USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 970 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 128 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 129 SER OG : rot -5:sc= 0.165 USER MOD Set 2.1: A 19 ASN : amide:sc= -1.32! C(o=-3!,f=-3.8!) USER MOD Set 2.2: A 116 HIS : no HD1:sc= -1.7 X(o=-3,f=-2.6) USER MOD Set 3.1: A 101 LYS NZ :NH3+ -166:sc= -1.3 (180deg=-2.11!) USER MOD Set 3.2: A 105 MET CE :methyl -153:sc= -0.158 (180deg=-0.703) USER MOD Set 4.1: A 61 ASN : amide:sc= -3.18! C(o=-2.1!,f=-1.3!) USER MOD Set 4.2: A 63 GLN : amide:sc= 0.541 X(o=-2.1,f=-2.4) USER MOD Set 4.3: A 65 THR OG1 : rot -150:sc= 0.524 USER MOD Single : A 1 GLY N :NH3+ -134:sc= 0.0242 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 37:sc= 0.576 USER MOD Single : A 5 SER OG : rot 42:sc= 0.8 USER MOD Single : A 6 SER OG : rot 53:sc= 0.355 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0538 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 HIS : no HE2:sc= -0.0616 K(o=-0.062,f=-1.6) USER MOD Single : A 32 ASN : amide:sc= -0.346 K(o=-0.35,f=-1.7) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.0059) USER MOD Single : A 40 TYR OH : rot -161:sc= 0.241 USER MOD Single : A 41 ASN : amide:sc= -5.2! C(o=-5.2!,f=-10!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.0107 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.743 USER MOD Single : A 51 ASN : amide:sc= -0.0376 X(o=-0.038,f=0) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.402 USER MOD Single : A 60 SER OG : rot 180:sc= -0.361 USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 70 TYR OH : rot -9:sc= 0.216 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.349 X(o=-0.35,f=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.119 K(o=-0.12,f=-1.9!) USER MOD Single : A 81 SER OG : rot 160:sc= 0 USER MOD Single : A 84 MET CE :methyl -129:sc= -0.5 (180deg=-2.66!) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.403 X(o=-0.4,f=-0.031) USER MOD Single : A 92 THR OG1 : rot 99:sc= 0.362 USER MOD Single : A 94 SER OG : rot 6:sc= 0.141 USER MOD Single : A 95 TYR OH : rot -38:sc= 1.13 USER MOD Single : A 96 THR OG1 : rot -140:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 103 ASN : amide:sc= -3.25 K(o=-3.3,f=-7.7!) USER MOD Single : A 106 SER OG : rot -54:sc= -0.451! USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00503 USER MOD Single : A 112 GLN : amide:sc= -2.03 K(o=-2,f=-8.1!) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= -0.0122 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.682 3.317 18.843 1.00 0.00 N ATOM 2 CA GLY A 1 0.243 4.257 19.449 1.00 0.00 C ATOM 3 C GLY A 1 -0.382 5.031 20.592 1.00 0.00 C ATOM 4 O GLY A 1 -1.245 4.514 21.302 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.209 2.400 18.712 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.509 3.195 19.462 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.992 3.681 17.920 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.117 3.718 19.815 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.595 4.956 18.690 1.00 0.00 H new ATOM 8 N SER A 2 0.054 6.273 20.772 1.00 0.00 N ATOM 9 CA SER A 2 -0.465 7.118 21.841 1.00 0.00 C ATOM 10 C SER A 2 -0.461 8.586 21.424 1.00 0.00 C ATOM 11 O SER A 2 0.429 9.035 20.702 1.00 0.00 O ATOM 12 CB SER A 2 0.364 6.935 23.113 1.00 0.00 C ATOM 13 OG SER A 2 0.226 5.622 23.627 1.00 0.00 O ATOM 0 H SER A 2 0.766 6.717 20.191 1.00 0.00 H new ATOM 0 HA SER A 2 -1.494 6.818 22.040 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.414 7.137 22.899 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.047 7.658 23.864 1.00 0.00 H new ATOM 0 HG SER A 2 0.767 5.530 24.439 1.00 0.00 H new ATOM 19 N SER A 3 -1.462 9.329 21.885 1.00 0.00 N ATOM 20 CA SER A 3 -1.576 10.745 21.558 1.00 0.00 C ATOM 21 C SER A 3 -0.207 11.417 21.567 1.00 0.00 C ATOM 22 O SER A 3 0.429 11.543 22.612 1.00 0.00 O ATOM 23 CB SER A 3 -2.507 11.446 22.550 1.00 0.00 C ATOM 24 OG SER A 3 -2.033 11.309 23.878 1.00 0.00 O ATOM 0 H SER A 3 -2.206 8.974 22.486 1.00 0.00 H new ATOM 0 HA SER A 3 -1.996 10.828 20.555 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.585 12.503 22.296 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.509 11.025 22.473 1.00 0.00 H new ATOM 0 HG SER A 3 -1.054 11.358 23.883 1.00 0.00 H new ATOM 30 N GLY A 4 0.241 11.848 20.391 1.00 0.00 N ATOM 31 CA GLY A 4 1.533 12.502 20.284 1.00 0.00 C ATOM 32 C GLY A 4 1.624 13.411 19.075 1.00 0.00 C ATOM 33 O GLY A 4 2.277 13.076 18.086 1.00 0.00 O ATOM 0 H GLY A 4 -0.267 11.756 19.511 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.718 13.084 21.187 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.316 11.746 20.226 1.00 0.00 H new ATOM 37 N SER A 5 0.966 14.563 19.151 1.00 0.00 N ATOM 38 CA SER A 5 0.971 15.521 18.051 1.00 0.00 C ATOM 39 C SER A 5 1.489 16.878 18.515 1.00 0.00 C ATOM 40 O SER A 5 0.763 17.652 19.138 1.00 0.00 O ATOM 41 CB SER A 5 -0.436 15.670 17.470 1.00 0.00 C ATOM 42 OG SER A 5 -1.352 16.106 18.460 1.00 0.00 O ATOM 0 H SER A 5 0.422 14.856 19.963 1.00 0.00 H new ATOM 0 HA SER A 5 1.638 15.143 17.276 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.419 16.383 16.646 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.766 14.716 17.059 1.00 0.00 H new ATOM 0 HG SER A 5 -0.936 16.807 19.005 1.00 0.00 H new ATOM 48 N SER A 6 2.751 17.161 18.207 1.00 0.00 N ATOM 49 CA SER A 6 3.369 18.423 18.595 1.00 0.00 C ATOM 50 C SER A 6 3.474 19.366 17.400 1.00 0.00 C ATOM 51 O SER A 6 4.533 19.497 16.789 1.00 0.00 O ATOM 52 CB SER A 6 4.758 18.175 19.186 1.00 0.00 C ATOM 53 OG SER A 6 5.556 17.402 18.307 1.00 0.00 O ATOM 0 H SER A 6 3.365 16.533 17.689 1.00 0.00 H new ATOM 0 HA SER A 6 2.738 18.890 19.351 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.248 19.128 19.383 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.663 17.661 20.143 1.00 0.00 H new ATOM 0 HG SER A 6 5.562 17.818 17.420 1.00 0.00 H new ATOM 59 N GLY A 7 2.365 20.023 17.074 1.00 0.00 N ATOM 60 CA GLY A 7 2.352 20.946 15.954 1.00 0.00 C ATOM 61 C GLY A 7 2.537 20.245 14.623 1.00 0.00 C ATOM 62 O GLY A 7 1.579 20.055 13.873 1.00 0.00 O ATOM 0 H GLY A 7 1.476 19.933 17.565 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.407 21.490 15.946 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.144 21.684 16.086 1.00 0.00 H new ATOM 66 N THR A 8 3.774 19.860 14.325 1.00 0.00 N ATOM 67 CA THR A 8 4.083 19.180 13.074 1.00 0.00 C ATOM 68 C THR A 8 2.942 18.262 12.652 1.00 0.00 C ATOM 69 O THR A 8 2.336 17.586 13.483 1.00 0.00 O ATOM 70 CB THR A 8 5.377 18.352 13.190 1.00 0.00 C ATOM 71 OG1 THR A 8 5.263 17.411 14.264 1.00 0.00 O ATOM 72 CG2 THR A 8 6.578 19.255 13.426 1.00 0.00 C ATOM 0 H THR A 8 4.579 20.008 14.934 1.00 0.00 H new ATOM 0 HA THR A 8 4.222 19.954 12.319 1.00 0.00 H new ATOM 0 HB THR A 8 5.524 17.816 12.252 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.089 16.888 14.330 1.00 0.00 H new ATOM 0 HG21 THR A 8 7.480 18.648 13.505 1.00 0.00 H new ATOM 0 HG22 THR A 8 6.680 19.950 12.593 1.00 0.00 H new ATOM 0 HG23 THR A 8 6.436 19.815 14.350 1.00 0.00 H new ATOM 80 N ALA A 9 2.654 18.242 11.354 1.00 0.00 N ATOM 81 CA ALA A 9 1.587 17.404 10.821 1.00 0.00 C ATOM 82 C ALA A 9 1.988 16.788 9.485 1.00 0.00 C ATOM 83 O ALA A 9 2.616 17.443 8.654 1.00 0.00 O ATOM 84 CB ALA A 9 0.307 18.213 10.669 1.00 0.00 C ATOM 0 H ALA A 9 3.145 18.797 10.653 1.00 0.00 H new ATOM 0 HA ALA A 9 1.409 16.592 11.526 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.482 17.575 10.270 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.003 18.600 11.642 1.00 0.00 H new ATOM 0 HB3 ALA A 9 0.481 19.045 9.986 1.00 0.00 H new ATOM 90 N GLN A 10 1.622 15.526 9.287 1.00 0.00 N ATOM 91 CA GLN A 10 1.945 14.822 8.052 1.00 0.00 C ATOM 92 C GLN A 10 0.924 13.726 7.766 1.00 0.00 C ATOM 93 O GLN A 10 0.560 12.954 8.655 1.00 0.00 O ATOM 94 CB GLN A 10 3.348 14.218 8.137 1.00 0.00 C ATOM 95 CG GLN A 10 3.536 13.279 9.318 1.00 0.00 C ATOM 96 CD GLN A 10 4.959 12.770 9.438 1.00 0.00 C ATOM 97 OE1 GLN A 10 5.914 13.485 9.133 1.00 0.00 O ATOM 98 NE2 GLN A 10 5.108 11.529 9.886 1.00 0.00 N ATOM 0 H GLN A 10 1.102 14.970 9.966 1.00 0.00 H new ATOM 0 HA GLN A 10 1.915 15.543 7.235 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.557 13.675 7.215 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.078 15.024 8.205 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.261 13.797 10.237 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.858 12.431 9.215 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.288 10.972 10.127 1.00 0.00 H new ATOM 0 HE22 GLN A 10 6.042 11.133 9.989 1.00 0.00 H new ATOM 107 N LEU A 11 0.463 13.664 6.522 1.00 0.00 N ATOM 108 CA LEU A 11 -0.518 12.662 6.118 1.00 0.00 C ATOM 109 C LEU A 11 -0.116 11.276 6.613 1.00 0.00 C ATOM 110 O LEU A 11 0.878 10.707 6.159 1.00 0.00 O ATOM 111 CB LEU A 11 -0.667 12.650 4.596 1.00 0.00 C ATOM 112 CG LEU A 11 -1.794 11.780 4.039 1.00 0.00 C ATOM 113 CD1 LEU A 11 -3.140 12.245 4.573 1.00 0.00 C ATOM 114 CD2 LEU A 11 -1.785 11.805 2.517 1.00 0.00 C ATOM 0 H LEU A 11 0.752 14.296 5.775 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.476 12.924 6.568 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.825 13.674 4.258 1.00 0.00 H new ATOM 0 HB3 LEU A 11 0.274 12.313 4.161 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.631 10.753 4.367 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.930 11.614 4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.144 12.175 5.661 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.312 13.279 4.275 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.594 11.180 2.138 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -1.924 12.829 2.169 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.831 11.424 2.152 1.00 0.00 H new ATOM 126 N THR A 12 -0.895 10.736 7.545 1.00 0.00 N ATOM 127 CA THR A 12 -0.622 9.417 8.100 1.00 0.00 C ATOM 128 C THR A 12 -1.882 8.560 8.128 1.00 0.00 C ATOM 129 O THR A 12 -2.948 8.992 7.687 1.00 0.00 O ATOM 130 CB THR A 12 -0.049 9.516 9.526 1.00 0.00 C ATOM 131 OG1 THR A 12 0.738 8.356 9.820 1.00 0.00 O ATOM 132 CG2 THR A 12 -1.167 9.649 10.550 1.00 0.00 C ATOM 0 H THR A 12 -1.721 11.193 7.931 1.00 0.00 H new ATOM 0 HA THR A 12 0.118 8.948 7.451 1.00 0.00 H new ATOM 0 HB THR A 12 0.580 10.404 9.580 1.00 0.00 H new ATOM 0 HG1 THR A 12 1.100 8.428 10.728 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.738 9.717 11.550 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.746 10.548 10.341 1.00 0.00 H new ATOM 0 HG23 THR A 12 -1.818 8.777 10.493 1.00 0.00 H new ATOM 140 N ILE A 13 -1.755 7.345 8.651 1.00 0.00 N ATOM 141 CA ILE A 13 -2.885 6.429 8.738 1.00 0.00 C ATOM 142 C ILE A 13 -2.818 5.593 10.012 1.00 0.00 C ATOM 143 O ILE A 13 -1.737 5.343 10.545 1.00 0.00 O ATOM 144 CB ILE A 13 -2.942 5.487 7.521 1.00 0.00 C ATOM 145 CG1 ILE A 13 -3.487 6.229 6.299 1.00 0.00 C ATOM 146 CG2 ILE A 13 -3.798 4.269 7.834 1.00 0.00 C ATOM 147 CD1 ILE A 13 -3.244 5.505 4.994 1.00 0.00 C ATOM 0 H ILE A 13 -0.881 6.972 9.021 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.787 7.041 8.755 1.00 0.00 H new ATOM 0 HB ILE A 13 -1.931 5.148 7.295 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -4.559 6.383 6.426 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.027 7.216 6.249 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.829 3.613 6.964 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.370 3.731 8.680 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.810 4.589 8.083 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -3.657 6.089 4.172 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.172 5.375 4.844 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.727 4.529 5.024 1.00 0.00 H new ATOM 159 N GLU A 14 -3.980 5.162 10.492 1.00 0.00 N ATOM 160 CA GLU A 14 -4.052 4.352 11.703 1.00 0.00 C ATOM 161 C GLU A 14 -5.048 3.209 11.534 1.00 0.00 C ATOM 162 O GLU A 14 -6.121 3.386 10.959 1.00 0.00 O ATOM 163 CB GLU A 14 -4.451 5.219 12.899 1.00 0.00 C ATOM 164 CG GLU A 14 -4.151 4.576 14.243 1.00 0.00 C ATOM 165 CD GLU A 14 -2.771 4.929 14.763 1.00 0.00 C ATOM 166 OE1 GLU A 14 -1.797 4.804 13.992 1.00 0.00 O ATOM 167 OE2 GLU A 14 -2.665 5.330 15.941 1.00 0.00 O ATOM 0 H GLU A 14 -4.883 5.360 10.062 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.065 3.927 11.885 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.927 6.173 12.837 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.517 5.437 12.840 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.901 4.892 14.968 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -4.234 3.493 14.150 1.00 0.00 H new ATOM 174 N ALA A 15 -4.683 2.035 12.039 1.00 0.00 N ATOM 175 CA ALA A 15 -5.544 0.862 11.946 1.00 0.00 C ATOM 176 C ALA A 15 -6.451 0.749 13.167 1.00 0.00 C ATOM 177 O ALA A 15 -5.980 0.739 14.304 1.00 0.00 O ATOM 178 CB ALA A 15 -4.706 -0.397 11.791 1.00 0.00 C ATOM 0 H ALA A 15 -3.797 1.871 12.517 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.176 0.975 11.065 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.362 -1.265 11.723 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.105 -0.325 10.885 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.049 -0.506 12.654 1.00 0.00 H new ATOM 184 N VAL A 16 -7.756 0.666 12.924 1.00 0.00 N ATOM 185 CA VAL A 16 -8.729 0.553 14.003 1.00 0.00 C ATOM 186 C VAL A 16 -9.693 -0.602 13.756 1.00 0.00 C ATOM 187 O VAL A 16 -10.582 -0.530 12.908 1.00 0.00 O ATOM 188 CB VAL A 16 -9.536 1.854 14.169 1.00 0.00 C ATOM 189 CG1 VAL A 16 -10.571 1.703 15.274 1.00 0.00 C ATOM 190 CG2 VAL A 16 -8.607 3.024 14.455 1.00 0.00 C ATOM 0 H VAL A 16 -8.163 0.675 11.989 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.167 0.363 14.917 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.062 2.056 13.236 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.132 2.632 15.377 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.255 0.892 15.023 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.069 1.476 16.214 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.194 3.935 14.569 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.052 2.832 15.373 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.908 3.144 13.627 1.00 0.00 H new ATOM 200 N PRO A 17 -9.514 -1.694 14.514 1.00 0.00 N ATOM 201 CA PRO A 17 -8.459 -1.791 15.527 1.00 0.00 C ATOM 202 C PRO A 17 -7.068 -1.874 14.908 1.00 0.00 C ATOM 203 O PRO A 17 -6.914 -1.785 13.690 1.00 0.00 O ATOM 204 CB PRO A 17 -8.793 -3.089 16.265 1.00 0.00 C ATOM 205 CG PRO A 17 -9.556 -3.902 15.276 1.00 0.00 C ATOM 206 CD PRO A 17 -10.329 -2.918 14.441 1.00 0.00 C ATOM 0 HA PRO A 17 -8.432 -0.913 16.172 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -7.889 -3.605 16.588 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -9.386 -2.895 17.159 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -8.884 -4.496 14.657 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -10.226 -4.599 15.778 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.442 -3.265 13.414 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.332 -2.757 14.836 1.00 0.00 H new ATOM 214 N SER A 18 -6.057 -2.044 15.754 1.00 0.00 N ATOM 215 CA SER A 18 -4.678 -2.136 15.290 1.00 0.00 C ATOM 216 C SER A 18 -4.342 -3.561 14.863 1.00 0.00 C ATOM 217 O SER A 18 -3.453 -3.782 14.042 1.00 0.00 O ATOM 218 CB SER A 18 -3.716 -1.680 16.389 1.00 0.00 C ATOM 219 OG SER A 18 -2.451 -1.338 15.850 1.00 0.00 O ATOM 0 H SER A 18 -6.167 -2.121 16.765 1.00 0.00 H new ATOM 0 HA SER A 18 -4.567 -1.481 14.426 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.137 -0.821 16.911 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.598 -2.474 17.126 1.00 0.00 H new ATOM 0 HG SER A 18 -1.855 -1.049 16.572 1.00 0.00 H new ATOM 225 N ASN A 19 -5.061 -4.526 15.427 1.00 0.00 N ATOM 226 CA ASN A 19 -4.839 -5.932 15.106 1.00 0.00 C ATOM 227 C ASN A 19 -6.138 -6.725 15.210 1.00 0.00 C ATOM 228 O ASN A 19 -6.630 -6.989 16.307 1.00 0.00 O ATOM 229 CB ASN A 19 -3.787 -6.530 16.042 1.00 0.00 C ATOM 230 CG ASN A 19 -4.335 -6.803 17.429 1.00 0.00 C ATOM 231 OD1 ASN A 19 -4.454 -7.956 17.846 1.00 0.00 O ATOM 232 ND2 ASN A 19 -4.671 -5.741 18.152 1.00 0.00 N ATOM 0 H ASN A 19 -5.802 -4.361 16.108 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.478 -5.992 14.079 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.410 -7.459 15.614 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -2.941 -5.847 16.117 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.045 -5.862 19.093 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.555 -4.804 17.766 1.00 0.00 H new ATOM 239 N ALA A 20 -6.688 -7.102 14.061 1.00 0.00 N ATOM 240 CA ALA A 20 -7.929 -7.867 14.022 1.00 0.00 C ATOM 241 C ALA A 20 -7.655 -9.343 13.753 1.00 0.00 C ATOM 242 O ALA A 20 -6.582 -9.707 13.274 1.00 0.00 O ATOM 243 CB ALA A 20 -8.866 -7.300 12.966 1.00 0.00 C ATOM 0 H ALA A 20 -6.294 -6.890 13.144 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.408 -7.785 14.997 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.788 -7.881 12.948 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.096 -6.261 13.204 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.386 -7.351 11.989 1.00 0.00 H new ATOM 249 N ALA A 21 -8.633 -10.187 14.064 1.00 0.00 N ATOM 250 CA ALA A 21 -8.498 -11.623 13.854 1.00 0.00 C ATOM 251 C ALA A 21 -9.119 -12.045 12.527 1.00 0.00 C ATOM 252 O ALA A 21 -9.787 -11.252 11.864 1.00 0.00 O ATOM 253 CB ALA A 21 -9.136 -12.388 15.004 1.00 0.00 C ATOM 0 H ALA A 21 -9.527 -9.901 14.462 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.435 -11.861 13.820 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -9.027 -13.459 14.833 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.644 -12.118 15.938 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.195 -12.136 15.066 1.00 0.00 H new ATOM 259 N GLU A 22 -8.893 -13.298 12.144 1.00 0.00 N ATOM 260 CA GLU A 22 -9.431 -13.823 10.894 1.00 0.00 C ATOM 261 C GLU A 22 -10.954 -13.736 10.878 1.00 0.00 C ATOM 262 O GLU A 22 -11.632 -14.386 11.672 1.00 0.00 O ATOM 263 CB GLU A 22 -8.990 -15.275 10.694 1.00 0.00 C ATOM 264 CG GLU A 22 -7.677 -15.413 9.942 1.00 0.00 C ATOM 265 CD GLU A 22 -7.281 -16.860 9.721 1.00 0.00 C ATOM 266 OE1 GLU A 22 -7.221 -17.616 10.714 1.00 0.00 O ATOM 267 OE2 GLU A 22 -7.030 -17.237 8.558 1.00 0.00 O ATOM 0 H GLU A 22 -8.342 -13.968 12.681 1.00 0.00 H new ATOM 0 HA GLU A 22 -9.041 -13.216 10.077 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -8.893 -15.754 11.668 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -9.768 -15.811 10.151 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.760 -14.912 8.978 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.889 -14.905 10.498 1.00 0.00 H new ATOM 274 N GLY A 23 -11.485 -12.927 9.966 1.00 0.00 N ATOM 275 CA GLY A 23 -12.924 -12.768 9.863 1.00 0.00 C ATOM 276 C GLY A 23 -13.402 -11.441 10.418 1.00 0.00 C ATOM 277 O GLY A 23 -14.586 -11.114 10.333 1.00 0.00 O ATOM 0 H GLY A 23 -10.944 -12.379 9.297 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.221 -12.849 8.818 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.415 -13.580 10.398 1.00 0.00 H new ATOM 281 N LYS A 24 -12.480 -10.674 10.990 1.00 0.00 N ATOM 282 CA LYS A 24 -12.813 -9.375 11.562 1.00 0.00 C ATOM 283 C LYS A 24 -12.623 -8.263 10.534 1.00 0.00 C ATOM 284 O LYS A 24 -12.214 -8.517 9.402 1.00 0.00 O ATOM 285 CB LYS A 24 -11.946 -9.099 12.792 1.00 0.00 C ATOM 286 CG LYS A 24 -12.254 -10.008 13.970 1.00 0.00 C ATOM 287 CD LYS A 24 -13.587 -9.658 14.610 1.00 0.00 C ATOM 288 CE LYS A 24 -13.942 -10.631 15.724 1.00 0.00 C ATOM 289 NZ LYS A 24 -13.204 -10.329 16.981 1.00 0.00 N ATOM 0 H LYS A 24 -11.496 -10.930 11.070 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.861 -9.395 11.861 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.897 -9.214 12.520 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -12.084 -8.062 13.098 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.271 -11.045 13.636 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -11.460 -9.925 14.712 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -13.545 -8.645 15.010 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -14.370 -9.669 13.852 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -15.015 -10.590 15.914 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.714 -11.648 15.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.474 -11.014 17.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -12.181 -10.393 16.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.441 -9.368 17.300 1.00 0.00 H new ATOM 303 N GLU A 25 -12.922 -7.032 10.938 1.00 0.00 N ATOM 304 CA GLU A 25 -12.783 -5.883 10.052 1.00 0.00 C ATOM 305 C GLU A 25 -11.782 -4.879 10.615 1.00 0.00 C ATOM 306 O GLU A 25 -11.563 -4.815 11.825 1.00 0.00 O ATOM 307 CB GLU A 25 -14.139 -5.206 9.843 1.00 0.00 C ATOM 308 CG GLU A 25 -15.261 -6.177 9.518 1.00 0.00 C ATOM 309 CD GLU A 25 -15.963 -6.693 10.759 1.00 0.00 C ATOM 310 OE1 GLU A 25 -15.503 -6.378 11.876 1.00 0.00 O ATOM 311 OE2 GLU A 25 -16.973 -7.413 10.612 1.00 0.00 O ATOM 0 H GLU A 25 -13.262 -6.806 11.873 1.00 0.00 H new ATOM 0 HA GLU A 25 -12.411 -6.240 9.092 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -14.401 -4.650 10.743 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -14.052 -4.480 9.034 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -15.988 -5.684 8.872 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -14.856 -7.019 8.957 1.00 0.00 H new ATOM 318 N VAL A 26 -11.175 -4.096 9.729 1.00 0.00 N ATOM 319 CA VAL A 26 -10.197 -3.094 10.136 1.00 0.00 C ATOM 320 C VAL A 26 -10.419 -1.778 9.399 1.00 0.00 C ATOM 321 O VAL A 26 -10.384 -1.729 8.169 1.00 0.00 O ATOM 322 CB VAL A 26 -8.758 -3.578 9.879 1.00 0.00 C ATOM 323 CG1 VAL A 26 -7.756 -2.499 10.261 1.00 0.00 C ATOM 324 CG2 VAL A 26 -8.485 -4.866 10.640 1.00 0.00 C ATOM 0 H VAL A 26 -11.343 -4.136 8.724 1.00 0.00 H new ATOM 0 HA VAL A 26 -10.333 -2.935 11.206 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.646 -3.783 8.814 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.744 -2.859 10.073 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.940 -1.605 9.666 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.865 -2.259 11.319 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.463 -5.193 10.447 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.614 -4.692 11.708 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.182 -5.637 10.311 1.00 0.00 H new ATOM 334 N LEU A 27 -10.647 -0.713 10.159 1.00 0.00 N ATOM 335 CA LEU A 27 -10.875 0.606 9.579 1.00 0.00 C ATOM 336 C LEU A 27 -9.604 1.449 9.628 1.00 0.00 C ATOM 337 O LEU A 27 -9.202 1.923 10.691 1.00 0.00 O ATOM 338 CB LEU A 27 -12.005 1.323 10.319 1.00 0.00 C ATOM 339 CG LEU A 27 -12.129 2.825 10.062 1.00 0.00 C ATOM 340 CD1 LEU A 27 -12.942 3.086 8.804 1.00 0.00 C ATOM 341 CD2 LEU A 27 -12.759 3.521 11.260 1.00 0.00 C ATOM 0 H LEU A 27 -10.679 -0.737 11.178 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.161 0.472 8.536 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -12.948 0.849 10.047 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.867 1.168 11.389 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.129 3.233 9.915 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -13.020 4.160 8.637 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.450 2.621 7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.940 2.664 8.922 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.839 4.589 11.059 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.752 3.110 11.439 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -12.137 3.363 12.141 1.00 0.00 H new ATOM 353 N LEU A 28 -8.979 1.634 8.471 1.00 0.00 N ATOM 354 CA LEU A 28 -7.754 2.423 8.381 1.00 0.00 C ATOM 355 C LEU A 28 -8.071 3.911 8.280 1.00 0.00 C ATOM 356 O LEU A 28 -8.379 4.420 7.202 1.00 0.00 O ATOM 357 CB LEU A 28 -6.929 1.983 7.170 1.00 0.00 C ATOM 358 CG LEU A 28 -6.465 0.526 7.168 1.00 0.00 C ATOM 359 CD1 LEU A 28 -5.984 0.120 5.784 1.00 0.00 C ATOM 360 CD2 LEU A 28 -5.365 0.315 8.199 1.00 0.00 C ATOM 0 H LEU A 28 -9.299 1.249 7.582 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.175 2.254 9.289 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.520 2.157 6.271 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.050 2.624 7.102 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.313 -0.105 7.435 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.658 -0.920 5.803 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.798 0.232 5.068 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.150 0.756 5.487 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.047 -0.727 8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.516 0.957 7.962 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.743 0.564 9.190 1.00 0.00 H new ATOM 372 N LEU A 29 -7.992 4.605 9.410 1.00 0.00 N ATOM 373 CA LEU A 29 -8.268 6.037 9.450 1.00 0.00 C ATOM 374 C LEU A 29 -7.120 6.830 8.836 1.00 0.00 C ATOM 375 O LEU A 29 -6.006 6.325 8.698 1.00 0.00 O ATOM 376 CB LEU A 29 -8.503 6.491 10.892 1.00 0.00 C ATOM 377 CG LEU A 29 -9.949 6.435 11.386 1.00 0.00 C ATOM 378 CD1 LEU A 29 -10.005 6.621 12.894 1.00 0.00 C ATOM 379 CD2 LEU A 29 -10.794 7.490 10.686 1.00 0.00 C ATOM 0 H LEU A 29 -7.739 4.199 10.311 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.168 6.225 8.865 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.891 5.874 11.550 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.145 7.516 10.992 1.00 0.00 H new ATOM 0 HG LEU A 29 -10.357 5.453 11.145 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.042 6.578 13.228 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.435 5.829 13.380 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.579 7.589 13.157 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -11.820 7.435 11.050 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -10.387 8.479 10.895 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.781 7.312 9.611 1.00 0.00 H new ATOM 391 N VAL A 30 -7.398 8.078 8.470 1.00 0.00 N ATOM 392 CA VAL A 30 -6.387 8.943 7.873 1.00 0.00 C ATOM 393 C VAL A 30 -6.338 10.295 8.574 1.00 0.00 C ATOM 394 O VAL A 30 -7.316 11.045 8.571 1.00 0.00 O ATOM 395 CB VAL A 30 -6.653 9.164 6.372 1.00 0.00 C ATOM 396 CG1 VAL A 30 -5.421 9.739 5.690 1.00 0.00 C ATOM 397 CG2 VAL A 30 -7.082 7.864 5.710 1.00 0.00 C ATOM 0 H VAL A 30 -8.315 8.512 8.577 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.428 8.440 7.994 1.00 0.00 H new ATOM 0 HB VAL A 30 -7.465 9.883 6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.628 9.888 4.630 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.164 10.694 6.148 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.586 9.047 5.803 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.266 8.039 4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.293 7.120 5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.995 7.500 6.181 1.00 0.00 H new ATOM 407 N HIS A 31 -5.193 10.603 9.176 1.00 0.00 N ATOM 408 CA HIS A 31 -5.016 11.867 9.881 1.00 0.00 C ATOM 409 C HIS A 31 -4.157 12.828 9.066 1.00 0.00 C ATOM 410 O HIS A 31 -3.532 12.435 8.082 1.00 0.00 O ATOM 411 CB HIS A 31 -4.376 11.627 11.249 1.00 0.00 C ATOM 412 CG HIS A 31 -4.899 10.411 11.950 1.00 0.00 C ATOM 413 ND1 HIS A 31 -6.215 10.276 12.341 1.00 0.00 N ATOM 414 CD2 HIS A 31 -4.276 9.271 12.329 1.00 0.00 C ATOM 415 CE1 HIS A 31 -6.378 9.106 12.931 1.00 0.00 C ATOM 416 NE2 HIS A 31 -5.217 8.476 12.937 1.00 0.00 N ATOM 0 H HIS A 31 -4.375 9.994 9.189 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.999 12.317 10.022 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -3.298 11.529 11.124 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -4.546 12.500 11.879 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -6.947 10.971 12.197 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -3.233 9.031 12.181 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -7.304 8.728 13.339 1.00 0.00 H new ATOM 425 N ASN A 32 -4.131 14.090 9.482 1.00 0.00 N ATOM 426 CA ASN A 32 -3.349 15.108 8.789 1.00 0.00 C ATOM 427 C ASN A 32 -3.715 15.160 7.309 1.00 0.00 C ATOM 428 O ASN A 32 -2.906 15.563 6.472 1.00 0.00 O ATOM 429 CB ASN A 32 -1.854 14.827 8.947 1.00 0.00 C ATOM 430 CG ASN A 32 -1.411 14.851 10.397 1.00 0.00 C ATOM 431 OD1 ASN A 32 -1.747 15.769 11.146 1.00 0.00 O ATOM 432 ND2 ASN A 32 -0.652 13.839 10.801 1.00 0.00 N ATOM 0 H ASN A 32 -4.642 14.432 10.295 1.00 0.00 H new ATOM 0 HA ASN A 32 -3.579 16.075 9.236 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -1.623 13.853 8.515 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.286 15.568 8.384 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -0.324 13.801 11.766 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -0.397 13.099 10.146 1.00 0.00 H new ATOM 439 N LEU A 33 -4.938 14.751 6.992 1.00 0.00 N ATOM 440 CA LEU A 33 -5.413 14.752 5.613 1.00 0.00 C ATOM 441 C LEU A 33 -5.183 16.111 4.959 1.00 0.00 C ATOM 442 O LEU A 33 -4.992 17.126 5.629 1.00 0.00 O ATOM 443 CB LEU A 33 -6.899 14.394 5.564 1.00 0.00 C ATOM 444 CG LEU A 33 -7.228 12.904 5.474 1.00 0.00 C ATOM 445 CD1 LEU A 33 -8.718 12.673 5.673 1.00 0.00 C ATOM 446 CD2 LEU A 33 -6.773 12.337 4.137 1.00 0.00 C ATOM 0 H LEU A 33 -5.620 14.414 7.672 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.847 14.003 5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.379 14.798 6.455 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.345 14.897 4.706 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.691 12.385 6.268 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.933 11.607 5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.015 13.042 6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.275 13.205 4.902 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.015 11.275 4.091 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -7.281 12.861 3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.696 12.468 4.034 1.00 0.00 H new ATOM 458 N PRO A 34 -5.204 16.133 3.618 1.00 0.00 N ATOM 459 CA PRO A 34 -5.002 17.361 2.843 1.00 0.00 C ATOM 460 C PRO A 34 -6.174 18.328 2.975 1.00 0.00 C ATOM 461 O PRO A 34 -7.071 18.122 3.791 1.00 0.00 O ATOM 462 CB PRO A 34 -4.884 16.857 1.403 1.00 0.00 C ATOM 463 CG PRO A 34 -5.626 15.565 1.392 1.00 0.00 C ATOM 464 CD PRO A 34 -5.425 14.961 2.754 1.00 0.00 C ATOM 0 HA PRO A 34 -4.131 17.921 3.185 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -5.316 17.568 0.698 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -3.842 16.717 1.117 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.685 15.725 1.188 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.247 14.904 0.612 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.295 14.386 3.071 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -4.572 14.283 2.771 1.00 0.00 H new ATOM 472 N GLN A 35 -6.158 19.383 2.167 1.00 0.00 N ATOM 473 CA GLN A 35 -7.220 20.382 2.194 1.00 0.00 C ATOM 474 C GLN A 35 -8.364 19.986 1.266 1.00 0.00 C ATOM 475 O GLN A 35 -9.517 19.900 1.688 1.00 0.00 O ATOM 476 CB GLN A 35 -6.671 21.752 1.792 1.00 0.00 C ATOM 477 CG GLN A 35 -6.081 21.784 0.392 1.00 0.00 C ATOM 478 CD GLN A 35 -5.229 23.013 0.145 1.00 0.00 C ATOM 479 OE1 GLN A 35 -4.226 23.234 0.826 1.00 0.00 O ATOM 480 NE2 GLN A 35 -5.623 23.821 -0.832 1.00 0.00 N ATOM 0 H GLN A 35 -5.422 19.568 1.486 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.606 20.438 3.212 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -7.472 22.488 1.857 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.905 22.051 2.507 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.477 20.890 0.236 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -6.889 21.754 -0.339 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.460 23.599 -1.371 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.089 24.664 -1.044 1.00 0.00 H new ATOM 489 N ASP A 36 -8.036 19.748 0.001 1.00 0.00 N ATOM 490 CA ASP A 36 -9.036 19.361 -0.988 1.00 0.00 C ATOM 491 C ASP A 36 -8.630 18.071 -1.695 1.00 0.00 C ATOM 492 O ASP A 36 -8.014 18.086 -2.761 1.00 0.00 O ATOM 493 CB ASP A 36 -9.230 20.479 -2.013 1.00 0.00 C ATOM 494 CG ASP A 36 -10.025 21.644 -1.456 1.00 0.00 C ATOM 495 OD1 ASP A 36 -11.040 21.397 -0.771 1.00 0.00 O ATOM 496 OD2 ASP A 36 -9.631 22.803 -1.703 1.00 0.00 O ATOM 0 H ASP A 36 -7.086 19.816 -0.364 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.978 19.188 -0.468 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -8.255 20.835 -2.347 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -9.741 20.080 -2.889 1.00 0.00 H new ATOM 501 N PRO A 37 -8.982 16.928 -1.088 1.00 0.00 N ATOM 502 CA PRO A 37 -8.664 15.608 -1.641 1.00 0.00 C ATOM 503 C PRO A 37 -9.465 15.300 -2.902 1.00 0.00 C ATOM 504 O PRO A 37 -10.466 14.585 -2.853 1.00 0.00 O ATOM 505 CB PRO A 37 -9.052 14.648 -0.513 1.00 0.00 C ATOM 506 CG PRO A 37 -10.087 15.380 0.268 1.00 0.00 C ATOM 507 CD PRO A 37 -9.717 16.836 0.185 1.00 0.00 C ATOM 0 HA PRO A 37 -7.619 15.533 -1.942 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.444 13.711 -0.908 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -8.191 14.398 0.107 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -11.081 15.206 -0.143 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.107 15.041 1.304 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -10.599 17.476 0.187 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.099 17.143 1.029 1.00 0.00 H new ATOM 515 N ARG A 38 -9.017 15.843 -4.029 1.00 0.00 N ATOM 516 CA ARG A 38 -9.692 15.626 -5.303 1.00 0.00 C ATOM 517 C ARG A 38 -10.197 14.190 -5.413 1.00 0.00 C ATOM 518 O ARG A 38 -11.223 13.928 -6.038 1.00 0.00 O ATOM 519 CB ARG A 38 -8.747 15.936 -6.465 1.00 0.00 C ATOM 520 CG ARG A 38 -9.459 16.123 -7.795 1.00 0.00 C ATOM 521 CD ARG A 38 -8.490 16.540 -8.891 1.00 0.00 C ATOM 522 NE ARG A 38 -8.975 16.172 -10.219 1.00 0.00 N ATOM 523 CZ ARG A 38 -9.912 16.848 -10.873 1.00 0.00 C ATOM 524 NH1 ARG A 38 -10.463 17.923 -10.325 1.00 0.00 N ATOM 525 NH2 ARG A 38 -10.300 16.451 -12.078 1.00 0.00 N ATOM 0 H ARG A 38 -8.189 16.437 -4.086 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.548 16.299 -5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.184 16.840 -6.233 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -8.024 15.126 -6.560 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -9.953 15.194 -8.079 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -10.238 16.878 -7.689 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -8.335 17.618 -8.847 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -7.521 16.072 -8.716 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.571 15.350 -10.669 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -10.167 18.232 -9.399 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -11.183 18.441 -10.830 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -9.878 15.625 -12.503 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -11.020 16.971 -12.579 1.00 0.00 H new ATOM 539 N GLY A 39 -9.467 13.263 -4.800 1.00 0.00 N ATOM 540 CA GLY A 39 -9.856 11.865 -4.842 1.00 0.00 C ATOM 541 C GLY A 39 -8.863 10.966 -4.133 1.00 0.00 C ATOM 542 O GLY A 39 -7.675 11.278 -4.059 1.00 0.00 O ATOM 0 H GLY A 39 -8.614 13.455 -4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -10.838 11.750 -4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -9.951 11.548 -5.881 1.00 0.00 H new ATOM 546 N TYR A 40 -9.351 9.847 -3.609 1.00 0.00 N ATOM 547 CA TYR A 40 -8.499 8.901 -2.898 1.00 0.00 C ATOM 548 C TYR A 40 -8.177 7.694 -3.773 1.00 0.00 C ATOM 549 O TYR A 40 -8.965 7.311 -4.637 1.00 0.00 O ATOM 550 CB TYR A 40 -9.177 8.442 -1.606 1.00 0.00 C ATOM 551 CG TYR A 40 -9.815 9.568 -0.824 1.00 0.00 C ATOM 552 CD1 TYR A 40 -9.059 10.641 -0.371 1.00 0.00 C ATOM 553 CD2 TYR A 40 -11.176 9.558 -0.540 1.00 0.00 C ATOM 554 CE1 TYR A 40 -9.638 11.671 0.344 1.00 0.00 C ATOM 555 CE2 TYR A 40 -11.764 10.585 0.173 1.00 0.00 C ATOM 556 CZ TYR A 40 -10.991 11.639 0.614 1.00 0.00 C ATOM 557 OH TYR A 40 -11.572 12.664 1.324 1.00 0.00 O ATOM 0 H TYR A 40 -10.332 9.573 -3.663 1.00 0.00 H new ATOM 0 HA TYR A 40 -7.566 9.407 -2.650 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -9.939 7.702 -1.849 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -8.440 7.945 -0.975 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -8.000 10.671 -0.581 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.784 8.734 -0.883 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -9.035 12.497 0.690 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.823 10.563 0.384 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.432 12.364 1.687 1.00 0.00 H new ATOM 567 N ASN A 41 -7.012 7.097 -3.542 1.00 0.00 N ATOM 568 CA ASN A 41 -6.583 5.933 -4.309 1.00 0.00 C ATOM 569 C ASN A 41 -5.777 4.975 -3.438 1.00 0.00 C ATOM 570 O ASN A 41 -4.615 5.233 -3.124 1.00 0.00 O ATOM 571 CB ASN A 41 -5.749 6.369 -5.515 1.00 0.00 C ATOM 572 CG ASN A 41 -6.133 7.748 -6.015 1.00 0.00 C ATOM 573 OD1 ASN A 41 -5.836 8.757 -5.376 1.00 0.00 O ATOM 574 ND2 ASN A 41 -6.796 7.797 -7.165 1.00 0.00 N ATOM 0 H ASN A 41 -6.348 7.400 -2.830 1.00 0.00 H new ATOM 0 HA ASN A 41 -7.474 5.413 -4.662 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -4.693 6.365 -5.244 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -5.874 5.645 -6.321 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -7.080 8.697 -7.552 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -7.021 6.935 -7.661 1.00 0.00 H new ATOM 581 N TRP A 42 -6.401 3.868 -3.051 1.00 0.00 N ATOM 582 CA TRP A 42 -5.741 2.870 -2.217 1.00 0.00 C ATOM 583 C TRP A 42 -5.031 1.827 -3.073 1.00 0.00 C ATOM 584 O TRP A 42 -5.481 1.504 -4.173 1.00 0.00 O ATOM 585 CB TRP A 42 -6.758 2.189 -1.300 1.00 0.00 C ATOM 586 CG TRP A 42 -7.178 3.041 -0.141 1.00 0.00 C ATOM 587 CD1 TRP A 42 -8.202 3.944 -0.116 1.00 0.00 C ATOM 588 CD2 TRP A 42 -6.583 3.070 1.161 1.00 0.00 C ATOM 589 NE1 TRP A 42 -8.279 4.534 1.123 1.00 0.00 N ATOM 590 CE2 TRP A 42 -7.297 4.014 1.924 1.00 0.00 C ATOM 591 CE3 TRP A 42 -5.517 2.390 1.756 1.00 0.00 C ATOM 592 CZ2 TRP A 42 -6.978 4.293 3.250 1.00 0.00 C ATOM 593 CZ3 TRP A 42 -5.201 2.669 3.072 1.00 0.00 C ATOM 594 CH2 TRP A 42 -5.930 3.613 3.808 1.00 0.00 C ATOM 0 H TRP A 42 -7.363 3.639 -3.301 1.00 0.00 H new ATOM 0 HA TRP A 42 -4.995 3.379 -1.606 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -7.639 1.921 -1.883 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -6.331 1.260 -0.923 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -8.855 4.163 -0.948 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -8.957 5.244 1.401 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.950 1.660 1.197 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -7.538 5.021 3.818 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -4.378 2.151 3.541 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.659 3.807 4.835 1.00 0.00 H new ATOM 605 N TYR A 43 -3.922 1.305 -2.563 1.00 0.00 N ATOM 606 CA TYR A 43 -3.149 0.300 -3.283 1.00 0.00 C ATOM 607 C TYR A 43 -2.635 -0.776 -2.332 1.00 0.00 C ATOM 608 O TYR A 43 -2.856 -0.711 -1.123 1.00 0.00 O ATOM 609 CB TYR A 43 -1.975 0.955 -4.013 1.00 0.00 C ATOM 610 CG TYR A 43 -2.381 2.116 -4.893 1.00 0.00 C ATOM 611 CD1 TYR A 43 -2.473 3.403 -4.379 1.00 0.00 C ATOM 612 CD2 TYR A 43 -2.673 1.925 -6.238 1.00 0.00 C ATOM 613 CE1 TYR A 43 -2.844 4.467 -5.179 1.00 0.00 C ATOM 614 CE2 TYR A 43 -3.043 2.982 -7.045 1.00 0.00 C ATOM 615 CZ TYR A 43 -3.128 4.251 -6.512 1.00 0.00 C ATOM 616 OH TYR A 43 -3.498 5.307 -7.313 1.00 0.00 O ATOM 0 H TYR A 43 -3.538 1.561 -1.654 1.00 0.00 H new ATOM 0 HA TYR A 43 -3.805 -0.171 -4.015 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -1.250 1.304 -3.278 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -1.474 0.205 -4.624 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.251 3.575 -3.336 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -2.609 0.933 -6.659 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.911 5.462 -4.763 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -3.265 2.816 -8.089 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.662 4.985 -8.224 1.00 0.00 H new ATOM 626 N LYS A 44 -1.945 -1.767 -2.888 1.00 0.00 N ATOM 627 CA LYS A 44 -1.396 -2.858 -2.091 1.00 0.00 C ATOM 628 C LYS A 44 0.128 -2.876 -2.171 1.00 0.00 C ATOM 629 O LYS A 44 0.705 -2.712 -3.245 1.00 0.00 O ATOM 630 CB LYS A 44 -1.958 -4.199 -2.569 1.00 0.00 C ATOM 631 CG LYS A 44 -1.540 -5.376 -1.705 1.00 0.00 C ATOM 632 CD LYS A 44 -2.255 -6.652 -2.117 1.00 0.00 C ATOM 633 CE LYS A 44 -1.645 -7.874 -1.448 1.00 0.00 C ATOM 634 NZ LYS A 44 -1.900 -7.889 0.019 1.00 0.00 N ATOM 0 H LYS A 44 -1.753 -1.837 -3.887 1.00 0.00 H new ATOM 0 HA LYS A 44 -1.687 -2.699 -1.053 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -3.046 -4.141 -2.588 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.630 -4.376 -3.593 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -0.462 -5.521 -1.782 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -1.758 -5.157 -0.660 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.310 -6.580 -1.853 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -2.204 -6.765 -3.200 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.057 -8.778 -1.897 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.570 -7.889 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -1.468 -8.737 0.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.485 -7.040 0.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.925 -7.901 0.193 1.00 0.00 H new ATOM 648 N GLY A 45 0.773 -3.077 -1.026 1.00 0.00 N ATOM 649 CA GLY A 45 2.223 -3.114 -0.988 1.00 0.00 C ATOM 650 C GLY A 45 2.810 -2.003 -0.140 1.00 0.00 C ATOM 651 O GLY A 45 2.174 -1.531 0.801 1.00 0.00 O ATOM 0 H GLY A 45 0.317 -3.215 -0.124 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.548 -4.077 -0.595 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.612 -3.036 -2.003 1.00 0.00 H new ATOM 655 N GLU A 46 4.028 -1.587 -0.473 1.00 0.00 N ATOM 656 CA GLU A 46 4.701 -0.526 0.268 1.00 0.00 C ATOM 657 C GLU A 46 5.022 0.655 -0.643 1.00 0.00 C ATOM 658 O GLU A 46 5.992 1.380 -0.421 1.00 0.00 O ATOM 659 CB GLU A 46 5.986 -1.056 0.906 1.00 0.00 C ATOM 660 CG GLU A 46 5.744 -1.947 2.114 1.00 0.00 C ATOM 661 CD GLU A 46 6.992 -2.145 2.952 1.00 0.00 C ATOM 662 OE1 GLU A 46 7.396 -1.190 3.648 1.00 0.00 O ATOM 663 OE2 GLU A 46 7.565 -3.253 2.912 1.00 0.00 O ATOM 0 H GLU A 46 4.568 -1.968 -1.250 1.00 0.00 H new ATOM 0 HA GLU A 46 4.028 -0.183 1.054 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.548 -1.616 0.159 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.607 -0.212 1.206 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.961 -1.509 2.733 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.379 -2.917 1.778 1.00 0.00 H new ATOM 670 N THR A 47 4.200 0.842 -1.672 1.00 0.00 N ATOM 671 CA THR A 47 4.396 1.932 -2.618 1.00 0.00 C ATOM 672 C THR A 47 3.240 2.015 -3.609 1.00 0.00 C ATOM 673 O THR A 47 2.385 1.131 -3.656 1.00 0.00 O ATOM 674 CB THR A 47 5.715 1.769 -3.398 1.00 0.00 C ATOM 675 OG1 THR A 47 5.603 2.388 -4.684 1.00 0.00 O ATOM 676 CG2 THR A 47 6.066 0.299 -3.566 1.00 0.00 C ATOM 0 H THR A 47 3.392 0.252 -1.870 1.00 0.00 H new ATOM 0 HA THR A 47 4.438 2.852 -2.035 1.00 0.00 H new ATOM 0 HB THR A 47 6.510 2.253 -2.830 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.446 2.282 -5.173 1.00 0.00 H new ATOM 0 HG21 THR A 47 7.001 0.209 -4.119 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.179 -0.162 -2.585 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.270 -0.205 -4.114 1.00 0.00 H new ATOM 684 N VAL A 48 3.221 3.083 -4.400 1.00 0.00 N ATOM 685 CA VAL A 48 2.170 3.281 -5.392 1.00 0.00 C ATOM 686 C VAL A 48 2.241 2.222 -6.486 1.00 0.00 C ATOM 687 O VAL A 48 3.120 2.262 -7.347 1.00 0.00 O ATOM 688 CB VAL A 48 2.262 4.676 -6.036 1.00 0.00 C ATOM 689 CG1 VAL A 48 1.210 4.833 -7.123 1.00 0.00 C ATOM 690 CG2 VAL A 48 2.115 5.762 -4.980 1.00 0.00 C ATOM 0 H VAL A 48 3.921 3.824 -4.373 1.00 0.00 H new ATOM 0 HA VAL A 48 1.219 3.194 -4.867 1.00 0.00 H new ATOM 0 HB VAL A 48 3.244 4.780 -6.497 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.291 5.825 -7.567 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.367 4.077 -7.893 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.218 4.709 -6.690 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.183 6.741 -5.453 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.147 5.663 -4.488 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.910 5.661 -4.241 1.00 0.00 H new ATOM 700 N ASP A 49 1.310 1.275 -6.447 1.00 0.00 N ATOM 701 CA ASP A 49 1.265 0.205 -7.436 1.00 0.00 C ATOM 702 C ASP A 49 -0.050 0.235 -8.210 1.00 0.00 C ATOM 703 O ASP A 49 -1.078 -0.235 -7.724 1.00 0.00 O ATOM 704 CB ASP A 49 1.440 -1.154 -6.757 1.00 0.00 C ATOM 705 CG ASP A 49 2.895 -1.571 -6.663 1.00 0.00 C ATOM 706 OD1 ASP A 49 3.695 -1.131 -7.515 1.00 0.00 O ATOM 707 OD2 ASP A 49 3.234 -2.335 -5.736 1.00 0.00 O ATOM 0 H ASP A 49 0.576 1.227 -5.740 1.00 0.00 H new ATOM 0 HA ASP A 49 2.084 0.359 -8.139 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.011 -1.115 -5.756 1.00 0.00 H new ATOM 0 HB3 ASP A 49 0.884 -1.909 -7.313 1.00 0.00 H new ATOM 712 N ALA A 50 -0.008 0.791 -9.416 1.00 0.00 N ATOM 713 CA ALA A 50 -1.195 0.881 -10.257 1.00 0.00 C ATOM 714 C ALA A 50 -1.691 -0.504 -10.657 1.00 0.00 C ATOM 715 O ALA A 50 -2.864 -0.683 -10.983 1.00 0.00 O ATOM 716 CB ALA A 50 -0.902 1.716 -11.495 1.00 0.00 C ATOM 0 H ALA A 50 0.835 1.186 -9.833 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.982 1.368 -9.681 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.797 1.775 -12.114 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.602 2.720 -11.194 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.097 1.252 -12.065 1.00 0.00 H new ATOM 722 N ASN A 51 -0.791 -1.481 -10.629 1.00 0.00 N ATOM 723 CA ASN A 51 -1.138 -2.851 -10.990 1.00 0.00 C ATOM 724 C ASN A 51 -1.906 -3.533 -9.861 1.00 0.00 C ATOM 725 O ASN A 51 -2.612 -4.516 -10.083 1.00 0.00 O ATOM 726 CB ASN A 51 0.125 -3.650 -11.317 1.00 0.00 C ATOM 727 CG ASN A 51 0.854 -3.107 -12.532 1.00 0.00 C ATOM 728 OD1 ASN A 51 2.031 -2.755 -12.457 1.00 0.00 O ATOM 729 ND2 ASN A 51 0.154 -3.038 -13.659 1.00 0.00 N ATOM 0 H ASN A 51 0.184 -1.350 -10.360 1.00 0.00 H new ATOM 0 HA ASN A 51 -1.777 -2.817 -11.872 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.795 -3.634 -10.457 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -0.143 -4.692 -11.493 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.590 -2.682 -14.509 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -0.820 -3.341 -13.674 1.00 0.00 H new ATOM 736 N ARG A 52 -1.763 -3.002 -8.651 1.00 0.00 N ATOM 737 CA ARG A 52 -2.442 -3.559 -7.488 1.00 0.00 C ATOM 738 C ARG A 52 -3.474 -2.578 -6.939 1.00 0.00 C ATOM 739 O ARG A 52 -3.902 -2.690 -5.790 1.00 0.00 O ATOM 740 CB ARG A 52 -1.428 -3.911 -6.398 1.00 0.00 C ATOM 741 CG ARG A 52 -0.352 -4.882 -6.858 1.00 0.00 C ATOM 742 CD ARG A 52 -0.904 -6.289 -7.020 1.00 0.00 C ATOM 743 NE ARG A 52 0.141 -7.303 -6.907 1.00 0.00 N ATOM 744 CZ ARG A 52 0.911 -7.682 -7.921 1.00 0.00 C ATOM 745 NH1 ARG A 52 0.754 -7.133 -9.117 1.00 0.00 N ATOM 746 NH2 ARG A 52 1.840 -8.611 -7.739 1.00 0.00 N ATOM 0 H ARG A 52 -1.183 -2.187 -8.451 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.958 -4.466 -7.801 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.953 -2.995 -6.046 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.956 -4.343 -5.548 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.065 -4.542 -7.806 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.464 -4.891 -6.136 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.667 -6.469 -6.262 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.392 -6.378 -7.991 1.00 0.00 H new ATOM 0 HE ARG A 52 0.288 -7.745 -5.999 1.00 0.00 H new ATOM 0 HH11 ARG A 52 0.041 -6.418 -9.260 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.346 -7.425 -9.894 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.964 -9.035 -6.820 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.431 -8.901 -8.518 1.00 0.00 H new ATOM 760 N ARG A 53 -3.869 -1.618 -7.768 1.00 0.00 N ATOM 761 CA ARG A 53 -4.849 -0.616 -7.366 1.00 0.00 C ATOM 762 C ARG A 53 -6.081 -1.276 -6.755 1.00 0.00 C ATOM 763 O ARG A 53 -6.958 -1.760 -7.472 1.00 0.00 O ATOM 764 CB ARG A 53 -5.257 0.240 -8.566 1.00 0.00 C ATOM 765 CG ARG A 53 -6.231 1.353 -8.217 1.00 0.00 C ATOM 766 CD ARG A 53 -6.164 2.489 -9.226 1.00 0.00 C ATOM 767 NE ARG A 53 -6.582 2.062 -10.559 1.00 0.00 N ATOM 768 CZ ARG A 53 -6.682 2.885 -11.597 1.00 0.00 C ATOM 769 NH1 ARG A 53 -6.395 4.172 -11.456 1.00 0.00 N ATOM 770 NH2 ARG A 53 -7.070 2.421 -12.778 1.00 0.00 N ATOM 0 H ARG A 53 -3.525 -1.513 -8.723 1.00 0.00 H new ATOM 0 HA ARG A 53 -4.390 0.024 -6.613 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -4.363 0.677 -9.010 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -5.708 -0.402 -9.323 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -7.245 0.954 -8.184 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -6.006 1.736 -7.221 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.800 3.309 -8.892 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -5.145 2.874 -9.271 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.810 1.078 -10.701 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -6.097 4.532 -10.549 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -6.472 4.802 -12.254 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -7.292 1.432 -12.889 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -7.147 3.054 -13.574 1.00 0.00 H new ATOM 784 N ILE A 54 -6.140 -1.293 -5.427 1.00 0.00 N ATOM 785 CA ILE A 54 -7.265 -1.893 -4.721 1.00 0.00 C ATOM 786 C ILE A 54 -8.581 -1.232 -5.120 1.00 0.00 C ATOM 787 O ILE A 54 -9.515 -1.903 -5.558 1.00 0.00 O ATOM 788 CB ILE A 54 -7.093 -1.786 -3.194 1.00 0.00 C ATOM 789 CG1 ILE A 54 -5.824 -2.516 -2.750 1.00 0.00 C ATOM 790 CG2 ILE A 54 -8.313 -2.351 -2.482 1.00 0.00 C ATOM 791 CD1 ILE A 54 -5.253 -1.998 -1.448 1.00 0.00 C ATOM 0 H ILE A 54 -5.422 -0.898 -4.819 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.289 -2.945 -5.003 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.997 -0.734 -2.927 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.044 -3.578 -2.644 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -5.069 -2.423 -3.531 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.176 -2.268 -1.404 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -9.200 -1.791 -2.779 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.439 -3.399 -2.752 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.355 -2.561 -1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.001 -0.943 -1.555 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.991 -2.116 -0.655 1.00 0.00 H new ATOM 803 N ILE A 55 -8.645 0.086 -4.967 1.00 0.00 N ATOM 804 CA ILE A 55 -9.845 0.837 -5.315 1.00 0.00 C ATOM 805 C ILE A 55 -9.571 2.337 -5.324 1.00 0.00 C ATOM 806 O ILE A 55 -8.798 2.843 -4.511 1.00 0.00 O ATOM 807 CB ILE A 55 -10.996 0.543 -4.335 1.00 0.00 C ATOM 808 CG1 ILE A 55 -12.310 1.114 -4.873 1.00 0.00 C ATOM 809 CG2 ILE A 55 -10.684 1.119 -2.962 1.00 0.00 C ATOM 810 CD1 ILE A 55 -13.535 0.372 -4.387 1.00 0.00 C ATOM 0 H ILE A 55 -7.881 0.656 -4.605 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.139 0.518 -6.315 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.104 -0.537 -4.237 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.389 2.161 -4.580 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.289 1.089 -5.963 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -11.507 0.903 -2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -9.768 0.669 -2.578 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.553 2.198 -3.041 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -14.429 0.831 -4.808 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -13.479 -0.670 -4.703 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -13.581 0.419 -3.299 1.00 0.00 H new ATOM 822 N GLY A 56 -10.212 3.045 -6.249 1.00 0.00 N ATOM 823 CA GLY A 56 -10.025 4.481 -6.346 1.00 0.00 C ATOM 824 C GLY A 56 -11.340 5.234 -6.398 1.00 0.00 C ATOM 825 O GLY A 56 -12.228 4.894 -7.180 1.00 0.00 O ATOM 0 H GLY A 56 -10.857 2.650 -6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.445 4.827 -5.491 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.443 4.709 -7.239 1.00 0.00 H new ATOM 829 N TYR A 57 -11.466 6.259 -5.562 1.00 0.00 N ATOM 830 CA TYR A 57 -12.683 7.059 -5.512 1.00 0.00 C ATOM 831 C TYR A 57 -12.376 8.534 -5.757 1.00 0.00 C ATOM 832 O TYR A 57 -11.388 9.066 -5.251 1.00 0.00 O ATOM 833 CB TYR A 57 -13.376 6.889 -4.160 1.00 0.00 C ATOM 834 CG TYR A 57 -14.401 7.961 -3.864 1.00 0.00 C ATOM 835 CD1 TYR A 57 -15.655 7.933 -4.461 1.00 0.00 C ATOM 836 CD2 TYR A 57 -14.114 9.002 -2.991 1.00 0.00 C ATOM 837 CE1 TYR A 57 -16.595 8.911 -4.195 1.00 0.00 C ATOM 838 CE2 TYR A 57 -15.047 9.983 -2.718 1.00 0.00 C ATOM 839 CZ TYR A 57 -16.286 9.933 -3.322 1.00 0.00 C ATOM 840 OH TYR A 57 -17.218 10.910 -3.054 1.00 0.00 O ATOM 0 H TYR A 57 -10.740 6.555 -4.910 1.00 0.00 H new ATOM 0 HA TYR A 57 -13.349 6.709 -6.300 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -13.864 5.915 -4.131 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -12.622 6.892 -3.372 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -15.900 7.134 -5.145 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.144 9.045 -2.517 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -17.565 8.875 -4.668 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -14.808 10.785 -2.035 1.00 0.00 H new ATOM 0 HH TYR A 57 -16.843 11.555 -2.419 1.00 0.00 H new ATOM 850 N VAL A 58 -13.231 9.189 -6.535 1.00 0.00 N ATOM 851 CA VAL A 58 -13.054 10.602 -6.846 1.00 0.00 C ATOM 852 C VAL A 58 -14.164 11.444 -6.228 1.00 0.00 C ATOM 853 O VAL A 58 -15.344 11.242 -6.516 1.00 0.00 O ATOM 854 CB VAL A 58 -13.029 10.843 -8.368 1.00 0.00 C ATOM 855 CG1 VAL A 58 -12.497 12.234 -8.679 1.00 0.00 C ATOM 856 CG2 VAL A 58 -12.195 9.777 -9.062 1.00 0.00 C ATOM 0 H VAL A 58 -14.054 8.763 -6.962 1.00 0.00 H new ATOM 0 HA VAL A 58 -12.096 10.902 -6.422 1.00 0.00 H new ATOM 0 HB VAL A 58 -14.049 10.777 -8.746 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -12.486 12.387 -9.758 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.139 12.982 -8.213 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.484 12.332 -8.289 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.188 9.962 -10.136 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.174 9.809 -8.682 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.624 8.794 -8.866 1.00 0.00 H new ATOM 866 N ILE A 59 -13.778 12.389 -5.377 1.00 0.00 N ATOM 867 CA ILE A 59 -14.740 13.263 -4.719 1.00 0.00 C ATOM 868 C ILE A 59 -15.316 14.281 -5.697 1.00 0.00 C ATOM 869 O ILE A 59 -16.511 14.578 -5.668 1.00 0.00 O ATOM 870 CB ILE A 59 -14.103 14.011 -3.533 1.00 0.00 C ATOM 871 CG1 ILE A 59 -13.780 13.035 -2.400 1.00 0.00 C ATOM 872 CG2 ILE A 59 -15.029 15.113 -3.042 1.00 0.00 C ATOM 873 CD1 ILE A 59 -12.687 13.522 -1.475 1.00 0.00 C ATOM 0 H ILE A 59 -12.805 12.568 -5.127 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.542 12.625 -4.347 1.00 0.00 H new ATOM 0 HB ILE A 59 -13.173 14.469 -3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -14.684 12.855 -1.818 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -13.482 12.079 -2.829 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -14.564 15.632 -2.204 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -15.213 15.821 -3.850 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -15.975 14.677 -2.720 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -12.512 12.780 -0.697 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -11.770 13.675 -2.044 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -12.991 14.463 -1.017 1.00 0.00 H new ATOM 885 N SER A 60 -14.460 14.812 -6.563 1.00 0.00 N ATOM 886 CA SER A 60 -14.883 15.799 -7.550 1.00 0.00 C ATOM 887 C SER A 60 -16.063 15.280 -8.366 1.00 0.00 C ATOM 888 O SER A 60 -16.968 16.035 -8.718 1.00 0.00 O ATOM 889 CB SER A 60 -13.721 16.152 -8.481 1.00 0.00 C ATOM 890 OG SER A 60 -13.398 15.063 -9.329 1.00 0.00 O ATOM 0 H SER A 60 -13.469 14.575 -6.602 1.00 0.00 H new ATOM 0 HA SER A 60 -15.198 16.696 -7.017 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.985 17.021 -9.084 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.848 16.428 -7.890 1.00 0.00 H new ATOM 0 HG SER A 60 -12.654 15.314 -9.915 1.00 0.00 H new ATOM 896 N ASN A 61 -16.045 13.984 -8.662 1.00 0.00 N ATOM 897 CA ASN A 61 -17.113 13.363 -9.437 1.00 0.00 C ATOM 898 C ASN A 61 -17.779 12.242 -8.645 1.00 0.00 C ATOM 899 O ASN A 61 -18.553 11.458 -9.192 1.00 0.00 O ATOM 900 CB ASN A 61 -16.562 12.813 -10.755 1.00 0.00 C ATOM 901 CG ASN A 61 -17.595 12.014 -11.525 1.00 0.00 C ATOM 902 OD1 ASN A 61 -18.752 12.420 -11.639 1.00 0.00 O ATOM 903 ND2 ASN A 61 -17.181 10.870 -12.058 1.00 0.00 N ATOM 0 H ASN A 61 -15.303 13.344 -8.377 1.00 0.00 H new ATOM 0 HA ASN A 61 -17.861 14.126 -9.653 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -16.212 13.640 -11.373 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -15.698 12.181 -10.549 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -17.831 10.289 -12.587 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -16.213 10.573 -11.938 1.00 0.00 H new ATOM 910 N GLN A 62 -17.471 12.174 -7.353 1.00 0.00 N ATOM 911 CA GLN A 62 -18.040 11.150 -6.486 1.00 0.00 C ATOM 912 C GLN A 62 -18.197 9.830 -7.233 1.00 0.00 C ATOM 913 O GLN A 62 -19.218 9.154 -7.109 1.00 0.00 O ATOM 914 CB GLN A 62 -19.395 11.606 -5.942 1.00 0.00 C ATOM 915 CG GLN A 62 -19.297 12.751 -4.947 1.00 0.00 C ATOM 916 CD GLN A 62 -20.645 13.149 -4.380 1.00 0.00 C ATOM 917 OE1 GLN A 62 -21.612 12.391 -4.458 1.00 0.00 O ATOM 918 NE2 GLN A 62 -20.717 14.343 -3.805 1.00 0.00 N ATOM 0 H GLN A 62 -16.831 12.816 -6.885 1.00 0.00 H new ATOM 0 HA GLN A 62 -17.356 10.996 -5.652 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -20.027 11.913 -6.775 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -19.888 10.760 -5.463 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -18.635 12.462 -4.131 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -18.844 13.614 -5.435 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -19.890 14.939 -3.762 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -21.599 14.664 -3.406 1.00 0.00 H new ATOM 927 N GLN A 63 -17.180 9.470 -8.009 1.00 0.00 N ATOM 928 CA GLN A 63 -17.207 8.231 -8.777 1.00 0.00 C ATOM 929 C GLN A 63 -16.263 7.196 -8.174 1.00 0.00 C ATOM 930 O GLN A 63 -15.221 7.542 -7.617 1.00 0.00 O ATOM 931 CB GLN A 63 -16.824 8.500 -10.234 1.00 0.00 C ATOM 932 CG GLN A 63 -16.654 7.237 -11.062 1.00 0.00 C ATOM 933 CD GLN A 63 -16.131 7.519 -12.456 1.00 0.00 C ATOM 934 OE1 GLN A 63 -16.750 8.253 -13.227 1.00 0.00 O ATOM 935 NE2 GLN A 63 -14.984 6.938 -12.788 1.00 0.00 N ATOM 0 H GLN A 63 -16.327 10.018 -8.123 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.222 7.834 -8.743 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -17.590 9.125 -10.693 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -15.894 9.068 -10.257 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -15.968 6.562 -10.551 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -17.613 6.723 -11.135 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -14.504 6.337 -12.118 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.583 7.093 -13.713 1.00 0.00 H new ATOM 944 N ILE A 64 -16.634 5.925 -8.289 1.00 0.00 N ATOM 945 CA ILE A 64 -15.820 4.840 -7.756 1.00 0.00 C ATOM 946 C ILE A 64 -15.373 3.893 -8.864 1.00 0.00 C ATOM 947 O ILE A 64 -16.196 3.350 -9.602 1.00 0.00 O ATOM 948 CB ILE A 64 -16.583 4.037 -6.686 1.00 0.00 C ATOM 949 CG1 ILE A 64 -16.931 4.934 -5.496 1.00 0.00 C ATOM 950 CG2 ILE A 64 -15.757 2.843 -6.232 1.00 0.00 C ATOM 951 CD1 ILE A 64 -17.990 4.349 -4.588 1.00 0.00 C ATOM 0 H ILE A 64 -17.494 5.622 -8.747 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.944 5.299 -7.298 1.00 0.00 H new ATOM 0 HB ILE A 64 -17.511 3.668 -7.122 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -16.028 5.120 -4.915 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -17.275 5.899 -5.867 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -16.309 2.285 -5.476 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -15.554 2.195 -7.085 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -14.815 3.192 -5.810 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -18.186 5.038 -3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -18.907 4.189 -5.155 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -17.641 3.397 -4.187 1.00 0.00 H new ATOM 963 N THR A 65 -14.063 3.696 -8.974 1.00 0.00 N ATOM 964 CA THR A 65 -13.505 2.813 -9.991 1.00 0.00 C ATOM 965 C THR A 65 -12.531 1.814 -9.378 1.00 0.00 C ATOM 966 O THR A 65 -11.362 2.117 -9.138 1.00 0.00 O ATOM 967 CB THR A 65 -12.781 3.611 -11.091 1.00 0.00 C ATOM 968 OG1 THR A 65 -13.655 4.609 -11.629 1.00 0.00 O ATOM 969 CG2 THR A 65 -12.308 2.689 -12.206 1.00 0.00 C ATOM 0 H THR A 65 -13.368 4.136 -8.371 1.00 0.00 H new ATOM 0 HA THR A 65 -14.342 2.274 -10.435 1.00 0.00 H new ATOM 0 HB THR A 65 -11.911 4.093 -10.646 1.00 0.00 H new ATOM 0 HG1 THR A 65 -13.424 4.775 -12.567 1.00 0.00 H new ATOM 0 HG21 THR A 65 -11.800 3.275 -12.972 1.00 0.00 H new ATOM 0 HG22 THR A 65 -11.619 1.949 -11.799 1.00 0.00 H new ATOM 0 HG23 THR A 65 -13.166 2.182 -12.647 1.00 0.00 H new ATOM 977 N PRO A 66 -13.020 0.592 -9.117 1.00 0.00 N ATOM 978 CA PRO A 66 -12.208 -0.477 -8.529 1.00 0.00 C ATOM 979 C PRO A 66 -11.150 -0.999 -9.496 1.00 0.00 C ATOM 980 O PRO A 66 -11.397 -1.122 -10.695 1.00 0.00 O ATOM 981 CB PRO A 66 -13.233 -1.570 -8.216 1.00 0.00 C ATOM 982 CG PRO A 66 -14.349 -1.328 -9.173 1.00 0.00 C ATOM 983 CD PRO A 66 -14.404 0.161 -9.377 1.00 0.00 C ATOM 0 HA PRO A 66 -11.651 -0.134 -7.657 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.805 -2.564 -8.350 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.576 -1.507 -7.183 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -14.173 -1.845 -10.116 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -15.292 -1.703 -8.775 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.721 0.417 -10.388 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -15.108 0.635 -8.693 1.00 0.00 H new ATOM 991 N GLY A 67 -9.970 -1.306 -8.965 1.00 0.00 N ATOM 992 CA GLY A 67 -8.893 -1.812 -9.795 1.00 0.00 C ATOM 993 C GLY A 67 -8.833 -3.327 -9.808 1.00 0.00 C ATOM 994 O GLY A 67 -9.772 -4.010 -9.398 1.00 0.00 O ATOM 0 H GLY A 67 -9.741 -1.213 -7.975 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -9.022 -1.448 -10.814 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -7.944 -1.417 -9.433 1.00 0.00 H new ATOM 998 N PRO A 68 -7.707 -3.875 -10.289 1.00 0.00 N ATOM 999 CA PRO A 68 -7.502 -5.324 -10.366 1.00 0.00 C ATOM 1000 C PRO A 68 -7.339 -5.960 -8.990 1.00 0.00 C ATOM 1001 O PRO A 68 -7.725 -7.110 -8.778 1.00 0.00 O ATOM 1002 CB PRO A 68 -6.208 -5.457 -11.173 1.00 0.00 C ATOM 1003 CG PRO A 68 -5.485 -4.175 -10.943 1.00 0.00 C ATOM 1004 CD PRO A 68 -6.548 -3.121 -10.795 1.00 0.00 C ATOM 0 HA PRO A 68 -8.355 -5.833 -10.815 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.618 -6.310 -10.838 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -6.416 -5.610 -12.232 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -4.865 -4.232 -10.049 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -4.822 -3.946 -11.777 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -6.244 -2.338 -10.101 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.768 -2.636 -11.746 1.00 0.00 H new ATOM 1012 N ALA A 69 -6.766 -5.205 -8.058 1.00 0.00 N ATOM 1013 CA ALA A 69 -6.555 -5.695 -6.702 1.00 0.00 C ATOM 1014 C ALA A 69 -7.809 -5.518 -5.852 1.00 0.00 C ATOM 1015 O ALA A 69 -7.726 -5.274 -4.649 1.00 0.00 O ATOM 1016 CB ALA A 69 -5.375 -4.980 -6.060 1.00 0.00 C ATOM 0 H ALA A 69 -6.440 -4.252 -8.218 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.334 -6.761 -6.758 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.229 -5.356 -5.047 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.475 -5.162 -6.648 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -5.574 -3.909 -6.024 1.00 0.00 H new ATOM 1022 N TYR A 70 -8.970 -5.641 -6.487 1.00 0.00 N ATOM 1023 CA TYR A 70 -10.242 -5.491 -5.790 1.00 0.00 C ATOM 1024 C TYR A 70 -10.925 -6.843 -5.605 1.00 0.00 C ATOM 1025 O TYR A 70 -10.928 -7.678 -6.509 1.00 0.00 O ATOM 1026 CB TYR A 70 -11.162 -4.543 -6.561 1.00 0.00 C ATOM 1027 CG TYR A 70 -12.299 -3.994 -5.731 1.00 0.00 C ATOM 1028 CD1 TYR A 70 -12.078 -3.510 -4.448 1.00 0.00 C ATOM 1029 CD2 TYR A 70 -13.596 -3.959 -6.230 1.00 0.00 C ATOM 1030 CE1 TYR A 70 -13.115 -3.008 -3.685 1.00 0.00 C ATOM 1031 CE2 TYR A 70 -14.638 -3.457 -5.476 1.00 0.00 C ATOM 1032 CZ TYR A 70 -14.393 -2.983 -4.204 1.00 0.00 C ATOM 1033 OH TYR A 70 -15.429 -2.483 -3.448 1.00 0.00 O ATOM 0 H TYR A 70 -9.056 -5.844 -7.483 1.00 0.00 H new ATOM 0 HA TYR A 70 -10.040 -5.069 -4.806 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.572 -3.712 -6.948 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -11.573 -5.070 -7.422 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -11.078 -3.526 -4.040 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -13.792 -4.331 -7.225 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -12.926 -2.637 -2.688 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -15.639 -3.436 -5.880 1.00 0.00 H new ATOM 0 HH TYR A 70 -15.118 -2.321 -2.533 1.00 0.00 H new ATOM 1043 N SER A 71 -11.502 -7.050 -4.426 1.00 0.00 N ATOM 1044 CA SER A 71 -12.186 -8.301 -4.119 1.00 0.00 C ATOM 1045 C SER A 71 -13.606 -8.037 -3.626 1.00 0.00 C ATOM 1046 O SER A 71 -14.287 -8.943 -3.149 1.00 0.00 O ATOM 1047 CB SER A 71 -11.406 -9.088 -3.065 1.00 0.00 C ATOM 1048 OG SER A 71 -11.006 -8.249 -1.995 1.00 0.00 O ATOM 0 H SER A 71 -11.510 -6.368 -3.668 1.00 0.00 H new ATOM 0 HA SER A 71 -12.241 -8.890 -5.034 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.023 -9.901 -2.683 1.00 0.00 H new ATOM 0 HB3 SER A 71 -10.528 -9.543 -3.523 1.00 0.00 H new ATOM 0 HG SER A 71 -10.511 -8.776 -1.334 1.00 0.00 H new ATOM 1054 N ASN A 72 -14.045 -6.788 -3.746 1.00 0.00 N ATOM 1055 CA ASN A 72 -15.383 -6.403 -3.312 1.00 0.00 C ATOM 1056 C ASN A 72 -15.550 -6.615 -1.810 1.00 0.00 C ATOM 1057 O ASN A 72 -16.617 -7.016 -1.345 1.00 0.00 O ATOM 1058 CB ASN A 72 -16.439 -7.207 -4.073 1.00 0.00 C ATOM 1059 CG ASN A 72 -16.677 -6.672 -5.472 1.00 0.00 C ATOM 1060 OD1 ASN A 72 -17.781 -6.238 -5.803 1.00 0.00 O ATOM 1061 ND2 ASN A 72 -15.639 -6.699 -6.300 1.00 0.00 N ATOM 0 H ASN A 72 -13.494 -6.026 -4.140 1.00 0.00 H new ATOM 0 HA ASN A 72 -15.517 -5.343 -3.528 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -16.124 -8.249 -4.134 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -17.376 -7.189 -3.516 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -15.738 -6.351 -7.254 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -14.743 -7.068 -5.982 1.00 0.00 H new ATOM 1068 N ARG A 73 -14.489 -6.343 -1.058 1.00 0.00 N ATOM 1069 CA ARG A 73 -14.518 -6.505 0.391 1.00 0.00 C ATOM 1070 C ARG A 73 -14.108 -5.212 1.090 1.00 0.00 C ATOM 1071 O ARG A 73 -14.486 -4.968 2.235 1.00 0.00 O ATOM 1072 CB ARG A 73 -13.590 -7.644 0.817 1.00 0.00 C ATOM 1073 CG ARG A 73 -13.968 -8.991 0.224 1.00 0.00 C ATOM 1074 CD ARG A 73 -13.257 -10.132 0.936 1.00 0.00 C ATOM 1075 NE ARG A 73 -11.824 -9.885 1.070 1.00 0.00 N ATOM 1076 CZ ARG A 73 -10.995 -10.699 1.714 1.00 0.00 C ATOM 1077 NH1 ARG A 73 -11.455 -11.806 2.281 1.00 0.00 N ATOM 1078 NH2 ARG A 73 -9.703 -10.405 1.793 1.00 0.00 N ATOM 0 H ARG A 73 -13.599 -6.010 -1.428 1.00 0.00 H new ATOM 0 HA ARG A 73 -15.539 -6.749 0.684 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -12.570 -7.400 0.522 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -13.597 -7.720 1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -15.047 -9.132 0.296 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -13.714 -9.007 -0.836 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -13.695 -10.271 1.924 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -13.415 -11.058 0.384 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.439 -9.041 0.646 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -12.447 -12.034 2.223 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -10.816 -12.429 2.775 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -9.346 -9.554 1.359 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -9.067 -11.030 2.288 1.00 0.00 H new ATOM 1092 N GLU A 74 -13.332 -4.388 0.392 1.00 0.00 N ATOM 1093 CA GLU A 74 -12.871 -3.121 0.948 1.00 0.00 C ATOM 1094 C GLU A 74 -13.799 -1.979 0.545 1.00 0.00 C ATOM 1095 O GLU A 74 -14.373 -1.985 -0.545 1.00 0.00 O ATOM 1096 CB GLU A 74 -11.445 -2.823 0.479 1.00 0.00 C ATOM 1097 CG GLU A 74 -10.389 -3.675 1.163 1.00 0.00 C ATOM 1098 CD GLU A 74 -10.316 -5.080 0.596 1.00 0.00 C ATOM 1099 OE1 GLU A 74 -10.028 -5.217 -0.612 1.00 0.00 O ATOM 1100 OE2 GLU A 74 -10.546 -6.041 1.359 1.00 0.00 O ATOM 0 H GLU A 74 -13.010 -4.575 -0.558 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.879 -3.206 2.035 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.385 -2.981 -0.598 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.224 -1.771 0.660 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.416 -3.194 1.059 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.606 -3.729 2.230 1.00 0.00 H new ATOM 1107 N THR A 75 -13.943 -1.000 1.432 1.00 0.00 N ATOM 1108 CA THR A 75 -14.803 0.147 1.171 1.00 0.00 C ATOM 1109 C THR A 75 -14.105 1.452 1.537 1.00 0.00 C ATOM 1110 O THR A 75 -13.607 1.609 2.652 1.00 0.00 O ATOM 1111 CB THR A 75 -16.125 0.049 1.955 1.00 0.00 C ATOM 1112 OG1 THR A 75 -16.842 -1.127 1.561 1.00 0.00 O ATOM 1113 CG2 THR A 75 -16.989 1.279 1.717 1.00 0.00 C ATOM 0 H THR A 75 -13.475 -0.979 2.338 1.00 0.00 H new ATOM 0 HA THR A 75 -15.021 0.141 0.103 1.00 0.00 H new ATOM 0 HB THR A 75 -15.888 -0.009 3.017 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.681 -1.183 2.065 1.00 0.00 H new ATOM 0 HG21 THR A 75 -17.917 1.186 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 75 -16.452 2.169 2.045 1.00 0.00 H new ATOM 0 HG23 THR A 75 -17.217 1.363 0.654 1.00 0.00 H new ATOM 1121 N ILE A 76 -14.072 2.386 0.592 1.00 0.00 N ATOM 1122 CA ILE A 76 -13.436 3.678 0.817 1.00 0.00 C ATOM 1123 C ILE A 76 -14.313 4.579 1.679 1.00 0.00 C ATOM 1124 O ILE A 76 -15.485 4.284 1.912 1.00 0.00 O ATOM 1125 CB ILE A 76 -13.133 4.395 -0.512 1.00 0.00 C ATOM 1126 CG1 ILE A 76 -12.889 3.373 -1.624 1.00 0.00 C ATOM 1127 CG2 ILE A 76 -11.930 5.313 -0.356 1.00 0.00 C ATOM 1128 CD1 ILE A 76 -14.140 3.006 -2.393 1.00 0.00 C ATOM 0 H ILE A 76 -14.478 2.272 -0.337 1.00 0.00 H new ATOM 0 HA ILE A 76 -12.498 3.482 1.337 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.996 5.002 -0.785 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.150 3.773 -2.318 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.462 2.470 -1.189 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.728 5.813 -1.304 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -12.139 6.059 0.410 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.060 4.726 -0.063 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -13.892 2.278 -3.165 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -14.873 2.576 -1.711 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -14.557 3.900 -2.858 1.00 0.00 H new ATOM 1140 N TYR A 77 -13.738 5.680 2.149 1.00 0.00 N ATOM 1141 CA TYR A 77 -14.466 6.626 2.987 1.00 0.00 C ATOM 1142 C TYR A 77 -14.230 8.060 2.522 1.00 0.00 C ATOM 1143 O TYR A 77 -13.272 8.359 1.810 1.00 0.00 O ATOM 1144 CB TYR A 77 -14.043 6.476 4.449 1.00 0.00 C ATOM 1145 CG TYR A 77 -14.853 5.453 5.212 1.00 0.00 C ATOM 1146 CD1 TYR A 77 -14.802 4.105 4.877 1.00 0.00 C ATOM 1147 CD2 TYR A 77 -15.670 5.834 6.270 1.00 0.00 C ATOM 1148 CE1 TYR A 77 -15.541 3.168 5.571 1.00 0.00 C ATOM 1149 CE2 TYR A 77 -16.412 4.902 6.970 1.00 0.00 C ATOM 1150 CZ TYR A 77 -16.345 3.571 6.617 1.00 0.00 C ATOM 1151 OH TYR A 77 -17.082 2.640 7.311 1.00 0.00 O ATOM 0 H TYR A 77 -12.769 5.940 1.964 1.00 0.00 H new ATOM 0 HA TYR A 77 -15.530 6.405 2.899 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -12.990 6.195 4.487 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -14.133 7.442 4.945 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -14.173 3.785 4.059 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -15.726 6.876 6.550 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -15.490 2.125 5.296 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -17.042 5.215 7.790 1.00 0.00 H new ATOM 0 HH TYR A 77 -17.593 3.088 8.017 1.00 0.00 H new ATOM 1161 N PRO A 78 -15.126 8.969 2.935 1.00 0.00 N ATOM 1162 CA PRO A 78 -15.037 10.387 2.574 1.00 0.00 C ATOM 1163 C PRO A 78 -13.866 11.087 3.257 1.00 0.00 C ATOM 1164 O PRO A 78 -13.670 12.290 3.094 1.00 0.00 O ATOM 1165 CB PRO A 78 -16.366 10.963 3.070 1.00 0.00 C ATOM 1166 CG PRO A 78 -16.788 10.050 4.170 1.00 0.00 C ATOM 1167 CD PRO A 78 -16.293 8.683 3.785 1.00 0.00 C ATOM 0 HA PRO A 78 -14.868 10.526 1.506 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -16.245 11.985 3.428 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -17.108 10.991 2.272 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -16.363 10.365 5.123 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -17.872 10.054 4.287 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -16.018 8.094 4.660 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -17.053 8.117 3.246 1.00 0.00 H new ATOM 1175 N ASN A 79 -13.091 10.324 4.021 1.00 0.00 N ATOM 1176 CA ASN A 79 -11.939 10.871 4.728 1.00 0.00 C ATOM 1177 C ASN A 79 -10.650 10.192 4.275 1.00 0.00 C ATOM 1178 O ASN A 79 -9.621 10.281 4.945 1.00 0.00 O ATOM 1179 CB ASN A 79 -12.114 10.702 6.238 1.00 0.00 C ATOM 1180 CG ASN A 79 -12.909 11.835 6.859 1.00 0.00 C ATOM 1181 OD1 ASN A 79 -13.286 12.789 6.178 1.00 0.00 O ATOM 1182 ND2 ASN A 79 -13.169 11.734 8.157 1.00 0.00 N ATOM 0 H ASN A 79 -13.240 9.325 4.166 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.871 11.933 4.493 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -12.617 9.756 6.439 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.133 10.648 6.711 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -13.701 12.465 8.629 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.837 10.925 8.682 1.00 0.00 H new ATOM 1189 N ALA A 80 -10.714 9.515 3.133 1.00 0.00 N ATOM 1190 CA ALA A 80 -9.552 8.824 2.589 1.00 0.00 C ATOM 1191 C ALA A 80 -9.234 7.567 3.393 1.00 0.00 C ATOM 1192 O ALA A 80 -8.094 7.106 3.416 1.00 0.00 O ATOM 1193 CB ALA A 80 -8.348 9.754 2.564 1.00 0.00 C ATOM 0 H ALA A 80 -11.558 9.431 2.567 1.00 0.00 H new ATOM 0 HA ALA A 80 -9.786 8.522 1.568 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.488 9.224 2.155 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.570 10.620 1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.122 10.085 3.578 1.00 0.00 H new ATOM 1199 N SER A 81 -10.251 7.019 4.050 1.00 0.00 N ATOM 1200 CA SER A 81 -10.079 5.818 4.859 1.00 0.00 C ATOM 1201 C SER A 81 -10.627 4.592 4.135 1.00 0.00 C ATOM 1202 O SER A 81 -11.506 4.703 3.279 1.00 0.00 O ATOM 1203 CB SER A 81 -10.780 5.982 6.209 1.00 0.00 C ATOM 1204 OG SER A 81 -10.552 7.272 6.748 1.00 0.00 O ATOM 0 H SER A 81 -11.202 7.387 4.038 1.00 0.00 H new ATOM 0 HA SER A 81 -9.012 5.673 5.027 1.00 0.00 H new ATOM 0 HB2 SER A 81 -11.851 5.819 6.088 1.00 0.00 H new ATOM 0 HB3 SER A 81 -10.418 5.225 6.905 1.00 0.00 H new ATOM 0 HG SER A 81 -11.239 7.473 7.418 1.00 0.00 H new ATOM 1210 N LEU A 82 -10.102 3.423 4.483 1.00 0.00 N ATOM 1211 CA LEU A 82 -10.537 2.174 3.867 1.00 0.00 C ATOM 1212 C LEU A 82 -10.897 1.140 4.929 1.00 0.00 C ATOM 1213 O LEU A 82 -10.091 0.828 5.806 1.00 0.00 O ATOM 1214 CB LEU A 82 -9.441 1.624 2.954 1.00 0.00 C ATOM 1215 CG LEU A 82 -9.850 0.476 2.030 1.00 0.00 C ATOM 1216 CD1 LEU A 82 -10.359 1.016 0.702 1.00 0.00 C ATOM 1217 CD2 LEU A 82 -8.682 -0.474 1.809 1.00 0.00 C ATOM 0 H LEU A 82 -9.374 3.313 5.189 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.426 2.381 3.272 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.064 2.441 2.340 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.613 1.285 3.577 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.658 -0.079 2.507 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.645 0.185 0.057 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.225 1.655 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.572 1.595 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.992 -1.284 1.149 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -7.853 0.068 1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.363 -0.887 2.766 1.00 0.00 H new ATOM 1229 N LEU A 83 -12.112 0.609 4.842 1.00 0.00 N ATOM 1230 CA LEU A 83 -12.579 -0.393 5.794 1.00 0.00 C ATOM 1231 C LEU A 83 -12.435 -1.799 5.219 1.00 0.00 C ATOM 1232 O LEU A 83 -13.142 -2.173 4.284 1.00 0.00 O ATOM 1233 CB LEU A 83 -14.039 -0.130 6.167 1.00 0.00 C ATOM 1234 CG LEU A 83 -14.745 -1.243 6.942 1.00 0.00 C ATOM 1235 CD1 LEU A 83 -14.394 -1.169 8.420 1.00 0.00 C ATOM 1236 CD2 LEU A 83 -16.251 -1.157 6.745 1.00 0.00 C ATOM 0 H LEU A 83 -12.791 0.856 4.122 1.00 0.00 H new ATOM 0 HA LEU A 83 -11.963 -0.321 6.690 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.082 0.783 6.761 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -14.599 0.059 5.251 1.00 0.00 H new ATOM 0 HG LEU A 83 -14.402 -2.203 6.556 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -14.905 -1.969 8.956 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -13.317 -1.280 8.544 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -14.708 -0.205 8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -16.737 -1.957 7.304 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -16.610 -0.193 7.104 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -16.486 -1.260 5.686 1.00 0.00 H new ATOM 1248 N MET A 84 -11.516 -2.573 5.787 1.00 0.00 N ATOM 1249 CA MET A 84 -11.282 -3.939 5.333 1.00 0.00 C ATOM 1250 C MET A 84 -12.171 -4.923 6.088 1.00 0.00 C ATOM 1251 O MET A 84 -12.178 -4.948 7.319 1.00 0.00 O ATOM 1252 CB MET A 84 -9.811 -4.317 5.519 1.00 0.00 C ATOM 1253 CG MET A 84 -9.316 -5.345 4.515 1.00 0.00 C ATOM 1254 SD MET A 84 -7.554 -5.181 4.165 1.00 0.00 S ATOM 1255 CE MET A 84 -7.497 -3.526 3.484 1.00 0.00 C ATOM 0 H MET A 84 -10.922 -2.278 6.562 1.00 0.00 H new ATOM 0 HA MET A 84 -11.531 -3.990 4.273 1.00 0.00 H new ATOM 0 HB2 MET A 84 -9.200 -3.418 5.437 1.00 0.00 H new ATOM 0 HB3 MET A 84 -9.669 -4.708 6.527 1.00 0.00 H new ATOM 0 HG2 MET A 84 -9.515 -6.346 4.898 1.00 0.00 H new ATOM 0 HG3 MET A 84 -9.878 -5.241 3.587 1.00 0.00 H new ATOM 0 HE1 MET A 84 -6.964 -3.542 2.533 1.00 0.00 H new ATOM 0 HE2 MET A 84 -8.512 -3.163 3.325 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.980 -2.864 4.179 1.00 0.00 H new ATOM 1265 N ARG A 85 -12.918 -5.730 5.343 1.00 0.00 N ATOM 1266 CA ARG A 85 -13.812 -6.714 5.942 1.00 0.00 C ATOM 1267 C ARG A 85 -13.291 -8.131 5.715 1.00 0.00 C ATOM 1268 O ARG A 85 -12.588 -8.395 4.741 1.00 0.00 O ATOM 1269 CB ARG A 85 -15.220 -6.577 5.361 1.00 0.00 C ATOM 1270 CG ARG A 85 -15.957 -5.336 5.836 1.00 0.00 C ATOM 1271 CD ARG A 85 -17.340 -5.237 5.213 1.00 0.00 C ATOM 1272 NE ARG A 85 -18.232 -6.290 5.689 1.00 0.00 N ATOM 1273 CZ ARG A 85 -19.550 -6.266 5.526 1.00 0.00 C ATOM 1274 NH1 ARG A 85 -20.127 -5.248 4.903 1.00 0.00 N ATOM 1275 NH2 ARG A 85 -20.295 -7.263 5.988 1.00 0.00 N ATOM 0 H ARG A 85 -12.922 -5.722 4.323 1.00 0.00 H new ATOM 0 HA ARG A 85 -13.850 -6.527 7.015 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -15.154 -6.556 4.273 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -15.802 -7.459 5.628 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -16.047 -5.358 6.922 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -15.378 -4.448 5.582 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -17.773 -4.264 5.444 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -17.254 -5.298 4.128 1.00 0.00 H new ATOM 0 HE ARG A 85 -17.821 -7.088 6.173 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -19.559 -4.480 4.547 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -21.139 -5.233 4.780 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -19.855 -8.048 6.468 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -21.307 -7.244 5.863 1.00 0.00 H new ATOM 1289 N ASN A 86 -13.642 -9.037 6.622 1.00 0.00 N ATOM 1290 CA ASN A 86 -13.210 -10.426 6.521 1.00 0.00 C ATOM 1291 C ASN A 86 -11.694 -10.515 6.376 1.00 0.00 C ATOM 1292 O ASN A 86 -11.180 -11.303 5.582 1.00 0.00 O ATOM 1293 CB ASN A 86 -13.888 -11.108 5.331 1.00 0.00 C ATOM 1294 CG ASN A 86 -15.361 -11.371 5.577 1.00 0.00 C ATOM 1295 OD1 ASN A 86 -15.739 -11.939 6.602 1.00 0.00 O ATOM 1296 ND2 ASN A 86 -16.201 -10.957 4.636 1.00 0.00 N ATOM 0 H ASN A 86 -14.224 -8.834 7.435 1.00 0.00 H new ATOM 0 HA ASN A 86 -13.500 -10.938 7.438 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.776 -10.482 4.445 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.384 -12.051 5.121 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.204 -11.105 4.747 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.843 -10.491 3.802 1.00 0.00 H new ATOM 1303 N VAL A 87 -10.982 -9.700 7.149 1.00 0.00 N ATOM 1304 CA VAL A 87 -9.525 -9.687 7.108 1.00 0.00 C ATOM 1305 C VAL A 87 -8.956 -11.082 7.343 1.00 0.00 C ATOM 1306 O VAL A 87 -9.579 -11.917 8.000 1.00 0.00 O ATOM 1307 CB VAL A 87 -8.942 -8.724 8.159 1.00 0.00 C ATOM 1308 CG1 VAL A 87 -9.426 -7.304 7.908 1.00 0.00 C ATOM 1309 CG2 VAL A 87 -9.311 -9.181 9.563 1.00 0.00 C ATOM 0 H VAL A 87 -11.391 -9.041 7.811 1.00 0.00 H new ATOM 0 HA VAL A 87 -9.240 -9.344 6.114 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.856 -8.733 8.072 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -9.004 -6.637 8.660 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -9.107 -6.981 6.917 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -10.514 -7.275 7.967 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.891 -8.489 10.293 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -10.396 -9.202 9.665 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -8.911 -10.180 9.738 1.00 0.00 H new ATOM 1319 N THR A 88 -7.767 -11.330 6.801 1.00 0.00 N ATOM 1320 CA THR A 88 -7.114 -12.624 6.951 1.00 0.00 C ATOM 1321 C THR A 88 -5.623 -12.459 7.224 1.00 0.00 C ATOM 1322 O THR A 88 -5.066 -11.376 7.043 1.00 0.00 O ATOM 1323 CB THR A 88 -7.300 -13.496 5.695 1.00 0.00 C ATOM 1324 OG1 THR A 88 -6.753 -12.831 4.551 1.00 0.00 O ATOM 1325 CG2 THR A 88 -8.773 -13.795 5.457 1.00 0.00 C ATOM 0 H THR A 88 -7.237 -10.651 6.254 1.00 0.00 H new ATOM 0 HA THR A 88 -7.584 -13.118 7.801 1.00 0.00 H new ATOM 0 HB THR A 88 -6.775 -14.438 5.853 1.00 0.00 H new ATOM 0 HG1 THR A 88 -6.874 -13.393 3.757 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.879 -14.412 4.565 1.00 0.00 H new ATOM 0 HG22 THR A 88 -9.180 -14.327 6.317 1.00 0.00 H new ATOM 0 HG23 THR A 88 -9.316 -12.860 5.319 1.00 0.00 H new ATOM 1333 N ARG A 89 -4.983 -13.539 7.661 1.00 0.00 N ATOM 1334 CA ARG A 89 -3.557 -13.513 7.960 1.00 0.00 C ATOM 1335 C ARG A 89 -2.751 -13.098 6.732 1.00 0.00 C ATOM 1336 O ARG A 89 -1.628 -12.611 6.850 1.00 0.00 O ATOM 1337 CB ARG A 89 -3.091 -14.886 8.448 1.00 0.00 C ATOM 1338 CG ARG A 89 -3.340 -16.004 7.449 1.00 0.00 C ATOM 1339 CD ARG A 89 -3.257 -17.371 8.111 1.00 0.00 C ATOM 1340 NE ARG A 89 -2.957 -18.427 7.148 1.00 0.00 N ATOM 1341 CZ ARG A 89 -2.554 -19.644 7.495 1.00 0.00 C ATOM 1342 NH1 ARG A 89 -2.402 -19.957 8.774 1.00 0.00 N ATOM 1343 NH2 ARG A 89 -2.301 -20.552 6.561 1.00 0.00 N ATOM 0 H ARG A 89 -5.430 -14.443 7.816 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.390 -12.779 8.748 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.025 -14.840 8.671 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.602 -15.123 9.381 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -4.323 -15.877 6.996 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.608 -15.943 6.644 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.487 -17.354 8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -4.202 -17.591 8.608 1.00 0.00 H new ATOM 0 HE ARG A 89 -3.063 -18.219 6.155 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.595 -19.262 9.495 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -2.092 -20.893 9.037 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.416 -20.316 5.575 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.992 -21.486 6.829 1.00 0.00 H new ATOM 1357 N ASN A 90 -3.335 -13.295 5.554 1.00 0.00 N ATOM 1358 CA ASN A 90 -2.671 -12.942 4.304 1.00 0.00 C ATOM 1359 C ASN A 90 -2.631 -11.428 4.118 1.00 0.00 C ATOM 1360 O ASN A 90 -1.595 -10.863 3.768 1.00 0.00 O ATOM 1361 CB ASN A 90 -3.388 -13.594 3.120 1.00 0.00 C ATOM 1362 CG ASN A 90 -2.640 -13.403 1.815 1.00 0.00 C ATOM 1363 OD1 ASN A 90 -1.915 -14.290 1.366 1.00 0.00 O ATOM 1364 ND2 ASN A 90 -2.814 -12.239 1.198 1.00 0.00 N ATOM 0 H ASN A 90 -4.265 -13.697 5.439 1.00 0.00 H new ATOM 0 HA ASN A 90 -1.647 -13.312 4.348 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.509 -14.660 3.314 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -4.389 -13.172 3.027 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.337 -12.053 0.316 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -3.425 -11.532 1.607 1.00 0.00 H new ATOM 1371 N ASP A 91 -3.765 -10.778 4.354 1.00 0.00 N ATOM 1372 CA ASP A 91 -3.860 -9.330 4.215 1.00 0.00 C ATOM 1373 C ASP A 91 -2.669 -8.641 4.875 1.00 0.00 C ATOM 1374 O ASP A 91 -2.182 -7.619 4.391 1.00 0.00 O ATOM 1375 CB ASP A 91 -5.164 -8.821 4.830 1.00 0.00 C ATOM 1376 CG ASP A 91 -6.367 -9.103 3.951 1.00 0.00 C ATOM 1377 OD1 ASP A 91 -6.240 -8.980 2.715 1.00 0.00 O ATOM 1378 OD2 ASP A 91 -7.436 -9.445 4.500 1.00 0.00 O ATOM 0 H ASP A 91 -4.632 -11.231 4.643 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.852 -9.091 3.152 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.311 -9.290 5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.087 -7.747 5.002 1.00 0.00 H new ATOM 1383 N THR A 92 -2.204 -9.208 5.984 1.00 0.00 N ATOM 1384 CA THR A 92 -1.073 -8.648 6.712 1.00 0.00 C ATOM 1385 C THR A 92 0.083 -8.328 5.770 1.00 0.00 C ATOM 1386 O THR A 92 0.595 -9.207 5.079 1.00 0.00 O ATOM 1387 CB THR A 92 -0.576 -9.611 7.806 1.00 0.00 C ATOM 1388 OG1 THR A 92 -1.690 -10.145 8.531 1.00 0.00 O ATOM 1389 CG2 THR A 92 0.367 -8.901 8.766 1.00 0.00 C ATOM 0 H THR A 92 -2.594 -10.055 6.397 1.00 0.00 H new ATOM 0 HA THR A 92 -1.423 -7.728 7.180 1.00 0.00 H new ATOM 0 HB THR A 92 -0.033 -10.424 7.324 1.00 0.00 H new ATOM 0 HG1 THR A 92 -1.901 -11.040 8.193 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.704 -9.602 9.530 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.228 -8.521 8.216 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.155 -8.070 9.241 1.00 0.00 H new ATOM 1397 N GLY A 93 0.490 -7.062 5.749 1.00 0.00 N ATOM 1398 CA GLY A 93 1.583 -6.648 4.889 1.00 0.00 C ATOM 1399 C GLY A 93 1.761 -5.143 4.861 1.00 0.00 C ATOM 1400 O GLY A 93 2.313 -4.559 5.793 1.00 0.00 O ATOM 0 H GLY A 93 0.082 -6.316 6.312 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.507 -7.114 5.232 1.00 0.00 H new ATOM 0 HA3 GLY A 93 1.401 -7.008 3.876 1.00 0.00 H new ATOM 1404 N SER A 94 1.294 -4.514 3.787 1.00 0.00 N ATOM 1405 CA SER A 94 1.410 -3.068 3.638 1.00 0.00 C ATOM 1406 C SER A 94 0.356 -2.535 2.672 1.00 0.00 C ATOM 1407 O SER A 94 -0.008 -3.202 1.703 1.00 0.00 O ATOM 1408 CB SER A 94 2.808 -2.695 3.142 1.00 0.00 C ATOM 1409 OG SER A 94 3.787 -2.955 4.133 1.00 0.00 O ATOM 0 H SER A 94 0.832 -4.983 3.008 1.00 0.00 H new ATOM 0 HA SER A 94 1.246 -2.613 4.615 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.040 -3.261 2.240 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.832 -1.639 2.871 1.00 0.00 H new ATOM 0 HG SER A 94 3.370 -3.411 4.893 1.00 0.00 H new ATOM 1415 N TYR A 95 -0.130 -1.329 2.943 1.00 0.00 N ATOM 1416 CA TYR A 95 -1.144 -0.706 2.100 1.00 0.00 C ATOM 1417 C TYR A 95 -0.873 0.786 1.934 1.00 0.00 C ATOM 1418 O TYR A 95 -0.922 1.550 2.899 1.00 0.00 O ATOM 1419 CB TYR A 95 -2.535 -0.920 2.698 1.00 0.00 C ATOM 1420 CG TYR A 95 -2.948 -2.372 2.768 1.00 0.00 C ATOM 1421 CD1 TYR A 95 -2.417 -3.221 3.732 1.00 0.00 C ATOM 1422 CD2 TYR A 95 -3.870 -2.897 1.871 1.00 0.00 C ATOM 1423 CE1 TYR A 95 -2.791 -4.549 3.799 1.00 0.00 C ATOM 1424 CE2 TYR A 95 -4.251 -4.223 1.931 1.00 0.00 C ATOM 1425 CZ TYR A 95 -3.709 -5.045 2.897 1.00 0.00 C ATOM 1426 OH TYR A 95 -4.085 -6.367 2.961 1.00 0.00 O ATOM 0 H TYR A 95 0.162 -0.763 3.740 1.00 0.00 H new ATOM 0 HA TYR A 95 -1.102 -1.175 1.117 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.559 -0.496 3.702 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.265 -0.372 2.103 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -1.699 -2.836 4.441 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.296 -2.257 1.113 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -2.367 -5.195 4.553 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -4.969 -4.614 1.226 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.307 -6.918 3.189 1.00 0.00 H new ATOM 1436 N THR A 96 -0.586 1.195 0.702 1.00 0.00 N ATOM 1437 CA THR A 96 -0.306 2.594 0.407 1.00 0.00 C ATOM 1438 C THR A 96 -1.538 3.295 -0.153 1.00 0.00 C ATOM 1439 O THR A 96 -2.198 2.784 -1.059 1.00 0.00 O ATOM 1440 CB THR A 96 0.853 2.736 -0.598 1.00 0.00 C ATOM 1441 OG1 THR A 96 2.019 2.073 -0.098 1.00 0.00 O ATOM 1442 CG2 THR A 96 1.168 4.201 -0.858 1.00 0.00 C ATOM 0 H THR A 96 -0.541 0.576 -0.108 1.00 0.00 H new ATOM 0 HA THR A 96 -0.020 3.064 1.348 1.00 0.00 H new ATOM 0 HB THR A 96 0.548 2.275 -1.537 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.813 2.611 -0.299 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.989 4.276 -1.571 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.287 4.696 -1.267 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.454 4.683 0.077 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.844 4.468 0.391 1.00 0.00 N ATOM 1451 CA LEU A 97 -2.998 5.241 -0.055 1.00 0.00 C ATOM 1452 C LEU A 97 -2.578 6.636 -0.507 1.00 0.00 C ATOM 1453 O LEU A 97 -2.076 7.430 0.288 1.00 0.00 O ATOM 1454 CB LEU A 97 -4.032 5.345 1.068 1.00 0.00 C ATOM 1455 CG LEU A 97 -5.007 6.519 0.975 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -4.352 7.798 1.473 1.00 0.00 C ATOM 1457 CD2 LEU A 97 -5.499 6.692 -0.454 1.00 0.00 C ATOM 0 H LEU A 97 -1.309 4.905 1.142 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.444 4.724 -0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.609 4.420 1.091 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.502 5.413 2.018 1.00 0.00 H new ATOM 0 HG LEU A 97 -5.866 6.304 1.610 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.061 8.623 1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -4.050 7.671 2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.475 8.018 0.865 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.192 7.532 -0.501 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.650 6.884 -1.110 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.008 5.783 -0.776 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.789 6.927 -1.786 1.00 0.00 N ATOM 1470 CA GLN A 98 -2.433 8.227 -2.342 1.00 0.00 C ATOM 1471 C GLN A 98 -3.679 9.069 -2.597 1.00 0.00 C ATOM 1472 O GLN A 98 -4.621 8.621 -3.251 1.00 0.00 O ATOM 1473 CB GLN A 98 -1.647 8.051 -3.643 1.00 0.00 C ATOM 1474 CG GLN A 98 -1.650 9.288 -4.527 1.00 0.00 C ATOM 1475 CD GLN A 98 -0.571 9.247 -5.591 1.00 0.00 C ATOM 1476 OE1 GLN A 98 0.611 9.435 -5.301 1.00 0.00 O ATOM 1477 NE2 GLN A 98 -0.973 9.000 -6.832 1.00 0.00 N ATOM 0 H GLN A 98 -3.205 6.281 -2.457 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.808 8.746 -1.616 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.617 7.789 -3.403 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -2.067 7.214 -4.201 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -2.624 9.385 -5.006 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.510 10.173 -3.907 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -1.963 8.850 -7.027 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.292 8.960 -7.590 1.00 0.00 H new ATOM 1486 N VAL A 99 -3.677 10.292 -2.075 1.00 0.00 N ATOM 1487 CA VAL A 99 -4.807 11.198 -2.247 1.00 0.00 C ATOM 1488 C VAL A 99 -4.435 12.377 -3.139 1.00 0.00 C ATOM 1489 O VAL A 99 -3.455 13.077 -2.884 1.00 0.00 O ATOM 1490 CB VAL A 99 -5.309 11.732 -0.892 1.00 0.00 C ATOM 1491 CG1 VAL A 99 -4.142 12.212 -0.042 1.00 0.00 C ATOM 1492 CG2 VAL A 99 -6.321 12.848 -1.102 1.00 0.00 C ATOM 0 H VAL A 99 -2.906 10.678 -1.530 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.604 10.625 -2.721 1.00 0.00 H new ATOM 0 HB VAL A 99 -5.804 10.919 -0.361 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.516 12.586 0.911 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.457 11.383 0.137 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.616 13.011 -0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.665 13.214 -0.135 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.854 13.664 -1.653 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -7.170 12.467 -1.669 1.00 0.00 H new ATOM 1502 N ILE A 100 -5.225 12.591 -4.186 1.00 0.00 N ATOM 1503 CA ILE A 100 -4.980 13.686 -5.116 1.00 0.00 C ATOM 1504 C ILE A 100 -5.618 14.980 -4.621 1.00 0.00 C ATOM 1505 O ILE A 100 -6.713 14.970 -4.058 1.00 0.00 O ATOM 1506 CB ILE A 100 -5.522 13.364 -6.521 1.00 0.00 C ATOM 1507 CG1 ILE A 100 -4.702 12.244 -7.163 1.00 0.00 C ATOM 1508 CG2 ILE A 100 -5.502 14.610 -7.395 1.00 0.00 C ATOM 1509 CD1 ILE A 100 -4.856 10.908 -6.470 1.00 0.00 C ATOM 0 H ILE A 100 -6.040 12.020 -4.411 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.899 13.815 -5.174 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.554 13.026 -6.428 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.000 12.139 -8.206 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.649 12.527 -7.159 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.888 14.366 -8.385 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.125 15.382 -6.943 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.479 14.975 -7.484 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.246 10.162 -6.979 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.531 10.996 -5.433 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.902 10.602 -6.497 1.00 0.00 H new ATOM 1521 N LYS A 101 -4.927 16.094 -4.837 1.00 0.00 N ATOM 1522 CA LYS A 101 -5.426 17.398 -4.417 1.00 0.00 C ATOM 1523 C LYS A 101 -5.986 18.175 -5.604 1.00 0.00 C ATOM 1524 O LYS A 101 -5.558 17.982 -6.743 1.00 0.00 O ATOM 1525 CB LYS A 101 -4.309 18.203 -3.749 1.00 0.00 C ATOM 1526 CG LYS A 101 -3.742 17.541 -2.505 1.00 0.00 C ATOM 1527 CD LYS A 101 -2.793 18.467 -1.763 1.00 0.00 C ATOM 1528 CE LYS A 101 -1.371 18.348 -2.291 1.00 0.00 C ATOM 1529 NZ LYS A 101 -0.961 16.927 -2.464 1.00 0.00 N ATOM 0 H LYS A 101 -4.019 16.120 -5.301 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.230 17.237 -3.699 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.504 18.357 -4.468 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -4.692 19.188 -3.483 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.558 17.249 -1.844 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.216 16.628 -2.785 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -3.135 19.497 -1.864 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.808 18.229 -0.699 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.294 18.867 -3.246 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.685 18.843 -1.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.070 16.876 -2.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.231 16.382 -1.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.435 16.528 -3.300 1.00 0.00 H new ATOM 1543 N LEU A 102 -6.944 19.053 -5.331 1.00 0.00 N ATOM 1544 CA LEU A 102 -7.562 19.861 -6.377 1.00 0.00 C ATOM 1545 C LEU A 102 -6.515 20.682 -7.121 1.00 0.00 C ATOM 1546 O LEU A 102 -6.768 21.185 -8.215 1.00 0.00 O ATOM 1547 CB LEU A 102 -8.620 20.787 -5.775 1.00 0.00 C ATOM 1548 CG LEU A 102 -10.009 20.179 -5.574 1.00 0.00 C ATOM 1549 CD1 LEU A 102 -10.870 20.395 -6.809 1.00 0.00 C ATOM 1550 CD2 LEU A 102 -9.900 18.696 -5.250 1.00 0.00 C ATOM 0 H LEU A 102 -7.310 19.224 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 102 -8.040 19.187 -7.088 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.257 21.141 -4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.718 21.661 -6.419 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.486 20.680 -4.732 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.854 19.956 -6.648 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.976 21.464 -6.997 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.398 19.921 -7.669 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -10.898 18.280 -5.110 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.403 18.180 -6.071 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.321 18.565 -4.336 1.00 0.00 H new ATOM 1562 N ASN A 103 -5.336 20.812 -6.521 1.00 0.00 N ATOM 1563 CA ASN A 103 -4.249 21.571 -7.128 1.00 0.00 C ATOM 1564 C ASN A 103 -3.391 20.677 -8.018 1.00 0.00 C ATOM 1565 O ASN A 103 -2.187 20.895 -8.161 1.00 0.00 O ATOM 1566 CB ASN A 103 -3.381 22.215 -6.045 1.00 0.00 C ATOM 1567 CG ASN A 103 -3.417 21.441 -4.741 1.00 0.00 C ATOM 1568 OD1 ASN A 103 -4.481 21.234 -4.158 1.00 0.00 O ATOM 1569 ND2 ASN A 103 -2.249 21.011 -4.277 1.00 0.00 N ATOM 0 H ASN A 103 -5.109 20.402 -5.615 1.00 0.00 H new ATOM 0 HA ASN A 103 -4.688 22.354 -7.746 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -2.352 22.279 -6.398 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -3.722 23.235 -5.869 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -2.209 20.486 -3.404 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.392 21.206 -4.794 1.00 0.00 H new ATOM 1576 N LEU A 104 -4.018 19.669 -8.614 1.00 0.00 N ATOM 1577 CA LEU A 104 -3.313 18.740 -9.491 1.00 0.00 C ATOM 1578 C LEU A 104 -2.110 18.127 -8.781 1.00 0.00 C ATOM 1579 O LEU A 104 -1.076 17.876 -9.397 1.00 0.00 O ATOM 1580 CB LEU A 104 -2.858 19.456 -10.764 1.00 0.00 C ATOM 1581 CG LEU A 104 -3.948 20.190 -11.547 1.00 0.00 C ATOM 1582 CD1 LEU A 104 -3.350 20.911 -12.745 1.00 0.00 C ATOM 1583 CD2 LEU A 104 -5.030 19.218 -11.993 1.00 0.00 C ATOM 0 H LEU A 104 -5.013 19.474 -8.506 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.001 17.938 -9.758 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.084 20.175 -10.496 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.396 18.722 -11.424 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.403 20.933 -10.891 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.140 21.428 -13.290 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.612 21.636 -12.402 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.869 20.187 -13.403 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.797 19.757 -12.549 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.590 18.452 -12.632 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.479 18.747 -11.119 1.00 0.00 H new ATOM 1595 N MET A 105 -2.255 17.888 -7.482 1.00 0.00 N ATOM 1596 CA MET A 105 -1.181 17.301 -6.689 1.00 0.00 C ATOM 1597 C MET A 105 -1.611 15.962 -6.099 1.00 0.00 C ATOM 1598 O MET A 105 -2.720 15.490 -6.349 1.00 0.00 O ATOM 1599 CB MET A 105 -0.766 18.256 -5.568 1.00 0.00 C ATOM 1600 CG MET A 105 0.259 19.292 -6.000 1.00 0.00 C ATOM 1601 SD MET A 105 1.954 18.700 -5.843 1.00 0.00 S ATOM 1602 CE MET A 105 2.110 18.589 -4.062 1.00 0.00 C ATOM 0 H MET A 105 -3.105 18.092 -6.956 1.00 0.00 H new ATOM 0 HA MET A 105 -0.328 17.131 -7.346 1.00 0.00 H new ATOM 0 HB2 MET A 105 -1.652 18.768 -5.192 1.00 0.00 H new ATOM 0 HB3 MET A 105 -0.358 17.676 -4.740 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.071 19.573 -7.036 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.136 20.192 -5.398 1.00 0.00 H new ATOM 0 HE1 MET A 105 3.156 18.712 -3.780 1.00 0.00 H new ATOM 0 HE2 MET A 105 1.514 19.373 -3.595 1.00 0.00 H new ATOM 0 HE3 MET A 105 1.756 17.615 -3.726 1.00 0.00 H new ATOM 1612 N SER A 106 -0.726 15.354 -5.315 1.00 0.00 N ATOM 1613 CA SER A 106 -1.012 14.067 -4.693 1.00 0.00 C ATOM 1614 C SER A 106 0.020 13.742 -3.617 1.00 0.00 C ATOM 1615 O SER A 106 1.205 14.033 -3.772 1.00 0.00 O ATOM 1616 CB SER A 106 -1.031 12.960 -5.748 1.00 0.00 C ATOM 1617 OG SER A 106 -1.440 13.463 -7.009 1.00 0.00 O ATOM 0 H SER A 106 0.195 15.733 -5.096 1.00 0.00 H new ATOM 0 HA SER A 106 -1.994 14.129 -4.223 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.038 12.518 -5.834 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.707 12.165 -5.433 1.00 0.00 H new ATOM 0 HG SER A 106 -2.302 13.920 -6.915 1.00 0.00 H new ATOM 1623 N GLU A 107 -0.442 13.136 -2.527 1.00 0.00 N ATOM 1624 CA GLU A 107 0.441 12.772 -1.425 1.00 0.00 C ATOM 1625 C GLU A 107 0.529 11.256 -1.276 1.00 0.00 C ATOM 1626 O GLU A 107 -0.075 10.511 -2.048 1.00 0.00 O ATOM 1627 CB GLU A 107 -0.055 13.396 -0.119 1.00 0.00 C ATOM 1628 CG GLU A 107 0.456 14.808 0.114 1.00 0.00 C ATOM 1629 CD GLU A 107 1.776 14.835 0.860 1.00 0.00 C ATOM 1630 OE1 GLU A 107 1.756 14.723 2.104 1.00 0.00 O ATOM 1631 OE2 GLU A 107 2.828 14.969 0.201 1.00 0.00 O ATOM 0 H GLU A 107 -1.421 12.887 -2.384 1.00 0.00 H new ATOM 0 HA GLU A 107 1.437 13.156 -1.648 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.145 13.409 -0.124 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.253 12.765 0.715 1.00 0.00 H new ATOM 0 HG2 GLU A 107 0.575 15.310 -0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -0.288 15.371 0.678 1.00 0.00 H new ATOM 1638 N GLU A 108 1.285 10.808 -0.280 1.00 0.00 N ATOM 1639 CA GLU A 108 1.453 9.381 -0.031 1.00 0.00 C ATOM 1640 C GLU A 108 1.498 9.091 1.467 1.00 0.00 C ATOM 1641 O GLU A 108 1.994 9.899 2.252 1.00 0.00 O ATOM 1642 CB GLU A 108 2.732 8.871 -0.698 1.00 0.00 C ATOM 1643 CG GLU A 108 2.523 8.381 -2.121 1.00 0.00 C ATOM 1644 CD GLU A 108 3.753 8.564 -2.989 1.00 0.00 C ATOM 1645 OE1 GLU A 108 4.114 9.727 -3.266 1.00 0.00 O ATOM 1646 OE2 GLU A 108 4.353 7.546 -3.390 1.00 0.00 O ATOM 0 H GLU A 108 1.791 11.412 0.368 1.00 0.00 H new ATOM 0 HA GLU A 108 0.596 8.861 -0.459 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.473 9.671 -0.703 1.00 0.00 H new ATOM 0 HB3 GLU A 108 3.144 8.058 -0.100 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.251 7.326 -2.101 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.686 8.918 -2.567 1.00 0.00 H new ATOM 1653 N VAL A 109 0.975 7.933 1.855 1.00 0.00 N ATOM 1654 CA VAL A 109 0.955 7.535 3.258 1.00 0.00 C ATOM 1655 C VAL A 109 0.795 6.025 3.399 1.00 0.00 C ATOM 1656 O VAL A 109 -0.242 5.463 3.043 1.00 0.00 O ATOM 1657 CB VAL A 109 -0.183 8.235 4.024 1.00 0.00 C ATOM 1658 CG1 VAL A 109 -1.482 8.160 3.235 1.00 0.00 C ATOM 1659 CG2 VAL A 109 -0.352 7.620 5.405 1.00 0.00 C ATOM 0 H VAL A 109 0.559 7.254 1.218 1.00 0.00 H new ATOM 0 HA VAL A 109 1.911 7.837 3.686 1.00 0.00 H new ATOM 0 HB VAL A 109 0.078 9.286 4.149 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.275 8.660 3.791 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.351 8.651 2.271 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.752 7.116 3.077 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.160 8.127 5.932 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -0.591 6.561 5.305 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.574 7.731 5.968 1.00 0.00 H new ATOM 1669 N THR A 110 1.828 5.372 3.921 1.00 0.00 N ATOM 1670 CA THR A 110 1.803 3.927 4.109 1.00 0.00 C ATOM 1671 C THR A 110 1.053 3.551 5.382 1.00 0.00 C ATOM 1672 O THR A 110 1.567 3.715 6.488 1.00 0.00 O ATOM 1673 CB THR A 110 3.227 3.344 4.174 1.00 0.00 C ATOM 1674 OG1 THR A 110 4.126 4.162 3.418 1.00 0.00 O ATOM 1675 CG2 THR A 110 3.254 1.921 3.637 1.00 0.00 C ATOM 0 H THR A 110 2.693 5.821 4.221 1.00 0.00 H new ATOM 0 HA THR A 110 1.285 3.505 3.248 1.00 0.00 H new ATOM 0 HB THR A 110 3.542 3.328 5.217 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.030 3.786 3.466 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.270 1.530 3.693 1.00 0.00 H new ATOM 0 HG22 THR A 110 2.591 1.294 4.233 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.921 1.917 2.599 1.00 0.00 H new ATOM 1683 N GLY A 111 -0.165 3.044 5.219 1.00 0.00 N ATOM 1684 CA GLY A 111 -0.966 2.652 6.364 1.00 0.00 C ATOM 1685 C GLY A 111 -1.522 1.249 6.230 1.00 0.00 C ATOM 1686 O GLY A 111 -2.357 0.986 5.365 1.00 0.00 O ATOM 0 H GLY A 111 -0.612 2.898 4.314 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -0.358 2.714 7.267 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.790 3.356 6.485 1.00 0.00 H new ATOM 1690 N GLN A 112 -1.057 0.345 7.086 1.00 0.00 N ATOM 1691 CA GLN A 112 -1.512 -1.040 7.057 1.00 0.00 C ATOM 1692 C GLN A 112 -1.840 -1.535 8.462 1.00 0.00 C ATOM 1693 O GLN A 112 -1.715 -0.794 9.437 1.00 0.00 O ATOM 1694 CB GLN A 112 -0.446 -1.936 6.424 1.00 0.00 C ATOM 1695 CG GLN A 112 0.904 -1.859 7.119 1.00 0.00 C ATOM 1696 CD GLN A 112 1.696 -0.628 6.722 1.00 0.00 C ATOM 1697 OE1 GLN A 112 1.903 -0.365 5.537 1.00 0.00 O ATOM 1698 NE2 GLN A 112 2.142 0.134 7.713 1.00 0.00 N ATOM 0 H GLN A 112 -0.365 0.547 7.808 1.00 0.00 H new ATOM 0 HA GLN A 112 -2.419 -1.085 6.455 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -0.795 -2.968 6.440 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -0.323 -1.657 5.378 1.00 0.00 H new ATOM 0 HG2 GLN A 112 0.753 -1.857 8.198 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.483 -2.751 6.880 1.00 0.00 H new ATOM 0 HE21 GLN A 112 1.947 -0.122 8.681 1.00 0.00 H new ATOM 0 HE22 GLN A 112 2.680 0.976 7.507 1.00 0.00 H new ATOM 1707 N PHE A 113 -2.262 -2.791 8.558 1.00 0.00 N ATOM 1708 CA PHE A 113 -2.610 -3.385 9.843 1.00 0.00 C ATOM 1709 C PHE A 113 -2.048 -4.799 9.959 1.00 0.00 C ATOM 1710 O PHE A 113 -1.380 -5.290 9.049 1.00 0.00 O ATOM 1711 CB PHE A 113 -4.129 -3.411 10.022 1.00 0.00 C ATOM 1712 CG PHE A 113 -4.840 -4.243 8.993 1.00 0.00 C ATOM 1713 CD1 PHE A 113 -4.967 -3.795 7.688 1.00 0.00 C ATOM 1714 CD2 PHE A 113 -5.381 -5.473 9.331 1.00 0.00 C ATOM 1715 CE1 PHE A 113 -5.620 -4.558 6.739 1.00 0.00 C ATOM 1716 CE2 PHE A 113 -6.035 -6.240 8.386 1.00 0.00 C ATOM 1717 CZ PHE A 113 -6.156 -5.782 7.089 1.00 0.00 C ATOM 0 H PHE A 113 -2.371 -3.418 7.761 1.00 0.00 H new ATOM 0 HA PHE A 113 -2.169 -2.773 10.629 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -4.363 -3.796 11.014 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -4.509 -2.390 9.978 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -4.551 -2.838 7.409 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -5.291 -5.836 10.344 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -5.711 -4.198 5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -6.451 -7.198 8.662 1.00 0.00 H new ATOM 0 HZ PHE A 113 -6.669 -6.380 6.350 1.00 0.00 H new ATOM 1727 N SER A 114 -2.325 -5.449 11.085 1.00 0.00 N ATOM 1728 CA SER A 114 -1.844 -6.805 11.323 1.00 0.00 C ATOM 1729 C SER A 114 -2.996 -7.731 11.702 1.00 0.00 C ATOM 1730 O SER A 114 -3.921 -7.333 12.410 1.00 0.00 O ATOM 1731 CB SER A 114 -0.788 -6.808 12.430 1.00 0.00 C ATOM 1732 OG SER A 114 0.390 -6.140 12.012 1.00 0.00 O ATOM 0 H SER A 114 -2.880 -5.059 11.847 1.00 0.00 H new ATOM 0 HA SER A 114 -1.394 -7.171 10.400 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.188 -6.323 13.320 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.549 -7.835 12.706 1.00 0.00 H new ATOM 0 HG SER A 114 1.049 -6.154 12.737 1.00 0.00 H new ATOM 1738 N VAL A 115 -2.933 -8.970 11.224 1.00 0.00 N ATOM 1739 CA VAL A 115 -3.969 -9.954 11.512 1.00 0.00 C ATOM 1740 C VAL A 115 -3.401 -11.141 12.282 1.00 0.00 C ATOM 1741 O VAL A 115 -2.243 -11.518 12.097 1.00 0.00 O ATOM 1742 CB VAL A 115 -4.633 -10.465 10.219 1.00 0.00 C ATOM 1743 CG1 VAL A 115 -5.888 -11.261 10.542 1.00 0.00 C ATOM 1744 CG2 VAL A 115 -4.952 -9.304 9.290 1.00 0.00 C ATOM 0 H VAL A 115 -2.175 -9.316 10.635 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.720 -9.453 12.124 1.00 0.00 H new ATOM 0 HB VAL A 115 -3.934 -11.127 9.709 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -6.343 -11.614 9.617 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.626 -12.115 11.166 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.595 -10.625 11.075 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -5.420 -9.683 8.382 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -5.633 -8.615 9.789 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.031 -8.781 9.032 1.00 0.00 H new ATOM 1754 N HIS A 116 -4.223 -11.727 13.146 1.00 0.00 N ATOM 1755 CA HIS A 116 -3.803 -12.873 13.944 1.00 0.00 C ATOM 1756 C HIS A 116 -4.994 -13.764 14.284 1.00 0.00 C ATOM 1757 O HIS A 116 -6.040 -13.299 14.736 1.00 0.00 O ATOM 1758 CB HIS A 116 -3.120 -12.403 15.229 1.00 0.00 C ATOM 1759 CG HIS A 116 -4.040 -11.689 16.170 1.00 0.00 C ATOM 1760 ND1 HIS A 116 -3.903 -11.741 17.541 1.00 0.00 N ATOM 1761 CD2 HIS A 116 -5.114 -10.901 15.930 1.00 0.00 C ATOM 1762 CE1 HIS A 116 -4.855 -11.017 18.104 1.00 0.00 C ATOM 1763 NE2 HIS A 116 -5.603 -10.496 17.148 1.00 0.00 N ATOM 0 H HIS A 116 -5.184 -11.427 13.312 1.00 0.00 H new ATOM 0 HA HIS A 116 -3.093 -13.454 13.355 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -2.690 -13.265 15.739 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -2.293 -11.741 14.970 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.512 -10.639 14.961 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -4.997 -10.876 19.165 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -6.412 -9.891 17.291 1.00 0.00 H new ATOM 1772 N PRO A 117 -4.833 -15.077 14.061 1.00 0.00 N ATOM 1773 CA PRO A 117 -5.885 -16.061 14.336 1.00 0.00 C ATOM 1774 C PRO A 117 -6.130 -16.245 15.830 1.00 0.00 C ATOM 1775 O PRO A 117 -5.188 -16.295 16.621 1.00 0.00 O ATOM 1776 CB PRO A 117 -5.334 -17.350 13.722 1.00 0.00 C ATOM 1777 CG PRO A 117 -3.855 -17.172 13.731 1.00 0.00 C ATOM 1778 CD PRO A 117 -3.613 -15.702 13.523 1.00 0.00 C ATOM 0 HA PRO A 117 -6.847 -15.755 13.926 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.631 -18.223 14.302 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.709 -17.498 12.709 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -3.427 -17.508 14.676 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -3.386 -17.760 12.942 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -2.721 -15.363 14.050 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -3.470 -15.463 12.469 1.00 0.00 H new ATOM 1786 N GLU A 118 -7.400 -16.346 16.209 1.00 0.00 N ATOM 1787 CA GLU A 118 -7.767 -16.524 17.609 1.00 0.00 C ATOM 1788 C GLU A 118 -7.648 -17.989 18.020 1.00 0.00 C ATOM 1789 O GLU A 118 -8.610 -18.752 17.929 1.00 0.00 O ATOM 1790 CB GLU A 118 -9.194 -16.029 17.852 1.00 0.00 C ATOM 1791 CG GLU A 118 -9.349 -14.524 17.712 1.00 0.00 C ATOM 1792 CD GLU A 118 -8.368 -13.754 18.575 1.00 0.00 C ATOM 1793 OE1 GLU A 118 -8.162 -14.154 19.740 1.00 0.00 O ATOM 1794 OE2 GLU A 118 -7.807 -12.752 18.085 1.00 0.00 O ATOM 0 H GLU A 118 -8.191 -16.308 15.567 1.00 0.00 H new ATOM 0 HA GLU A 118 -7.078 -15.937 18.216 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -9.865 -16.522 17.148 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -9.507 -16.326 18.853 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -9.207 -14.243 16.668 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -10.366 -14.240 17.983 1.00 0.00 H new ATOM 1801 N THR A 119 -6.460 -18.376 18.474 1.00 0.00 N ATOM 1802 CA THR A 119 -6.213 -19.748 18.898 1.00 0.00 C ATOM 1803 C THR A 119 -5.366 -19.788 20.164 1.00 0.00 C ATOM 1804 O THR A 119 -4.421 -19.017 20.333 1.00 0.00 O ATOM 1805 CB THR A 119 -5.505 -20.558 17.795 1.00 0.00 C ATOM 1806 OG1 THR A 119 -4.314 -19.881 17.378 1.00 0.00 O ATOM 1807 CG2 THR A 119 -6.424 -20.762 16.599 1.00 0.00 C ATOM 0 H THR A 119 -5.653 -17.758 18.557 1.00 0.00 H new ATOM 0 HA THR A 119 -7.186 -20.196 19.100 1.00 0.00 H new ATOM 0 HB THR A 119 -5.243 -21.534 18.203 1.00 0.00 H new ATOM 0 HG1 THR A 119 -3.869 -20.403 16.678 1.00 0.00 H new ATOM 0 HG21 THR A 119 -5.903 -21.336 15.833 1.00 0.00 H new ATOM 0 HG22 THR A 119 -7.316 -21.303 16.914 1.00 0.00 H new ATOM 0 HG23 THR A 119 -6.712 -19.793 16.192 1.00 0.00 H new ATOM 1815 N PRO A 120 -5.709 -20.709 21.077 1.00 0.00 N ATOM 1816 CA PRO A 120 -4.991 -20.872 22.345 1.00 0.00 C ATOM 1817 C PRO A 120 -3.592 -21.446 22.149 1.00 0.00 C ATOM 1818 O PRO A 120 -3.384 -22.334 21.322 1.00 0.00 O ATOM 1819 CB PRO A 120 -5.868 -21.856 23.125 1.00 0.00 C ATOM 1820 CG PRO A 120 -6.602 -22.621 22.078 1.00 0.00 C ATOM 1821 CD PRO A 120 -6.824 -21.661 20.942 1.00 0.00 C ATOM 0 HA PRO A 120 -4.839 -19.920 22.853 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -5.265 -22.516 23.748 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -6.556 -21.333 23.789 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -6.025 -23.486 21.751 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -7.550 -22.997 22.462 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.805 -22.168 19.978 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -7.790 -21.162 21.020 1.00 0.00 H new ATOM 1829 N LYS A 121 -2.635 -20.934 22.916 1.00 0.00 N ATOM 1830 CA LYS A 121 -1.255 -21.396 22.829 1.00 0.00 C ATOM 1831 C LYS A 121 -0.438 -20.897 24.016 1.00 0.00 C ATOM 1832 O LYS A 121 -0.341 -19.697 24.273 1.00 0.00 O ATOM 1833 CB LYS A 121 -0.618 -20.920 21.522 1.00 0.00 C ATOM 1834 CG LYS A 121 0.476 -21.840 21.007 1.00 0.00 C ATOM 1835 CD LYS A 121 0.569 -21.803 19.491 1.00 0.00 C ATOM 1836 CE LYS A 121 -0.370 -22.814 18.850 1.00 0.00 C ATOM 1837 NZ LYS A 121 -0.191 -22.878 17.373 1.00 0.00 N ATOM 0 H LYS A 121 -2.790 -20.198 23.605 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.261 -22.486 22.848 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -1.394 -20.830 20.761 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -0.202 -19.924 21.672 1.00 0.00 H new ATOM 0 HG2 LYS A 121 1.433 -21.546 21.438 1.00 0.00 H new ATOM 0 HG3 LYS A 121 0.279 -22.860 21.335 1.00 0.00 H new ATOM 0 HD2 LYS A 121 0.326 -20.802 19.135 1.00 0.00 H new ATOM 0 HD3 LYS A 121 1.594 -22.010 19.183 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -0.192 -23.799 19.281 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -1.402 -22.548 19.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -0.848 -23.578 16.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -0.386 -21.944 16.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 0.787 -23.157 17.154 1.00 0.00 H new ATOM 1851 N PRO A 122 0.165 -21.838 24.758 1.00 0.00 N ATOM 1852 CA PRO A 122 0.986 -21.517 25.929 1.00 0.00 C ATOM 1853 C PRO A 122 2.297 -20.837 25.550 1.00 0.00 C ATOM 1854 O PRO A 122 2.867 -20.083 26.338 1.00 0.00 O ATOM 1855 CB PRO A 122 1.256 -22.886 26.559 1.00 0.00 C ATOM 1856 CG PRO A 122 1.139 -23.852 25.431 1.00 0.00 C ATOM 1857 CD PRO A 122 0.092 -23.288 24.510 1.00 0.00 C ATOM 0 HA PRO A 122 0.486 -20.816 26.597 1.00 0.00 H new ATOM 0 HB2 PRO A 122 2.247 -22.925 27.012 1.00 0.00 H new ATOM 0 HB3 PRO A 122 0.536 -23.108 27.347 1.00 0.00 H new ATOM 0 HG2 PRO A 122 2.092 -23.967 24.915 1.00 0.00 H new ATOM 0 HG3 PRO A 122 0.851 -24.840 25.791 1.00 0.00 H new ATOM 0 HD2 PRO A 122 0.302 -23.529 23.468 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -0.898 -23.685 24.736 1.00 0.00 H new ATOM 1865 N SER A 123 2.769 -21.109 24.337 1.00 0.00 N ATOM 1866 CA SER A 123 4.015 -20.525 23.854 1.00 0.00 C ATOM 1867 C SER A 123 3.793 -19.097 23.366 1.00 0.00 C ATOM 1868 O SER A 123 2.659 -18.679 23.132 1.00 0.00 O ATOM 1869 CB SER A 123 4.598 -21.377 22.725 1.00 0.00 C ATOM 1870 OG SER A 123 3.933 -21.124 21.500 1.00 0.00 O ATOM 0 H SER A 123 2.308 -21.729 23.672 1.00 0.00 H new ATOM 0 HA SER A 123 4.722 -20.501 24.684 1.00 0.00 H new ATOM 0 HB2 SER A 123 5.661 -21.164 22.616 1.00 0.00 H new ATOM 0 HB3 SER A 123 4.509 -22.433 22.979 1.00 0.00 H new ATOM 0 HG SER A 123 4.325 -21.679 20.794 1.00 0.00 H new ATOM 1876 N ILE A 124 4.884 -18.353 23.215 1.00 0.00 N ATOM 1877 CA ILE A 124 4.809 -16.973 22.754 1.00 0.00 C ATOM 1878 C ILE A 124 4.212 -16.892 21.354 1.00 0.00 C ATOM 1879 O ILE A 124 4.223 -17.870 20.606 1.00 0.00 O ATOM 1880 CB ILE A 124 6.197 -16.305 22.747 1.00 0.00 C ATOM 1881 CG1 ILE A 124 6.062 -14.798 22.520 1.00 0.00 C ATOM 1882 CG2 ILE A 124 7.080 -16.930 21.677 1.00 0.00 C ATOM 1883 CD1 ILE A 124 7.181 -13.991 23.139 1.00 0.00 C ATOM 0 H ILE A 124 5.830 -18.683 23.405 1.00 0.00 H new ATOM 0 HA ILE A 124 4.163 -16.442 23.453 1.00 0.00 H new ATOM 0 HB ILE A 124 6.666 -16.466 23.718 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.033 -14.601 21.448 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.111 -14.461 22.932 1.00 0.00 H new ATOM 0 HG21 ILE A 124 8.057 -16.448 21.684 1.00 0.00 H new ATOM 0 HG22 ILE A 124 7.199 -17.994 21.880 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.617 -16.796 20.699 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.020 -12.932 22.938 1.00 0.00 H new ATOM 0 HD12 ILE A 124 7.197 -14.158 24.216 1.00 0.00 H new ATOM 0 HD13 ILE A 124 8.134 -14.301 22.710 1.00 0.00 H new ATOM 1895 N SER A 125 3.692 -15.720 21.004 1.00 0.00 N ATOM 1896 CA SER A 125 3.088 -15.512 19.693 1.00 0.00 C ATOM 1897 C SER A 125 4.160 -15.296 18.629 1.00 0.00 C ATOM 1898 O SER A 125 5.324 -15.055 18.945 1.00 0.00 O ATOM 1899 CB SER A 125 2.140 -14.311 19.730 1.00 0.00 C ATOM 1900 OG SER A 125 2.848 -13.111 19.985 1.00 0.00 O ATOM 0 H SER A 125 3.677 -14.900 21.610 1.00 0.00 H new ATOM 0 HA SER A 125 2.520 -16.406 19.435 1.00 0.00 H new ATOM 0 HB2 SER A 125 1.612 -14.231 18.780 1.00 0.00 H new ATOM 0 HB3 SER A 125 1.385 -14.463 20.502 1.00 0.00 H new ATOM 0 HG SER A 125 2.221 -12.358 20.002 1.00 0.00 H new ATOM 1906 N GLY A 126 3.757 -15.385 17.365 1.00 0.00 N ATOM 1907 CA GLY A 126 4.694 -15.197 16.273 1.00 0.00 C ATOM 1908 C GLY A 126 5.327 -16.499 15.822 1.00 0.00 C ATOM 1909 O GLY A 126 6.458 -16.823 16.186 1.00 0.00 O ATOM 0 H GLY A 126 2.799 -15.584 17.078 1.00 0.00 H new ATOM 0 HA2 GLY A 126 4.178 -14.736 15.431 1.00 0.00 H new ATOM 0 HA3 GLY A 126 5.476 -14.505 16.585 1.00 0.00 H new ATOM 1913 N PRO A 127 4.588 -17.271 15.011 1.00 0.00 N ATOM 1914 CA PRO A 127 5.064 -18.557 14.494 1.00 0.00 C ATOM 1915 C PRO A 127 6.187 -18.393 13.476 1.00 0.00 C ATOM 1916 O PRO A 127 7.097 -19.219 13.402 1.00 0.00 O ATOM 1917 CB PRO A 127 3.821 -19.153 13.828 1.00 0.00 C ATOM 1918 CG PRO A 127 2.982 -17.975 13.468 1.00 0.00 C ATOM 1919 CD PRO A 127 3.232 -16.947 14.537 1.00 0.00 C ATOM 0 HA PRO A 127 5.484 -19.183 15.282 1.00 0.00 H new ATOM 0 HB2 PRO A 127 4.086 -19.735 12.945 1.00 0.00 H new ATOM 0 HB3 PRO A 127 3.292 -19.824 14.505 1.00 0.00 H new ATOM 0 HG2 PRO A 127 3.252 -17.589 12.485 1.00 0.00 H new ATOM 0 HG3 PRO A 127 1.927 -18.246 13.426 1.00 0.00 H new ATOM 0 HD2 PRO A 127 3.176 -15.933 14.140 1.00 0.00 H new ATOM 0 HD3 PRO A 127 2.498 -17.016 15.340 1.00 0.00 H new ATOM 1927 N SER A 128 6.117 -17.322 12.692 1.00 0.00 N ATOM 1928 CA SER A 128 7.126 -17.052 11.675 1.00 0.00 C ATOM 1929 C SER A 128 7.984 -15.852 12.067 1.00 0.00 C ATOM 1930 O SER A 128 7.680 -15.145 13.027 1.00 0.00 O ATOM 1931 CB SER A 128 6.462 -16.796 10.321 1.00 0.00 C ATOM 1932 OG SER A 128 5.792 -15.547 10.309 1.00 0.00 O ATOM 0 H SER A 128 5.372 -16.627 12.742 1.00 0.00 H new ATOM 0 HA SER A 128 7.769 -17.928 11.596 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.215 -16.816 9.534 1.00 0.00 H new ATOM 0 HB3 SER A 128 5.753 -17.595 10.103 1.00 0.00 H new ATOM 0 HG SER A 128 5.378 -15.407 9.432 1.00 0.00 H new ATOM 1938 N SER A 129 9.059 -15.631 11.316 1.00 0.00 N ATOM 1939 CA SER A 129 9.964 -14.520 11.586 1.00 0.00 C ATOM 1940 C SER A 129 10.127 -14.305 13.088 1.00 0.00 C ATOM 1941 O SER A 129 10.135 -13.171 13.567 1.00 0.00 O ATOM 1942 CB SER A 129 9.445 -13.240 10.929 1.00 0.00 C ATOM 1943 OG SER A 129 8.241 -12.806 11.538 1.00 0.00 O ATOM 0 H SER A 129 9.324 -16.206 10.517 1.00 0.00 H new ATOM 0 HA SER A 129 10.938 -14.766 11.164 1.00 0.00 H new ATOM 0 HB2 SER A 129 10.199 -12.456 11.007 1.00 0.00 H new ATOM 0 HB3 SER A 129 9.276 -13.416 9.867 1.00 0.00 H new ATOM 0 HG SER A 129 7.957 -13.464 12.207 1.00 0.00 H new ATOM 1949 N GLY A 130 10.256 -15.403 13.827 1.00 0.00 N ATOM 1950 CA GLY A 130 10.417 -15.314 15.266 1.00 0.00 C ATOM 1951 C GLY A 130 9.126 -15.588 16.012 1.00 0.00 C ATOM 1952 O GLY A 130 8.948 -15.140 17.144 1.00 0.00 O ATOM 0 H GLY A 130 10.252 -16.352 13.454 1.00 0.00 H new ATOM 0 HA2 GLY A 130 11.177 -16.026 15.588 1.00 0.00 H new ATOM 0 HA3 GLY A 130 10.780 -14.320 15.527 1.00 0.00 H new TER 1956 GLY A 130