USER MOD reduce.3.24.130724 H: found=0, std=0, add=1079, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1076 hydrogens (30 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 90 HIS HE2 : A 90 HIS NE2 : A 148 HEMFE :(H bumps) USER MOD Set 1.1: A 41 MET CE :methyl -137:sc= -3.22! (180deg=-1.84) USER MOD Set 1.2: A 148 HEM CMB :methyl -30:sc= -9.03! (180deg=-5!) USER MOD Set 2.1: A 114 MET CE :methyl -124:sc= -6.65! (180deg=-11.8!) USER MOD Set 2.2: A 134 TYR OH : rot 75:sc= -1.38! USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0867 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= -0.16 USER MOD Single : A 6 GLN : amide:sc= -3.32! C(o=-3.3!,f=-10!) USER MOD Single : A 8 GLN : amide:sc= -4.59! C(o=-4.6!,f=-11!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 75:sc= 0.558 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0243 USER MOD Single : A 22 ASN : amide:sc= -0.471 K(o=-0.47,f=-2.6!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot -120:sc= -0.614 USER MOD Single : A 32 THR OG1 : rot 100:sc= -3.41! USER MOD Single : A 33 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00137) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -5.54! K(o=-5.5!,f=-1.3) USER MOD Single : A 39 HIS : no HD1:sc= -0.839 X(o=-0.84,f=-0.88) USER MOD Single : A 48 SER OG : rot -46:sc= 0.312 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -2.77 K(o=-2.8,f=-4.5!) USER MOD Single : A 71 SER OG : rot -38:sc= 0.615 USER MOD Single : A 72 HIS : no HD1:sc= -2.63! C(o=-2.6!,f=-4.4!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 158:sc= -2.9 (180deg=-4.53!) USER MOD Single : A 83 MET CE :methyl -172:sc= -4.4! (180deg=-4.54!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -20.2! C(o=-20!,f=-19!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.022 X(o=-0.022,f=-0.022) USER MOD Single : A 99 LYS NZ :NH3+ 134:sc= 0.254 (180deg=-3.42!) USER MOD Single : A 102 TYR OH : rot 137:sc= 1.27 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= -2.59 X(o=-2.6,f=-2.3!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl -104:sc= -0.924 (180deg=-2.36!) USER MOD Single : A 123 ASN : amide:sc= -9.37! C(o=-9.4!,f=-4.2!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot -103:sc= 1.27 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= -5.04! C(o=-5!,f=-3.3!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 HEM CMA :methyl 150:sc= -9.02! (180deg=-9.02!) USER MOD Single : A 148 HEM CMC :methyl -30:sc= -10.9! (180deg=-12.9!) USER MOD Single : A 148 HEM CMD :methyl -30:sc= -0.382 (180deg=-0.723) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.077 6.319 9.923 1.00 0.00 N ATOM 2 CA GLY A 1 14.152 5.122 9.039 1.00 0.00 C ATOM 3 C GLY A 1 14.322 5.580 7.590 1.00 0.00 C ATOM 4 O GLY A 1 14.772 6.678 7.331 1.00 0.00 O ATOM 0 H1 GLY A 1 14.778 6.232 10.686 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.276 7.175 9.366 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.124 6.387 10.335 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.989 4.489 9.334 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.247 4.522 9.140 1.00 0.00 H new ATOM 8 N LEU A 2 13.958 4.746 6.644 1.00 0.00 N ATOM 9 CA LEU A 2 14.090 5.119 5.193 1.00 0.00 C ATOM 10 C LEU A 2 15.425 5.807 4.971 1.00 0.00 C ATOM 11 O LEU A 2 15.547 6.725 4.184 1.00 0.00 O ATOM 12 CB LEU A 2 12.953 6.098 4.865 1.00 0.00 C ATOM 13 CG LEU A 2 11.727 5.829 5.735 1.00 0.00 C ATOM 14 CD1 LEU A 2 11.792 6.710 6.982 1.00 0.00 C ATOM 15 CD2 LEU A 2 10.475 6.169 4.935 1.00 0.00 C ATOM 0 H LEU A 2 13.573 3.817 6.813 1.00 0.00 H new ATOM 0 HA LEU A 2 14.036 4.235 4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 2 13.295 7.122 5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 2 12.683 6.007 3.813 1.00 0.00 H new ATOM 0 HG LEU A 2 11.701 4.781 6.034 1.00 0.00 H new ATOM 0 HD11 LEU A 2 10.919 6.522 7.606 1.00 0.00 H new ATOM 0 HD12 LEU A 2 12.697 6.479 7.544 1.00 0.00 H new ATOM 0 HD13 LEU A 2 11.807 7.759 6.686 1.00 0.00 H new ATOM 0 HD21 LEU A 2 9.591 5.981 5.545 1.00 0.00 H new ATOM 0 HD22 LEU A 2 10.501 7.220 4.648 1.00 0.00 H new ATOM 0 HD23 LEU A 2 10.436 5.549 4.039 1.00 0.00 H new ATOM 27 N SER A 3 16.416 5.387 5.680 1.00 0.00 N ATOM 28 CA SER A 3 17.743 6.032 5.540 1.00 0.00 C ATOM 29 C SER A 3 18.560 5.323 4.464 1.00 0.00 C ATOM 30 O SER A 3 18.028 4.692 3.574 1.00 0.00 O ATOM 31 CB SER A 3 18.389 5.886 6.911 1.00 0.00 C ATOM 32 OG SER A 3 19.159 4.690 6.950 1.00 0.00 O ATOM 0 H SER A 3 16.370 4.623 6.354 1.00 0.00 H new ATOM 0 HA SER A 3 17.675 7.077 5.236 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.025 6.747 7.118 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.622 5.862 7.685 1.00 0.00 H new ATOM 0 HG SER A 3 19.576 4.598 7.832 1.00 0.00 H new ATOM 38 N ALA A 4 19.853 5.432 4.538 1.00 0.00 N ATOM 39 CA ALA A 4 20.718 4.775 3.518 1.00 0.00 C ATOM 40 C ALA A 4 20.594 3.252 3.621 1.00 0.00 C ATOM 41 O ALA A 4 21.066 2.527 2.768 1.00 0.00 O ATOM 42 CB ALA A 4 22.141 5.226 3.849 1.00 0.00 C ATOM 0 H ALA A 4 20.352 5.949 5.262 1.00 0.00 H new ATOM 0 HA ALA A 4 20.435 5.047 2.501 1.00 0.00 H new ATOM 0 HB1 ALA A 4 22.838 4.782 3.139 1.00 0.00 H new ATOM 0 HB2 ALA A 4 22.202 6.312 3.786 1.00 0.00 H new ATOM 0 HB3 ALA A 4 22.399 4.906 4.859 1.00 0.00 H new ATOM 48 N ALA A 5 19.970 2.756 4.656 1.00 0.00 N ATOM 49 CA ALA A 5 19.834 1.280 4.795 1.00 0.00 C ATOM 50 C ALA A 5 18.405 0.846 4.452 1.00 0.00 C ATOM 51 O ALA A 5 18.196 -0.013 3.618 1.00 0.00 O ATOM 52 CB ALA A 5 20.155 0.983 6.261 1.00 0.00 C ATOM 0 H ALA A 5 19.552 3.306 5.406 1.00 0.00 H new ATOM 0 HA ALA A 5 20.498 0.739 4.121 1.00 0.00 H new ATOM 0 HB1 ALA A 5 20.075 -0.089 6.441 1.00 0.00 H new ATOM 0 HB2 ALA A 5 21.169 1.314 6.486 1.00 0.00 H new ATOM 0 HB3 ALA A 5 19.450 1.512 6.902 1.00 0.00 H new ATOM 58 N GLN A 6 17.418 1.422 5.086 1.00 0.00 N ATOM 59 CA GLN A 6 16.016 1.022 4.783 1.00 0.00 C ATOM 60 C GLN A 6 15.630 1.533 3.394 1.00 0.00 C ATOM 61 O GLN A 6 15.144 0.792 2.563 1.00 0.00 O ATOM 62 CB GLN A 6 15.163 1.678 5.869 1.00 0.00 C ATOM 63 CG GLN A 6 15.196 0.811 7.131 1.00 0.00 C ATOM 64 CD GLN A 6 14.244 1.378 8.183 1.00 0.00 C ATOM 65 OE1 GLN A 6 14.216 2.569 8.413 1.00 0.00 O ATOM 66 NE2 GLN A 6 13.457 0.569 8.838 1.00 0.00 N ATOM 0 H GLN A 6 17.522 2.147 5.796 1.00 0.00 H new ATOM 0 HA GLN A 6 15.879 -0.059 4.777 1.00 0.00 H new ATOM 0 HB2 GLN A 6 15.540 2.677 6.090 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.137 1.795 5.521 1.00 0.00 H new ATOM 0 HG2 GLN A 6 14.912 -0.212 6.886 1.00 0.00 H new ATOM 0 HG3 GLN A 6 16.210 0.774 7.529 1.00 0.00 H new ATOM 0 HE21 GLN A 6 13.480 -0.432 8.645 1.00 0.00 H new ATOM 0 HE22 GLN A 6 12.819 0.938 9.543 1.00 0.00 H new ATOM 75 N ARG A 7 15.851 2.791 3.130 1.00 0.00 N ATOM 76 CA ARG A 7 15.502 3.337 1.789 1.00 0.00 C ATOM 77 C ARG A 7 16.156 2.471 0.712 1.00 0.00 C ATOM 78 O ARG A 7 15.705 2.413 -0.415 1.00 0.00 O ATOM 79 CB ARG A 7 16.075 4.756 1.768 1.00 0.00 C ATOM 80 CG ARG A 7 15.204 5.645 0.882 1.00 0.00 C ATOM 81 CD ARG A 7 16.077 6.340 -0.165 1.00 0.00 C ATOM 82 NE ARG A 7 16.579 5.250 -1.044 1.00 0.00 N ATOM 83 CZ ARG A 7 16.875 5.500 -2.290 1.00 0.00 C ATOM 84 NH1 ARG A 7 17.774 6.400 -2.581 1.00 0.00 N ATOM 85 NH2 ARG A 7 16.271 4.849 -3.246 1.00 0.00 N ATOM 0 H ARG A 7 16.257 3.462 3.782 1.00 0.00 H new ATOM 0 HA ARG A 7 14.428 3.343 1.600 1.00 0.00 H new ATOM 0 HB2 ARG A 7 16.113 5.159 2.780 1.00 0.00 H new ATOM 0 HB3 ARG A 7 17.098 4.741 1.392 1.00 0.00 H new ATOM 0 HG2 ARG A 7 14.437 5.046 0.391 1.00 0.00 H new ATOM 0 HG3 ARG A 7 14.688 6.388 1.490 1.00 0.00 H new ATOM 0 HD2 ARG A 7 15.502 7.071 -0.734 1.00 0.00 H new ATOM 0 HD3 ARG A 7 16.901 6.878 0.304 1.00 0.00 H new ATOM 0 HE ARG A 7 16.692 4.307 -0.673 1.00 0.00 H new ATOM 0 HH11 ARG A 7 18.246 6.909 -1.834 1.00 0.00 H new ATOM 0 HH12 ARG A 7 18.004 6.594 -3.555 1.00 0.00 H new ATOM 0 HH21 ARG A 7 15.568 4.145 -3.019 1.00 0.00 H new ATOM 0 HH22 ARG A 7 16.502 5.044 -4.220 1.00 0.00 H new ATOM 99 N GLN A 8 17.217 1.794 1.056 1.00 0.00 N ATOM 100 CA GLN A 8 17.908 0.926 0.062 1.00 0.00 C ATOM 101 C GLN A 8 17.202 -0.428 -0.012 1.00 0.00 C ATOM 102 O GLN A 8 16.820 -0.883 -1.071 1.00 0.00 O ATOM 103 CB GLN A 8 19.333 0.765 0.599 1.00 0.00 C ATOM 104 CG GLN A 8 20.237 1.859 0.021 1.00 0.00 C ATOM 105 CD GLN A 8 19.596 3.236 0.212 1.00 0.00 C ATOM 106 OE1 GLN A 8 19.274 3.622 1.318 1.00 0.00 O ATOM 107 NE2 GLN A 8 19.394 3.997 -0.829 1.00 0.00 N ATOM 0 H GLN A 8 17.636 1.805 1.986 1.00 0.00 H new ATOM 0 HA GLN A 8 17.903 1.349 -0.943 1.00 0.00 H new ATOM 0 HB2 GLN A 8 19.329 0.822 1.687 1.00 0.00 H new ATOM 0 HB3 GLN A 8 19.722 -0.218 0.333 1.00 0.00 H new ATOM 0 HG2 GLN A 8 21.210 1.832 0.511 1.00 0.00 H new ATOM 0 HG3 GLN A 8 20.409 1.675 -1.039 1.00 0.00 H new ATOM 0 HE21 GLN A 8 19.664 3.673 -1.758 1.00 0.00 H new ATOM 0 HE22 GLN A 8 18.966 4.916 -0.714 1.00 0.00 H new ATOM 116 N VAL A 9 17.025 -1.075 1.107 1.00 0.00 N ATOM 117 CA VAL A 9 16.343 -2.400 1.098 1.00 0.00 C ATOM 118 C VAL A 9 14.976 -2.263 0.427 1.00 0.00 C ATOM 119 O VAL A 9 14.508 -3.165 -0.240 1.00 0.00 O ATOM 120 CB VAL A 9 16.188 -2.790 2.568 1.00 0.00 C ATOM 121 CG1 VAL A 9 15.688 -4.232 2.659 1.00 0.00 C ATOM 122 CG2 VAL A 9 17.541 -2.677 3.273 1.00 0.00 C ATOM 0 H VAL A 9 17.322 -0.745 2.025 1.00 0.00 H new ATOM 0 HA VAL A 9 16.904 -3.155 0.547 1.00 0.00 H new ATOM 0 HB VAL A 9 15.472 -2.123 3.048 1.00 0.00 H new ATOM 0 HG11 VAL A 9 15.577 -4.513 3.706 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.724 -4.315 2.156 1.00 0.00 H new ATOM 0 HG13 VAL A 9 16.406 -4.897 2.179 1.00 0.00 H new ATOM 0 HG21 VAL A 9 17.430 -2.955 4.321 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.257 -3.345 2.795 1.00 0.00 H new ATOM 0 HG23 VAL A 9 17.901 -1.650 3.206 1.00 0.00 H new ATOM 132 N VAL A 10 14.333 -1.140 0.594 1.00 0.00 N ATOM 133 CA VAL A 10 12.999 -0.948 -0.039 1.00 0.00 C ATOM 134 C VAL A 10 13.123 -1.144 -1.551 1.00 0.00 C ATOM 135 O VAL A 10 12.299 -1.782 -2.175 1.00 0.00 O ATOM 136 CB VAL A 10 12.599 0.490 0.291 1.00 0.00 C ATOM 137 CG1 VAL A 10 11.244 0.805 -0.346 1.00 0.00 C ATOM 138 CG2 VAL A 10 12.497 0.653 1.809 1.00 0.00 C ATOM 0 H VAL A 10 14.673 -0.349 1.140 1.00 0.00 H new ATOM 0 HA VAL A 10 12.256 -1.659 0.322 1.00 0.00 H new ATOM 0 HB VAL A 10 13.351 1.174 -0.101 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.960 1.831 -0.110 1.00 0.00 H new ATOM 0 HG12 VAL A 10 11.314 0.688 -1.427 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.491 0.121 0.045 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.212 1.678 2.047 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.745 -0.033 2.199 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.462 0.430 2.265 1.00 0.00 H new ATOM 148 N ALA A 11 14.152 -0.601 -2.145 1.00 0.00 N ATOM 149 CA ALA A 11 14.331 -0.759 -3.615 1.00 0.00 C ATOM 150 C ALA A 11 14.840 -2.171 -3.930 1.00 0.00 C ATOM 151 O ALA A 11 14.890 -2.580 -5.073 1.00 0.00 O ATOM 152 CB ALA A 11 15.370 0.292 -4.008 1.00 0.00 C ATOM 0 H ALA A 11 14.875 -0.056 -1.675 1.00 0.00 H new ATOM 0 HA ALA A 11 13.399 -0.626 -4.164 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.555 0.237 -5.081 1.00 0.00 H new ATOM 0 HB2 ALA A 11 14.997 1.284 -3.754 1.00 0.00 H new ATOM 0 HB3 ALA A 11 16.299 0.105 -3.469 1.00 0.00 H new ATOM 158 N SER A 12 15.225 -2.917 -2.928 1.00 0.00 N ATOM 159 CA SER A 12 15.734 -4.295 -3.181 1.00 0.00 C ATOM 160 C SER A 12 14.591 -5.307 -3.054 1.00 0.00 C ATOM 161 O SER A 12 14.625 -6.368 -3.644 1.00 0.00 O ATOM 162 CB SER A 12 16.790 -4.536 -2.103 1.00 0.00 C ATOM 163 OG SER A 12 17.611 -5.631 -2.488 1.00 0.00 O ATOM 0 H SER A 12 15.209 -2.632 -1.949 1.00 0.00 H new ATOM 0 HA SER A 12 16.149 -4.406 -4.183 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.397 -3.641 -1.966 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.310 -4.745 -1.147 1.00 0.00 H new ATOM 0 HG SER A 12 18.291 -5.788 -1.800 1.00 0.00 H new ATOM 169 N THR A 13 13.581 -4.992 -2.288 1.00 0.00 N ATOM 170 CA THR A 13 12.447 -5.946 -2.129 1.00 0.00 C ATOM 171 C THR A 13 11.322 -5.588 -3.104 1.00 0.00 C ATOM 172 O THR A 13 10.427 -6.373 -3.345 1.00 0.00 O ATOM 173 CB THR A 13 11.983 -5.780 -0.680 1.00 0.00 C ATOM 174 OG1 THR A 13 11.824 -4.398 -0.390 1.00 0.00 O ATOM 175 CG2 THR A 13 13.024 -6.385 0.264 1.00 0.00 C ATOM 0 H THR A 13 13.493 -4.119 -1.768 1.00 0.00 H new ATOM 0 HA THR A 13 12.737 -6.975 -2.342 1.00 0.00 H new ATOM 0 HB THR A 13 11.031 -6.292 -0.543 1.00 0.00 H new ATOM 0 HG1 THR A 13 11.009 -4.065 -0.820 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.692 -6.266 1.296 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.144 -7.445 0.041 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.978 -5.875 0.129 1.00 0.00 H new ATOM 183 N TRP A 14 11.355 -4.410 -3.667 1.00 0.00 N ATOM 184 CA TRP A 14 10.280 -4.015 -4.623 1.00 0.00 C ATOM 185 C TRP A 14 10.661 -4.454 -6.036 1.00 0.00 C ATOM 186 O TRP A 14 9.816 -4.629 -6.891 1.00 0.00 O ATOM 187 CB TRP A 14 10.189 -2.491 -4.528 1.00 0.00 C ATOM 188 CG TRP A 14 8.764 -2.100 -4.302 1.00 0.00 C ATOM 189 CD1 TRP A 14 8.224 -1.795 -3.100 1.00 0.00 C ATOM 190 CD2 TRP A 14 7.691 -1.974 -5.278 1.00 0.00 C ATOM 191 NE1 TRP A 14 6.886 -1.492 -3.276 1.00 0.00 N ATOM 192 CE2 TRP A 14 6.510 -1.588 -4.602 1.00 0.00 C ATOM 193 CE3 TRP A 14 7.628 -2.156 -6.671 1.00 0.00 C ATOM 194 CZ2 TRP A 14 5.309 -1.389 -5.283 1.00 0.00 C ATOM 195 CZ3 TRP A 14 6.420 -1.957 -7.360 1.00 0.00 C ATOM 196 CH2 TRP A 14 5.263 -1.576 -6.667 1.00 0.00 C ATOM 0 H TRP A 14 12.076 -3.707 -3.507 1.00 0.00 H new ATOM 0 HA TRP A 14 9.323 -4.482 -4.390 1.00 0.00 H new ATOM 0 HB2 TRP A 14 10.813 -2.127 -3.712 1.00 0.00 H new ATOM 0 HB3 TRP A 14 10.564 -2.034 -5.444 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.751 -1.789 -2.157 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.254 -1.230 -2.519 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.514 -2.451 -7.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 4.421 -1.093 -4.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.383 -2.098 -8.430 1.00 0.00 H new ATOM 0 HH2 TRP A 14 4.337 -1.427 -7.202 1.00 0.00 H new ATOM 207 N LYS A 15 11.926 -4.639 -6.289 1.00 0.00 N ATOM 208 CA LYS A 15 12.355 -5.073 -7.647 1.00 0.00 C ATOM 209 C LYS A 15 12.184 -6.591 -7.787 1.00 0.00 C ATOM 210 O LYS A 15 12.498 -7.166 -8.810 1.00 0.00 O ATOM 211 CB LYS A 15 13.828 -4.677 -7.748 1.00 0.00 C ATOM 212 CG LYS A 15 13.930 -3.180 -8.046 1.00 0.00 C ATOM 213 CD LYS A 15 15.403 -2.778 -8.141 1.00 0.00 C ATOM 214 CE LYS A 15 15.533 -1.505 -8.980 1.00 0.00 C ATOM 215 NZ LYS A 15 16.990 -1.197 -8.972 1.00 0.00 N ATOM 0 H LYS A 15 12.681 -4.509 -5.615 1.00 0.00 H new ATOM 0 HA LYS A 15 11.764 -4.613 -8.438 1.00 0.00 H new ATOM 0 HB2 LYS A 15 14.344 -4.910 -6.816 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.317 -5.250 -8.535 1.00 0.00 H new ATOM 0 HG2 LYS A 15 13.418 -2.949 -8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 15 13.436 -2.608 -7.261 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.810 -2.612 -7.144 1.00 0.00 H new ATOM 0 HD3 LYS A 15 15.982 -3.584 -8.592 1.00 0.00 H new ATOM 0 HE2 LYS A 15 15.166 -1.660 -9.995 1.00 0.00 H new ATOM 0 HE3 LYS A 15 14.953 -0.687 -8.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 17.166 -0.335 -9.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 17.308 -1.049 -7.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 17.515 -1.991 -9.390 1.00 0.00 H new ATOM 229 N ASP A 16 11.684 -7.244 -6.771 1.00 0.00 N ATOM 230 CA ASP A 16 11.491 -8.719 -6.856 1.00 0.00 C ATOM 231 C ASP A 16 10.007 -9.045 -6.677 1.00 0.00 C ATOM 232 O ASP A 16 9.427 -9.788 -7.444 1.00 0.00 O ATOM 233 CB ASP A 16 12.319 -9.303 -5.710 1.00 0.00 C ATOM 234 CG ASP A 16 13.679 -9.770 -6.233 1.00 0.00 C ATOM 235 OD1 ASP A 16 14.447 -8.926 -6.664 1.00 0.00 O ATOM 236 OD2 ASP A 16 13.928 -10.963 -6.195 1.00 0.00 O ATOM 0 H ASP A 16 11.402 -6.819 -5.888 1.00 0.00 H new ATOM 0 HA ASP A 16 11.802 -9.130 -7.816 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.457 -8.553 -4.931 1.00 0.00 H new ATOM 0 HB3 ASP A 16 11.788 -10.140 -5.256 1.00 0.00 H new ATOM 241 N ILE A 17 9.386 -8.490 -5.671 1.00 0.00 N ATOM 242 CA ILE A 17 7.939 -8.764 -5.445 1.00 0.00 C ATOM 243 C ILE A 17 7.113 -8.066 -6.529 1.00 0.00 C ATOM 244 O ILE A 17 6.041 -8.510 -6.889 1.00 0.00 O ATOM 245 CB ILE A 17 7.629 -8.181 -4.066 1.00 0.00 C ATOM 246 CG1 ILE A 17 8.468 -8.903 -3.008 1.00 0.00 C ATOM 247 CG2 ILE A 17 6.143 -8.370 -3.753 1.00 0.00 C ATOM 248 CD1 ILE A 17 8.080 -8.401 -1.616 1.00 0.00 C ATOM 0 H ILE A 17 9.819 -7.859 -4.997 1.00 0.00 H new ATOM 0 HA ILE A 17 7.701 -9.827 -5.489 1.00 0.00 H new ATOM 0 HB ILE A 17 7.869 -7.118 -4.059 1.00 0.00 H new ATOM 0 HG12 ILE A 17 8.309 -9.979 -3.075 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.529 -8.726 -3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.923 -7.954 -2.770 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.544 -7.858 -4.506 1.00 0.00 H new ATOM 0 HG23 ILE A 17 5.902 -9.433 -3.760 1.00 0.00 H new ATOM 0 HD11 ILE A 17 8.678 -8.916 -0.864 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.262 -7.328 -1.552 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.023 -8.601 -1.439 1.00 0.00 H new ATOM 260 N ALA A 18 7.604 -6.976 -7.052 1.00 0.00 N ATOM 261 CA ALA A 18 6.850 -6.251 -8.111 1.00 0.00 C ATOM 262 C ALA A 18 7.565 -6.415 -9.454 1.00 0.00 C ATOM 263 O ALA A 18 7.571 -5.523 -10.279 1.00 0.00 O ATOM 264 CB ALA A 18 6.856 -4.788 -7.670 1.00 0.00 C ATOM 0 H ALA A 18 8.496 -6.556 -6.791 1.00 0.00 H new ATOM 0 HA ALA A 18 5.835 -6.628 -8.238 1.00 0.00 H new ATOM 0 HB1 ALA A 18 6.318 -4.185 -8.401 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.370 -4.699 -6.698 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.884 -4.435 -7.595 1.00 0.00 H new ATOM 270 N GLY A 19 8.169 -7.550 -9.680 1.00 0.00 N ATOM 271 CA GLY A 19 8.884 -7.770 -10.969 1.00 0.00 C ATOM 272 C GLY A 19 7.942 -7.448 -12.130 1.00 0.00 C ATOM 273 O GLY A 19 7.918 -6.344 -12.635 1.00 0.00 O ATOM 0 H GLY A 19 8.198 -8.334 -9.028 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.771 -7.138 -11.019 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.225 -8.803 -11.038 1.00 0.00 H new ATOM 277 N SER A 20 7.166 -8.406 -12.559 1.00 0.00 N ATOM 278 CA SER A 20 6.226 -8.154 -13.688 1.00 0.00 C ATOM 279 C SER A 20 4.815 -7.924 -13.143 1.00 0.00 C ATOM 280 O SER A 20 3.992 -7.288 -13.771 1.00 0.00 O ATOM 281 CB SER A 20 6.277 -9.420 -14.543 1.00 0.00 C ATOM 282 OG SER A 20 6.043 -10.553 -13.718 1.00 0.00 O ATOM 0 H SER A 20 7.142 -9.351 -12.177 1.00 0.00 H new ATOM 0 HA SER A 20 6.495 -7.270 -14.266 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.527 -9.370 -15.333 1.00 0.00 H new ATOM 0 HB3 SER A 20 7.248 -9.505 -15.030 1.00 0.00 H new ATOM 0 HG SER A 20 6.073 -11.367 -14.263 1.00 0.00 H new ATOM 288 N ASP A 21 4.528 -8.436 -11.977 1.00 0.00 N ATOM 289 CA ASP A 21 3.170 -8.245 -11.394 1.00 0.00 C ATOM 290 C ASP A 21 3.079 -6.865 -10.740 1.00 0.00 C ATOM 291 O ASP A 21 2.005 -6.335 -10.533 1.00 0.00 O ATOM 292 CB ASP A 21 3.023 -9.352 -10.347 1.00 0.00 C ATOM 293 CG ASP A 21 4.134 -9.235 -9.303 1.00 0.00 C ATOM 294 OD1 ASP A 21 5.279 -9.463 -9.658 1.00 0.00 O ATOM 295 OD2 ASP A 21 3.822 -8.921 -8.166 1.00 0.00 O ATOM 0 H ASP A 21 5.175 -8.978 -11.404 1.00 0.00 H new ATOM 0 HA ASP A 21 2.382 -8.298 -12.145 1.00 0.00 H new ATOM 0 HB2 ASP A 21 2.049 -9.279 -9.863 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.067 -10.328 -10.829 1.00 0.00 H new ATOM 300 N ASN A 22 4.197 -6.278 -10.411 1.00 0.00 N ATOM 301 CA ASN A 22 4.173 -4.933 -9.770 1.00 0.00 C ATOM 302 C ASN A 22 3.331 -4.988 -8.493 1.00 0.00 C ATOM 303 O ASN A 22 2.720 -4.015 -8.099 1.00 0.00 O ATOM 304 CB ASN A 22 3.530 -4.005 -10.803 1.00 0.00 C ATOM 305 CG ASN A 22 4.076 -2.585 -10.643 1.00 0.00 C ATOM 306 OD1 ASN A 22 5.226 -2.400 -10.297 1.00 0.00 O ATOM 307 ND2 ASN A 22 3.295 -1.568 -10.882 1.00 0.00 N ATOM 0 H ASN A 22 5.126 -6.672 -10.558 1.00 0.00 H new ATOM 0 HA ASN A 22 5.167 -4.587 -9.488 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.734 -4.371 -11.809 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.447 -4.003 -10.678 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.650 -0.617 -10.778 1.00 0.00 H new ATOM 0 HD22 ASN A 22 2.330 -1.723 -11.172 1.00 0.00 H new ATOM 314 N GLY A 23 3.294 -6.120 -7.845 1.00 0.00 N ATOM 315 CA GLY A 23 2.491 -6.236 -6.595 1.00 0.00 C ATOM 316 C GLY A 23 1.062 -6.646 -6.954 1.00 0.00 C ATOM 317 O GLY A 23 0.107 -6.194 -6.354 1.00 0.00 O ATOM 0 H GLY A 23 3.785 -6.969 -8.127 1.00 0.00 H new ATOM 0 HA2 GLY A 23 2.938 -6.974 -5.928 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.487 -5.286 -6.061 1.00 0.00 H new ATOM 321 N ALA A 24 0.907 -7.499 -7.929 1.00 0.00 N ATOM 322 CA ALA A 24 -0.461 -7.937 -8.327 1.00 0.00 C ATOM 323 C ALA A 24 -0.968 -8.997 -7.346 1.00 0.00 C ATOM 324 O ALA A 24 -2.066 -8.908 -6.835 1.00 0.00 O ATOM 325 CB ALA A 24 -0.302 -8.528 -9.729 1.00 0.00 C ATOM 0 H ALA A 24 1.669 -7.912 -8.467 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.181 -7.119 -8.318 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -1.271 -8.873 -10.090 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.086 -7.765 -10.404 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.392 -9.368 -9.693 1.00 0.00 H new ATOM 331 N GLY A 25 -0.176 -9.999 -7.080 1.00 0.00 N ATOM 332 CA GLY A 25 -0.615 -11.063 -6.134 1.00 0.00 C ATOM 333 C GLY A 25 -0.509 -10.539 -4.702 1.00 0.00 C ATOM 334 O GLY A 25 -1.175 -11.017 -3.806 1.00 0.00 O ATOM 0 H GLY A 25 0.755 -10.127 -7.476 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.642 -11.358 -6.351 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.004 -11.952 -6.255 1.00 0.00 H new ATOM 338 N VAL A 26 0.324 -9.560 -4.480 1.00 0.00 N ATOM 339 CA VAL A 26 0.477 -9.003 -3.106 1.00 0.00 C ATOM 340 C VAL A 26 -0.817 -8.298 -2.684 1.00 0.00 C ATOM 341 O VAL A 26 -1.125 -8.196 -1.513 1.00 0.00 O ATOM 342 CB VAL A 26 1.636 -8.005 -3.211 1.00 0.00 C ATOM 343 CG1 VAL A 26 1.688 -7.128 -1.956 1.00 0.00 C ATOM 344 CG2 VAL A 26 2.954 -8.771 -3.349 1.00 0.00 C ATOM 0 H VAL A 26 0.907 -9.121 -5.192 1.00 0.00 H new ATOM 0 HA VAL A 26 0.676 -9.772 -2.360 1.00 0.00 H new ATOM 0 HB VAL A 26 1.484 -7.371 -4.084 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.514 -6.422 -2.039 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.751 -6.580 -1.856 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.836 -7.757 -1.078 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.780 -8.064 -3.424 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.099 -9.407 -2.475 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.923 -9.389 -4.246 1.00 0.00 H new ATOM 354 N GLY A 27 -1.572 -7.805 -3.626 1.00 0.00 N ATOM 355 CA GLY A 27 -2.837 -7.101 -3.273 1.00 0.00 C ATOM 356 C GLY A 27 -3.964 -8.121 -3.100 1.00 0.00 C ATOM 357 O GLY A 27 -4.671 -8.116 -2.112 1.00 0.00 O ATOM 0 H GLY A 27 -1.368 -7.859 -4.624 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.703 -6.533 -2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.097 -6.386 -4.054 1.00 0.00 H new ATOM 361 N LYS A 28 -4.145 -8.991 -4.055 1.00 0.00 N ATOM 362 CA LYS A 28 -5.234 -10.001 -3.944 1.00 0.00 C ATOM 363 C LYS A 28 -5.053 -10.830 -2.669 1.00 0.00 C ATOM 364 O LYS A 28 -5.995 -11.389 -2.144 1.00 0.00 O ATOM 365 CB LYS A 28 -5.104 -10.876 -5.194 1.00 0.00 C ATOM 366 CG LYS A 28 -3.835 -11.726 -5.105 1.00 0.00 C ATOM 367 CD LYS A 28 -3.696 -12.566 -6.376 1.00 0.00 C ATOM 368 CE LYS A 28 -3.680 -11.643 -7.598 1.00 0.00 C ATOM 369 NZ LYS A 28 -2.863 -12.370 -8.609 1.00 0.00 N ATOM 0 H LYS A 28 -3.586 -9.046 -4.907 1.00 0.00 H new ATOM 0 HA LYS A 28 -6.221 -9.542 -3.882 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.978 -11.520 -5.290 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.071 -10.249 -6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.962 -11.085 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.879 -12.375 -4.230 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.778 -13.153 -6.338 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.523 -13.272 -6.451 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.689 -11.454 -7.965 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.242 -10.674 -7.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.803 -11.803 -9.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.907 -12.530 -8.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.308 -13.285 -8.822 1.00 0.00 H new ATOM 383 N GLU A 29 -3.852 -10.918 -2.165 1.00 0.00 N ATOM 384 CA GLU A 29 -3.627 -11.715 -0.925 1.00 0.00 C ATOM 385 C GLU A 29 -3.624 -10.787 0.294 1.00 0.00 C ATOM 386 O GLU A 29 -3.963 -11.185 1.391 1.00 0.00 O ATOM 387 CB GLU A 29 -2.260 -12.384 -1.114 1.00 0.00 C ATOM 388 CG GLU A 29 -1.146 -11.337 -1.019 1.00 0.00 C ATOM 389 CD GLU A 29 0.205 -11.980 -1.337 1.00 0.00 C ATOM 390 OE1 GLU A 29 0.818 -12.507 -0.423 1.00 0.00 O ATOM 391 OE2 GLU A 29 0.604 -11.936 -2.489 1.00 0.00 O ATOM 0 H GLU A 29 -3.021 -10.475 -2.556 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.409 -12.456 -0.757 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.114 -13.152 -0.355 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.221 -12.882 -2.083 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.342 -10.521 -1.715 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -1.126 -10.905 -0.018 1.00 0.00 H new ATOM 398 N CYS A 30 -3.242 -9.554 0.109 1.00 0.00 N ATOM 399 CA CYS A 30 -3.214 -8.601 1.255 1.00 0.00 C ATOM 400 C CYS A 30 -4.607 -8.003 1.463 1.00 0.00 C ATOM 401 O CYS A 30 -5.147 -8.026 2.550 1.00 0.00 O ATOM 402 CB CYS A 30 -2.213 -7.517 0.851 1.00 0.00 C ATOM 403 SG CYS A 30 -2.208 -6.206 2.099 1.00 0.00 S ATOM 0 H CYS A 30 -2.948 -9.164 -0.787 1.00 0.00 H new ATOM 0 HA CYS A 30 -2.927 -9.081 2.191 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.216 -7.946 0.754 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.479 -7.106 -0.123 1.00 0.00 H new ATOM 0 HG CYS A 30 -2.545 -5.079 1.546 1.00 0.00 H new ATOM 409 N PHE A 31 -5.189 -7.463 0.428 1.00 0.00 N ATOM 410 CA PHE A 31 -6.545 -6.859 0.565 1.00 0.00 C ATOM 411 C PHE A 31 -7.544 -7.926 1.018 1.00 0.00 C ATOM 412 O PHE A 31 -8.344 -7.703 1.904 1.00 0.00 O ATOM 413 CB PHE A 31 -6.893 -6.336 -0.833 1.00 0.00 C ATOM 414 CG PHE A 31 -6.361 -4.927 -1.011 1.00 0.00 C ATOM 415 CD1 PHE A 31 -5.239 -4.493 -0.289 1.00 0.00 C ATOM 416 CD2 PHE A 31 -6.993 -4.056 -1.906 1.00 0.00 C ATOM 417 CE1 PHE A 31 -4.754 -3.191 -0.463 1.00 0.00 C ATOM 418 CE2 PHE A 31 -6.507 -2.755 -2.079 1.00 0.00 C ATOM 419 CZ PHE A 31 -5.388 -2.322 -1.357 1.00 0.00 C ATOM 0 H PHE A 31 -4.784 -7.414 -0.507 1.00 0.00 H new ATOM 0 HA PHE A 31 -6.576 -6.061 1.307 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.467 -6.992 -1.592 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -7.974 -6.345 -0.974 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -4.749 -5.164 0.401 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -7.856 -4.388 -2.463 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -3.890 -2.858 0.093 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -6.996 -2.084 -2.770 1.00 0.00 H new ATOM 0 HZ PHE A 31 -5.015 -1.317 -1.490 1.00 0.00 H new ATOM 429 N THR A 32 -7.505 -9.086 0.420 1.00 0.00 N ATOM 430 CA THR A 32 -8.455 -10.162 0.824 1.00 0.00 C ATOM 431 C THR A 32 -8.385 -10.361 2.340 1.00 0.00 C ATOM 432 O THR A 32 -9.390 -10.535 3.000 1.00 0.00 O ATOM 433 CB THR A 32 -7.982 -11.417 0.086 1.00 0.00 C ATOM 434 OG1 THR A 32 -8.234 -11.268 -1.304 1.00 0.00 O ATOM 435 CG2 THR A 32 -8.736 -12.639 0.614 1.00 0.00 C ATOM 0 H THR A 32 -6.858 -9.335 -0.329 1.00 0.00 H new ATOM 0 HA THR A 32 -9.489 -9.924 0.576 1.00 0.00 H new ATOM 0 HB THR A 32 -6.913 -11.554 0.251 1.00 0.00 H new ATOM 0 HG1 THR A 32 -7.406 -11.010 -1.761 1.00 0.00 H new ATOM 0 HG21 THR A 32 -8.397 -13.531 0.087 1.00 0.00 H new ATOM 0 HG22 THR A 32 -8.543 -12.753 1.681 1.00 0.00 H new ATOM 0 HG23 THR A 32 -9.805 -12.505 0.451 1.00 0.00 H new ATOM 443 N LYS A 33 -7.204 -10.335 2.897 1.00 0.00 N ATOM 444 CA LYS A 33 -7.072 -10.521 4.370 1.00 0.00 C ATOM 445 C LYS A 33 -7.653 -9.305 5.094 1.00 0.00 C ATOM 446 O LYS A 33 -8.429 -9.434 6.020 1.00 0.00 O ATOM 447 CB LYS A 33 -5.569 -10.640 4.628 1.00 0.00 C ATOM 448 CG LYS A 33 -5.137 -12.100 4.470 1.00 0.00 C ATOM 449 CD LYS A 33 -3.736 -12.154 3.858 1.00 0.00 C ATOM 450 CE LYS A 33 -2.743 -12.677 4.898 1.00 0.00 C ATOM 451 NZ LYS A 33 -1.402 -12.399 4.311 1.00 0.00 N ATOM 0 H LYS A 33 -6.327 -10.193 2.396 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.608 -11.399 4.731 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.019 -10.009 3.930 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.333 -10.286 5.632 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.142 -12.599 5.439 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.844 -12.633 3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.736 -12.802 2.981 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.437 -11.162 3.521 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -2.869 -12.172 5.856 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.883 -13.743 5.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.663 -12.759 4.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.323 -12.871 3.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.283 -11.373 4.187 1.00 0.00 H new ATOM 465 N PHE A 34 -7.285 -8.124 4.678 1.00 0.00 N ATOM 466 CA PHE A 34 -7.819 -6.901 5.342 1.00 0.00 C ATOM 467 C PHE A 34 -9.346 -6.891 5.243 1.00 0.00 C ATOM 468 O PHE A 34 -10.040 -6.701 6.221 1.00 0.00 O ATOM 469 CB PHE A 34 -7.217 -5.726 4.568 1.00 0.00 C ATOM 470 CG PHE A 34 -7.195 -4.501 5.451 1.00 0.00 C ATOM 471 CD1 PHE A 34 -6.421 -4.493 6.617 1.00 0.00 C ATOM 472 CD2 PHE A 34 -7.948 -3.373 5.103 1.00 0.00 C ATOM 473 CE1 PHE A 34 -6.401 -3.359 7.436 1.00 0.00 C ATOM 474 CE2 PHE A 34 -7.927 -2.238 5.922 1.00 0.00 C ATOM 475 CZ PHE A 34 -7.154 -2.231 7.090 1.00 0.00 C ATOM 0 H PHE A 34 -6.638 -7.953 3.908 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.562 -6.853 6.400 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.206 -5.971 4.242 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -7.803 -5.530 3.670 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -5.839 -5.363 6.885 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.545 -3.379 4.203 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -5.804 -3.354 8.336 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.507 -1.367 5.653 1.00 0.00 H new ATOM 0 HZ PHE A 34 -7.139 -1.356 7.723 1.00 0.00 H new ATOM 485 N LEU A 35 -9.873 -7.096 4.067 1.00 0.00 N ATOM 486 CA LEU A 35 -11.355 -7.099 3.904 1.00 0.00 C ATOM 487 C LEU A 35 -11.973 -8.153 4.825 1.00 0.00 C ATOM 488 O LEU A 35 -12.952 -7.904 5.500 1.00 0.00 O ATOM 489 CB LEU A 35 -11.594 -7.452 2.436 1.00 0.00 C ATOM 490 CG LEU A 35 -10.991 -6.366 1.545 1.00 0.00 C ATOM 491 CD1 LEU A 35 -10.818 -6.906 0.125 1.00 0.00 C ATOM 492 CD2 LEU A 35 -11.923 -5.153 1.518 1.00 0.00 C ATOM 0 H LEU A 35 -9.342 -7.262 3.212 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.807 -6.142 4.164 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.144 -8.418 2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -12.663 -7.544 2.243 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.020 -6.071 1.942 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -10.388 -6.131 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -10.154 -7.770 0.143 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -11.789 -7.203 -0.272 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.494 -4.378 0.883 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.894 -5.449 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.046 -4.766 2.530 1.00 0.00 H new ATOM 504 N SER A 36 -11.411 -9.330 4.858 1.00 0.00 N ATOM 505 CA SER A 36 -11.969 -10.398 5.735 1.00 0.00 C ATOM 506 C SER A 36 -11.862 -9.972 7.201 1.00 0.00 C ATOM 507 O SER A 36 -12.851 -9.867 7.900 1.00 0.00 O ATOM 508 CB SER A 36 -11.107 -11.632 5.465 1.00 0.00 C ATOM 509 OG SER A 36 -11.055 -12.433 6.638 1.00 0.00 O ATOM 0 H SER A 36 -10.590 -9.598 4.316 1.00 0.00 H new ATOM 0 HA SER A 36 -13.022 -10.594 5.533 1.00 0.00 H new ATOM 0 HB2 SER A 36 -11.522 -12.206 4.637 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.101 -11.331 5.171 1.00 0.00 H new ATOM 0 HG SER A 36 -10.505 -13.226 6.469 1.00 0.00 H new ATOM 515 N ALA A 37 -10.670 -9.728 7.673 1.00 0.00 N ATOM 516 CA ALA A 37 -10.502 -9.311 9.095 1.00 0.00 C ATOM 517 C ALA A 37 -11.269 -8.010 9.346 1.00 0.00 C ATOM 518 O ALA A 37 -11.689 -7.730 10.451 1.00 0.00 O ATOM 519 CB ALA A 37 -8.999 -9.097 9.277 1.00 0.00 C ATOM 0 H ALA A 37 -9.806 -9.799 7.136 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.888 -10.052 9.795 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.797 -8.788 10.302 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.471 -10.027 9.068 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.656 -8.323 8.590 1.00 0.00 H new ATOM 525 N HIS A 38 -11.454 -7.215 8.330 1.00 0.00 N ATOM 526 CA HIS A 38 -12.192 -5.933 8.510 1.00 0.00 C ATOM 527 C HIS A 38 -13.437 -5.923 7.620 1.00 0.00 C ATOM 528 O HIS A 38 -13.357 -5.732 6.423 1.00 0.00 O ATOM 529 CB HIS A 38 -11.212 -4.839 8.085 1.00 0.00 C ATOM 530 CG HIS A 38 -9.943 -4.964 8.883 1.00 0.00 C ATOM 531 ND1 HIS A 38 -9.535 -3.989 9.780 1.00 0.00 N ATOM 532 CD2 HIS A 38 -8.981 -5.942 8.929 1.00 0.00 C ATOM 533 CE1 HIS A 38 -8.374 -4.398 10.323 1.00 0.00 C ATOM 534 NE2 HIS A 38 -7.991 -5.583 9.839 1.00 0.00 N ATOM 0 H HIS A 38 -11.126 -7.397 7.382 1.00 0.00 H new ATOM 0 HA HIS A 38 -12.530 -5.788 9.536 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -10.994 -4.925 7.020 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.657 -3.856 8.241 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.991 -6.852 8.347 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -7.819 -3.837 11.060 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -7.153 -6.111 10.084 1.00 0.00 H new ATOM 543 N HIS A 39 -14.590 -6.119 8.201 1.00 0.00 N ATOM 544 CA HIS A 39 -15.843 -6.113 7.395 1.00 0.00 C ATOM 545 C HIS A 39 -16.355 -4.678 7.262 1.00 0.00 C ATOM 546 O HIS A 39 -17.096 -4.355 6.356 1.00 0.00 O ATOM 547 CB HIS A 39 -16.834 -6.973 8.183 1.00 0.00 C ATOM 548 CG HIS A 39 -16.462 -8.423 8.041 1.00 0.00 C ATOM 549 ND1 HIS A 39 -17.072 -9.419 8.787 1.00 0.00 N ATOM 550 CD2 HIS A 39 -15.543 -9.061 7.245 1.00 0.00 C ATOM 551 CE1 HIS A 39 -16.519 -10.592 8.427 1.00 0.00 C ATOM 552 NE2 HIS A 39 -15.581 -10.430 7.490 1.00 0.00 N ATOM 0 H HIS A 39 -14.718 -6.283 9.200 1.00 0.00 H new ATOM 0 HA HIS A 39 -15.696 -6.500 6.387 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -16.826 -6.686 9.234 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -17.847 -6.809 7.816 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -14.890 -8.574 6.536 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -16.799 -11.548 8.845 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -15.014 -11.154 7.049 1.00 0.00 H new ATOM 561 N ASP A 40 -15.958 -3.812 8.154 1.00 0.00 N ATOM 562 CA ASP A 40 -16.417 -2.397 8.072 1.00 0.00 C ATOM 563 C ASP A 40 -15.808 -1.732 6.833 1.00 0.00 C ATOM 564 O ASP A 40 -16.255 -0.691 6.394 1.00 0.00 O ATOM 565 CB ASP A 40 -15.905 -1.731 9.351 1.00 0.00 C ATOM 566 CG ASP A 40 -14.378 -1.800 9.402 1.00 0.00 C ATOM 567 OD1 ASP A 40 -13.854 -2.902 9.404 1.00 0.00 O ATOM 568 OD2 ASP A 40 -13.758 -0.750 9.438 1.00 0.00 O ATOM 0 H ASP A 40 -15.337 -4.023 8.935 1.00 0.00 H new ATOM 0 HA ASP A 40 -17.500 -2.313 7.986 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.232 -0.692 9.385 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -16.329 -2.227 10.224 1.00 0.00 H new ATOM 573 N MET A 41 -14.790 -2.324 6.267 1.00 0.00 N ATOM 574 CA MET A 41 -14.155 -1.724 5.060 1.00 0.00 C ATOM 575 C MET A 41 -14.472 -2.577 3.829 1.00 0.00 C ATOM 576 O MET A 41 -14.458 -2.102 2.712 1.00 0.00 O ATOM 577 CB MET A 41 -12.654 -1.731 5.351 1.00 0.00 C ATOM 578 CG MET A 41 -12.390 -1.046 6.693 1.00 0.00 C ATOM 579 SD MET A 41 -12.978 0.664 6.623 1.00 0.00 S ATOM 580 CE MET A 41 -11.709 1.292 5.497 1.00 0.00 C ATOM 0 H MET A 41 -14.372 -3.197 6.589 1.00 0.00 H new ATOM 0 HA MET A 41 -14.519 -0.717 4.855 1.00 0.00 H new ATOM 0 HB2 MET A 41 -12.282 -2.755 5.374 1.00 0.00 H new ATOM 0 HB3 MET A 41 -12.116 -1.215 4.556 1.00 0.00 H new ATOM 0 HG2 MET A 41 -12.897 -1.584 7.494 1.00 0.00 H new ATOM 0 HG3 MET A 41 -11.324 -1.066 6.920 1.00 0.00 H new ATOM 0 HE1 MET A 41 -11.360 2.263 5.848 1.00 0.00 H new ATOM 0 HE2 MET A 41 -10.872 0.595 5.467 1.00 0.00 H new ATOM 0 HE3 MET A 41 -12.130 1.397 4.497 1.00 0.00 H new ATOM 590 N ALA A 42 -14.759 -3.835 4.022 1.00 0.00 N ATOM 591 CA ALA A 42 -15.076 -4.714 2.859 1.00 0.00 C ATOM 592 C ALA A 42 -16.099 -4.023 1.953 1.00 0.00 C ATOM 593 O ALA A 42 -16.006 -4.074 0.743 1.00 0.00 O ATOM 594 CB ALA A 42 -15.660 -5.990 3.464 1.00 0.00 C ATOM 0 H ALA A 42 -14.788 -4.293 4.933 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.199 -4.929 2.248 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -15.918 -6.686 2.666 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.924 -6.450 4.123 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -16.556 -5.745 4.035 1.00 0.00 H new ATOM 600 N ALA A 43 -17.072 -3.373 2.531 1.00 0.00 N ATOM 601 CA ALA A 43 -18.095 -2.675 1.703 1.00 0.00 C ATOM 602 C ALA A 43 -17.507 -1.369 1.164 1.00 0.00 C ATOM 603 O ALA A 43 -17.975 -0.821 0.186 1.00 0.00 O ATOM 604 CB ALA A 43 -19.261 -2.394 2.652 1.00 0.00 C ATOM 0 H ALA A 43 -17.202 -3.295 3.540 1.00 0.00 H new ATOM 0 HA ALA A 43 -18.416 -3.267 0.846 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -20.055 -1.880 2.111 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -19.643 -3.335 3.048 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -18.918 -1.767 3.475 1.00 0.00 H new ATOM 610 N VAL A 44 -16.483 -0.866 1.798 1.00 0.00 N ATOM 611 CA VAL A 44 -15.861 0.403 1.327 1.00 0.00 C ATOM 612 C VAL A 44 -15.030 0.131 0.070 1.00 0.00 C ATOM 613 O VAL A 44 -15.019 0.913 -0.860 1.00 0.00 O ATOM 614 CB VAL A 44 -14.975 0.868 2.488 1.00 0.00 C ATOM 615 CG1 VAL A 44 -14.024 1.969 2.012 1.00 0.00 C ATOM 616 CG2 VAL A 44 -15.858 1.413 3.613 1.00 0.00 C ATOM 0 H VAL A 44 -16.050 -1.280 2.623 1.00 0.00 H new ATOM 0 HA VAL A 44 -16.597 1.163 1.063 1.00 0.00 H new ATOM 0 HB VAL A 44 -14.391 0.023 2.853 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -13.398 2.294 2.843 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -13.393 1.583 1.211 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -14.603 2.815 1.642 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -15.230 1.744 4.440 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -16.443 2.254 3.241 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -16.531 0.629 3.960 1.00 0.00 H new ATOM 626 N PHE A 45 -14.333 -0.971 0.035 1.00 0.00 N ATOM 627 CA PHE A 45 -13.505 -1.288 -1.162 1.00 0.00 C ATOM 628 C PHE A 45 -14.417 -1.578 -2.355 1.00 0.00 C ATOM 629 O PHE A 45 -14.071 -1.318 -3.491 1.00 0.00 O ATOM 630 CB PHE A 45 -12.701 -2.531 -0.778 1.00 0.00 C ATOM 631 CG PHE A 45 -11.501 -2.123 0.041 1.00 0.00 C ATOM 632 CD1 PHE A 45 -11.680 -1.568 1.313 1.00 0.00 C ATOM 633 CD2 PHE A 45 -10.210 -2.298 -0.472 1.00 0.00 C ATOM 634 CE1 PHE A 45 -10.568 -1.188 2.073 1.00 0.00 C ATOM 635 CE2 PHE A 45 -9.098 -1.918 0.289 1.00 0.00 C ATOM 636 CZ PHE A 45 -9.277 -1.363 1.562 1.00 0.00 C ATOM 0 H PHE A 45 -14.301 -1.665 0.782 1.00 0.00 H new ATOM 0 HA PHE A 45 -12.851 -0.464 -1.449 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -13.326 -3.219 -0.209 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -12.379 -3.060 -1.675 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -12.676 -1.433 1.708 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -10.072 -2.726 -1.454 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -10.706 -0.759 3.055 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -8.102 -2.053 -0.106 1.00 0.00 H new ATOM 0 HZ PHE A 45 -8.419 -1.070 2.149 1.00 0.00 H new ATOM 646 N GLY A 46 -15.581 -2.114 -2.108 1.00 0.00 N ATOM 647 CA GLY A 46 -16.514 -2.418 -3.229 1.00 0.00 C ATOM 648 C GLY A 46 -16.681 -3.934 -3.348 1.00 0.00 C ATOM 649 O GLY A 46 -16.959 -4.455 -4.410 1.00 0.00 O ATOM 0 H GLY A 46 -15.926 -2.354 -1.179 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -17.481 -1.947 -3.051 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -16.126 -2.009 -4.162 1.00 0.00 H new ATOM 653 N PHE A 47 -16.513 -4.646 -2.267 1.00 0.00 N ATOM 654 CA PHE A 47 -16.662 -6.129 -2.322 1.00 0.00 C ATOM 655 C PHE A 47 -17.732 -6.576 -1.324 1.00 0.00 C ATOM 656 O PHE A 47 -18.207 -5.801 -0.518 1.00 0.00 O ATOM 657 CB PHE A 47 -15.295 -6.697 -1.928 1.00 0.00 C ATOM 658 CG PHE A 47 -14.201 -6.012 -2.715 1.00 0.00 C ATOM 659 CD1 PHE A 47 -14.408 -5.668 -4.056 1.00 0.00 C ATOM 660 CD2 PHE A 47 -12.977 -5.724 -2.100 1.00 0.00 C ATOM 661 CE1 PHE A 47 -13.391 -5.034 -4.781 1.00 0.00 C ATOM 662 CE2 PHE A 47 -11.961 -5.092 -2.824 1.00 0.00 C ATOM 663 CZ PHE A 47 -12.167 -4.747 -4.164 1.00 0.00 C ATOM 0 H PHE A 47 -16.279 -4.266 -1.350 1.00 0.00 H new ATOM 0 HA PHE A 47 -16.968 -6.475 -3.309 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -15.128 -6.556 -0.860 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -15.271 -7.770 -2.115 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -15.352 -5.891 -4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -12.817 -5.990 -1.066 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -13.551 -4.767 -5.815 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -11.017 -4.870 -2.348 1.00 0.00 H new ATOM 0 HZ PHE A 47 -11.382 -4.259 -4.723 1.00 0.00 H new ATOM 673 N SER A 48 -18.108 -7.825 -1.367 1.00 0.00 N ATOM 674 CA SER A 48 -19.140 -8.328 -0.416 1.00 0.00 C ATOM 675 C SER A 48 -18.485 -9.294 0.573 1.00 0.00 C ATOM 676 O SER A 48 -19.134 -10.142 1.153 1.00 0.00 O ATOM 677 CB SER A 48 -20.170 -9.051 -1.283 1.00 0.00 C ATOM 678 OG SER A 48 -21.314 -9.357 -0.495 1.00 0.00 O ATOM 0 H SER A 48 -17.745 -8.519 -2.020 1.00 0.00 H new ATOM 0 HA SER A 48 -19.604 -7.531 0.165 1.00 0.00 H new ATOM 0 HB2 SER A 48 -20.454 -8.425 -2.129 1.00 0.00 H new ATOM 0 HB3 SER A 48 -19.741 -9.965 -1.692 1.00 0.00 H new ATOM 0 HG SER A 48 -21.029 -9.740 0.361 1.00 0.00 H new ATOM 684 N GLY A 49 -17.200 -9.173 0.765 1.00 0.00 N ATOM 685 CA GLY A 49 -16.495 -10.082 1.711 1.00 0.00 C ATOM 686 C GLY A 49 -15.104 -10.394 1.157 1.00 0.00 C ATOM 687 O GLY A 49 -14.612 -9.719 0.274 1.00 0.00 O ATOM 0 H GLY A 49 -16.607 -8.482 0.306 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -16.413 -9.615 2.692 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -17.063 -11.003 1.843 1.00 0.00 H new ATOM 691 N ALA A 50 -14.466 -11.411 1.665 1.00 0.00 N ATOM 692 CA ALA A 50 -13.107 -11.765 1.164 1.00 0.00 C ATOM 693 C ALA A 50 -13.226 -12.811 0.053 1.00 0.00 C ATOM 694 O ALA A 50 -12.347 -13.626 -0.142 1.00 0.00 O ATOM 695 CB ALA A 50 -12.368 -12.339 2.373 1.00 0.00 C ATOM 0 H ALA A 50 -14.826 -12.013 2.406 1.00 0.00 H new ATOM 0 HA ALA A 50 -12.579 -10.908 0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -11.357 -12.623 2.080 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -12.320 -11.587 3.161 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.899 -13.217 2.741 1.00 0.00 H new ATOM 701 N SER A 51 -14.308 -12.793 -0.677 1.00 0.00 N ATOM 702 CA SER A 51 -14.483 -13.787 -1.774 1.00 0.00 C ATOM 703 C SER A 51 -14.794 -13.058 -3.084 1.00 0.00 C ATOM 704 O SER A 51 -15.369 -13.618 -3.996 1.00 0.00 O ATOM 705 CB SER A 51 -15.665 -14.656 -1.344 1.00 0.00 C ATOM 706 OG SER A 51 -15.238 -15.561 -0.334 1.00 0.00 O ATOM 0 H SER A 51 -15.078 -12.134 -0.561 1.00 0.00 H new ATOM 0 HA SER A 51 -13.588 -14.386 -1.942 1.00 0.00 H new ATOM 0 HB2 SER A 51 -16.475 -14.030 -0.969 1.00 0.00 H new ATOM 0 HB3 SER A 51 -16.057 -15.206 -2.199 1.00 0.00 H new ATOM 0 HG SER A 51 -15.993 -16.119 -0.054 1.00 0.00 H new ATOM 712 N ASP A 52 -14.419 -11.812 -3.184 1.00 0.00 N ATOM 713 CA ASP A 52 -14.693 -11.049 -4.435 1.00 0.00 C ATOM 714 C ASP A 52 -13.392 -10.865 -5.220 1.00 0.00 C ATOM 715 O ASP A 52 -12.358 -10.579 -4.650 1.00 0.00 O ATOM 716 CB ASP A 52 -15.243 -9.699 -3.971 1.00 0.00 C ATOM 717 CG ASP A 52 -16.732 -9.596 -4.306 1.00 0.00 C ATOM 718 OD1 ASP A 52 -17.075 -9.797 -5.459 1.00 0.00 O ATOM 719 OD2 ASP A 52 -17.504 -9.319 -3.403 1.00 0.00 O ATOM 0 H ASP A 52 -13.935 -11.289 -2.454 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.396 -11.561 -5.092 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.095 -9.587 -2.897 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.696 -8.889 -4.454 1.00 0.00 H new ATOM 724 N PRO A 53 -13.489 -11.037 -6.511 1.00 0.00 N ATOM 725 CA PRO A 53 -12.280 -10.881 -7.365 1.00 0.00 C ATOM 726 C PRO A 53 -11.812 -9.423 -7.352 1.00 0.00 C ATOM 727 O PRO A 53 -10.659 -9.129 -7.596 1.00 0.00 O ATOM 728 CB PRO A 53 -12.751 -11.299 -8.757 1.00 0.00 C ATOM 729 CG PRO A 53 -14.241 -11.222 -8.731 1.00 0.00 C ATOM 730 CD PRO A 53 -14.677 -11.383 -7.302 1.00 0.00 C ATOM 0 HA PRO A 53 -11.434 -11.477 -7.023 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.340 -10.640 -9.522 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -12.417 -12.309 -8.994 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.583 -10.267 -9.131 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -14.676 -12.003 -9.355 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -15.515 -10.727 -7.067 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -15.005 -12.403 -7.100 1.00 0.00 H new ATOM 738 N GLY A 54 -12.699 -8.508 -7.072 1.00 0.00 N ATOM 739 CA GLY A 54 -12.305 -7.071 -7.046 1.00 0.00 C ATOM 740 C GLY A 54 -11.117 -6.891 -6.100 1.00 0.00 C ATOM 741 O GLY A 54 -10.277 -6.036 -6.298 1.00 0.00 O ATOM 0 H GLY A 54 -13.679 -8.693 -6.860 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -12.040 -6.736 -8.049 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.144 -6.458 -6.716 1.00 0.00 H new ATOM 745 N VAL A 55 -11.041 -7.689 -5.072 1.00 0.00 N ATOM 746 CA VAL A 55 -9.907 -7.563 -4.112 1.00 0.00 C ATOM 747 C VAL A 55 -8.582 -7.628 -4.873 1.00 0.00 C ATOM 748 O VAL A 55 -7.741 -6.759 -4.751 1.00 0.00 O ATOM 749 CB VAL A 55 -10.048 -8.755 -3.165 1.00 0.00 C ATOM 750 CG1 VAL A 55 -8.870 -8.775 -2.188 1.00 0.00 C ATOM 751 CG2 VAL A 55 -11.357 -8.629 -2.383 1.00 0.00 C ATOM 0 H VAL A 55 -11.715 -8.423 -4.854 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.921 -6.618 -3.568 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.055 -9.680 -3.742 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.971 -9.625 -1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.937 -8.863 -2.745 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.862 -7.851 -1.609 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -11.460 -9.478 -1.707 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.349 -7.704 -1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -12.196 -8.615 -3.078 1.00 0.00 H new ATOM 761 N ALA A 56 -8.388 -8.652 -5.657 1.00 0.00 N ATOM 762 CA ALA A 56 -7.116 -8.772 -6.425 1.00 0.00 C ATOM 763 C ALA A 56 -6.993 -7.605 -7.409 1.00 0.00 C ATOM 764 O ALA A 56 -5.935 -7.347 -7.946 1.00 0.00 O ATOM 765 CB ALA A 56 -7.221 -10.102 -7.172 1.00 0.00 C ATOM 0 H ALA A 56 -9.055 -9.411 -5.799 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.237 -8.743 -5.782 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.318 -10.260 -7.762 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.333 -10.915 -6.454 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.087 -10.080 -7.834 1.00 0.00 H new ATOM 771 N ASP A 57 -8.064 -6.899 -7.652 1.00 0.00 N ATOM 772 CA ASP A 57 -8.000 -5.754 -8.602 1.00 0.00 C ATOM 773 C ASP A 57 -7.582 -4.486 -7.854 1.00 0.00 C ATOM 774 O ASP A 57 -6.756 -3.724 -8.316 1.00 0.00 O ATOM 775 CB ASP A 57 -9.418 -5.612 -9.159 1.00 0.00 C ATOM 776 CG ASP A 57 -9.471 -6.131 -10.596 1.00 0.00 C ATOM 777 OD1 ASP A 57 -8.898 -7.179 -10.848 1.00 0.00 O ATOM 778 OD2 ASP A 57 -10.083 -5.473 -11.421 1.00 0.00 O ATOM 0 H ASP A 57 -8.979 -7.066 -7.234 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.273 -5.913 -9.398 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.119 -6.168 -8.537 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.726 -4.567 -9.130 1.00 0.00 H new ATOM 783 N LEU A 58 -8.150 -4.251 -6.702 1.00 0.00 N ATOM 784 CA LEU A 58 -7.788 -3.031 -5.929 1.00 0.00 C ATOM 785 C LEU A 58 -6.364 -3.160 -5.381 1.00 0.00 C ATOM 786 O LEU A 58 -5.483 -2.401 -5.735 1.00 0.00 O ATOM 787 CB LEU A 58 -8.807 -2.958 -4.788 1.00 0.00 C ATOM 788 CG LEU A 58 -9.615 -1.663 -4.905 1.00 0.00 C ATOM 789 CD1 LEU A 58 -10.511 -1.497 -3.679 1.00 0.00 C ATOM 790 CD2 LEU A 58 -8.664 -0.470 -4.993 1.00 0.00 C ATOM 0 H LEU A 58 -8.849 -4.851 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.811 -2.131 -6.543 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.474 -3.819 -4.826 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -8.295 -2.994 -3.826 1.00 0.00 H new ATOM 0 HG LEU A 58 -10.231 -1.710 -5.803 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -11.083 -0.574 -3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -11.195 -2.343 -3.611 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.895 -1.456 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -9.242 0.451 -5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.046 -0.431 -4.096 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.025 -0.578 -5.870 1.00 0.00 H new ATOM 802 N GLY A 59 -6.129 -4.111 -4.518 1.00 0.00 N ATOM 803 CA GLY A 59 -4.762 -4.278 -3.949 1.00 0.00 C ATOM 804 C GLY A 59 -3.740 -4.349 -5.086 1.00 0.00 C ATOM 805 O GLY A 59 -2.596 -3.970 -4.929 1.00 0.00 O ATOM 0 H GLY A 59 -6.824 -4.778 -4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.528 -3.444 -3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.716 -5.186 -3.347 1.00 0.00 H new ATOM 809 N ALA A 60 -4.139 -4.836 -6.229 1.00 0.00 N ATOM 810 CA ALA A 60 -3.184 -4.935 -7.370 1.00 0.00 C ATOM 811 C ALA A 60 -2.808 -3.535 -7.862 1.00 0.00 C ATOM 812 O ALA A 60 -1.667 -3.267 -8.184 1.00 0.00 O ATOM 813 CB ALA A 60 -3.935 -5.707 -8.456 1.00 0.00 C ATOM 0 H ALA A 60 -5.083 -5.169 -6.422 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.256 -5.434 -7.091 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.295 -5.820 -9.331 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.211 -6.692 -8.078 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.836 -5.160 -8.734 1.00 0.00 H new ATOM 819 N LYS A 61 -3.756 -2.640 -7.928 1.00 0.00 N ATOM 820 CA LYS A 61 -3.447 -1.262 -8.405 1.00 0.00 C ATOM 821 C LYS A 61 -2.836 -0.440 -7.266 1.00 0.00 C ATOM 822 O LYS A 61 -1.962 0.376 -7.477 1.00 0.00 O ATOM 823 CB LYS A 61 -4.792 -0.674 -8.837 1.00 0.00 C ATOM 824 CG LYS A 61 -5.303 -1.421 -10.070 1.00 0.00 C ATOM 825 CD LYS A 61 -6.733 -0.974 -10.381 1.00 0.00 C ATOM 826 CE LYS A 61 -7.342 -1.905 -11.432 1.00 0.00 C ATOM 827 NZ LYS A 61 -6.921 -1.326 -12.738 1.00 0.00 N ATOM 0 H LYS A 61 -4.730 -2.803 -7.673 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.727 -1.258 -9.223 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.514 -0.755 -8.025 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.682 0.387 -9.061 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.655 -1.222 -10.923 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.277 -2.496 -9.894 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.336 -0.990 -9.473 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.733 0.053 -10.746 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.978 -2.926 -11.315 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.428 -1.942 -11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -7.299 -1.907 -13.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.287 -0.356 -12.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.883 -1.310 -12.792 1.00 0.00 H new ATOM 841 N VAL A 62 -3.292 -0.646 -6.061 1.00 0.00 N ATOM 842 CA VAL A 62 -2.739 0.128 -4.913 1.00 0.00 C ATOM 843 C VAL A 62 -1.235 -0.123 -4.792 1.00 0.00 C ATOM 844 O VAL A 62 -0.446 0.800 -4.768 1.00 0.00 O ATOM 845 CB VAL A 62 -3.480 -0.395 -3.682 1.00 0.00 C ATOM 846 CG1 VAL A 62 -2.942 0.298 -2.429 1.00 0.00 C ATOM 847 CG2 VAL A 62 -4.974 -0.099 -3.826 1.00 0.00 C ATOM 0 H VAL A 62 -4.023 -1.316 -5.822 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.873 1.203 -5.033 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.327 -1.471 -3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.470 -0.075 -1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.877 0.090 -2.327 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.095 1.374 -2.514 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.505 -0.471 -2.950 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.125 0.977 -3.912 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.358 -0.592 -4.719 1.00 0.00 H new ATOM 857 N LEU A 63 -0.829 -1.363 -4.713 1.00 0.00 N ATOM 858 CA LEU A 63 0.627 -1.667 -4.592 1.00 0.00 C ATOM 859 C LEU A 63 1.415 -0.853 -5.622 1.00 0.00 C ATOM 860 O LEU A 63 2.493 -0.364 -5.347 1.00 0.00 O ATOM 861 CB LEU A 63 0.749 -3.164 -4.876 1.00 0.00 C ATOM 862 CG LEU A 63 1.093 -3.902 -3.582 1.00 0.00 C ATOM 863 CD1 LEU A 63 0.012 -4.941 -3.283 1.00 0.00 C ATOM 864 CD2 LEU A 63 2.444 -4.602 -3.742 1.00 0.00 C ATOM 0 H LEU A 63 -1.442 -2.178 -4.727 1.00 0.00 H new ATOM 0 HA LEU A 63 1.025 -1.412 -3.610 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.186 -3.544 -5.287 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.521 -3.341 -5.625 1.00 0.00 H new ATOM 0 HG LEU A 63 1.146 -3.189 -2.759 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.258 -5.467 -2.360 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.951 -4.442 -3.171 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.043 -5.656 -4.104 1.00 0.00 H new ATOM 0 HD21 LEU A 63 2.692 -5.129 -2.821 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.389 -5.315 -4.565 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.215 -3.861 -3.955 1.00 0.00 H new ATOM 876 N ALA A 64 0.886 -0.700 -6.804 1.00 0.00 N ATOM 877 CA ALA A 64 1.607 0.084 -7.846 1.00 0.00 C ATOM 878 C ALA A 64 2.004 1.450 -7.279 1.00 0.00 C ATOM 879 O ALA A 64 3.138 1.871 -7.391 1.00 0.00 O ATOM 880 CB ALA A 64 0.612 0.241 -8.997 1.00 0.00 C ATOM 0 H ALA A 64 -0.014 -1.084 -7.094 1.00 0.00 H new ATOM 0 HA ALA A 64 2.522 -0.406 -8.178 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.075 0.810 -9.803 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.325 -0.743 -9.366 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.274 0.768 -8.643 1.00 0.00 H new ATOM 886 N GLN A 65 1.082 2.146 -6.670 1.00 0.00 N ATOM 887 CA GLN A 65 1.417 3.481 -6.097 1.00 0.00 C ATOM 888 C GLN A 65 2.634 3.351 -5.183 1.00 0.00 C ATOM 889 O GLN A 65 3.576 4.113 -5.274 1.00 0.00 O ATOM 890 CB GLN A 65 0.181 3.902 -5.300 1.00 0.00 C ATOM 891 CG GLN A 65 0.390 5.310 -4.740 1.00 0.00 C ATOM 892 CD GLN A 65 0.341 6.337 -5.873 1.00 0.00 C ATOM 893 OE1 GLN A 65 -0.685 6.939 -6.119 1.00 0.00 O ATOM 894 NE2 GLN A 65 1.416 6.563 -6.578 1.00 0.00 N ATOM 0 H GLN A 65 0.114 1.849 -6.545 1.00 0.00 H new ATOM 0 HA GLN A 65 1.663 4.216 -6.863 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.702 3.881 -5.939 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.003 3.198 -4.487 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.380 5.534 -4.001 1.00 0.00 H new ATOM 0 HG3 GLN A 65 1.350 5.367 -4.227 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.277 6.057 -6.371 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.395 7.245 -7.336 1.00 0.00 H new ATOM 903 N ILE A 66 2.625 2.388 -4.306 1.00 0.00 N ATOM 904 CA ILE A 66 3.785 2.206 -3.393 1.00 0.00 C ATOM 905 C ILE A 66 5.059 2.048 -4.225 1.00 0.00 C ATOM 906 O ILE A 66 6.128 2.468 -3.830 1.00 0.00 O ATOM 907 CB ILE A 66 3.477 0.933 -2.605 1.00 0.00 C ATOM 908 CG1 ILE A 66 2.213 1.154 -1.768 1.00 0.00 C ATOM 909 CG2 ILE A 66 4.652 0.603 -1.683 1.00 0.00 C ATOM 910 CD1 ILE A 66 1.791 -0.165 -1.120 1.00 0.00 C ATOM 0 H ILE A 66 1.865 1.719 -4.182 1.00 0.00 H new ATOM 0 HA ILE A 66 3.940 3.053 -2.725 1.00 0.00 H new ATOM 0 HB ILE A 66 3.320 0.104 -3.295 1.00 0.00 H new ATOM 0 HG12 ILE A 66 2.400 1.905 -1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.409 1.535 -2.398 1.00 0.00 H new ATOM 0 HG21 ILE A 66 4.430 -0.305 -1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.551 0.450 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.813 1.428 -0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.892 -0.007 -0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.587 -0.903 -1.896 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.593 -0.527 -0.477 1.00 0.00 H new ATOM 922 N GLY A 67 4.949 1.452 -5.381 1.00 0.00 N ATOM 923 CA GLY A 67 6.149 1.275 -6.247 1.00 0.00 C ATOM 924 C GLY A 67 6.620 2.646 -6.727 1.00 0.00 C ATOM 925 O GLY A 67 7.745 3.043 -6.495 1.00 0.00 O ATOM 0 H GLY A 67 4.080 1.080 -5.763 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.944 0.776 -5.692 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.908 0.640 -7.099 1.00 0.00 H new ATOM 929 N VAL A 68 5.767 3.376 -7.391 1.00 0.00 N ATOM 930 CA VAL A 68 6.170 4.724 -7.880 1.00 0.00 C ATOM 931 C VAL A 68 6.673 5.554 -6.698 1.00 0.00 C ATOM 932 O VAL A 68 7.466 6.461 -6.854 1.00 0.00 O ATOM 933 CB VAL A 68 4.901 5.336 -8.474 1.00 0.00 C ATOM 934 CG1 VAL A 68 5.209 6.736 -9.007 1.00 0.00 C ATOM 935 CG2 VAL A 68 4.401 4.455 -9.621 1.00 0.00 C ATOM 0 H VAL A 68 4.811 3.099 -7.615 1.00 0.00 H new ATOM 0 HA VAL A 68 6.970 4.685 -8.619 1.00 0.00 H new ATOM 0 HB VAL A 68 4.134 5.402 -7.702 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.304 7.171 -9.430 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.567 7.365 -8.192 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.976 6.671 -9.779 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.496 4.890 -10.046 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.169 4.391 -10.392 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.181 3.456 -9.244 1.00 0.00 H new ATOM 945 N ALA A 69 6.214 5.247 -5.516 1.00 0.00 N ATOM 946 CA ALA A 69 6.662 6.013 -4.321 1.00 0.00 C ATOM 947 C ALA A 69 7.974 5.423 -3.797 1.00 0.00 C ATOM 948 O ALA A 69 8.766 6.103 -3.174 1.00 0.00 O ATOM 949 CB ALA A 69 5.538 5.848 -3.296 1.00 0.00 C ATOM 0 H ALA A 69 5.548 4.498 -5.327 1.00 0.00 H new ATOM 0 HA ALA A 69 6.848 7.065 -4.539 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.795 6.387 -2.384 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.611 6.249 -3.705 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.406 4.790 -3.068 1.00 0.00 H new ATOM 955 N VAL A 70 8.213 4.163 -4.046 1.00 0.00 N ATOM 956 CA VAL A 70 9.477 3.534 -3.563 1.00 0.00 C ATOM 957 C VAL A 70 10.678 4.268 -4.170 1.00 0.00 C ATOM 958 O VAL A 70 11.785 4.176 -3.680 1.00 0.00 O ATOM 959 CB VAL A 70 9.417 2.078 -4.044 1.00 0.00 C ATOM 960 CG1 VAL A 70 10.797 1.427 -3.904 1.00 0.00 C ATOM 961 CG2 VAL A 70 8.409 1.304 -3.192 1.00 0.00 C ATOM 0 H VAL A 70 7.589 3.543 -4.562 1.00 0.00 H new ATOM 0 HA VAL A 70 9.585 3.585 -2.480 1.00 0.00 H new ATOM 0 HB VAL A 70 9.111 2.058 -5.090 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.748 0.394 -4.247 1.00 0.00 H new ATOM 0 HG12 VAL A 70 11.521 1.976 -4.507 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.105 1.448 -2.859 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.364 0.269 -3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.720 1.330 -2.147 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.424 1.761 -3.289 1.00 0.00 H new ATOM 971 N SER A 71 10.468 4.991 -5.237 1.00 0.00 N ATOM 972 CA SER A 71 11.601 5.722 -5.875 1.00 0.00 C ATOM 973 C SER A 71 11.752 7.114 -5.250 1.00 0.00 C ATOM 974 O SER A 71 12.491 7.944 -5.742 1.00 0.00 O ATOM 975 CB SER A 71 11.225 5.831 -7.352 1.00 0.00 C ATOM 976 OG SER A 71 12.288 6.452 -8.063 1.00 0.00 O ATOM 0 H SER A 71 9.563 5.107 -5.694 1.00 0.00 H new ATOM 0 HA SER A 71 12.553 5.209 -5.737 1.00 0.00 H new ATOM 0 HB2 SER A 71 11.027 4.841 -7.763 1.00 0.00 H new ATOM 0 HB3 SER A 71 10.309 6.411 -7.464 1.00 0.00 H new ATOM 0 HG SER A 71 12.680 7.162 -7.512 1.00 0.00 H new ATOM 982 N HIS A 72 11.062 7.382 -4.173 1.00 0.00 N ATOM 983 CA HIS A 72 11.180 8.724 -3.532 1.00 0.00 C ATOM 984 C HIS A 72 11.003 8.593 -2.017 1.00 0.00 C ATOM 985 O HIS A 72 10.223 9.300 -1.410 1.00 0.00 O ATOM 986 CB HIS A 72 10.052 9.561 -4.136 1.00 0.00 C ATOM 987 CG HIS A 72 10.416 9.961 -5.538 1.00 0.00 C ATOM 988 ND1 HIS A 72 11.709 10.310 -5.897 1.00 0.00 N ATOM 989 CD2 HIS A 72 9.666 10.076 -6.682 1.00 0.00 C ATOM 990 CE1 HIS A 72 11.697 10.616 -7.207 1.00 0.00 C ATOM 991 NE2 HIS A 72 10.476 10.490 -7.735 1.00 0.00 N ATOM 0 H HIS A 72 10.425 6.733 -3.711 1.00 0.00 H new ATOM 0 HA HIS A 72 12.154 9.181 -3.704 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.124 8.990 -4.139 1.00 0.00 H new ATOM 0 HB3 HIS A 72 9.878 10.448 -3.527 1.00 0.00 H new ATOM 0 HD2 HIS A 72 8.607 9.875 -6.754 1.00 0.00 H new ATOM 0 HE1 HIS A 72 12.569 10.926 -7.764 1.00 0.00 H new ATOM 0 HE2 HIS A 72 10.198 10.660 -8.701 1.00 0.00 H new ATOM 1000 N LEU A 73 11.724 7.697 -1.404 1.00 0.00 N ATOM 1001 CA LEU A 73 11.602 7.522 0.072 1.00 0.00 C ATOM 1002 C LEU A 73 12.296 8.685 0.783 1.00 0.00 C ATOM 1003 O LEU A 73 11.780 9.244 1.730 1.00 0.00 O ATOM 1004 CB LEU A 73 12.311 6.203 0.371 1.00 0.00 C ATOM 1005 CG LEU A 73 11.288 5.068 0.422 1.00 0.00 C ATOM 1006 CD1 LEU A 73 10.345 5.283 1.606 1.00 0.00 C ATOM 1007 CD2 LEU A 73 10.476 5.049 -0.875 1.00 0.00 C ATOM 0 H LEU A 73 12.393 7.077 -1.860 1.00 0.00 H new ATOM 0 HA LEU A 73 10.567 7.508 0.413 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.058 5.998 -0.396 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.841 6.271 1.321 1.00 0.00 H new ATOM 0 HG LEU A 73 11.810 4.118 0.538 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.616 4.474 1.642 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.920 5.295 2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.826 6.234 1.489 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.747 4.239 -0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.956 6.000 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.146 4.895 -1.721 1.00 0.00 H new ATOM 1019 N GLY A 74 13.462 9.055 0.331 1.00 0.00 N ATOM 1020 CA GLY A 74 14.189 10.183 0.977 1.00 0.00 C ATOM 1021 C GLY A 74 13.783 11.489 0.295 1.00 0.00 C ATOM 1022 O GLY A 74 13.705 12.530 0.917 1.00 0.00 O ATOM 0 H GLY A 74 13.943 8.624 -0.459 1.00 0.00 H new ATOM 0 HA2 GLY A 74 13.953 10.224 2.040 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.266 10.034 0.895 1.00 0.00 H new ATOM 1026 N ASP A 75 13.519 11.438 -0.980 1.00 0.00 N ATOM 1027 CA ASP A 75 13.112 12.673 -1.709 1.00 0.00 C ATOM 1028 C ASP A 75 11.587 12.713 -1.827 1.00 0.00 C ATOM 1029 O ASP A 75 11.033 12.561 -2.897 1.00 0.00 O ATOM 1030 CB ASP A 75 13.760 12.559 -3.090 1.00 0.00 C ATOM 1031 CG ASP A 75 15.284 12.554 -2.954 1.00 0.00 C ATOM 1032 OD1 ASP A 75 15.838 11.486 -2.755 1.00 0.00 O ATOM 1033 OD2 ASP A 75 15.872 13.619 -3.053 1.00 0.00 O ATOM 0 H ASP A 75 13.567 10.594 -1.550 1.00 0.00 H new ATOM 0 HA ASP A 75 13.424 13.584 -1.199 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.428 11.645 -3.582 1.00 0.00 H new ATOM 0 HB3 ASP A 75 13.445 13.392 -3.718 1.00 0.00 H new ATOM 1038 N GLU A 76 10.904 12.916 -0.733 1.00 0.00 N ATOM 1039 CA GLU A 76 9.415 12.964 -0.783 1.00 0.00 C ATOM 1040 C GLU A 76 8.949 14.395 -1.068 1.00 0.00 C ATOM 1041 O GLU A 76 7.797 14.731 -0.879 1.00 0.00 O ATOM 1042 CB GLU A 76 8.952 12.509 0.603 1.00 0.00 C ATOM 1043 CG GLU A 76 9.495 13.468 1.664 1.00 0.00 C ATOM 1044 CD GLU A 76 10.318 12.695 2.696 1.00 0.00 C ATOM 1045 OE1 GLU A 76 11.237 12.002 2.293 1.00 0.00 O ATOM 1046 OE2 GLU A 76 10.016 12.811 3.873 1.00 0.00 O ATOM 0 H GLU A 76 11.312 13.050 0.192 1.00 0.00 H new ATOM 0 HA GLU A 76 9.005 12.332 -1.570 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.863 12.484 0.644 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.302 11.496 0.800 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.113 14.233 1.193 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.670 13.983 2.156 1.00 0.00 H new ATOM 1053 N GLY A 77 9.833 15.243 -1.522 1.00 0.00 N ATOM 1054 CA GLY A 77 9.433 16.647 -1.818 1.00 0.00 C ATOM 1055 C GLY A 77 8.293 16.639 -2.836 1.00 0.00 C ATOM 1056 O GLY A 77 7.454 17.517 -2.850 1.00 0.00 O ATOM 0 H GLY A 77 10.813 15.023 -1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 77 9.117 17.148 -0.903 1.00 0.00 H new ATOM 0 HA3 GLY A 77 10.283 17.205 -2.210 1.00 0.00 H new ATOM 1060 N LYS A 78 8.254 15.653 -3.691 1.00 0.00 N ATOM 1061 CA LYS A 78 7.166 15.593 -4.708 1.00 0.00 C ATOM 1062 C LYS A 78 6.362 14.302 -4.533 1.00 0.00 C ATOM 1063 O LYS A 78 5.197 14.238 -4.873 1.00 0.00 O ATOM 1064 CB LYS A 78 7.874 15.610 -6.063 1.00 0.00 C ATOM 1065 CG LYS A 78 6.831 15.667 -7.179 1.00 0.00 C ATOM 1066 CD LYS A 78 6.787 17.078 -7.768 1.00 0.00 C ATOM 1067 CE LYS A 78 7.835 17.204 -8.876 1.00 0.00 C ATOM 1068 NZ LYS A 78 7.518 18.493 -9.550 1.00 0.00 N ATOM 0 H LYS A 78 8.927 14.888 -3.729 1.00 0.00 H new ATOM 0 HA LYS A 78 6.466 16.423 -4.614 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.539 16.471 -6.127 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.493 14.720 -6.174 1.00 0.00 H new ATOM 0 HG2 LYS A 78 7.077 14.945 -7.957 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.851 15.394 -6.789 1.00 0.00 H new ATOM 0 HD2 LYS A 78 5.794 17.286 -8.167 1.00 0.00 H new ATOM 0 HD3 LYS A 78 6.977 17.815 -6.988 1.00 0.00 H new ATOM 0 HE2 LYS A 78 8.845 17.209 -8.467 1.00 0.00 H new ATOM 0 HE3 LYS A 78 7.777 16.368 -9.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.193 18.655 -10.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 6.552 18.456 -9.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 7.587 19.270 -8.863 1.00 0.00 H new ATOM 1082 N MET A 79 6.969 13.271 -4.007 1.00 0.00 N ATOM 1083 CA MET A 79 6.227 11.990 -3.815 1.00 0.00 C ATOM 1084 C MET A 79 4.889 12.274 -3.130 1.00 0.00 C ATOM 1085 O MET A 79 3.867 11.725 -3.490 1.00 0.00 O ATOM 1086 CB MET A 79 7.121 11.130 -2.921 1.00 0.00 C ATOM 1087 CG MET A 79 6.515 9.733 -2.784 1.00 0.00 C ATOM 1088 SD MET A 79 6.010 9.459 -1.068 1.00 0.00 S ATOM 1089 CE MET A 79 7.666 9.486 -0.338 1.00 0.00 C ATOM 0 H MET A 79 7.943 13.260 -3.703 1.00 0.00 H new ATOM 0 HA MET A 79 6.011 11.488 -4.758 1.00 0.00 H new ATOM 0 HB2 MET A 79 8.122 11.063 -3.347 1.00 0.00 H new ATOM 0 HB3 MET A 79 7.222 11.592 -1.939 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.656 9.631 -3.448 1.00 0.00 H new ATOM 0 HG3 MET A 79 7.242 8.979 -3.085 1.00 0.00 H new ATOM 0 HE1 MET A 79 7.592 9.724 0.723 1.00 0.00 H new ATOM 0 HE2 MET A 79 8.133 8.508 -0.459 1.00 0.00 H new ATOM 0 HE3 MET A 79 8.272 10.241 -0.838 1.00 0.00 H new ATOM 1099 N VAL A 80 4.888 13.135 -2.151 1.00 0.00 N ATOM 1100 CA VAL A 80 3.617 13.461 -1.450 1.00 0.00 C ATOM 1101 C VAL A 80 2.692 14.212 -2.409 1.00 0.00 C ATOM 1102 O VAL A 80 1.485 14.170 -2.283 1.00 0.00 O ATOM 1103 CB VAL A 80 4.020 14.350 -0.272 1.00 0.00 C ATOM 1104 CG1 VAL A 80 2.789 14.657 0.582 1.00 0.00 C ATOM 1105 CG2 VAL A 80 5.062 13.623 0.580 1.00 0.00 C ATOM 0 H VAL A 80 5.713 13.627 -1.807 1.00 0.00 H new ATOM 0 HA VAL A 80 3.083 12.574 -1.109 1.00 0.00 H new ATOM 0 HB VAL A 80 4.442 15.282 -0.648 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.077 15.290 1.421 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.045 15.174 -0.024 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.366 13.726 0.959 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.350 14.255 1.420 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.639 12.691 0.955 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.940 13.404 -0.028 1.00 0.00 H new ATOM 1115 N ALA A 81 3.250 14.896 -3.371 1.00 0.00 N ATOM 1116 CA ALA A 81 2.401 15.644 -4.340 1.00 0.00 C ATOM 1117 C ALA A 81 1.447 14.671 -5.035 1.00 0.00 C ATOM 1118 O ALA A 81 0.259 14.911 -5.129 1.00 0.00 O ATOM 1119 CB ALA A 81 3.379 16.258 -5.344 1.00 0.00 C ATOM 0 H ALA A 81 4.255 14.969 -3.527 1.00 0.00 H new ATOM 0 HA ALA A 81 1.792 16.411 -3.861 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.825 16.826 -6.091 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.068 16.921 -4.821 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.942 15.464 -5.836 1.00 0.00 H new ATOM 1125 N GLU A 82 1.956 13.570 -5.515 1.00 0.00 N ATOM 1126 CA GLU A 82 1.077 12.578 -6.197 1.00 0.00 C ATOM 1127 C GLU A 82 0.315 11.771 -5.145 1.00 0.00 C ATOM 1128 O GLU A 82 -0.885 11.601 -5.228 1.00 0.00 O ATOM 1129 CB GLU A 82 2.024 11.679 -6.992 1.00 0.00 C ATOM 1130 CG GLU A 82 1.712 11.803 -8.485 1.00 0.00 C ATOM 1131 CD GLU A 82 2.371 13.060 -9.055 1.00 0.00 C ATOM 1132 OE1 GLU A 82 3.524 12.976 -9.445 1.00 0.00 O ATOM 1133 OE2 GLU A 82 1.711 14.086 -9.092 1.00 0.00 O ATOM 0 H GLU A 82 2.942 13.314 -5.465 1.00 0.00 H new ATOM 0 HA GLU A 82 0.338 13.046 -6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.059 11.964 -6.801 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.914 10.643 -6.671 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.073 10.921 -9.015 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.634 11.847 -8.637 1.00 0.00 H new ATOM 1140 N MET A 83 1.002 11.277 -4.151 1.00 0.00 N ATOM 1141 CA MET A 83 0.316 10.488 -3.091 1.00 0.00 C ATOM 1142 C MET A 83 -0.787 11.340 -2.463 1.00 0.00 C ATOM 1143 O MET A 83 -1.943 10.966 -2.455 1.00 0.00 O ATOM 1144 CB MET A 83 1.402 10.156 -2.067 1.00 0.00 C ATOM 1145 CG MET A 83 2.143 8.892 -2.505 1.00 0.00 C ATOM 1146 SD MET A 83 2.355 7.793 -1.083 1.00 0.00 S ATOM 1147 CE MET A 83 0.653 7.180 -1.014 1.00 0.00 C ATOM 0 H MET A 83 2.009 11.386 -4.028 1.00 0.00 H new ATOM 0 HA MET A 83 -0.152 9.582 -3.475 1.00 0.00 H new ATOM 0 HB2 MET A 83 2.100 10.988 -1.978 1.00 0.00 H new ATOM 0 HB3 MET A 83 0.957 10.007 -1.083 1.00 0.00 H new ATOM 0 HG2 MET A 83 1.584 8.384 -3.291 1.00 0.00 H new ATOM 0 HG3 MET A 83 3.115 9.154 -2.924 1.00 0.00 H new ATOM 0 HE1 MET A 83 0.517 6.585 -0.111 1.00 0.00 H new ATOM 0 HE2 MET A 83 -0.037 8.023 -1.000 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.453 6.562 -1.889 1.00 0.00 H new ATOM 1157 N LYS A 84 -0.444 12.490 -1.945 1.00 0.00 N ATOM 1158 CA LYS A 84 -1.483 13.365 -1.333 1.00 0.00 C ATOM 1159 C LYS A 84 -2.628 13.544 -2.330 1.00 0.00 C ATOM 1160 O LYS A 84 -3.779 13.657 -1.958 1.00 0.00 O ATOM 1161 CB LYS A 84 -0.786 14.698 -1.057 1.00 0.00 C ATOM 1162 CG LYS A 84 -1.743 15.630 -0.311 1.00 0.00 C ATOM 1163 CD LYS A 84 -1.807 16.979 -1.030 1.00 0.00 C ATOM 1164 CE LYS A 84 -1.356 18.087 -0.075 1.00 0.00 C ATOM 1165 NZ LYS A 84 -2.466 19.078 -0.097 1.00 0.00 N ATOM 0 H LYS A 84 0.507 12.859 -1.920 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.902 12.948 -0.417 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.114 14.534 -0.465 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.472 15.157 -1.994 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -2.737 15.185 -0.262 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.405 15.769 0.716 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.169 16.963 -1.913 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.823 17.172 -1.374 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.190 17.700 0.930 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.418 18.535 -0.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.235 19.872 0.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.596 19.432 -1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.344 18.623 0.226 1.00 0.00 H new ATOM 1179 N ALA A 85 -2.318 13.555 -3.598 1.00 0.00 N ATOM 1180 CA ALA A 85 -3.386 13.709 -4.622 1.00 0.00 C ATOM 1181 C ALA A 85 -4.295 12.482 -4.575 1.00 0.00 C ATOM 1182 O ALA A 85 -5.498 12.584 -4.687 1.00 0.00 O ATOM 1183 CB ALA A 85 -2.655 13.796 -5.963 1.00 0.00 C ATOM 0 H ALA A 85 -1.372 13.464 -3.967 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.008 14.589 -4.459 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.382 13.911 -6.767 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.983 14.654 -5.956 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.078 12.885 -6.123 1.00 0.00 H new ATOM 1189 N VAL A 86 -3.726 11.319 -4.398 1.00 0.00 N ATOM 1190 CA VAL A 86 -4.559 10.086 -4.332 1.00 0.00 C ATOM 1191 C VAL A 86 -5.654 10.275 -3.281 1.00 0.00 C ATOM 1192 O VAL A 86 -6.819 10.044 -3.535 1.00 0.00 O ATOM 1193 CB VAL A 86 -3.603 8.967 -3.919 1.00 0.00 C ATOM 1194 CG1 VAL A 86 -4.363 7.641 -3.871 1.00 0.00 C ATOM 1195 CG2 VAL A 86 -2.464 8.861 -4.935 1.00 0.00 C ATOM 0 H VAL A 86 -2.722 11.171 -4.297 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.046 9.858 -5.280 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.191 9.190 -2.935 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.682 6.842 -3.577 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.174 7.712 -3.146 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.775 7.422 -4.856 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.784 8.062 -4.638 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.875 8.640 -5.920 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.920 9.805 -4.972 1.00 0.00 H new ATOM 1205 N GLY A 87 -5.287 10.699 -2.101 1.00 0.00 N ATOM 1206 CA GLY A 87 -6.305 10.910 -1.033 1.00 0.00 C ATOM 1207 C GLY A 87 -7.441 11.766 -1.594 1.00 0.00 C ATOM 1208 O GLY A 87 -8.603 11.431 -1.473 1.00 0.00 O ATOM 0 H GLY A 87 -4.326 10.908 -1.831 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.691 9.952 -0.686 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.852 11.402 -0.172 1.00 0.00 H new ATOM 1212 N VAL A 88 -7.113 12.866 -2.216 1.00 0.00 N ATOM 1213 CA VAL A 88 -8.174 13.740 -2.794 1.00 0.00 C ATOM 1214 C VAL A 88 -9.128 12.889 -3.635 1.00 0.00 C ATOM 1215 O VAL A 88 -10.284 13.221 -3.807 1.00 0.00 O ATOM 1216 CB VAL A 88 -7.434 14.755 -3.667 1.00 0.00 C ATOM 1217 CG1 VAL A 88 -8.447 15.660 -4.370 1.00 0.00 C ATOM 1218 CG2 VAL A 88 -6.514 15.607 -2.790 1.00 0.00 C ATOM 0 H VAL A 88 -6.157 13.197 -2.349 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.770 14.239 -2.030 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.840 14.226 -4.413 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.919 16.383 -4.992 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -9.103 15.055 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -9.042 16.188 -3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.986 16.330 -3.412 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -7.108 16.135 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.791 14.964 -2.289 1.00 0.00 H new ATOM 1228 N ARG A 89 -8.653 11.788 -4.151 1.00 0.00 N ATOM 1229 CA ARG A 89 -9.535 10.909 -4.970 1.00 0.00 C ATOM 1230 C ARG A 89 -10.420 10.085 -4.033 1.00 0.00 C ATOM 1231 O ARG A 89 -11.620 10.007 -4.201 1.00 0.00 O ATOM 1232 CB ARG A 89 -8.594 9.996 -5.766 1.00 0.00 C ATOM 1233 CG ARG A 89 -7.483 10.825 -6.420 1.00 0.00 C ATOM 1234 CD ARG A 89 -8.096 11.979 -7.216 1.00 0.00 C ATOM 1235 NE ARG A 89 -6.968 12.569 -7.990 1.00 0.00 N ATOM 1236 CZ ARG A 89 -7.177 13.595 -8.768 1.00 0.00 C ATOM 1237 NH1 ARG A 89 -7.961 14.563 -8.377 1.00 0.00 N ATOM 1238 NH2 ARG A 89 -6.602 13.654 -9.938 1.00 0.00 N ATOM 0 H ARG A 89 -7.694 11.460 -4.041 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.186 11.474 -5.638 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -8.158 9.246 -5.106 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.156 9.460 -6.531 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -6.810 11.215 -5.656 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -6.886 10.194 -7.078 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -8.884 11.623 -7.880 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -8.547 12.718 -6.553 1.00 0.00 H new ATOM 0 HE ARG A 89 -6.032 12.171 -7.912 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -8.411 14.517 -7.463 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -8.124 15.365 -8.986 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.989 12.898 -10.244 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -6.765 14.456 -10.547 1.00 0.00 H new ATOM 1252 N HIS A 90 -9.830 9.476 -3.039 1.00 0.00 N ATOM 1253 CA HIS A 90 -10.628 8.662 -2.080 1.00 0.00 C ATOM 1254 C HIS A 90 -11.741 9.528 -1.484 1.00 0.00 C ATOM 1255 O HIS A 90 -12.787 9.039 -1.103 1.00 0.00 O ATOM 1256 CB HIS A 90 -9.635 8.238 -0.994 1.00 0.00 C ATOM 1257 CG HIS A 90 -8.844 7.046 -1.459 1.00 0.00 C ATOM 1258 ND1 HIS A 90 -8.107 7.059 -2.629 1.00 0.00 N ATOM 1259 CD2 HIS A 90 -8.662 5.800 -0.915 1.00 0.00 C ATOM 1260 CE1 HIS A 90 -7.520 5.854 -2.750 1.00 0.00 C ATOM 1261 NE2 HIS A 90 -7.825 5.042 -1.731 1.00 0.00 N ATOM 0 H HIS A 90 -8.828 9.508 -2.851 1.00 0.00 H new ATOM 0 HA HIS A 90 -11.100 7.799 -2.550 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -8.962 9.064 -0.762 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -10.169 7.995 -0.076 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -8.024 7.839 -3.281 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -9.103 5.457 0.010 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -6.878 5.575 -3.573 1.00 0.00 H new ATOM 1269 N LYS A 91 -11.522 10.812 -1.400 1.00 0.00 N ATOM 1270 CA LYS A 91 -12.561 11.715 -0.828 1.00 0.00 C ATOM 1271 C LYS A 91 -13.775 11.777 -1.762 1.00 0.00 C ATOM 1272 O LYS A 91 -14.809 12.310 -1.410 1.00 0.00 O ATOM 1273 CB LYS A 91 -11.887 13.084 -0.727 1.00 0.00 C ATOM 1274 CG LYS A 91 -12.895 14.115 -0.214 1.00 0.00 C ATOM 1275 CD LYS A 91 -13.338 15.016 -1.369 1.00 0.00 C ATOM 1276 CE LYS A 91 -12.173 15.912 -1.795 1.00 0.00 C ATOM 1277 NZ LYS A 91 -12.815 17.178 -2.244 1.00 0.00 N ATOM 0 H LYS A 91 -10.666 11.276 -1.704 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.922 11.370 0.141 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.031 13.031 -0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.507 13.386 -1.703 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -13.759 13.610 0.219 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -12.446 14.715 0.578 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -13.670 14.409 -2.211 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -14.187 15.627 -1.062 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.486 16.088 -0.968 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -11.595 15.455 -2.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -12.082 17.848 -2.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -13.459 16.979 -3.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.353 17.593 -1.457 1.00 0.00 H new ATOM 1291 N GLY A 92 -13.663 11.242 -2.949 1.00 0.00 N ATOM 1292 CA GLY A 92 -14.816 11.283 -3.892 1.00 0.00 C ATOM 1293 C GLY A 92 -14.934 9.937 -4.612 1.00 0.00 C ATOM 1294 O GLY A 92 -15.021 9.877 -5.823 1.00 0.00 O ATOM 0 H GLY A 92 -12.826 10.780 -3.304 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -15.736 11.499 -3.349 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -14.678 12.085 -4.617 1.00 0.00 H new ATOM 1298 N TYR A 93 -14.940 8.857 -3.880 1.00 0.00 N ATOM 1299 CA TYR A 93 -15.056 7.519 -4.527 1.00 0.00 C ATOM 1300 C TYR A 93 -16.492 7.006 -4.391 1.00 0.00 C ATOM 1301 O TYR A 93 -17.387 7.736 -4.012 1.00 0.00 O ATOM 1302 CB TYR A 93 -14.077 6.618 -3.765 1.00 0.00 C ATOM 1303 CG TYR A 93 -12.700 6.670 -4.404 1.00 0.00 C ATOM 1304 CD1 TYR A 93 -12.355 7.712 -5.279 1.00 0.00 C ATOM 1305 CD2 TYR A 93 -11.765 5.669 -4.113 1.00 0.00 C ATOM 1306 CE1 TYR A 93 -11.083 7.749 -5.860 1.00 0.00 C ATOM 1307 CE2 TYR A 93 -10.491 5.707 -4.695 1.00 0.00 C ATOM 1308 CZ TYR A 93 -10.151 6.747 -5.568 1.00 0.00 C ATOM 1309 OH TYR A 93 -8.896 6.785 -6.141 1.00 0.00 O ATOM 0 H TYR A 93 -14.870 8.843 -2.863 1.00 0.00 H new ATOM 0 HA TYR A 93 -14.825 7.545 -5.592 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -14.014 6.937 -2.725 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -14.445 5.592 -3.762 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -13.073 8.487 -5.504 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -12.026 4.867 -3.439 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -10.820 8.551 -6.534 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -9.771 4.934 -4.470 1.00 0.00 H new ATOM 0 HH TYR A 93 -8.372 6.016 -5.832 1.00 0.00 H new ATOM 1319 N GLY A 94 -16.722 5.758 -4.696 1.00 0.00 N ATOM 1320 CA GLY A 94 -18.102 5.207 -4.581 1.00 0.00 C ATOM 1321 C GLY A 94 -18.446 5.034 -3.102 1.00 0.00 C ATOM 1322 O GLY A 94 -19.486 5.460 -2.640 1.00 0.00 O ATOM 0 H GLY A 94 -16.015 5.097 -5.019 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -18.816 5.878 -5.058 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -18.170 4.250 -5.098 1.00 0.00 H new ATOM 1326 N ASN A 95 -17.575 4.413 -2.357 1.00 0.00 N ATOM 1327 CA ASN A 95 -17.841 4.212 -0.906 1.00 0.00 C ATOM 1328 C ASN A 95 -17.805 5.572 -0.192 1.00 0.00 C ATOM 1329 O ASN A 95 -18.711 5.920 0.539 1.00 0.00 O ATOM 1330 CB ASN A 95 -16.714 3.275 -0.433 1.00 0.00 C ATOM 1331 CG ASN A 95 -16.337 3.547 1.028 1.00 0.00 C ATOM 1332 OD1 ASN A 95 -17.008 3.099 1.937 1.00 0.00 O ATOM 1333 ND2 ASN A 95 -15.287 4.275 1.288 1.00 0.00 N ATOM 0 H ASN A 95 -16.688 4.035 -2.691 1.00 0.00 H new ATOM 0 HA ASN A 95 -18.819 3.781 -0.694 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -17.031 2.238 -0.541 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -15.838 3.408 -1.067 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -15.028 4.469 2.255 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -14.725 4.650 0.524 1.00 0.00 H new ATOM 1340 N LYS A 96 -16.758 6.337 -0.400 1.00 0.00 N ATOM 1341 CA LYS A 96 -16.628 7.685 0.255 1.00 0.00 C ATOM 1342 C LYS A 96 -16.274 7.538 1.743 1.00 0.00 C ATOM 1343 O LYS A 96 -15.373 8.188 2.233 1.00 0.00 O ATOM 1344 CB LYS A 96 -17.983 8.385 0.082 1.00 0.00 C ATOM 1345 CG LYS A 96 -17.755 9.861 -0.254 1.00 0.00 C ATOM 1346 CD LYS A 96 -19.067 10.481 -0.740 1.00 0.00 C ATOM 1347 CE LYS A 96 -18.790 11.861 -1.340 1.00 0.00 C ATOM 1348 NZ LYS A 96 -19.803 12.754 -0.711 1.00 0.00 N ATOM 0 H LYS A 96 -15.976 6.083 -1.004 1.00 0.00 H new ATOM 0 HA LYS A 96 -15.826 8.266 -0.201 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.554 7.904 -0.712 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -18.570 8.295 0.996 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.392 10.393 0.625 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.988 9.956 -1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -19.532 9.836 -1.485 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.769 10.568 0.089 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.776 12.194 -1.118 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.891 11.849 -2.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.682 13.723 -1.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -20.758 12.415 -0.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.677 12.749 0.321 1.00 0.00 H new ATOM 1362 N HIS A 97 -16.976 6.707 2.469 1.00 0.00 N ATOM 1363 CA HIS A 97 -16.672 6.541 3.922 1.00 0.00 C ATOM 1364 C HIS A 97 -15.306 5.868 4.105 1.00 0.00 C ATOM 1365 O HIS A 97 -15.204 4.798 4.671 1.00 0.00 O ATOM 1366 CB HIS A 97 -17.787 5.642 4.463 1.00 0.00 C ATOM 1367 CG HIS A 97 -19.114 6.331 4.302 1.00 0.00 C ATOM 1368 ND1 HIS A 97 -20.284 5.630 4.052 1.00 0.00 N ATOM 1369 CD2 HIS A 97 -19.474 7.655 4.352 1.00 0.00 C ATOM 1370 CE1 HIS A 97 -21.282 6.527 3.961 1.00 0.00 C ATOM 1371 NE2 HIS A 97 -20.843 7.776 4.136 1.00 0.00 N ATOM 0 H HIS A 97 -17.746 6.137 2.119 1.00 0.00 H new ATOM 0 HA HIS A 97 -16.629 7.497 4.444 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -17.792 4.691 3.930 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -17.608 5.417 5.514 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -18.797 8.477 4.532 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -22.313 6.269 3.770 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -21.393 8.635 4.116 1.00 0.00 H new ATOM 1380 N ILE A 98 -14.254 6.485 3.636 1.00 0.00 N ATOM 1381 CA ILE A 98 -12.902 5.874 3.792 1.00 0.00 C ATOM 1382 C ILE A 98 -12.257 6.386 5.081 1.00 0.00 C ATOM 1383 O ILE A 98 -12.658 7.393 5.630 1.00 0.00 O ATOM 1384 CB ILE A 98 -12.106 6.331 2.567 1.00 0.00 C ATOM 1385 CG1 ILE A 98 -12.784 5.808 1.298 1.00 0.00 C ATOM 1386 CG2 ILE A 98 -10.681 5.779 2.647 1.00 0.00 C ATOM 1387 CD1 ILE A 98 -11.997 6.269 0.069 1.00 0.00 C ATOM 0 H ILE A 98 -14.272 7.383 3.153 1.00 0.00 H new ATOM 0 HA ILE A 98 -12.939 4.787 3.857 1.00 0.00 H new ATOM 0 HB ILE A 98 -12.072 7.420 2.541 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -12.835 4.719 1.323 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -13.809 6.174 1.244 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -10.115 6.105 1.774 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -10.198 6.149 3.552 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.714 4.690 2.672 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.481 5.896 -0.834 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -11.969 7.358 0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.980 5.881 0.122 1.00 0.00 H new ATOM 1399 N LYS A 99 -11.263 5.700 5.574 1.00 0.00 N ATOM 1400 CA LYS A 99 -10.601 6.150 6.829 1.00 0.00 C ATOM 1401 C LYS A 99 -9.087 5.959 6.720 1.00 0.00 C ATOM 1402 O LYS A 99 -8.608 4.963 6.214 1.00 0.00 O ATOM 1403 CB LYS A 99 -11.175 5.259 7.930 1.00 0.00 C ATOM 1404 CG LYS A 99 -12.583 5.732 8.292 1.00 0.00 C ATOM 1405 CD LYS A 99 -13.616 4.793 7.663 1.00 0.00 C ATOM 1406 CE LYS A 99 -15.022 5.348 7.903 1.00 0.00 C ATOM 1407 NZ LYS A 99 -15.016 6.682 7.243 1.00 0.00 N ATOM 0 H LYS A 99 -10.881 4.848 5.162 1.00 0.00 H new ATOM 0 HA LYS A 99 -10.778 7.206 7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -11.204 4.222 7.594 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -10.532 5.291 8.810 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.705 5.750 9.375 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -12.738 6.751 7.937 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -13.430 4.694 6.594 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.528 3.796 8.095 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -15.784 4.697 7.474 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.238 5.433 8.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.881 6.793 6.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.978 7.427 7.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -14.185 6.759 6.623 1.00 0.00 H new ATOM 1421 N ALA A 100 -8.332 6.905 7.206 1.00 0.00 N ATOM 1422 CA ALA A 100 -6.849 6.782 7.149 1.00 0.00 C ATOM 1423 C ALA A 100 -6.366 5.853 8.269 1.00 0.00 C ATOM 1424 O ALA A 100 -5.200 5.521 8.350 1.00 0.00 O ATOM 1425 CB ALA A 100 -6.321 8.202 7.361 1.00 0.00 C ATOM 0 H ALA A 100 -8.679 7.760 7.641 1.00 0.00 H new ATOM 0 HA ALA A 100 -6.500 6.361 6.206 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -5.231 8.193 7.332 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.700 8.852 6.573 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.655 8.574 8.330 1.00 0.00 H new ATOM 1431 N GLU A 101 -7.251 5.429 9.134 1.00 0.00 N ATOM 1432 CA GLU A 101 -6.837 4.524 10.241 1.00 0.00 C ATOM 1433 C GLU A 101 -6.497 3.143 9.678 1.00 0.00 C ATOM 1434 O GLU A 101 -5.658 2.437 10.202 1.00 0.00 O ATOM 1435 CB GLU A 101 -8.054 4.440 11.165 1.00 0.00 C ATOM 1436 CG GLU A 101 -7.799 5.261 12.429 1.00 0.00 C ATOM 1437 CD GLU A 101 -9.078 5.990 12.847 1.00 0.00 C ATOM 1438 OE1 GLU A 101 -10.011 5.320 13.258 1.00 0.00 O ATOM 1439 OE2 GLU A 101 -9.101 7.206 12.749 1.00 0.00 O ATOM 0 H GLU A 101 -8.242 5.672 9.119 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.954 4.887 10.768 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.940 4.812 10.650 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -8.252 3.401 11.428 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -7.463 4.608 13.235 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.002 5.982 12.249 1.00 0.00 H new ATOM 1446 N TYR A 102 -7.152 2.747 8.622 1.00 0.00 N ATOM 1447 CA TYR A 102 -6.879 1.405 8.033 1.00 0.00 C ATOM 1448 C TYR A 102 -5.654 1.461 7.112 1.00 0.00 C ATOM 1449 O TYR A 102 -5.314 0.490 6.466 1.00 0.00 O ATOM 1450 CB TYR A 102 -8.142 1.055 7.247 1.00 0.00 C ATOM 1451 CG TYR A 102 -9.329 1.095 8.177 1.00 0.00 C ATOM 1452 CD1 TYR A 102 -10.009 2.298 8.385 1.00 0.00 C ATOM 1453 CD2 TYR A 102 -9.744 -0.068 8.836 1.00 0.00 C ATOM 1454 CE1 TYR A 102 -11.106 2.342 9.253 1.00 0.00 C ATOM 1455 CE2 TYR A 102 -10.842 -0.026 9.704 1.00 0.00 C ATOM 1456 CZ TYR A 102 -11.523 1.180 9.912 1.00 0.00 C ATOM 1457 OH TYR A 102 -12.604 1.222 10.769 1.00 0.00 O ATOM 0 H TYR A 102 -7.865 3.295 8.141 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.656 0.657 8.794 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.282 1.760 6.428 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.046 0.064 6.802 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -9.688 3.194 7.876 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -9.218 -0.997 8.675 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.630 3.272 9.414 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -11.163 -0.923 10.213 1.00 0.00 H new ATOM 0 HH TYR A 102 -13.173 0.439 10.617 1.00 0.00 H new ATOM 1467 N PHE A 103 -4.985 2.580 7.045 1.00 0.00 N ATOM 1468 CA PHE A 103 -3.783 2.672 6.165 1.00 0.00 C ATOM 1469 C PHE A 103 -2.596 1.976 6.835 1.00 0.00 C ATOM 1470 O PHE A 103 -2.009 1.065 6.286 1.00 0.00 O ATOM 1471 CB PHE A 103 -3.510 4.168 5.999 1.00 0.00 C ATOM 1472 CG PHE A 103 -4.239 4.682 4.781 1.00 0.00 C ATOM 1473 CD1 PHE A 103 -5.634 4.587 4.704 1.00 0.00 C ATOM 1474 CD2 PHE A 103 -3.517 5.255 3.726 1.00 0.00 C ATOM 1475 CE1 PHE A 103 -6.306 5.064 3.571 1.00 0.00 C ATOM 1476 CE2 PHE A 103 -4.189 5.732 2.594 1.00 0.00 C ATOM 1477 CZ PHE A 103 -5.584 5.636 2.517 1.00 0.00 C ATOM 0 H PHE A 103 -5.216 3.431 7.558 1.00 0.00 H new ATOM 0 HA PHE A 103 -3.939 2.188 5.201 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.838 4.709 6.887 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.439 4.344 5.896 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -6.191 4.146 5.517 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -2.441 5.329 3.786 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -7.382 4.990 3.511 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -3.632 6.174 1.781 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.103 6.003 1.644 1.00 0.00 H new ATOM 1487 N GLU A 104 -2.235 2.399 8.015 1.00 0.00 N ATOM 1488 CA GLU A 104 -1.082 1.764 8.713 1.00 0.00 C ATOM 1489 C GLU A 104 -1.344 0.266 8.893 1.00 0.00 C ATOM 1490 O GLU A 104 -0.515 -0.553 8.549 1.00 0.00 O ATOM 1491 CB GLU A 104 -0.991 2.468 10.068 1.00 0.00 C ATOM 1492 CG GLU A 104 0.342 3.214 10.166 1.00 0.00 C ATOM 1493 CD GLU A 104 0.262 4.289 11.252 1.00 0.00 C ATOM 1494 OE1 GLU A 104 -0.635 5.112 11.179 1.00 0.00 O ATOM 1495 OE2 GLU A 104 1.102 4.271 12.137 1.00 0.00 O ATOM 0 H GLU A 104 -2.688 3.157 8.526 1.00 0.00 H new ATOM 0 HA GLU A 104 -0.153 1.860 8.152 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.820 3.166 10.184 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -1.073 1.740 10.875 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.144 2.513 10.395 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.583 3.672 9.207 1.00 0.00 H new ATOM 1502 N PRO A 105 -2.495 -0.043 9.426 1.00 0.00 N ATOM 1503 CA PRO A 105 -2.840 -1.474 9.639 1.00 0.00 C ATOM 1504 C PRO A 105 -2.733 -2.235 8.315 1.00 0.00 C ATOM 1505 O PRO A 105 -1.998 -3.195 8.197 1.00 0.00 O ATOM 1506 CB PRO A 105 -4.281 -1.442 10.146 1.00 0.00 C ATOM 1507 CG PRO A 105 -4.530 -0.043 10.604 1.00 0.00 C ATOM 1508 CD PRO A 105 -3.569 0.853 9.873 1.00 0.00 C ATOM 0 HA PRO A 105 -2.175 -1.978 10.340 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.978 -1.723 9.356 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.422 -2.150 10.963 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.559 0.250 10.397 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -4.386 0.039 11.681 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.051 1.346 9.029 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.185 1.638 10.524 1.00 0.00 H new ATOM 1516 N LEU A 106 -3.459 -1.811 7.318 1.00 0.00 N ATOM 1517 CA LEU A 106 -3.396 -2.506 6.003 1.00 0.00 C ATOM 1518 C LEU A 106 -1.951 -2.507 5.497 1.00 0.00 C ATOM 1519 O LEU A 106 -1.583 -3.293 4.648 1.00 0.00 O ATOM 1520 CB LEU A 106 -4.309 -1.692 5.074 1.00 0.00 C ATOM 1521 CG LEU A 106 -4.349 -2.308 3.665 1.00 0.00 C ATOM 1522 CD1 LEU A 106 -3.063 -1.960 2.912 1.00 0.00 C ATOM 1523 CD2 LEU A 106 -4.490 -3.833 3.754 1.00 0.00 C ATOM 0 H LEU A 106 -4.093 -1.013 7.358 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.717 -3.546 6.057 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.317 -1.656 5.488 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.951 -0.664 5.016 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.208 -1.902 3.131 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.095 -2.398 1.915 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.971 -0.877 2.830 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.205 -2.357 3.455 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.517 -4.255 2.749 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.641 -4.246 4.298 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.413 -4.083 4.278 1.00 0.00 H new ATOM 1535 N GLY A 107 -1.129 -1.632 6.011 1.00 0.00 N ATOM 1536 CA GLY A 107 0.289 -1.586 5.556 1.00 0.00 C ATOM 1537 C GLY A 107 1.088 -2.666 6.287 1.00 0.00 C ATOM 1538 O GLY A 107 1.785 -3.454 5.678 1.00 0.00 O ATOM 0 H GLY A 107 -1.378 -0.948 6.725 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.343 -1.744 4.479 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.716 -0.603 5.756 1.00 0.00 H new ATOM 1542 N ALA A 108 0.996 -2.711 7.588 1.00 0.00 N ATOM 1543 CA ALA A 108 1.754 -3.744 8.351 1.00 0.00 C ATOM 1544 C ALA A 108 1.356 -5.138 7.861 1.00 0.00 C ATOM 1545 O ALA A 108 2.191 -5.934 7.481 1.00 0.00 O ATOM 1546 CB ALA A 108 1.349 -3.544 9.812 1.00 0.00 C ATOM 0 H ALA A 108 0.430 -2.079 8.155 1.00 0.00 H new ATOM 0 HA ALA A 108 2.832 -3.653 8.222 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.868 -4.271 10.436 1.00 0.00 H new ATOM 0 HB2 ALA A 108 1.617 -2.536 10.129 1.00 0.00 H new ATOM 0 HB3 ALA A 108 0.273 -3.682 9.913 1.00 0.00 H new ATOM 1552 N SER A 109 0.086 -5.439 7.866 1.00 0.00 N ATOM 1553 CA SER A 109 -0.361 -6.782 7.399 1.00 0.00 C ATOM 1554 C SER A 109 0.147 -7.026 5.976 1.00 0.00 C ATOM 1555 O SER A 109 0.314 -8.152 5.551 1.00 0.00 O ATOM 1556 CB SER A 109 -1.888 -6.732 7.429 1.00 0.00 C ATOM 1557 OG SER A 109 -2.406 -8.020 7.122 1.00 0.00 O ATOM 0 H SER A 109 -0.660 -4.814 8.173 1.00 0.00 H new ATOM 0 HA SER A 109 0.022 -7.590 8.022 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.234 -6.413 8.412 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.254 -5.999 6.710 1.00 0.00 H new ATOM 0 HG SER A 109 -3.385 -7.992 7.142 1.00 0.00 H new ATOM 1563 N LEU A 110 0.393 -5.979 5.235 1.00 0.00 N ATOM 1564 CA LEU A 110 0.890 -6.155 3.840 1.00 0.00 C ATOM 1565 C LEU A 110 2.301 -6.746 3.865 1.00 0.00 C ATOM 1566 O LEU A 110 2.616 -7.657 3.125 1.00 0.00 O ATOM 1567 CB LEU A 110 0.903 -4.751 3.235 1.00 0.00 C ATOM 1568 CG LEU A 110 0.939 -4.853 1.710 1.00 0.00 C ATOM 1569 CD1 LEU A 110 0.183 -3.672 1.101 1.00 0.00 C ATOM 1570 CD2 LEU A 110 2.393 -4.827 1.233 1.00 0.00 C ATOM 0 H LEU A 110 0.272 -5.012 5.535 1.00 0.00 H new ATOM 0 HA LEU A 110 0.266 -6.834 3.259 1.00 0.00 H new ATOM 0 HB2 LEU A 110 0.019 -4.199 3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 110 1.771 -4.197 3.594 1.00 0.00 H new ATOM 0 HG LEU A 110 0.469 -5.785 1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.209 -3.745 0.014 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.852 -3.688 1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.653 -2.739 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.421 -4.900 0.146 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.862 -3.894 1.546 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.933 -5.668 1.667 1.00 0.00 H new ATOM 1582 N LEU A 111 3.155 -6.233 4.708 1.00 0.00 N ATOM 1583 CA LEU A 111 4.546 -6.765 4.775 1.00 0.00 C ATOM 1584 C LEU A 111 4.509 -8.269 5.061 1.00 0.00 C ATOM 1585 O LEU A 111 5.364 -9.014 4.625 1.00 0.00 O ATOM 1586 CB LEU A 111 5.215 -6.008 5.925 1.00 0.00 C ATOM 1587 CG LEU A 111 5.783 -4.683 5.410 1.00 0.00 C ATOM 1588 CD1 LEU A 111 6.488 -3.948 6.552 1.00 0.00 C ATOM 1589 CD2 LEU A 111 6.790 -4.958 4.291 1.00 0.00 C ATOM 0 H LEU A 111 2.950 -5.469 5.353 1.00 0.00 H new ATOM 0 HA LEU A 111 5.090 -6.628 3.841 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.492 -5.821 6.719 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.012 -6.613 6.356 1.00 0.00 H new ATOM 0 HG LEU A 111 4.969 -4.068 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.892 -3.005 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.775 -3.749 7.352 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.300 -4.565 6.935 1.00 0.00 H new ATOM 0 HD21 LEU A 111 7.194 -4.014 3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 111 7.602 -5.575 4.676 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.292 -5.481 3.474 1.00 0.00 H new ATOM 1601 N SER A 112 3.527 -8.720 5.792 1.00 0.00 N ATOM 1602 CA SER A 112 3.438 -10.175 6.105 1.00 0.00 C ATOM 1603 C SER A 112 3.138 -10.963 4.827 1.00 0.00 C ATOM 1604 O SER A 112 3.533 -12.102 4.682 1.00 0.00 O ATOM 1605 CB SER A 112 2.287 -10.303 7.103 1.00 0.00 C ATOM 1606 OG SER A 112 2.537 -11.402 7.969 1.00 0.00 O ATOM 0 H SER A 112 2.783 -8.145 6.186 1.00 0.00 H new ATOM 0 HA SER A 112 4.368 -10.570 6.515 1.00 0.00 H new ATOM 0 HB2 SER A 112 2.188 -9.384 7.681 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.346 -10.449 6.573 1.00 0.00 H new ATOM 0 HG SER A 112 1.802 -11.486 8.611 1.00 0.00 H new ATOM 1612 N ALA A 113 2.439 -10.369 3.900 1.00 0.00 N ATOM 1613 CA ALA A 113 2.114 -11.088 2.635 1.00 0.00 C ATOM 1614 C ALA A 113 3.293 -10.987 1.664 1.00 0.00 C ATOM 1615 O ALA A 113 3.561 -11.895 0.905 1.00 0.00 O ATOM 1616 CB ALA A 113 0.886 -10.374 2.072 1.00 0.00 C ATOM 0 H ALA A 113 2.079 -9.417 3.963 1.00 0.00 H new ATOM 0 HA ALA A 113 1.921 -12.149 2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 113 0.586 -10.848 1.137 1.00 0.00 H new ATOM 0 HB2 ALA A 113 0.068 -10.437 2.790 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.127 -9.327 1.887 1.00 0.00 H new ATOM 1622 N MET A 114 3.994 -9.887 1.679 1.00 0.00 N ATOM 1623 CA MET A 114 5.153 -9.723 0.752 1.00 0.00 C ATOM 1624 C MET A 114 6.029 -10.980 0.767 1.00 0.00 C ATOM 1625 O MET A 114 6.446 -11.468 -0.264 1.00 0.00 O ATOM 1626 CB MET A 114 5.931 -8.522 1.294 1.00 0.00 C ATOM 1627 CG MET A 114 5.109 -7.245 1.106 1.00 0.00 C ATOM 1628 SD MET A 114 4.813 -6.967 -0.658 1.00 0.00 S ATOM 1629 CE MET A 114 4.863 -5.159 -0.616 1.00 0.00 C ATOM 0 H MET A 114 3.815 -9.093 2.293 1.00 0.00 H new ATOM 0 HA MET A 114 4.835 -9.571 -0.279 1.00 0.00 H new ATOM 0 HB2 MET A 114 6.155 -8.669 2.351 1.00 0.00 H new ATOM 0 HB3 MET A 114 6.885 -8.431 0.775 1.00 0.00 H new ATOM 0 HG2 MET A 114 4.160 -7.330 1.635 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.638 -6.394 1.535 1.00 0.00 H new ATOM 0 HE1 MET A 114 3.937 -4.760 -1.030 1.00 0.00 H new ATOM 0 HE2 MET A 114 4.975 -4.822 0.414 1.00 0.00 H new ATOM 0 HE3 MET A 114 5.707 -4.805 -1.208 1.00 0.00 H new ATOM 1639 N GLU A 115 6.321 -11.502 1.926 1.00 0.00 N ATOM 1640 CA GLU A 115 7.182 -12.719 2.000 1.00 0.00 C ATOM 1641 C GLU A 115 6.655 -13.800 1.048 1.00 0.00 C ATOM 1642 O GLU A 115 7.384 -14.678 0.631 1.00 0.00 O ATOM 1643 CB GLU A 115 7.100 -13.185 3.457 1.00 0.00 C ATOM 1644 CG GLU A 115 5.701 -13.732 3.746 1.00 0.00 C ATOM 1645 CD GLU A 115 5.463 -13.792 5.256 1.00 0.00 C ATOM 1646 OE1 GLU A 115 5.701 -12.793 5.913 1.00 0.00 O ATOM 1647 OE2 GLU A 115 5.044 -14.836 5.729 1.00 0.00 O ATOM 0 H GLU A 115 6.002 -11.140 2.825 1.00 0.00 H new ATOM 0 HA GLU A 115 8.211 -12.514 1.703 1.00 0.00 H new ATOM 0 HB2 GLU A 115 7.848 -13.955 3.645 1.00 0.00 H new ATOM 0 HB3 GLU A 115 7.322 -12.355 4.127 1.00 0.00 H new ATOM 0 HG2 GLU A 115 4.949 -13.097 3.276 1.00 0.00 H new ATOM 0 HG3 GLU A 115 5.594 -14.727 3.313 1.00 0.00 H new ATOM 1654 N HIS A 116 5.396 -13.749 0.703 1.00 0.00 N ATOM 1655 CA HIS A 116 4.838 -14.781 -0.217 1.00 0.00 C ATOM 1656 C HIS A 116 5.637 -14.794 -1.524 1.00 0.00 C ATOM 1657 O HIS A 116 6.021 -15.836 -2.017 1.00 0.00 O ATOM 1658 CB HIS A 116 3.388 -14.364 -0.473 1.00 0.00 C ATOM 1659 CG HIS A 116 2.555 -14.659 0.745 1.00 0.00 C ATOM 1660 ND1 HIS A 116 1.193 -14.905 0.666 1.00 0.00 N ATOM 1661 CD2 HIS A 116 2.874 -14.752 2.077 1.00 0.00 C ATOM 1662 CE1 HIS A 116 0.748 -15.131 1.915 1.00 0.00 C ATOM 1663 NE2 HIS A 116 1.732 -15.049 2.814 1.00 0.00 N ATOM 0 H HIS A 116 4.733 -13.041 1.017 1.00 0.00 H new ATOM 0 HA HIS A 116 4.892 -15.784 0.206 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.341 -13.301 -0.709 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.992 -14.900 -1.335 1.00 0.00 H new ATOM 0 HD2 HIS A 116 3.862 -14.615 2.490 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -0.280 -15.352 2.161 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.662 -15.177 3.824 1.00 0.00 H new ATOM 1671 N ARG A 117 5.889 -13.645 -2.089 1.00 0.00 N ATOM 1672 CA ARG A 117 6.661 -13.595 -3.364 1.00 0.00 C ATOM 1673 C ARG A 117 8.136 -13.901 -3.090 1.00 0.00 C ATOM 1674 O ARG A 117 8.710 -14.801 -3.670 1.00 0.00 O ATOM 1675 CB ARG A 117 6.492 -12.167 -3.886 1.00 0.00 C ATOM 1676 CG ARG A 117 6.651 -12.154 -5.409 1.00 0.00 C ATOM 1677 CD ARG A 117 5.708 -11.109 -6.010 1.00 0.00 C ATOM 1678 NE ARG A 117 6.143 -10.944 -7.424 1.00 0.00 N ATOM 1679 CZ ARG A 117 6.111 -11.961 -8.242 1.00 0.00 C ATOM 1680 NH1 ARG A 117 7.152 -12.741 -8.350 1.00 0.00 N ATOM 1681 NH2 ARG A 117 5.041 -12.196 -8.951 1.00 0.00 N ATOM 0 H ARG A 117 5.594 -12.739 -1.724 1.00 0.00 H new ATOM 0 HA ARG A 117 6.310 -14.329 -4.090 1.00 0.00 H new ATOM 0 HB2 ARG A 117 5.510 -11.782 -3.610 1.00 0.00 H new ATOM 0 HB3 ARG A 117 7.232 -11.512 -3.427 1.00 0.00 H new ATOM 0 HG2 ARG A 117 7.683 -11.925 -5.676 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.427 -13.139 -5.817 1.00 0.00 H new ATOM 0 HD2 ARG A 117 4.671 -11.439 -5.955 1.00 0.00 H new ATOM 0 HD3 ARG A 117 5.771 -10.166 -5.468 1.00 0.00 H new ATOM 0 HE ARG A 117 6.467 -10.035 -7.754 1.00 0.00 H new ATOM 0 HH11 ARG A 117 7.988 -12.555 -7.796 1.00 0.00 H new ATOM 0 HH12 ARG A 117 7.129 -13.536 -8.988 1.00 0.00 H new ATOM 0 HH21 ARG A 117 4.229 -11.585 -8.866 1.00 0.00 H new ATOM 0 HH22 ARG A 117 5.017 -12.991 -9.590 1.00 0.00 H new ATOM 1695 N ILE A 118 8.756 -13.161 -2.211 1.00 0.00 N ATOM 1696 CA ILE A 118 10.195 -13.421 -1.912 1.00 0.00 C ATOM 1697 C ILE A 118 10.326 -14.229 -0.618 1.00 0.00 C ATOM 1698 O ILE A 118 11.102 -13.896 0.255 1.00 0.00 O ATOM 1699 CB ILE A 118 10.853 -12.046 -1.758 1.00 0.00 C ATOM 1700 CG1 ILE A 118 10.045 -11.178 -0.787 1.00 0.00 C ATOM 1701 CG2 ILE A 118 10.931 -11.355 -3.119 1.00 0.00 C ATOM 1702 CD1 ILE A 118 10.976 -10.169 -0.108 1.00 0.00 C ATOM 0 H ILE A 118 8.333 -12.393 -1.690 1.00 0.00 H new ATOM 0 HA ILE A 118 10.672 -13.999 -2.704 1.00 0.00 H new ATOM 0 HB ILE A 118 11.859 -12.180 -1.361 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.253 -10.655 -1.323 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.562 -11.805 -0.037 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.400 -10.378 -3.004 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.523 -11.963 -3.803 1.00 0.00 H new ATOM 0 HG23 ILE A 118 9.926 -11.230 -3.522 1.00 0.00 H new ATOM 0 HD11 ILE A 118 10.402 -9.552 0.583 1.00 0.00 H new ATOM 0 HD12 ILE A 118 11.752 -10.702 0.441 1.00 0.00 H new ATOM 0 HD13 ILE A 118 11.438 -9.534 -0.864 1.00 0.00 H new ATOM 1714 N GLY A 119 9.580 -15.293 -0.488 1.00 0.00 N ATOM 1715 CA GLY A 119 9.673 -16.121 0.748 1.00 0.00 C ATOM 1716 C GLY A 119 11.125 -16.563 0.945 1.00 0.00 C ATOM 1717 O GLY A 119 11.594 -17.488 0.312 1.00 0.00 O ATOM 0 H GLY A 119 8.911 -15.624 -1.183 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.334 -15.548 1.611 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.022 -16.992 0.667 1.00 0.00 H new ATOM 1721 N GLY A 120 11.842 -15.909 1.818 1.00 0.00 N ATOM 1722 CA GLY A 120 13.264 -16.293 2.052 1.00 0.00 C ATOM 1723 C GLY A 120 14.137 -15.040 1.983 1.00 0.00 C ATOM 1724 O GLY A 120 14.995 -14.823 2.816 1.00 0.00 O ATOM 0 H GLY A 120 11.505 -15.126 2.379 1.00 0.00 H new ATOM 0 HA2 GLY A 120 13.369 -16.772 3.026 1.00 0.00 H new ATOM 0 HA3 GLY A 120 13.586 -17.018 1.304 1.00 0.00 H new ATOM 1728 N LYS A 121 13.923 -14.210 1.000 1.00 0.00 N ATOM 1729 CA LYS A 121 14.736 -12.971 0.882 1.00 0.00 C ATOM 1730 C LYS A 121 14.154 -11.899 1.805 1.00 0.00 C ATOM 1731 O LYS A 121 14.836 -10.983 2.222 1.00 0.00 O ATOM 1732 CB LYS A 121 14.605 -12.560 -0.583 1.00 0.00 C ATOM 1733 CG LYS A 121 15.023 -13.726 -1.480 1.00 0.00 C ATOM 1734 CD LYS A 121 16.351 -13.395 -2.157 1.00 0.00 C ATOM 1735 CE LYS A 121 17.218 -14.654 -2.232 1.00 0.00 C ATOM 1736 NZ LYS A 121 17.584 -14.772 -3.671 1.00 0.00 N ATOM 0 H LYS A 121 13.219 -14.338 0.273 1.00 0.00 H new ATOM 0 HA LYS A 121 15.779 -13.111 1.167 1.00 0.00 H new ATOM 0 HB2 LYS A 121 13.577 -12.271 -0.800 1.00 0.00 H new ATOM 0 HB3 LYS A 121 15.230 -11.690 -0.785 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.121 -14.637 -0.889 1.00 0.00 H new ATOM 0 HG3 LYS A 121 14.256 -13.914 -2.231 1.00 0.00 H new ATOM 0 HD2 LYS A 121 16.172 -13.004 -3.159 1.00 0.00 H new ATOM 0 HD3 LYS A 121 16.871 -12.616 -1.599 1.00 0.00 H new ATOM 0 HE2 LYS A 121 18.104 -14.563 -1.604 1.00 0.00 H new ATOM 0 HE3 LYS A 121 16.672 -15.533 -1.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 18.180 -15.613 -3.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 16.720 -14.862 -4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 18.108 -13.923 -3.967 1.00 0.00 H new ATOM 1750 N MET A 122 12.892 -12.009 2.124 1.00 0.00 N ATOM 1751 CA MET A 122 12.253 -11.003 3.019 1.00 0.00 C ATOM 1752 C MET A 122 12.871 -11.093 4.416 1.00 0.00 C ATOM 1753 O MET A 122 12.308 -11.682 5.318 1.00 0.00 O ATOM 1754 CB MET A 122 10.772 -11.385 3.057 1.00 0.00 C ATOM 1755 CG MET A 122 10.019 -10.413 3.966 1.00 0.00 C ATOM 1756 SD MET A 122 8.831 -9.465 2.983 1.00 0.00 S ATOM 1757 CE MET A 122 9.173 -7.851 3.721 1.00 0.00 C ATOM 0 H MET A 122 12.275 -12.755 1.802 1.00 0.00 H new ATOM 0 HA MET A 122 12.394 -9.981 2.668 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.353 -11.359 2.051 1.00 0.00 H new ATOM 0 HB3 MET A 122 10.658 -12.405 3.423 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.501 -10.961 4.753 1.00 0.00 H new ATOM 0 HG3 MET A 122 10.721 -9.739 4.457 1.00 0.00 H new ATOM 0 HE1 MET A 122 8.370 -7.588 4.409 1.00 0.00 H new ATOM 0 HE2 MET A 122 10.117 -7.892 4.264 1.00 0.00 H new ATOM 0 HE3 MET A 122 9.238 -7.098 2.935 1.00 0.00 H new ATOM 1767 N ASN A 123 14.026 -10.517 4.601 1.00 0.00 N ATOM 1768 CA ASN A 123 14.680 -10.575 5.940 1.00 0.00 C ATOM 1769 C ASN A 123 14.210 -9.402 6.810 1.00 0.00 C ATOM 1770 O ASN A 123 13.392 -8.601 6.404 1.00 0.00 O ATOM 1771 CB ASN A 123 16.191 -10.512 5.667 1.00 0.00 C ATOM 1772 CG ASN A 123 16.655 -9.079 5.368 1.00 0.00 C ATOM 1773 OD1 ASN A 123 17.806 -8.753 5.577 1.00 0.00 O ATOM 1774 ND2 ASN A 123 15.814 -8.204 4.890 1.00 0.00 N ATOM 0 H ASN A 123 14.545 -10.009 3.885 1.00 0.00 H new ATOM 0 HA ASN A 123 14.424 -11.483 6.486 1.00 0.00 H new ATOM 0 HB2 ASN A 123 16.733 -10.897 6.531 1.00 0.00 H new ATOM 0 HB3 ASN A 123 16.436 -11.157 4.823 1.00 0.00 H new ATOM 0 HD21 ASN A 123 16.125 -7.252 4.694 1.00 0.00 H new ATOM 0 HD22 ASN A 123 14.846 -8.471 4.712 1.00 0.00 H new ATOM 1781 N ALA A 124 14.720 -9.303 8.008 1.00 0.00 N ATOM 1782 CA ALA A 124 14.305 -8.193 8.911 1.00 0.00 C ATOM 1783 C ALA A 124 14.528 -6.848 8.218 1.00 0.00 C ATOM 1784 O ALA A 124 13.771 -5.916 8.398 1.00 0.00 O ATOM 1785 CB ALA A 124 15.198 -8.324 10.145 1.00 0.00 C ATOM 0 H ALA A 124 15.408 -9.945 8.401 1.00 0.00 H new ATOM 0 HA ALA A 124 13.249 -8.244 9.175 1.00 0.00 H new ATOM 0 HB1 ALA A 124 14.951 -7.538 10.858 1.00 0.00 H new ATOM 0 HB2 ALA A 124 15.038 -9.298 10.608 1.00 0.00 H new ATOM 0 HB3 ALA A 124 16.243 -8.230 9.850 1.00 0.00 H new ATOM 1791 N ALA A 125 15.557 -6.738 7.423 1.00 0.00 N ATOM 1792 CA ALA A 125 15.817 -5.449 6.722 1.00 0.00 C ATOM 1793 C ALA A 125 14.727 -5.203 5.674 1.00 0.00 C ATOM 1794 O ALA A 125 14.580 -4.109 5.165 1.00 0.00 O ATOM 1795 CB ALA A 125 17.182 -5.619 6.055 1.00 0.00 C ATOM 0 H ALA A 125 16.227 -7.482 7.229 1.00 0.00 H new ATOM 0 HA ALA A 125 15.810 -4.597 7.401 1.00 0.00 H new ATOM 0 HB1 ALA A 125 17.441 -4.706 5.518 1.00 0.00 H new ATOM 0 HB2 ALA A 125 17.936 -5.819 6.816 1.00 0.00 H new ATOM 0 HB3 ALA A 125 17.143 -6.453 5.355 1.00 0.00 H new ATOM 1801 N ALA A 126 13.958 -6.209 5.346 1.00 0.00 N ATOM 1802 CA ALA A 126 12.883 -6.018 4.330 1.00 0.00 C ATOM 1803 C ALA A 126 11.587 -5.598 5.026 1.00 0.00 C ATOM 1804 O ALA A 126 10.961 -4.626 4.655 1.00 0.00 O ATOM 1805 CB ALA A 126 12.720 -7.377 3.646 1.00 0.00 C ATOM 0 H ALA A 126 14.028 -7.149 5.736 1.00 0.00 H new ATOM 0 HA ALA A 126 13.127 -5.240 3.607 1.00 0.00 H new ATOM 0 HB1 ALA A 126 11.943 -7.310 2.884 1.00 0.00 H new ATOM 0 HB2 ALA A 126 13.662 -7.665 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A 126 12.439 -8.126 4.387 1.00 0.00 H new ATOM 1811 N LYS A 127 11.181 -6.320 6.034 1.00 0.00 N ATOM 1812 CA LYS A 127 9.928 -5.955 6.753 1.00 0.00 C ATOM 1813 C LYS A 127 10.152 -4.656 7.530 1.00 0.00 C ATOM 1814 O LYS A 127 9.235 -3.896 7.768 1.00 0.00 O ATOM 1815 CB LYS A 127 9.655 -7.119 7.708 1.00 0.00 C ATOM 1816 CG LYS A 127 10.791 -7.218 8.728 1.00 0.00 C ATOM 1817 CD LYS A 127 10.412 -8.222 9.818 1.00 0.00 C ATOM 1818 CE LYS A 127 10.267 -9.615 9.200 1.00 0.00 C ATOM 1819 NZ LYS A 127 10.547 -10.554 10.321 1.00 0.00 N ATOM 0 H LYS A 127 11.662 -7.146 6.390 1.00 0.00 H new ATOM 0 HA LYS A 127 9.088 -5.792 6.078 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.704 -6.968 8.220 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.572 -8.051 7.149 1.00 0.00 H new ATOM 0 HG2 LYS A 127 11.711 -7.531 8.234 1.00 0.00 H new ATOM 0 HG3 LYS A 127 10.983 -6.240 9.170 1.00 0.00 H new ATOM 0 HD2 LYS A 127 11.175 -8.235 10.596 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.477 -7.924 10.293 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.266 -9.767 8.796 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.968 -9.759 8.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.468 -11.534 9.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.509 -10.388 10.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.860 -10.397 11.086 1.00 0.00 H new ATOM 1833 N ASP A 128 11.369 -4.394 7.921 1.00 0.00 N ATOM 1834 CA ASP A 128 11.656 -3.144 8.677 1.00 0.00 C ATOM 1835 C ASP A 128 11.735 -1.967 7.705 1.00 0.00 C ATOM 1836 O ASP A 128 11.077 -0.960 7.875 1.00 0.00 O ATOM 1837 CB ASP A 128 13.009 -3.380 9.354 1.00 0.00 C ATOM 1838 CG ASP A 128 13.238 -2.335 10.448 1.00 0.00 C ATOM 1839 OD1 ASP A 128 12.395 -1.467 10.598 1.00 0.00 O ATOM 1840 OD2 ASP A 128 14.256 -2.420 11.116 1.00 0.00 O ATOM 0 H ASP A 128 12.177 -4.992 7.749 1.00 0.00 H new ATOM 0 HA ASP A 128 10.882 -2.911 9.408 1.00 0.00 H new ATOM 0 HB2 ASP A 128 13.040 -4.381 9.784 1.00 0.00 H new ATOM 0 HB3 ASP A 128 13.809 -3.326 8.615 1.00 0.00 H new ATOM 1845 N ALA A 129 12.537 -2.089 6.686 1.00 0.00 N ATOM 1846 CA ALA A 129 12.665 -0.980 5.696 1.00 0.00 C ATOM 1847 C ALA A 129 11.290 -0.643 5.116 1.00 0.00 C ATOM 1848 O ALA A 129 10.854 0.491 5.149 1.00 0.00 O ATOM 1849 CB ALA A 129 13.595 -1.512 4.605 1.00 0.00 C ATOM 0 H ALA A 129 13.111 -2.910 6.494 1.00 0.00 H new ATOM 0 HA ALA A 129 13.059 -0.068 6.145 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.735 -0.747 3.841 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.560 -1.768 5.043 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.154 -2.400 4.153 1.00 0.00 H new ATOM 1855 N TRP A 130 10.602 -1.617 4.584 1.00 0.00 N ATOM 1856 CA TRP A 130 9.258 -1.344 4.005 1.00 0.00 C ATOM 1857 C TRP A 130 8.319 -0.872 5.114 1.00 0.00 C ATOM 1858 O TRP A 130 7.389 -0.126 4.878 1.00 0.00 O ATOM 1859 CB TRP A 130 8.793 -2.679 3.411 1.00 0.00 C ATOM 1860 CG TRP A 130 9.149 -2.755 1.951 1.00 0.00 C ATOM 1861 CD1 TRP A 130 9.885 -1.842 1.266 1.00 0.00 C ATOM 1862 CD2 TRP A 130 8.795 -3.792 0.988 1.00 0.00 C ATOM 1863 NE1 TRP A 130 9.996 -2.253 -0.050 1.00 0.00 N ATOM 1864 CE2 TRP A 130 9.343 -3.446 -0.270 1.00 0.00 C ATOM 1865 CE3 TRP A 130 8.057 -4.986 1.082 1.00 0.00 C ATOM 1866 CZ2 TRP A 130 9.165 -4.253 -1.391 1.00 0.00 C ATOM 1867 CZ3 TRP A 130 7.879 -5.803 -0.048 1.00 0.00 C ATOM 1868 CH2 TRP A 130 8.432 -5.436 -1.282 1.00 0.00 C ATOM 0 H TRP A 130 10.913 -2.587 4.526 1.00 0.00 H new ATOM 0 HA TRP A 130 9.274 -0.564 3.244 1.00 0.00 H new ATOM 0 HB2 TRP A 130 9.258 -3.505 3.949 1.00 0.00 H new ATOM 0 HB3 TRP A 130 7.715 -2.784 3.535 1.00 0.00 H new ATOM 0 HD1 TRP A 130 10.314 -0.942 1.681 1.00 0.00 H new ATOM 0 HE1 TRP A 130 10.500 -1.736 -0.770 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.625 -5.277 2.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 9.592 -3.965 -2.340 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 7.313 -6.719 0.035 1.00 0.00 H new ATOM 0 HH2 TRP A 130 8.291 -6.067 -2.147 1.00 0.00 H new ATOM 1879 N ALA A 131 8.563 -1.286 6.327 1.00 0.00 N ATOM 1880 CA ALA A 131 7.691 -0.843 7.449 1.00 0.00 C ATOM 1881 C ALA A 131 7.909 0.653 7.681 1.00 0.00 C ATOM 1882 O ALA A 131 7.045 1.349 8.177 1.00 0.00 O ATOM 1883 CB ALA A 131 8.144 -1.655 8.663 1.00 0.00 C ATOM 0 H ALA A 131 9.326 -1.910 6.588 1.00 0.00 H new ATOM 0 HA ALA A 131 6.630 -0.998 7.250 1.00 0.00 H new ATOM 0 HB1 ALA A 131 7.543 -1.380 9.530 1.00 0.00 H new ATOM 0 HB2 ALA A 131 8.019 -2.718 8.457 1.00 0.00 H new ATOM 0 HB3 ALA A 131 9.194 -1.447 8.869 1.00 0.00 H new ATOM 1889 N ALA A 132 9.059 1.152 7.315 1.00 0.00 N ATOM 1890 CA ALA A 132 9.338 2.603 7.499 1.00 0.00 C ATOM 1891 C ALA A 132 8.811 3.372 6.287 1.00 0.00 C ATOM 1892 O ALA A 132 8.223 4.427 6.412 1.00 0.00 O ATOM 1893 CB ALA A 132 10.862 2.717 7.592 1.00 0.00 C ATOM 0 H ALA A 132 9.818 0.615 6.896 1.00 0.00 H new ATOM 0 HA ALA A 132 8.857 3.015 8.386 1.00 0.00 H new ATOM 0 HB1 ALA A 132 11.141 3.762 7.729 1.00 0.00 H new ATOM 0 HB2 ALA A 132 11.220 2.132 8.439 1.00 0.00 H new ATOM 0 HB3 ALA A 132 11.312 2.338 6.674 1.00 0.00 H new ATOM 1899 N ALA A 133 9.018 2.842 5.114 1.00 0.00 N ATOM 1900 CA ALA A 133 8.535 3.528 3.883 1.00 0.00 C ATOM 1901 C ALA A 133 7.008 3.464 3.820 1.00 0.00 C ATOM 1902 O ALA A 133 6.339 4.474 3.727 1.00 0.00 O ATOM 1903 CB ALA A 133 9.156 2.751 2.721 1.00 0.00 C ATOM 0 H ALA A 133 9.503 1.959 4.954 1.00 0.00 H new ATOM 0 HA ALA A 133 8.814 4.581 3.856 1.00 0.00 H new ATOM 0 HB1 ALA A 133 8.845 3.198 1.777 1.00 0.00 H new ATOM 0 HB2 ALA A 133 10.243 2.787 2.799 1.00 0.00 H new ATOM 0 HB3 ALA A 133 8.823 1.714 2.758 1.00 0.00 H new ATOM 1909 N TYR A 134 6.451 2.283 3.869 1.00 0.00 N ATOM 1910 CA TYR A 134 4.965 2.152 3.810 1.00 0.00 C ATOM 1911 C TYR A 134 4.322 3.144 4.783 1.00 0.00 C ATOM 1912 O TYR A 134 3.213 3.597 4.580 1.00 0.00 O ATOM 1913 CB TYR A 134 4.670 0.707 4.228 1.00 0.00 C ATOM 1914 CG TYR A 134 5.098 -0.270 3.142 1.00 0.00 C ATOM 1915 CD1 TYR A 134 5.825 0.166 2.020 1.00 0.00 C ATOM 1916 CD2 TYR A 134 4.764 -1.626 3.266 1.00 0.00 C ATOM 1917 CE1 TYR A 134 6.211 -0.749 1.034 1.00 0.00 C ATOM 1918 CE2 TYR A 134 5.152 -2.539 2.278 1.00 0.00 C ATOM 1919 CZ TYR A 134 5.875 -2.101 1.162 1.00 0.00 C ATOM 1920 OH TYR A 134 6.256 -3.002 0.190 1.00 0.00 O ATOM 0 H TYR A 134 6.961 1.403 3.947 1.00 0.00 H new ATOM 0 HA TYR A 134 4.565 2.368 2.819 1.00 0.00 H new ATOM 0 HB2 TYR A 134 5.194 0.478 5.156 1.00 0.00 H new ATOM 0 HB3 TYR A 134 3.605 0.592 4.427 1.00 0.00 H new ATOM 0 HD1 TYR A 134 6.086 1.209 1.919 1.00 0.00 H new ATOM 0 HD2 TYR A 134 4.206 -1.967 4.126 1.00 0.00 H new ATOM 0 HE1 TYR A 134 6.769 -0.411 0.173 1.00 0.00 H new ATOM 0 HE2 TYR A 134 4.893 -3.583 2.377 1.00 0.00 H new ATOM 0 HH TYR A 134 7.216 -3.182 0.269 1.00 0.00 H new ATOM 1930 N ALA A 135 5.014 3.492 5.834 1.00 0.00 N ATOM 1931 CA ALA A 135 4.445 4.461 6.811 1.00 0.00 C ATOM 1932 C ALA A 135 4.435 5.857 6.185 1.00 0.00 C ATOM 1933 O ALA A 135 3.474 6.592 6.296 1.00 0.00 O ATOM 1934 CB ALA A 135 5.380 4.413 8.020 1.00 0.00 C ATOM 0 H ALA A 135 5.948 3.147 6.057 1.00 0.00 H new ATOM 0 HA ALA A 135 3.420 4.222 7.096 1.00 0.00 H new ATOM 0 HB1 ALA A 135 5.023 5.104 8.784 1.00 0.00 H new ATOM 0 HB2 ALA A 135 5.399 3.401 8.426 1.00 0.00 H new ATOM 0 HB3 ALA A 135 6.386 4.699 7.714 1.00 0.00 H new ATOM 1940 N ASP A 136 5.497 6.224 5.522 1.00 0.00 N ATOM 1941 CA ASP A 136 5.549 7.568 4.882 1.00 0.00 C ATOM 1942 C ASP A 136 4.694 7.558 3.613 1.00 0.00 C ATOM 1943 O ASP A 136 4.039 8.528 3.286 1.00 0.00 O ATOM 1944 CB ASP A 136 7.023 7.799 4.543 1.00 0.00 C ATOM 1945 CG ASP A 136 7.748 8.405 5.747 1.00 0.00 C ATOM 1946 OD1 ASP A 136 7.636 7.844 6.825 1.00 0.00 O ATOM 1947 OD2 ASP A 136 8.402 9.419 5.570 1.00 0.00 O ATOM 0 H ASP A 136 6.331 5.651 5.396 1.00 0.00 H new ATOM 0 HA ASP A 136 5.164 8.357 5.528 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.492 6.856 4.262 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.107 8.465 3.684 1.00 0.00 H new ATOM 1952 N ILE A 137 4.691 6.465 2.899 1.00 0.00 N ATOM 1953 CA ILE A 137 3.874 6.390 1.656 1.00 0.00 C ATOM 1954 C ILE A 137 2.389 6.446 2.034 1.00 0.00 C ATOM 1955 O ILE A 137 1.661 7.318 1.603 1.00 0.00 O ATOM 1956 CB ILE A 137 4.247 5.044 1.014 1.00 0.00 C ATOM 1957 CG1 ILE A 137 5.569 5.198 0.258 1.00 0.00 C ATOM 1958 CG2 ILE A 137 3.158 4.596 0.030 1.00 0.00 C ATOM 1959 CD1 ILE A 137 6.697 4.554 1.064 1.00 0.00 C ATOM 0 H ILE A 137 5.219 5.622 3.123 1.00 0.00 H new ATOM 0 HA ILE A 137 4.059 7.212 0.964 1.00 0.00 H new ATOM 0 HB ILE A 137 4.344 4.295 1.800 1.00 0.00 H new ATOM 0 HG12 ILE A 137 5.496 4.729 -0.723 1.00 0.00 H new ATOM 0 HG13 ILE A 137 5.784 6.254 0.091 1.00 0.00 H new ATOM 0 HG21 ILE A 137 3.440 3.641 -0.414 1.00 0.00 H new ATOM 0 HG22 ILE A 137 2.212 4.484 0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 137 3.048 5.344 -0.756 1.00 0.00 H new ATOM 0 HD11 ILE A 137 7.638 4.664 0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.776 5.043 2.035 1.00 0.00 H new ATOM 0 HD13 ILE A 137 6.483 3.495 1.208 1.00 0.00 H new ATOM 1971 N SER A 138 1.938 5.525 2.839 1.00 0.00 N ATOM 1972 CA SER A 138 0.503 5.527 3.246 1.00 0.00 C ATOM 1973 C SER A 138 0.217 6.754 4.115 1.00 0.00 C ATOM 1974 O SER A 138 -0.904 7.212 4.209 1.00 0.00 O ATOM 1975 CB SER A 138 0.308 4.239 4.045 1.00 0.00 C ATOM 1976 OG SER A 138 0.846 4.409 5.350 1.00 0.00 O ATOM 0 H SER A 138 2.500 4.771 3.233 1.00 0.00 H new ATOM 0 HA SER A 138 -0.173 5.571 2.392 1.00 0.00 H new ATOM 0 HB2 SER A 138 -0.752 3.992 4.106 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.801 3.407 3.542 1.00 0.00 H new ATOM 0 HG SER A 138 1.712 3.955 5.408 1.00 0.00 H new ATOM 1982 N GLY A 139 1.222 7.289 4.751 1.00 0.00 N ATOM 1983 CA GLY A 139 1.006 8.486 5.613 1.00 0.00 C ATOM 1984 C GLY A 139 0.901 9.729 4.727 1.00 0.00 C ATOM 1985 O GLY A 139 0.245 10.693 5.068 1.00 0.00 O ATOM 0 H GLY A 139 2.183 6.950 4.712 1.00 0.00 H new ATOM 0 HA2 GLY A 139 0.097 8.366 6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 139 1.830 8.595 6.318 1.00 0.00 H new ATOM 1989 N ALA A 140 1.543 9.714 3.590 1.00 0.00 N ATOM 1990 CA ALA A 140 1.479 10.895 2.683 1.00 0.00 C ATOM 1991 C ALA A 140 0.099 10.962 2.024 1.00 0.00 C ATOM 1992 O ALA A 140 -0.340 12.007 1.587 1.00 0.00 O ATOM 1993 CB ALA A 140 2.569 10.658 1.637 1.00 0.00 C ATOM 0 H ALA A 140 2.108 8.936 3.251 1.00 0.00 H new ATOM 0 HA ALA A 140 1.631 11.837 3.210 1.00 0.00 H new ATOM 0 HB1 ALA A 140 2.583 11.489 0.932 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.538 10.585 2.131 1.00 0.00 H new ATOM 0 HB3 ALA A 140 2.364 9.731 1.102 1.00 0.00 H new ATOM 1999 N LEU A 141 -0.588 9.855 1.950 1.00 0.00 N ATOM 2000 CA LEU A 141 -1.939 9.858 1.320 1.00 0.00 C ATOM 2001 C LEU A 141 -3.001 10.230 2.360 1.00 0.00 C ATOM 2002 O LEU A 141 -4.185 10.094 2.125 1.00 0.00 O ATOM 2003 CB LEU A 141 -2.152 8.428 0.819 1.00 0.00 C ATOM 2004 CG LEU A 141 -3.207 8.425 -0.288 1.00 0.00 C ATOM 2005 CD1 LEU A 141 -2.905 7.299 -1.278 1.00 0.00 C ATOM 2006 CD2 LEU A 141 -4.591 8.202 0.327 1.00 0.00 C ATOM 0 H LEU A 141 -0.273 8.950 2.298 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.016 10.584 0.510 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.214 8.020 0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.471 7.787 1.641 1.00 0.00 H new ATOM 0 HG LEU A 141 -3.189 9.383 -0.809 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.657 7.297 -2.067 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -1.919 7.455 -1.717 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -2.923 6.342 -0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -5.343 8.200 -0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -4.608 7.244 0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.808 9.003 1.034 1.00 0.00 H new ATOM 2018 N ILE A 142 -2.591 10.700 3.508 1.00 0.00 N ATOM 2019 CA ILE A 142 -3.584 11.077 4.554 1.00 0.00 C ATOM 2020 C ILE A 142 -3.785 12.594 4.551 1.00 0.00 C ATOM 2021 O ILE A 142 -4.263 13.169 5.509 1.00 0.00 O ATOM 2022 CB ILE A 142 -2.973 10.615 5.876 1.00 0.00 C ATOM 2023 CG1 ILE A 142 -2.715 9.106 5.820 1.00 0.00 C ATOM 2024 CG2 ILE A 142 -3.941 10.925 7.018 1.00 0.00 C ATOM 2025 CD1 ILE A 142 -4.012 8.377 5.464 1.00 0.00 C ATOM 0 H ILE A 142 -1.614 10.839 3.766 1.00 0.00 H new ATOM 0 HA ILE A 142 -4.560 10.622 4.385 1.00 0.00 H new ATOM 0 HB ILE A 142 -2.031 11.138 6.045 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -1.947 8.885 5.079 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -2.341 8.755 6.782 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -3.507 10.596 7.962 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -4.125 11.999 7.058 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -4.882 10.402 6.849 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -3.827 7.304 5.424 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -4.767 8.587 6.221 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -4.367 8.720 4.492 1.00 0.00 H new ATOM 2037 N SER A 143 -3.425 13.246 3.480 1.00 0.00 N ATOM 2038 CA SER A 143 -3.596 14.725 3.415 1.00 0.00 C ATOM 2039 C SER A 143 -4.737 15.069 2.455 1.00 0.00 C ATOM 2040 O SER A 143 -5.653 15.789 2.798 1.00 0.00 O ATOM 2041 CB SER A 143 -2.265 15.261 2.889 1.00 0.00 C ATOM 2042 OG SER A 143 -1.337 15.351 3.962 1.00 0.00 O ATOM 0 H SER A 143 -3.020 12.819 2.647 1.00 0.00 H new ATOM 0 HA SER A 143 -3.846 15.160 4.383 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.877 14.603 2.112 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.409 16.241 2.434 1.00 0.00 H new ATOM 0 HG SER A 143 -0.482 15.693 3.627 1.00 0.00 H new ATOM 2048 N GLY A 144 -4.688 14.559 1.255 1.00 0.00 N ATOM 2049 CA GLY A 144 -5.770 14.857 0.275 1.00 0.00 C ATOM 2050 C GLY A 144 -7.018 14.039 0.622 1.00 0.00 C ATOM 2051 O GLY A 144 -8.070 14.225 0.043 1.00 0.00 O ATOM 0 H GLY A 144 -3.946 13.949 0.911 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -6.005 15.921 0.290 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -5.436 14.618 -0.735 1.00 0.00 H new ATOM 2055 N LEU A 145 -6.918 13.135 1.561 1.00 0.00 N ATOM 2056 CA LEU A 145 -8.102 12.314 1.934 1.00 0.00 C ATOM 2057 C LEU A 145 -8.793 12.976 3.135 1.00 0.00 C ATOM 2058 O LEU A 145 -8.664 14.166 3.345 1.00 0.00 O ATOM 2059 CB LEU A 145 -7.512 10.931 2.281 1.00 0.00 C ATOM 2060 CG LEU A 145 -8.571 9.799 2.269 1.00 0.00 C ATOM 2061 CD1 LEU A 145 -9.779 10.150 1.391 1.00 0.00 C ATOM 2062 CD2 LEU A 145 -7.922 8.523 1.730 1.00 0.00 C ATOM 0 H LEU A 145 -6.067 12.931 2.084 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.855 12.224 1.151 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -6.723 10.690 1.569 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -7.049 10.977 3.267 1.00 0.00 H new ATOM 0 HG LEU A 145 -8.927 9.660 3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -10.495 9.329 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -10.254 11.055 1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -9.448 10.316 0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -8.657 7.718 1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -7.559 8.699 0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -7.087 8.241 2.371 1.00 0.00 H new ATOM 2074 N GLN A 146 -9.525 12.234 3.922 1.00 0.00 N ATOM 2075 CA GLN A 146 -10.209 12.847 5.094 1.00 0.00 C ATOM 2076 C GLN A 146 -11.091 14.006 4.625 1.00 0.00 C ATOM 2077 O GLN A 146 -11.063 15.085 5.183 1.00 0.00 O ATOM 2078 CB GLN A 146 -9.079 13.350 5.998 1.00 0.00 C ATOM 2079 CG GLN A 146 -8.587 12.214 6.900 1.00 0.00 C ATOM 2080 CD GLN A 146 -8.290 10.961 6.072 1.00 0.00 C ATOM 2081 OE1 GLN A 146 -9.127 10.089 5.945 1.00 0.00 O ATOM 2082 NE2 GLN A 146 -7.125 10.834 5.500 1.00 0.00 N ATOM 0 H GLN A 146 -9.678 11.233 3.803 1.00 0.00 H new ATOM 0 HA GLN A 146 -10.856 12.144 5.619 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -8.256 13.726 5.391 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -9.432 14.182 6.607 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -7.688 12.527 7.431 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -9.341 11.988 7.654 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -6.422 11.566 5.606 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -6.917 10.003 4.946 1.00 0.00 H new ATOM 2091 N SER A 147 -11.876 13.792 3.604 1.00 0.00 N ATOM 2092 CA SER A 147 -12.759 14.882 3.101 1.00 0.00 C ATOM 2093 C SER A 147 -11.913 16.105 2.742 1.00 0.00 C ATOM 2094 O SER A 147 -10.708 15.953 2.621 1.00 0.00 O ATOM 2095 CB SER A 147 -13.706 15.198 4.259 1.00 0.00 C ATOM 2096 OG SER A 147 -14.958 14.567 4.027 1.00 0.00 O ATOM 2097 OXT SER A 147 -12.484 17.173 2.595 1.00 0.00 O ATOM 0 H SER A 147 -11.944 12.910 3.097 1.00 0.00 H new ATOM 0 HA SER A 147 -13.308 14.596 2.204 1.00 0.00 H new ATOM 0 HB2 SER A 147 -13.279 14.849 5.199 1.00 0.00 H new ATOM 0 HB3 SER A 147 -13.840 16.276 4.350 1.00 0.00 H new ATOM 0 HG SER A 147 -15.567 14.766 4.768 1.00 0.00 H new TER 2103 SER A 147 HETATM 2104 FE HEM A 148 -7.458 2.875 -1.832 1.00 0.00 FE HETATM 2105 CHA HEM A 148 -8.841 2.765 -4.914 1.00 0.00 C HETATM 2106 CHB HEM A 148 -10.497 2.336 -0.450 1.00 0.00 C HETATM 2107 CHC HEM A 148 -6.057 2.885 1.245 1.00 0.00 C HETATM 2108 CHD HEM A 148 -4.423 3.459 -3.213 1.00 0.00 C HETATM 2109 NA HEM A 148 -9.268 2.614 -2.528 1.00 0.00 N HETATM 2110 C1A HEM A 148 -9.676 2.593 -3.840 1.00 0.00 C HETATM 2111 C2A HEM A 148 -11.096 2.375 -3.952 1.00 0.00 C HETATM 2112 C3A HEM A 148 -11.566 2.262 -2.696 1.00 0.00 C HETATM 2113 C4A HEM A 148 -10.429 2.409 -1.819 1.00 0.00 C HETATM 2114 CMA HEM A 148 -12.980 2.033 -2.294 1.00 0.00 C HETATM 2115 CAA HEM A 148 -11.889 2.291 -5.211 1.00 0.00 C HETATM 2116 CBA HEM A 148 -13.000 1.243 -5.131 1.00 0.00 C HETATM 2117 CGA HEM A 148 -13.386 0.814 -6.520 1.00 0.00 C HETATM 2118 O1A HEM A 148 -14.576 1.004 -6.889 1.00 0.00 O HETATM 2119 O2A HEM A 148 -12.500 0.286 -7.244 1.00 0.00 O HETATM 2120 NB HEM A 148 -8.130 2.668 -0.006 1.00 0.00 N HETATM 2121 C1B HEM A 148 -9.426 2.454 0.401 1.00 0.00 C HETATM 2122 C2B HEM A 148 -9.517 2.339 1.837 1.00 0.00 C HETATM 2123 C3B HEM A 148 -8.264 2.473 2.311 1.00 0.00 C HETATM 2124 C4B HEM A 148 -7.412 2.684 1.167 1.00 0.00 C HETATM 2125 CMB HEM A 148 -10.755 2.132 2.638 1.00 0.00 C HETATM 2126 CAB HEM A 148 -7.865 2.377 3.628 1.00 0.00 C HETATM 2127 CBB HEM A 148 -7.308 1.210 4.113 1.00 0.00 C HETATM 2128 NC HEM A 148 -5.645 3.132 -1.137 1.00 0.00 N HETATM 2129 C1C HEM A 148 -5.227 3.096 0.173 1.00 0.00 C HETATM 2130 C2C HEM A 148 -3.804 3.313 0.282 1.00 0.00 C HETATM 2131 C3C HEM A 148 -3.348 3.487 -0.973 1.00 0.00 C HETATM 2132 C4C HEM A 148 -4.490 3.371 -1.846 1.00 0.00 C HETATM 2133 CMC HEM A 148 -2.997 3.326 1.534 1.00 0.00 C HETATM 2134 CAC HEM A 148 -2.043 3.728 -1.352 1.00 0.00 C HETATM 2135 CBC HEM A 148 -1.063 2.773 -1.175 1.00 0.00 C HETATM 2136 ND HEM A 148 -6.783 3.072 -3.659 1.00 0.00 N HETATM 2137 C1D HEM A 148 -5.490 3.318 -4.065 1.00 0.00 C HETATM 2138 C2D HEM A 148 -5.393 3.390 -5.503 1.00 0.00 C HETATM 2139 C3D HEM A 148 -6.634 3.184 -5.982 1.00 0.00 C HETATM 2140 C4D HEM A 148 -7.489 2.990 -4.836 1.00 0.00 C HETATM 2141 CMD HEM A 148 -4.160 3.640 -6.301 1.00 0.00 C HETATM 2142 CAD HEM A 148 -7.043 3.153 -7.414 1.00 0.00 C HETATM 2143 CBD HEM A 148 -7.876 1.916 -7.753 1.00 0.00 C HETATM 2144 CGD HEM A 148 -9.092 2.329 -8.536 1.00 0.00 C HETATM 2145 O1D HEM A 148 -8.981 2.441 -9.786 1.00 0.00 O HETATM 2146 O2D HEM A 148 -10.160 2.541 -7.901 1.00 0.00 O HETATM 0 HMA1 HEM A 148 -13.645 2.474 -3.036 1.00 0.00 H new HETATM 0 HMA2 HEM A 148 -13.162 2.495 -1.324 1.00 0.00 H new HETATM 0 HMA3 HEM A 148 -13.170 0.962 -2.227 1.00 0.00 H new HETATM 0 HMB1 HEM A 148 -11.602 2.586 2.123 1.00 0.00 H new HETATM 0 HMB2 HEM A 148 -10.636 2.594 3.618 1.00 0.00 H new HETATM 0 HMB3 HEM A 148 -10.935 1.064 2.760 1.00 0.00 H new HETATM 0 HMC1 HEM A 148 -3.615 3.673 2.362 1.00 0.00 H new HETATM 0 HMC2 HEM A 148 -2.146 3.996 1.411 1.00 0.00 H new HETATM 0 HMC3 HEM A 148 -2.639 2.319 1.746 1.00 0.00 H new HETATM 0 HMD1 HEM A 148 -3.474 4.262 -5.726 1.00 0.00 H new HETATM 0 HMD2 HEM A 148 -4.423 4.151 -7.227 1.00 0.00 H new HETATM 0 HMD3 HEM A 148 -3.679 2.690 -6.534 1.00 0.00 H new HETATM 0 HBB1 HEM A 148 -6.997 1.147 5.156 1.00 0.00 H new HETATM 0 HBB2 HEM A 148 -7.180 0.352 3.453 1.00 0.00 H new HETATM 0 HBC1 HEM A 148 -0.038 2.981 -1.480 1.00 0.00 H new HETATM 0 HBC2 HEM A 148 -1.314 1.810 -0.730 1.00 0.00 H new HETATM 0 HBA1 HEM A 148 -13.866 1.654 -4.612 1.00 0.00 H new HETATM 0 HBA2 HEM A 148 -12.662 0.382 -4.554 1.00 0.00 H new HETATM 0 HAA1 HEM A 148 -11.224 2.049 -6.040 1.00 0.00 H new HETATM 0 HAA2 HEM A 148 -12.327 3.265 -5.427 1.00 0.00 H new HETATM 0 HBD1 HEM A 148 -8.176 1.405 -6.838 1.00 0.00 H new HETATM 0 HBD2 HEM A 148 -7.280 1.211 -8.332 1.00 0.00 H new HETATM 0 HAD1 HEM A 148 -6.154 3.173 -8.044 1.00 0.00 H new HETATM 0 HAD2 HEM A 148 -7.618 4.050 -7.645 1.00 0.00 H new HETATM 0 HHA HEM A 148 -9.282 2.720 -5.899 1.00 0.00 H new HETATM 0 HHB HEM A 148 -11.469 2.173 -0.008 1.00 0.00 H new HETATM 0 HHC HEM A 148 -5.608 2.876 2.227 1.00 0.00 H new HETATM 0 HHD HEM A 148 -3.456 3.654 -3.653 1.00 0.00 H new HETATM 0 HAB HEM A 148 -7.991 3.231 4.293 1.00 0.00 H new HETATM 0 HAC HEM A 148 -1.782 4.688 -1.798 1.00 0.00 H new HETATM 2177 C CMO A 149 -7.150 1.005 -1.921 1.00 0.00 C HETATM 2178 O CMO A 149 -6.968 -0.105 -1.971 1.00 0.00 O