOM 1184 CG LEU A 80 1.225 2.261 -0.884 1.00 0.00 C ATOM 1185 CD1 LEU A 80 0.634 2.365 -2.282 1.00 0.00 C ATOM 1186 CD2 LEU A 80 1.963 3.540 -0.518 1.00 0.00 C ATOM 0 H LEU A 80 1.078 -0.533 -0.868 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.961 0.360 1.070 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.698 2.650 -0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.521 2.180 1.134 1.00 0.00 H new ATOM 0 HG LEU A 80 1.939 1.438 -0.874 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.428 2.577 -2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.152 1.423 -2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.102 3.169 -2.307 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.739 3.737 -1.258 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.260 4.373 -0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.419 3.428 0.465 1.00 0.00 H new ATOM 1198 N GLU A 81 -2.679 0.510 -0.744 1.00 0.00 N ATOM 1199 CA GLU A 81 -3.706 0.362 -1.768 1.00 0.00 C ATOM 1200 C GLU A 81 -4.726 1.495 -1.683 1.00 0.00 C ATOM 1201 O GLU A 81 -5.618 1.498 -0.835 1.00 0.00 O ATOM 1202 CB GLU A 81 -4.413 -0.987 -1.623 1.00 0.00 C ATOM 1203 CG GLU A 81 -5.673 -1.107 -2.463 1.00 0.00 C ATOM 1204 CD GLU A 81 -5.377 -1.222 -3.946 1.00 0.00 C ATOM 1205 OE1 GLU A 81 -4.456 -0.526 -4.422 1.00 0.00 O ATOM 1206 OE2 GLU A 81 -6.066 -2.007 -4.630 1.00 0.00 O ATOM 0 H GLU A 81 -3.037 0.740 0.183 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.220 0.406 -2.742 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -3.722 -1.782 -1.904 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -4.669 -1.143 -0.575 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -6.238 -1.981 -2.140 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -6.305 -0.236 -2.289 1.00 0.00 H new ATOM 1213 N PRO A 82 -4.591 2.481 -2.582 1.00 0.00 N ATOM 1214 CA PRO A 82 -5.490 3.637 -2.630 1.00 0.00 C ATOM 1215 C PRO A 82 -6.890 3.263 -3.104 1.00 0.00 C ATOM 1216 O PRO A 82 -7.879 3.866 -2.688 1.00 0.00 O ATOM 1217 CB PRO A 82 -4.815 4.570 -3.639 1.00 0.00 C ATOM 1218 CG PRO A 82 -4.008 3.668 -4.507 1.00 0.00 C ATOM 1219 CD PRO A 82 -3.550 2.542 -3.622 1.00 0.00 C ATOM 0 HA PRO A 82 -5.633 4.083 -1.646 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.552 5.124 -4.220 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -4.185 5.306 -3.138 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.603 3.293 -5.340 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.158 4.198 -4.936 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.475 1.604 -4.172 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.567 2.740 -3.195 1.00 0.00 H new ATOM 1227 N ASN A 83 -6.967 2.265 -3.978 1.00 0.00 N ATOM 1228 CA ASN A 83 -8.247 1.810 -4.510 1.00 0.00 C ATOM 1229 C ASN A 83 -9.289 1.701 -3.400 1.00 0.00 C ATOM 1230 O ASN A 83 -10.234 2.486 -3.343 1.00 0.00 O ATOM 1231 CB ASN A 83 -8.083 0.458 -5.205 1.00 0.00 C ATOM 1232 CG ASN A 83 -7.737 0.602 -6.675 1.00 0.00 C ATOM 1233 OD1 ASN A 83 -8.622 0.649 -7.530 1.00 0.00 O ATOM 1234 ND2 ASN A 83 -6.446 0.671 -6.974 1.00 0.00 N ATOM 0 H ASN A 83 -6.158 1.755 -4.333 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.592 2.545 -5.238 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.300 -0.112 -4.704 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -9.006 -0.113 -5.106 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.152 0.767 -7.946 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.748 0.628 -6.232 1.00 0.00 H new ATOM 1241 N ASN A 84 -9.107 0.722 -2.520 1.00 0.00 N ATOM 1242 CA ASN A 84 -10.031 0.510 -1.411 1.00 0.00 C ATOM 1243 C ASN A 84 -9.307 0.618 -0.072 1.00 0.00 C ATOM 1244 O ASN A 84 -8.077 0.646 -0.019 1.00 0.00 O ATOM 1245 CB ASN A 84 -10.700 -0.860 -1.533 1.00 0.00 C ATOM 1246 CG ASN A 84 -11.433 -1.031 -2.850 1.00 0.00 C ATOM 1247 OD1 ASN A 84 -12.626 -0.747 -2.950 1.00 0.00 O ATOM 1248 ND2 ASN A 84 -10.719 -1.497 -3.868 1.00 0.00 N ATOM 0 H ASN A 84 -8.329 0.063 -2.553 1.00 0.00 H new ATOM 0 HA ASN A 84 -10.796 1.285 -1.454 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -9.945 -1.640 -1.437 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -11.402 -0.993 -0.710 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -11.158 -1.633 -4.779 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -9.732 -1.719 -3.739 1.00 0.00 H new ATOM 1255 N LEU A 85 -10.079 0.677 1.008 1.00 0.00 N ATOM 1256 CA LEU A 85 -9.513 0.781 2.348 1.00 0.00 C ATOM 1257 C LEU A 85 -9.325 -0.600 2.969 1.00 0.00 C ATOM 1258 O LEU A 85 -9.368 -0.754 4.189 1.00 0.00 O ATOM 1259 CB LEU A 85 -10.415 1.635 3.240 1.00 0.00 C ATOM 1260 CG LEU A 85 -11.093 2.827 2.563 1.00 0.00 C ATOM 1261 CD1 LEU A 85 -12.415 3.147 3.244 1.00 0.00 C ATOM 1262 CD2 LEU A 85 -10.176 4.041 2.579 1.00 0.00 C ATOM 0 H LEU A 85 -11.098 0.655 0.981 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.537 1.258 2.266 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.189 0.993 3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.820 2.006 4.075 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.297 2.563 1.525 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.883 3.998 2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -13.075 2.282 3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.235 3.391 4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.674 4.880 2.093 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.941 4.306 3.610 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.255 3.808 2.045 1.00 0.00 H new ATOM 1274 N TRP A 86 -9.116 -1.600 2.121 1.00 0.00 N ATOM 1275 CA TRP A 86 -8.919 -2.968 2.586 1.00 0.00 C ATOM 1276 C TRP A 86 -7.934 -3.712 1.691 1.00 0.00 C ATOM 1277 O TRP A 86 -7.969 -3.578 0.468 1.00 0.00 O ATOM 1278 CB TRP A 86 -10.255 -3.713 2.624 1.00 0.00 C ATOM 1279 CG TRP A 86 -10.810 -4.006 1.263 1.00 0.00 C ATOM 1280 CD1 TRP A 86 -11.727 -3.264 0.574 1.00 0.00 C ATOM 1281 CD2 TRP A 86 -10.485 -5.122 0.427 1.00 0.00 C ATOM 1282 NE1 TRP A 86 -11.992 -3.852 -0.639 1.00 0.00 N ATOM 1283 CE2 TRP A 86 -11.242 -4.992 -0.754 1.00 0.00 C ATOM 1284 CE3 TRP A 86 -9.627 -6.217 0.560 1.00 0.00 C ATOM 1285 CZ2 TRP A 86 -11.165 -5.917 -1.792 1.00 0.00 C ATOM 1286 CZ3 TRP A 86 -9.552 -7.134 -0.471 1.00 0.00 C ATOM 1287 CH2 TRP A 86 -10.317 -6.979 -1.635 1.00 0.00 C ATOM 0 H TRP A 86 -9.079 -1.489 1.108 1.00 0.00 H new ATOM 0 HA TRP A 86 -8.505 -2.926 3.593 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.125 -4.650 3.165 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -10.978 -3.120 3.183 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -12.177 -2.349 0.931 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -12.642 -3.497 -1.340 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -9.033 -6.344 1.453 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -11.754 -5.800 -2.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -8.893 -7.984 -0.378 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.235 -7.712 -2.424 1.00 0.00 H new ATOM 1298 N TYR A 87 -7.056 -4.495 2.308 1.00 0.00 N ATOM 1299 CA TYR A 87 -6.059 -5.258 1.567 1.00 0.00 C ATOM 1300 C TYR A 87 -5.929 -6.672 2.125 1.00 0.00 C ATOM 1301 O TYR A 87 -5.642 -6.861 3.308 1.00 0.00 O ATOM 1302 CB TYR A 87 -4.704 -4.551 1.617 1.00 0.00 C ATOM 1303 CG TYR A 87 -3.713 -5.068 0.599 1.00 0.00 C ATOM 1304 CD1 TYR A 87 -3.100 -6.305 0.763 1.00 0.00 C ATOM 1305 CD2 TYR A 87 -3.389 -4.321 -0.526 1.00 0.00 C ATOM 1306 CE1 TYR A 87 -2.194 -6.781 -0.164 1.00 0.00 C ATOM 1307 CE2 TYR A 87 -2.484 -4.790 -1.459 1.00 0.00 C ATOM 1308 CZ TYR A 87 -1.889 -6.020 -1.274 1.00 0.00 C ATOM 1309 OH TYR A 87 -0.987 -6.491 -2.200 1.00 0.00 O ATOM 0 H TYR A 87 -7.015 -4.618 3.320 1.00 0.00 H new ATOM 0 HA TYR A 87 -6.388 -5.325 0.530 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.854 -3.484 1.455 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -4.280 -4.666 2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.336 -6.904 1.630 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.852 -3.357 -0.674 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.726 -7.744 -0.021 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -2.244 -4.196 -2.329 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.885 -5.835 -2.921 1.00 0.00 H new ATOM 1319 N LEU A 88 -6.142 -7.662 1.266 1.00 0.00 N ATOM 1320 CA LEU A 88 -6.048 -9.060 1.671 1.00 0.00 C ATOM 1321 C LEU A 88 -4.717 -9.665 1.237 1.00 0.00 C ATOM 1322 O LEU A 88 -4.258 -9.444 0.116 1.00 0.00 O ATOM 1323 CB LEU A 88 -7.205 -9.864 1.074 1.00 0.00 C ATOM 1324 CG LEU A 88 -7.445 -11.247 1.681 1.00 0.00 C ATOM 1325 CD1 LEU A 88 -8.909 -11.638 1.554 1.00 0.00 C ATOM 1326 CD2 LEU A 88 -6.554 -12.284 1.013 1.00 0.00 C ATOM 0 H LEU A 88 -6.381 -7.523 0.284 1.00 0.00 H new ATOM 0 HA LEU A 88 -6.108 -9.102 2.759 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.119 -9.280 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -7.024 -9.984 0.006 1.00 0.00 H new ATOM 0 HG LEU A 88 -7.191 -11.208 2.740 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -9.061 -12.625 1.991 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -9.527 -10.909 2.079 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -9.190 -11.660 0.501 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.738 -13.262 1.457 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -6.776 -12.322 -0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.508 -12.012 1.156 1.00 0.00 H new ATOM 1338 N PHE A 89 -4.101 -10.431 2.132 1.00 0.00 N ATOM 1339 CA PHE A 89 -2.822 -11.069 1.841 1.00 0.00 C ATOM 1340 C PHE A 89 -2.984 -12.581 1.721 1.00 0.00 C ATOM 1341 O PHE A 89 -3.554 -13.229 2.600 1.00 0.00 O ATOM 1342 CB PHE A 89 -1.803 -10.739 2.934 1.00 0.00 C ATOM 1343 CG PHE A 89 -1.339 -9.311 2.909 1.00 0.00 C ATOM 1344 CD1 PHE A 89 -2.082 -8.316 3.525 1.00 0.00 C ATOM 1345 CD2 PHE A 89 -0.159 -8.963 2.271 1.00 0.00 C ATOM 1346 CE1 PHE A 89 -1.657 -7.001 3.503 1.00 0.00 C ATOM 1347 CE2 PHE A 89 0.271 -7.650 2.246 1.00 0.00 C ATOM 1348 CZ PHE A 89 -0.478 -6.668 2.864 1.00 0.00 C ATOM 0 H PHE A 89 -4.467 -10.625 3.064 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.460 -10.683 0.888 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.244 -10.952 3.908 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.940 -11.395 2.825 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.003 -8.571 4.028 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.432 -9.727 1.788 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.246 -6.234 3.985 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.192 -7.392 1.744 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.143 -5.641 2.848 1.00 0.00 H new ATOM 1358 N THR A 90 -2.479 -13.139 0.625 1.00 0.00 N ATOM 1359 CA THR A 90 -2.568 -14.575 0.388 1.00 0.00 C ATOM 1360 C THR A 90 -1.187 -15.184 0.175 1.00 0.00 C ATOM 1361 O THR A 90 -0.248 -14.495 -0.222 1.00 0.00 O ATOM 1362 CB THR A 90 -3.449 -14.888 -0.837 1.00 0.00 C ATOM 1363 OG1 THR A 90 -2.900 -14.268 -2.006 1.00 0.00 O ATOM 1364 CG2 THR A 90 -4.873 -14.399 -0.619 1.00 0.00 C ATOM 0 H THR A 90 -2.004 -12.618 -0.113 1.00 0.00 H new ATOM 0 HA THR A 90 -3.023 -15.014 1.276 1.00 0.00 H new ATOM 0 HB THR A 90 -3.470 -15.969 -0.975 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.464 -14.473 -2.781 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.476 -14.631 -1.497 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.298 -14.894 0.254 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.867 -13.321 -0.458 1.00 0.00 H new ATOM 1372 N GLY A 91 -1.070 -16.481 0.443 1.00 0.00 N ATOM 1373 CA GLY A 91 0.201 -17.161 0.274 1.00 0.00 C ATOM 1374 C GLY A 91 1.014 -17.197 1.553 1.00 0.00 C ATOM 1375 O GLY A 91 2.240 -17.085 1.521 1.00 0.00 O ATOM 0 H GLY A 91 -1.832 -17.073 0.774 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.022 -18.180 -0.068 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.777 -16.661 -0.505 1.00 0.00 H new ATOM 1379 N LEU A 92 0.331 -17.351 2.682 1.00 0.00 N ATOM 1380 CA LEU A 92 0.997 -17.399 3.979 1.00 0.00 C ATOM 1381 C LEU A 92 1.162 -18.840 4.453 1.00 0.00 C ATOM 1382 O LEU A 92 0.518 -19.751 3.934 1.00 0.00 O ATOM 1383 CB LEU A 92 0.203 -16.598 5.012 1.00 0.00 C ATOM 1384 CG LEU A 92 -0.275 -15.216 4.567 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.273 -14.649 5.564 1.00 0.00 C ATOM 1386 CD2 LEU A 92 0.907 -14.272 4.398 1.00 0.00 C ATOM 0 H LEU A 92 -0.684 -17.445 2.726 1.00 0.00 H new ATOM 0 HA LEU A 92 1.987 -16.957 3.868 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.668 -17.184 5.306 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.821 -16.477 5.902 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.774 -15.319 3.603 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.602 -13.665 5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.134 -15.314 5.636 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.800 -14.561 6.542 1.00 0.00 H new ATOM 0 HD21 LEU A 92 0.548 -13.293 4.081 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.434 -14.175 5.347 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.586 -14.671 3.645 1.00 0.00 H new ATOM 1398 N GLU A 93 2.028 -19.036 5.442 1.00 0.00 N ATOM 1399 CA GLU A 93 2.276 -20.366 5.987 1.00 0.00 C ATOM 1400 C GLU A 93 1.239 -20.721 7.049 1.00 0.00 C ATOM 1401 O GLU A 93 0.540 -19.850 7.566 1.00 0.00 O ATOM 1402 CB GLU A 93 3.682 -20.442 6.585 1.00 0.00 C ATOM 1403 CG GLU A 93 4.777 -20.619 5.547 1.00 0.00 C ATOM 1404 CD GLU A 93 4.828 -22.027 4.986 1.00 0.00 C ATOM 1405 OE1 GLU A 93 5.154 -22.958 5.752 1.00 0.00 O ATOM 1406 OE2 GLU A 93 4.542 -22.198 3.783 1.00 0.00 O ATOM 0 H GLU A 93 2.569 -18.292 5.882 1.00 0.00 H new ATOM 0 HA GLU A 93 2.196 -21.085 5.172 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.876 -19.532 7.153 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.723 -21.273 7.290 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.617 -19.913 4.732 1.00 0.00 H new ATOM 0 HG3 GLU A 93 5.740 -20.376 5.995 1.00 0.00 H new ATOM 1413 N LYS A 94 1.145 -22.007 7.368 1.00 0.00 N ATOM 1414 CA LYS A 94 0.195 -22.480 8.368 1.00 0.00 C ATOM 1415 C LYS A 94 0.791 -22.390 9.769 1.00 0.00 C ATOM 1416 O LYS A 94 2.009 -22.363 9.936 1.00 0.00 O ATOM 1417 CB LYS A 94 -0.215 -23.924 8.069 1.00 0.00 C ATOM 1418 CG LYS A 94 0.931 -24.915 8.170 1.00 0.00 C ATOM 1419 CD LYS A 94 0.466 -26.335 7.891 1.00 0.00 C ATOM 1420 CE LYS A 94 0.465 -26.638 6.400 1.00 0.00 C ATOM 1421 NZ LYS A 94 1.792 -27.122 5.931 1.00 0.00 N ATOM 0 H LYS A 94 1.715 -22.741 6.948 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.688 -21.842 8.325 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.002 -24.220 8.762 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.639 -23.972 7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.713 -24.642 7.462 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.371 -24.864 9.166 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.118 -27.040 8.406 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.537 -26.476 8.293 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.293 -27.390 6.183 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.190 -25.740 5.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.749 -27.317 4.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.512 -26.394 6.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.043 -27.993 6.440 1.00 0.00 H new ATOM 1435 N GLY A 95 -0.078 -22.344 10.775 1.00 0.00 N ATOM 1436 CA GLY A 95 0.381 -22.259 12.149 1.00 0.00 C ATOM 1437 C GLY A 95 1.517 -21.270 12.320 1.00 0.00 C ATOM 1438 O GLY A 95 2.557 -21.601 12.890 1.00 0.00 O ATOM 0 H GLY A 95 -1.092 -22.364 10.662 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.451 -21.966 12.789 1.00 0.00 H new ATOM 0 HA3 GLY A 95 0.708 -23.244 12.481 1.00 0.00 H new ATOM 1442 N SER A 96 1.320 -20.053 11.824 1.00 0.00 N ATOM 1443 CA SER A 96 2.338 -19.014 11.920 1.00 0.00 C ATOM 1444 C SER A 96 1.742 -17.716 12.457 1.00 0.00 C ATOM 1445 O SER A 96 0.523 -17.559 12.514 1.00 0.00 O ATOM 1446 CB SER A 96 2.976 -18.767 10.552 1.00 0.00 C ATOM 1447 OG SER A 96 3.867 -19.814 10.208 1.00 0.00 O ATOM 0 H SER A 96 0.464 -19.762 11.351 1.00 0.00 H new ATOM 0 HA SER A 96 3.105 -19.356 12.615 1.00 0.00 H new ATOM 0 HB2 SER A 96 2.197 -18.684 9.794 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.512 -17.818 10.563 1.00 0.00 H new ATOM 0 HG SER A 96 3.368 -20.653 10.121 1.00 0.00 H new ATOM 1453 N GLN A 97 2.611 -16.790 12.848 1.00 0.00 N ATOM 1454 CA GLN A 97 2.171 -15.506 13.381 1.00 0.00 C ATOM 1455 C GLN A 97 2.507 -14.373 12.418 1.00 0.00 C ATOM 1456 O GLN A 97 3.473 -14.455 11.660 1.00 0.00 O ATOM 1457 CB GLN A 97 2.820 -15.245 14.741 1.00 0.00 C ATOM 1458 CG GLN A 97 2.227 -14.056 15.480 1.00 0.00 C ATOM 1459 CD GLN A 97 2.378 -14.170 16.985 1.00 0.00 C ATOM 1460 OE1 GLN A 97 3.418 -13.821 17.544 1.00 0.00 O ATOM 1461 NE2 GLN A 97 1.338 -14.660 17.649 1.00 0.00 N ATOM 0 H GLN A 97 3.624 -16.905 12.806 1.00 0.00 H new ATOM 0 HA GLN A 97 1.089 -15.544 13.504 1.00 0.00 H new ATOM 0 HB2 GLN A 97 2.716 -16.136 15.361 1.00 0.00 H new ATOM 0 HB3 GLN A 97 3.888 -15.078 14.599 1.00 0.00 H new ATOM 0 HG2 GLN A 97 2.712 -13.142 15.138 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.170 -13.968 15.230 1.00 0.00 H new ATOM 0 HE21 GLN A 97 0.496 -14.937 17.145 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.381 -14.760 18.663 1.00 0.00 H new ATOM 1470 N TYR A 98 1.703 -13.316 12.452 1.00 0.00 N ATOM 1471 CA TYR A 98 1.913 -12.167 11.580 1.00 0.00 C ATOM 1472 C TYR A 98 1.363 -10.893 12.215 1.00 0.00 C ATOM 1473 O TYR A 98 0.507 -10.946 13.098 1.00 0.00 O ATOM 1474 CB TYR A 98 1.248 -12.402 10.223 1.00 0.00 C ATOM 1475 CG TYR A 98 1.971 -13.412 9.361 1.00 0.00 C ATOM 1476 CD1 TYR A 98 2.987 -13.020 8.498 1.00 0.00 C ATOM 1477 CD2 TYR A 98 1.638 -14.761 9.411 1.00 0.00 C ATOM 1478 CE1 TYR A 98 3.649 -13.940 7.709 1.00 0.00 C ATOM 1479 CE2 TYR A 98 2.296 -15.688 8.626 1.00 0.00 C ATOM 1480 CZ TYR A 98 3.300 -15.273 7.776 1.00 0.00 C ATOM 1481 OH TYR A 98 3.959 -16.192 6.993 1.00 0.00 O ATOM 0 H TYR A 98 0.899 -13.231 13.075 1.00 0.00 H new ATOM 0 HA TYR A 98 2.986 -12.045 11.435 1.00 0.00 H new ATOM 0 HB2 TYR A 98 0.224 -12.740 10.383 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.190 -11.455 9.687 1.00 0.00 H new ATOM 0 HD1 TYR A 98 3.264 -11.978 8.443 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.852 -15.090 10.075 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.436 -13.618 7.043 1.00 0.00 H new ATOM 0 HE2 TYR A 98 2.026 -16.732 8.678 1.00 0.00 H new ATOM 0 HH TYR A 98 3.594 -17.086 7.160 1.00 0.00 H new ATOM 1491 N SER A 99 1.861 -9.749 11.756 1.00 0.00 N ATOM 1492 CA SER A 99 1.423 -8.460 12.280 1.00 0.00 C ATOM 1493 C SER A 99 1.057 -7.508 11.146 1.00 0.00 C ATOM 1494 O SER A 99 1.496 -7.682 10.008 1.00 0.00 O ATOM 1495 CB SER A 99 2.519 -7.840 13.149 1.00 0.00 C ATOM 1496 OG SER A 99 2.984 -8.762 14.119 1.00 0.00 O ATOM 0 H SER A 99 2.568 -9.688 11.023 1.00 0.00 H new ATOM 0 HA SER A 99 0.536 -8.627 12.891 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.349 -7.520 12.519 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.134 -6.949 13.645 1.00 0.00 H new ATOM 0 HG SER A 99 3.685 -8.342 14.660 1.00 0.00 H new ATOM 1502 N PHE A 100 0.250 -6.502 11.464 1.00 0.00 N ATOM 1503 CA PHE A 100 -0.177 -5.522 10.472 1.00 0.00 C ATOM 1504 C PHE A 100 -0.401 -4.157 11.117 1.00 0.00 C ATOM 1505 O PHE A 100 -0.421 -4.034 12.341 1.00 0.00 O ATOM 1506 CB PHE A 100 -1.460 -5.989 9.781 1.00 0.00 C ATOM 1507 CG PHE A 100 -1.293 -7.266 9.008 1.00 0.00 C ATOM 1508 CD1 PHE A 100 -1.339 -8.492 9.652 1.00 0.00 C ATOM 1509 CD2 PHE A 100 -1.091 -7.240 7.638 1.00 0.00 C ATOM 1510 CE1 PHE A 100 -1.187 -9.669 8.944 1.00 0.00 C ATOM 1511 CE2 PHE A 100 -0.938 -8.414 6.924 1.00 0.00 C ATOM 1512 CZ PHE A 100 -0.985 -9.630 7.578 1.00 0.00 C ATOM 0 H PHE A 100 -0.122 -6.344 12.401 1.00 0.00 H new ATOM 0 HA PHE A 100 0.614 -5.427 9.728 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.238 -6.127 10.532 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.805 -5.207 9.105 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.496 -8.528 10.720 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.053 -6.292 7.122 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.226 -10.618 9.458 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.782 -8.380 5.856 1.00 0.00 H new ATOM 0 HZ PHE A 100 -0.864 -10.548 7.022 1.00 0.00 H new ATOM 1522 N GLN A 101 -0.568 -3.135 10.283 1.00 0.00 N ATOM 1523 CA GLN A 101 -0.790 -1.780 10.772 1.00 0.00 C ATOM 1524 C GLN A 101 -1.343 -0.886 9.667 1.00 0.00 C ATOM 1525 O GLN A 101 -1.212 -1.193 8.482 1.00 0.00 O ATOM 1526 CB GLN A 101 0.514 -1.192 11.315 1.00 0.00 C ATOM 1527 CG GLN A 101 0.306 -0.173 12.424 1.00 0.00 C ATOM 1528 CD GLN A 101 1.597 0.497 12.851 1.00 0.00 C ATOM 1529 OE1 GLN A 101 2.203 1.247 12.085 1.00 0.00 O ATOM 1530 NE2 GLN A 101 2.025 0.229 14.079 1.00 0.00 N ATOM 0 H GLN A 101 -0.554 -3.220 9.267 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.523 -1.827 11.577 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.140 -2.002 11.690 1.00 0.00 H new ATOM 0 HB3 GLN A 101 1.059 -0.721 10.497 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -0.399 0.587 12.086 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -0.145 -0.666 13.285 1.00 0.00 H new ATOM 0 HE21 GLN A 101 1.491 -0.399 14.680 1.00 0.00 H new ATOM 0 HE22 GLN A 101 2.888 0.651 14.422 1.00 0.00 H new ATOM 1539 N VAL A 102 -1.962 0.222 10.063 1.00 0.00 N ATOM 1540 CA VAL A 102 -2.535 1.161 9.106 1.00 0.00 C ATOM 1541 C VAL A 102 -2.261 2.602 9.519 1.00 0.00 C ATOM 1542 O VAL A 102 -2.426 2.967 10.683 1.00 0.00 O ATOM 1543 CB VAL A 102 -4.056 0.959 8.963 1.00 0.00 C ATOM 1544 CG1 VAL A 102 -4.599 1.791 7.811 1.00 0.00 C ATOM 1545 CG2 VAL A 102 -4.381 -0.514 8.767 1.00 0.00 C ATOM 0 H VAL A 102 -2.079 0.491 11.040 1.00 0.00 H new ATOM 0 HA VAL A 102 -2.058 0.965 8.146 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.538 1.295 9.881 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.674 1.636 7.725 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.399 2.846 7.998 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -4.114 1.488 6.883 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -5.459 -0.639 8.668 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -3.889 -0.878 7.865 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -4.028 -1.082 9.628 1.00 0.00 H new ATOM 1555 N SER A 103 -1.842 3.418 8.557 1.00 0.00 N ATOM 1556 CA SER A 103 -1.541 4.821 8.822 1.00 0.00 C ATOM 1557 C SER A 103 -2.179 5.721 7.768 1.00 0.00 C ATOM 1558 O SER A 103 -1.909 5.586 6.575 1.00 0.00 O ATOM 1559 CB SER A 103 -0.028 5.043 8.851 1.00 0.00 C ATOM 1560 OG SER A 103 0.311 6.135 9.688 1.00 0.00 O ATOM 0 H SER A 103 -1.703 3.132 7.588 1.00 0.00 H new ATOM 0 HA SER A 103 -1.957 5.079 9.796 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.468 4.140 9.207 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.335 5.229 7.840 1.00 0.00 H new ATOM 0 HG SER A 103 1.282 6.158 9.819 1.00 0.00 H new ATOM 1566 N ALA A 104 -3.027 6.639 8.219 1.00 0.00 N ATOM 1567 CA ALA A 104 -3.703 7.563 7.317 1.00 0.00 C ATOM 1568 C ALA A 104 -2.703 8.479 6.619 1.00 0.00 C ATOM 1569 O ALA A 104 -2.017 9.271 7.264 1.00 0.00 O ATOM 1570 CB ALA A 104 -4.732 8.386 8.077 1.00 0.00 C ATOM 0 H ALA A 104 -3.262 6.763 9.204 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.215 6.977 6.554 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.229 9.072 7.390 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.471 7.721 8.524 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.234 8.956 8.862 1.00 0.00 H new ATOM 1576 N MET A 105 -2.624 8.363 5.297 1.00 0.00 N ATOM 1577 CA MET A 105 -1.707 9.182 4.512 1.00 0.00 C ATOM 1578 C MET A 105 -2.358 10.505 4.121 1.00 0.00 C ATOM 1579 O MET A 105 -3.490 10.533 3.636 1.00 0.00 O ATOM 1580 CB MET A 105 -1.264 8.427 3.257 1.00 0.00 C ATOM 1581 CG MET A 105 -0.033 7.562 3.471 1.00 0.00 C ATOM 1582 SD MET A 105 0.699 6.999 1.922 1.00 0.00 S ATOM 1583 CE MET A 105 -0.496 5.766 1.412 1.00 0.00 C ATOM 0 H MET A 105 -3.183 7.711 4.747 1.00 0.00 H new ATOM 0 HA MET A 105 -0.833 9.396 5.127 1.00 0.00 H new ATOM 0 HB2 MET A 105 -2.085 7.798 2.913 1.00 0.00 H new ATOM 0 HB3 MET A 105 -1.059 9.146 2.464 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.709 8.127 4.035 1.00 0.00 H new ATOM 0 HG3 MET A 105 -0.303 6.697 4.076 1.00 0.00 H new ATOM 0 HE1 MET A 105 -0.043 4.776 1.466 1.00 0.00 H new ATOM 0 HE2 MET A 105 -1.363 5.805 2.072 1.00 0.00 H new ATOM 0 HE3 MET A 105 -0.810 5.966 0.388 1.00 0.00 H new ATOM 1593 N THR A 106 -1.636 11.600 4.335 1.00 0.00 N ATOM 1594 CA THR A 106 -2.144 12.926 4.007 1.00 0.00 C ATOM 1595 C THR A 106 -1.260 13.612 2.971 1.00 0.00 C ATOM 1596 O THR A 106 -0.291 13.030 2.484 1.00 0.00 O ATOM 1597 CB THR A 106 -2.234 13.819 5.259 1.00 0.00 C ATOM 1598 OG1 THR A 106 -1.124 13.562 6.126 1.00 0.00 O ATOM 1599 CG2 THR A 106 -3.536 13.571 6.007 1.00 0.00 C ATOM 0 H THR A 106 -0.697 11.595 4.734 1.00 0.00 H new ATOM 0 HA THR A 106 -3.144 12.788 3.595 1.00 0.00 H new ATOM 0 HB THR A 106 -2.209 14.860 4.938 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.002 14.320 6.735 1.00 0.00 H new ATOM 0 HG21 THR A 106 -3.578 14.212 6.887 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.379 13.796 5.354 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.585 12.527 6.316 1.00 0.00 H new ATOM 1607 N VAL A 107 -1.601 14.853 2.638 1.00 0.00 N ATOM 1608 CA VAL A 107 -0.837 15.620 1.661 1.00 0.00 C ATOM 1609 C VAL A 107 0.626 15.734 2.074 1.00 0.00 C ATOM 1610 O VAL A 107 1.481 16.105 1.270 1.00 0.00 O ATOM 1611 CB VAL A 107 -1.419 17.034 1.478 1.00 0.00 C ATOM 1612 CG1 VAL A 107 -1.312 17.827 2.771 1.00 0.00 C ATOM 1613 CG2 VAL A 107 -0.714 17.757 0.340 1.00 0.00 C ATOM 0 H VAL A 107 -2.401 15.349 3.031 1.00 0.00 H new ATOM 0 HA VAL A 107 -0.904 15.083 0.715 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.475 16.943 1.222 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.728 18.823 2.622 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -1.866 17.316 3.558 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -0.265 17.911 3.061 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.138 18.755 0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 107 0.350 17.838 0.564 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -0.848 17.197 -0.585 1.00 0.00 H new ATOM 1623 N ASN A 108 0.907 15.411 3.332 1.00 0.00 N ATOM 1624 CA ASN A 108 2.268 15.477 3.852 1.00 0.00 C ATOM 1625 C ASN A 108 2.895 14.088 3.913 1.00 0.00 C ATOM 1626 O ASN A 108 3.858 13.798 3.204 1.00 0.00 O ATOM 1627 CB ASN A 108 2.274 16.113 5.244 1.00 0.00 C ATOM 1628 CG ASN A 108 3.628 16.689 5.611 1.00 0.00 C ATOM 1629 OD1 ASN A 108 4.163 16.411 6.684 1.00 0.00 O ATOM 1630 ND2 ASN A 108 4.188 17.497 4.718 1.00 0.00 N ATOM 0 H ASN A 108 0.211 15.101 4.010 1.00 0.00 H new ATOM 0 HA ASN A 108 2.859 16.094 3.175 1.00 0.00 H new ATOM 0 HB2 ASN A 108 1.524 16.903 5.283 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.988 15.365 5.983 1.00 0.00 H new ATOM 0 HD21 ASN A 108 5.099 17.915 4.909 1.00 0.00 H new ATOM 0 HD22 ASN A 108 3.708 17.699 3.841 1.00 0.00 H new ATOM 1637 N GLY A 109 2.341 13.230 4.765 1.00 0.00 N ATOM 1638 CA GLY A 109 2.858 11.881 4.902 1.00 0.00 C ATOM 1639 C GLY A 109 1.937 10.986 5.707 1.00 0.00 C ATOM 1640 O GLY A 109 0.766 11.309 5.910 1.00 0.00 O ATOM 0 H GLY A 109 1.543 13.446 5.363 1.00 0.00 H new ATOM 0 HA2 GLY A 109 3.005 11.449 3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.836 11.917 5.382 1.00 0.00 H new ATOM 1644 N THR A 110 2.465 9.855 6.165 1.00 0.00 N ATOM 1645 CA THR A 110 1.681 8.909 6.949 1.00 0.00 C ATOM 1646 C THR A 110 1.334 9.484 8.318 1.00 0.00 C ATOM 1647 O THR A 110 2.060 10.320 8.853 1.00 0.00 O ATOM 1648 CB THR A 110 2.434 7.579 7.139 1.00 0.00 C ATOM 1649 OG1 THR A 110 3.796 7.834 7.500 1.00 0.00 O ATOM 1650 CG2 THR A 110 2.389 6.745 5.868 1.00 0.00 C ATOM 0 H THR A 110 3.432 9.572 6.006 1.00 0.00 H new ATOM 0 HA THR A 110 0.762 8.722 6.393 1.00 0.00 H new ATOM 0 HB THR A 110 1.945 7.022 7.938 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.267 6.983 7.621 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.927 5.811 6.027 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.352 6.527 5.612 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.855 7.298 5.053 1.00 0.00 H new ATOM 1658 N GLY A 111 0.218 9.029 8.880 1.00 0.00 N ATOM 1659 CA GLY A 111 -0.205 9.509 10.182 1.00 0.00 C ATOM 1660 C GLY A 111 0.456 8.756 11.320 1.00 0.00 C ATOM 1661 O GLY A 111 1.473 8.087 11.142 1.00 0.00 O ATOM 0 H GLY A 111 -0.400 8.337 8.457 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.029 10.570 10.268 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.287 9.413 10.267 1.00 0.00 H new ATOM 1665 N PRO A 112 -0.128 8.864 12.523 1.00 0.00 N ATOM 1666 CA PRO A 112 0.395 8.196 13.719 1.00 0.00 C ATOM 1667 C PRO A 112 0.221 6.682 13.661 1.00 0.00 C ATOM 1668 O PRO A 112 -0.809 6.169 13.224 1.00 0.00 O ATOM 1669 CB PRO A 112 -0.446 8.788 14.853 1.00 0.00 C ATOM 1670 CG PRO A 112 -1.716 9.212 14.200 1.00 0.00 C ATOM 1671 CD PRO A 112 -1.343 9.645 12.809 1.00 0.00 C ATOM 0 HA PRO A 112 1.467 8.354 13.838 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -0.630 8.052 15.636 1.00 0.00 H new ATOM 0 HB3 PRO A 112 0.059 9.632 15.322 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -2.434 8.392 14.174 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -2.184 10.028 14.750 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -2.137 9.429 12.094 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -1.153 10.717 12.759 1.00 0.00 H new ATOM 1679 N PRO A 113 1.249 5.949 14.111 1.00 0.00 N ATOM 1680 CA PRO A 113 1.233 4.484 14.122 1.00 0.00 C ATOM 1681 C PRO A 113 0.255 3.922 15.149 1.00 0.00 C ATOM 1682 O PRO A 113 0.459 4.063 16.355 1.00 0.00 O ATOM 1683 CB PRO A 113 2.671 4.115 14.494 1.00 0.00 C ATOM 1684 CG PRO A 113 3.180 5.293 15.251 1.00 0.00 C ATOM 1685 CD PRO A 113 2.508 6.495 14.646 1.00 0.00 C ATOM 0 HA PRO A 113 0.908 4.073 13.166 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.703 3.210 15.101 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.273 3.925 13.606 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.945 5.207 16.312 1.00 0.00 H new ATOM 0 HG3 PRO A 113 4.264 5.370 15.170 1.00 0.00 H new ATOM 0 HD2 PRO A 113 2.326 7.270 15.390 1.00 0.00 H new ATOM 0 HD3 PRO A 113 3.117 6.943 13.861 1.00 0.00 H new ATOM 1693 N SER A 114 -0.805 3.285 14.663 1.00 0.00 N ATOM 1694 CA SER A 114 -1.816 2.705 15.540 1.00 0.00 C ATOM 1695 C SER A 114 -1.291 1.440 16.212 1.00 0.00 C ATOM 1696 O SER A 114 -0.349 0.814 15.730 1.00 0.00 O ATOM 1697 CB SER A 114 -3.086 2.387 14.748 1.00 0.00 C ATOM 1698 OG SER A 114 -2.844 1.381 13.780 1.00 0.00 O ATOM 0 H SER A 114 -0.986 3.157 13.667 1.00 0.00 H new ATOM 0 HA SER A 114 -2.053 3.435 16.314 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.871 2.059 15.430 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.448 3.290 14.256 1.00 0.00 H new ATOM 0 HG SER A 114 -3.542 1.414 13.093 1.00 0.00 H new ATOM 1704 N ASN A 115 -1.910 1.071 17.329 1.00 0.00 N ATOM 1705 CA ASN A 115 -1.506 -0.119 18.068 1.00 0.00 C ATOM 1706 C ASN A 115 -1.190 -1.270 17.117 1.00 0.00 C ATOM 1707 O ASN A 115 -1.965 -1.567 16.208 1.00 0.00 O ATOM 1708 CB ASN A 115 -2.607 -0.537 19.044 1.00 0.00 C ATOM 1709 CG ASN A 115 -3.152 0.635 19.837 1.00 0.00 C ATOM 1710 OD1 ASN A 115 -2.545 1.705 19.882 1.00 0.00 O ATOM 1711 ND2 ASN A 115 -4.304 0.438 20.468 1.00 0.00 N ATOM 0 H ASN A 115 -2.693 1.579 17.742 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.604 0.122 18.630 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.420 -1.007 18.491 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.214 -1.286 19.731 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -4.720 1.190 21.017 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.773 -0.465 20.403 1.00 0.00 H new ATOM 1718 N TRP A 116 -0.049 -1.913 17.335 1.00 0.00 N ATOM 1719 CA TRP A 116 0.369 -3.032 16.497 1.00 0.00 C ATOM 1720 C TRP A 116 -0.444 -4.282 16.813 1.00 0.00 C ATOM 1721 O TRP A 116 -0.225 -4.935 17.833 1.00 0.00 O ATOM 1722 CB TRP A 116 1.859 -3.315 16.695 1.00 0.00 C ATOM 1723 CG TRP A 116 2.743 -2.505 15.795 1.00 0.00 C ATOM 1724 CD1 TRP A 116 3.450 -1.386 16.130 1.00 0.00 C ATOM 1725 CD2 TRP A 116 3.010 -2.751 14.410 1.00 0.00 C ATOM 1726 NE1 TRP A 116 4.141 -0.922 15.037 1.00 0.00 N ATOM 1727 CE2 TRP A 116 3.889 -1.742 13.970 1.00 0.00 C ATOM 1728 CE3 TRP A 116 2.594 -3.726 13.499 1.00 0.00 C ATOM 1729 CZ2 TRP A 116 4.356 -1.682 12.660 1.00 0.00 C ATOM 1730 CZ3 TRP A 116 3.059 -3.665 12.199 1.00 0.00 C ATOM 1731 CH2 TRP A 116 3.933 -2.649 11.789 1.00 0.00 C ATOM 0 H TRP A 116 0.603 -1.680 18.084 1.00 0.00 H new ATOM 0 HA TRP A 116 0.193 -2.760 15.456 1.00 0.00 H new ATOM 0 HB2 TRP A 116 2.125 -3.112 17.732 1.00 0.00 H new ATOM 0 HB3 TRP A 116 2.047 -4.374 16.519 1.00 0.00 H new ATOM 0 HD1 TRP A 116 3.464 -0.932 17.110 1.00 0.00 H new ATOM 0 HE1 TRP A 116 4.744 -0.100 15.023 1.00 0.00 H new ATOM 0 HE3 TRP A 116 1.921 -4.513 13.806 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 5.029 -0.899 12.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 2.743 -4.413 11.487 1.00 0.00 H new ATOM 0 HH2 TRP A 116 4.279 -2.629 10.766 1.00 0.00 H new ATOM 1742 N TYR A 117 -1.384 -4.609 15.932 1.00 0.00 N ATOM 1743 CA TYR A 117 -2.232 -5.780 16.119 1.00 0.00 C ATOM 1744 C TYR A 117 -1.558 -7.034 15.570 1.00 0.00 C ATOM 1745 O TYR A 117 -0.668 -6.955 14.722 1.00 0.00 O ATOM 1746 CB TYR A 117 -3.583 -5.572 15.434 1.00 0.00 C ATOM 1747 CG TYR A 117 -4.407 -4.462 16.045 1.00 0.00 C ATOM 1748 CD1 TYR A 117 -4.189 -3.135 15.698 1.00 0.00 C ATOM 1749 CD2 TYR A 117 -5.406 -4.741 16.970 1.00 0.00 C ATOM 1750 CE1 TYR A 117 -4.939 -2.117 16.255 1.00 0.00 C ATOM 1751 CE2 TYR A 117 -6.163 -3.730 17.531 1.00 0.00 C ATOM 1752 CZ TYR A 117 -5.925 -2.420 17.171 1.00 0.00 C ATOM 1753 OH TYR A 117 -6.675 -1.409 17.727 1.00 0.00 O ATOM 0 H TYR A 117 -1.577 -4.079 15.082 1.00 0.00 H new ATOM 0 HA TYR A 117 -2.392 -5.914 17.189 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.416 -5.351 14.380 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.151 -6.501 15.479 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -3.419 -2.894 14.980 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -5.594 -5.766 17.255 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -4.754 -1.090 15.975 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -6.937 -3.964 18.247 1.00 0.00 H new ATOM 0 HH TYR A 117 -7.327 -1.791 18.351 1.00 0.00 H new ATOM 1763 N THR A 118 -1.989 -8.193 16.058 1.00 0.00 N ATOM 1764 CA THR A 118 -1.429 -9.464 15.618 1.00 0.00 C ATOM 1765 C THR A 118 -2.524 -10.504 15.410 1.00 0.00 C ATOM 1766 O THR A 118 -3.564 -10.464 16.066 1.00 0.00 O ATOM 1767 CB THR A 118 -0.406 -10.008 16.633 1.00 0.00 C ATOM 1768 OG1 THR A 118 0.440 -8.948 17.093 1.00 0.00 O ATOM 1769 CG2 THR A 118 0.443 -11.106 16.009 1.00 0.00 C ATOM 0 H THR A 118 -2.725 -8.277 16.759 1.00 0.00 H new ATOM 0 HA THR A 118 -0.925 -9.277 14.670 1.00 0.00 H new ATOM 0 HB THR A 118 -0.953 -10.428 17.477 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.086 -9.302 17.739 1.00 0.00 H new ATOM 0 HG21 THR A 118 1.158 -11.475 16.744 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.201 -11.924 15.686 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.980 -10.706 15.149 1.00 0.00 H new ATOM 1777 N ALA A 119 -2.282 -11.435 14.493 1.00 0.00 N ATOM 1778 CA ALA A 119 -3.247 -12.488 14.200 1.00 0.00 C ATOM 1779 C ALA A 119 -2.545 -13.814 13.923 1.00 0.00 C ATOM 1780 O ALA A 119 -1.474 -13.844 13.318 1.00 0.00 O ATOM 1781 CB ALA A 119 -4.118 -12.092 13.017 1.00 0.00 C ATOM 0 H ALA A 119 -1.426 -11.482 13.940 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.882 -12.619 15.076 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.834 -12.888 12.810 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.655 -11.173 13.252 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.490 -11.931 12.141 1.00 0.00 H new ATOM 1787 N GLU A 120 -3.157 -14.906 14.370 1.00 0.00 N ATOM 1788 CA GLU A 120 -2.589 -16.234 14.170 1.00 0.00 C ATOM 1789 C GLU A 120 -3.412 -17.032 13.163 1.00 0.00 C ATOM 1790 O GLU A 120 -4.642 -16.970 13.160 1.00 0.00 O ATOM 1791 CB GLU A 120 -2.519 -16.989 15.500 1.00 0.00 C ATOM 1792 CG GLU A 120 -1.288 -16.653 16.326 1.00 0.00 C ATOM 1793 CD GLU A 120 -0.988 -17.703 17.377 1.00 0.00 C ATOM 1794 OE1 GLU A 120 -0.465 -18.777 17.010 1.00 0.00 O ATOM 1795 OE2 GLU A 120 -1.274 -17.453 18.566 1.00 0.00 O ATOM 0 H GLU A 120 -4.045 -14.897 14.872 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.580 -16.114 13.775 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.411 -16.763 16.084 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.531 -18.061 15.301 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.428 -16.550 15.664 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.433 -15.688 16.812 1.00 0.00 H new ATOM 1802 N THR A 121 -2.724 -17.782 12.307 1.00 0.00 N ATOM 1803 CA THR A 121 -3.389 -18.591 11.294 1.00 0.00 C ATOM 1804 C THR A 121 -3.810 -19.943 11.859 1.00 0.00 C ATOM 1805 O THR A 121 -3.117 -20.543 12.681 1.00 0.00 O ATOM 1806 CB THR A 121 -2.480 -18.819 10.071 1.00 0.00 C ATOM 1807 OG1 THR A 121 -1.219 -19.352 10.491 1.00 0.00 O ATOM 1808 CG2 THR A 121 -2.259 -17.519 9.311 1.00 0.00 C ATOM 0 H THR A 121 -1.706 -17.845 12.296 1.00 0.00 H new ATOM 0 HA THR A 121 -4.275 -18.039 10.981 1.00 0.00 H new ATOM 0 HB THR A 121 -2.972 -19.530 9.407 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.493 -18.821 10.101 1.00 0.00 H new ATOM 0 HG21 THR A 121 -1.614 -17.705 8.452 1.00 0.00 H new ATOM 0 HG22 THR A 121 -3.218 -17.131 8.968 1.00 0.00 H new ATOM 0 HG23 THR A 121 -1.786 -16.789 9.968 1.00 0.00 H new ATOM 1816 N PRO A 122 -4.973 -20.437 11.409 1.00 0.00 N ATOM 1817 CA PRO A 122 -5.512 -21.725 11.855 1.00 0.00 C ATOM 1818 C PRO A 122 -4.698 -22.905 11.337 1.00 0.00 C ATOM 1819 O PRO A 122 -4.659 -23.163 10.134 1.00 0.00 O ATOM 1820 CB PRO A 122 -6.922 -21.745 11.260 1.00 0.00 C ATOM 1821 CG PRO A 122 -6.845 -20.847 10.073 1.00 0.00 C ATOM 1822 CD PRO A 122 -5.852 -19.776 10.428 1.00 0.00 C ATOM 0 HA PRO A 122 -5.492 -21.821 12.941 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -7.217 -22.755 10.974 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -7.660 -21.389 11.979 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.526 -21.397 9.188 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -7.820 -20.416 9.846 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.296 -19.438 9.554 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -6.341 -18.900 10.853 1.00 0.00 H new ATOM 1830 N GLU A 123 -4.049 -23.618 12.252 1.00 0.00 N ATOM 1831 CA GLU A 123 -3.235 -24.771 11.885 1.00 0.00 C ATOM 1832 C GLU A 123 -3.941 -25.623 10.834 1.00 0.00 C ATOM 1833 O GLU A 123 -3.305 -26.170 9.934 1.00 0.00 O ATOM 1834 CB GLU A 123 -2.926 -25.619 13.121 1.00 0.00 C ATOM 1835 CG GLU A 123 -1.668 -25.187 13.856 1.00 0.00 C ATOM 1836 CD GLU A 123 -0.977 -26.341 14.556 1.00 0.00 C ATOM 1837 OE1 GLU A 123 -0.646 -27.336 13.877 1.00 0.00 O ATOM 1838 OE2 GLU A 123 -0.766 -26.249 15.784 1.00 0.00 O ATOM 0 H GLU A 123 -4.071 -23.418 13.252 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.300 -24.404 11.462 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.772 -25.569 13.806 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.821 -26.661 12.819 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.977 -24.730 13.148 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.924 -24.423 14.590 1.00 0.00 H new ATOM 1845 N ASN A 124 -5.260 -25.732 10.957 1.00 0.00 N ATOM 1846 CA ASN A 124 -6.053 -26.518 10.019 1.00 0.00 C ATOM 1847 C ASN A 124 -7.075 -25.640 9.302 1.00 0.00 C ATOM 1848 O ASN A 124 -7.543 -24.643 9.849 1.00 0.00 O ATOM 1849 CB ASN A 124 -6.767 -27.656 10.752 1.00 0.00 C ATOM 1850 CG ASN A 124 -7.645 -27.156 11.882 1.00 0.00 C ATOM 1851 OD1 ASN A 124 -8.847 -26.956 11.708 1.00 0.00 O ATOM 1852 ND2 ASN A 124 -7.046 -26.950 13.050 1.00 0.00 N ATOM 0 H ASN A 124 -5.802 -25.286 11.697 1.00 0.00 H new ATOM 0 HA ASN A 124 -5.378 -26.941 9.275 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -7.377 -28.215 10.042 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -6.026 -28.349 11.151 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -7.585 -26.613 13.847 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -6.047 -27.129 13.149 1.00 0.00 H new TER 1859 ASN A 124