USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1098 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 50 ALY H2 : A 50 ALY N : A 49 ARG C :(H bumps) USER MOD Set 1.1: B 800 LYS NZ :NH3+ -119:sc= 0.00753 (180deg=0) USER MOD Set 1.2: B 810 TYR OH : rot 15:sc= -1.17! USER MOD Set 2.1: B 799 CYS SG : rot 136:sc= -5.96! USER MOD Set 2.2: B 802 TYR OH : rot -15:sc= -1.01 USER MOD Set 2.3: B 803 ASN : amide:sc= -8.3! C(o=-15!,f=-19!) USER MOD Set 3.1: B 793 GLN : amide:sc= -0.384 K(o=-1.2,f=-3.1!) USER MOD Set 3.2: B 797 THR OG1 : rot 63:sc= -0.789 USER MOD Set 4.1: B 760 TYR OH : rot -88:sc= -2.19! USER MOD Set 4.2: B 798 ASN : amide:sc= -6.63! C(o=-8.8!,f=-11!) USER MOD Single : A 46 SER OG : rot 36:sc= 0.0125 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -0.631 K(o=-0.63,f=-0.028) USER MOD Single : A 56 CYS SG : rot 180:sc= 0 USER MOD Single : B 716 SER OG : rot 68:sc= 1.12 USER MOD Single : B 717 HIS : no HD1:sc= -0.106 X(o=-0.11,f=-0.014) USER MOD Single : B 718 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 719 SER OG : rot 180:sc= 0 USER MOD Single : B 720 LYS NZ :NH3+ -137:sc= -1.94 (180deg=-5.43!) USER MOD Single : B 727 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.084) USER MOD Single : B 729 TYR OH : rot 180:sc= 0 USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 65:sc= 0.536 USER MOD Single : B 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 737 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 738 GLN : amide:sc= -4.36! C(o=-4.4!,f=-3!) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot 180:sc= -0.62 USER MOD Single : B 742 HIS : no HD1:sc= -2.15! C(o=-2.1!,f=-8!) USER MOD Single : B 743 GLN : amide:sc= -0.0223 X(o=-0.022,f=0) USER MOD Single : B 744 SER OG : rot 100:sc= -0.944 USER MOD Single : B 749 MET CE :methyl -145:sc= -3.78! (180deg=-6.06!) USER MOD Single : B 753 LYS NZ :NH3+ -173:sc= 0.665 (180deg=0.369) USER MOD Single : B 755 THR OG1 : rot 180:sc= 0 USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl -151:sc= -1.42 (180deg=-3.28!) USER MOD Single : B 771 LYS NZ :NH3+ 170:sc= -0.016 (180deg=-0.0813) USER MOD Single : B 772 THR OG1 : rot 180:sc= 0 USER MOD Single : B 773 MET CE :methyl -112:sc= -6.38! (180deg=-12!) USER MOD Single : B 774 SER OG : rot -93:sc= 0.345 USER MOD Single : B 778 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 779 ASN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot 180:sc= 0 USER MOD Single : B 784 SER OG : rot 180:sc= -0.946 USER MOD Single : B 785 LYS NZ :NH3+ -159:sc= 0.0358 (180deg=-0.588) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl -158:sc= -8.67! (180deg=-11.5!) USER MOD Single : B 807 SER OG : rot -170:sc= -0.116 USER MOD Single : B 809 TYR OH : rot 180:sc= 0 USER MOD Single : B 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 812 CYS SG : rot -64:sc= -1.16 USER MOD Single : B 814 ASN : amide:sc= -0.33 K(o=-0.33,f=-3!) USER MOD Single : B 818 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 822 SER OG : rot 180:sc= 0 USER MOD Single : B 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 832 LYS NZ :NH3+ -126:sc= -0.086 (180deg=-0.293) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 46 -19.279 10.052 -3.859 1.00 0.00 N ATOM 2 CA SER A 46 -18.979 9.557 -5.232 1.00 0.00 C ATOM 3 C SER A 46 -17.916 8.458 -5.181 1.00 0.00 C ATOM 4 O SER A 46 -16.909 8.587 -4.515 1.00 0.00 O ATOM 5 CB SER A 46 -18.445 10.779 -5.982 1.00 0.00 C ATOM 6 OG SER A 46 -19.515 11.669 -6.264 1.00 0.00 O ATOM 0 HA SER A 46 -19.856 9.127 -5.716 1.00 0.00 H new ATOM 0 HB2 SER A 46 -17.687 11.284 -5.383 1.00 0.00 H new ATOM 0 HB3 SER A 46 -17.963 10.468 -6.909 1.00 0.00 H new ATOM 0 HG SER A 46 -20.151 11.663 -5.518 1.00 0.00 H new ATOM 14 N TYR A 47 -18.133 7.375 -5.877 1.00 0.00 N ATOM 15 CA TYR A 47 -17.134 6.268 -5.868 1.00 0.00 C ATOM 16 C TYR A 47 -16.795 5.867 -4.431 1.00 0.00 C ATOM 17 O TYR A 47 -17.337 6.399 -3.483 1.00 0.00 O ATOM 18 CB TYR A 47 -15.899 6.850 -6.560 1.00 0.00 C ATOM 19 CG TYR A 47 -16.123 6.877 -8.053 1.00 0.00 C ATOM 20 CD1 TYR A 47 -16.843 7.928 -8.633 1.00 0.00 C ATOM 21 CD2 TYR A 47 -15.609 5.853 -8.857 1.00 0.00 C ATOM 22 CE1 TYR A 47 -17.050 7.953 -10.018 1.00 0.00 C ATOM 23 CE2 TYR A 47 -15.816 5.878 -10.241 1.00 0.00 C ATOM 24 CZ TYR A 47 -16.537 6.929 -10.821 1.00 0.00 C ATOM 25 OH TYR A 47 -16.743 6.955 -12.186 1.00 0.00 O ATOM 0 H TYR A 47 -18.959 7.209 -6.452 1.00 0.00 H new ATOM 0 HA TYR A 47 -17.506 5.374 -6.368 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -15.704 7.858 -6.193 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -15.020 6.250 -6.324 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -17.239 8.719 -8.013 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -15.052 5.043 -8.409 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -17.606 8.763 -10.466 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -15.420 5.087 -10.861 1.00 0.00 H new ATOM 0 HH TYR A 47 -16.321 6.171 -12.596 1.00 0.00 H new ATOM 35 N GLY A 48 -15.897 4.935 -4.261 1.00 0.00 N ATOM 36 CA GLY A 48 -15.515 4.511 -2.885 1.00 0.00 C ATOM 37 C GLY A 48 -16.662 3.721 -2.251 1.00 0.00 C ATOM 38 O GLY A 48 -17.754 4.224 -2.072 1.00 0.00 O ATOM 0 H GLY A 48 -15.412 4.449 -5.015 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -14.614 3.898 -2.920 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -15.283 5.385 -2.276 1.00 0.00 H new ATOM 42 N ARG A 49 -16.417 2.489 -1.905 1.00 0.00 N ATOM 43 CA ARG A 49 -17.473 1.664 -1.254 1.00 0.00 C ATOM 44 C ARG A 49 -16.806 0.536 -0.472 1.00 0.00 C ATOM 45 O ARG A 49 -17.010 -0.632 -0.737 1.00 0.00 O ATOM 46 CB ARG A 49 -18.319 1.108 -2.400 1.00 0.00 C ATOM 47 CG ARG A 49 -19.788 1.069 -1.972 1.00 0.00 C ATOM 48 CD ARG A 49 -20.357 2.489 -1.959 1.00 0.00 C ATOM 49 NE ARG A 49 -20.383 2.907 -3.393 1.00 0.00 N ATOM 50 CZ ARG A 49 -21.037 3.983 -3.769 1.00 0.00 C ATOM 51 NH1 ARG A 49 -21.684 4.720 -2.899 1.00 0.00 N ATOM 52 NH2 ARG A 49 -21.041 4.325 -5.029 1.00 0.00 N ATOM 0 H ARG A 49 -15.525 2.015 -2.046 1.00 0.00 H new ATOM 0 HA ARG A 49 -18.087 2.233 -0.556 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -18.203 1.730 -3.288 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -17.979 0.107 -2.666 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -20.360 0.443 -2.657 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -19.877 0.622 -0.982 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -21.356 2.510 -1.523 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -19.735 3.158 -1.364 1.00 0.00 H new ATOM 0 HE ARG A 49 -19.887 2.350 -4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -21.685 4.461 -1.912 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -22.186 5.552 -3.209 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -20.539 3.759 -5.713 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -21.546 5.159 -5.330 1.00 0.00 H new HETATM 66 OH ALY A 50 -10.784 -1.469 2.571 1.00 0.00 O HETATM 67 CH ALY A 50 -10.578 -1.137 1.421 1.00 0.00 C HETATM 68 CH3 ALY A 50 -9.161 -0.844 0.922 1.00 0.00 C HETATM 69 NZ ALY A 50 -11.559 -1.000 0.569 1.00 0.00 N HETATM 70 CE ALY A 50 -11.575 0.158 -0.364 1.00 0.00 C HETATM 71 CD ALY A 50 -11.887 1.366 0.517 1.00 0.00 C HETATM 72 CG ALY A 50 -13.399 1.525 0.644 1.00 0.00 C HETATM 73 CB ALY A 50 -13.938 0.573 1.728 1.00 0.00 C HETATM 74 CA ALY A 50 -15.222 -0.136 1.243 1.00 0.00 C HETATM 75 N ALY A 50 -15.975 0.890 0.464 1.00 0.00 N HETATM 76 C ALY A 50 -16.055 -0.599 2.440 1.00 0.00 C HETATM 77 O ALY A 50 -15.733 -0.319 3.577 1.00 0.00 O HETATM 0 HH33 ALY A 50 -8.734 -0.025 1.500 1.00 0.00 H new HETATM 0 HH32 ALY A 50 -8.542 -1.733 1.041 1.00 0.00 H new HETATM 0 HH31 ALY A 50 -9.197 -0.565 -0.131 1.00 0.00 H new HETATM 0 HZ ALY A 50 -12.313 -1.686 0.544 1.00 0.00 H new HETATM 0 HG3 ALY A 50 -13.877 1.310 -0.312 1.00 0.00 H new HETATM 0 HG2 ALY A 50 -13.645 2.556 0.899 1.00 0.00 H new HETATM 0 HE3 ALY A 50 -12.329 0.030 -1.141 1.00 0.00 H new HETATM 0 HE2 ALY A 50 -10.615 0.273 -0.868 1.00 0.00 H new HETATM 0 HD3 ALY A 50 -11.451 2.267 0.085 1.00 0.00 H new HETATM 0 HD2 ALY A 50 -11.440 1.236 1.503 1.00 0.00 H new HETATM 0 HCA ALY A 50 -14.994 -1.017 0.643 1.00 0.00 H new HETATM 0 HB3 ALY A 50 -14.148 1.133 2.639 1.00 0.00 H new HETATM 0 HB2 ALY A 50 -13.179 -0.169 1.978 1.00 0.00 H new HETATM 0 H ALY A 50 -15.594 1.830 0.357 1.00 0.00 H new ATOM 92 N LYS A 51 -17.130 -1.298 2.194 1.00 0.00 N ATOM 93 CA LYS A 51 -17.989 -1.759 3.320 1.00 0.00 C ATOM 94 C LYS A 51 -17.926 -3.281 3.464 1.00 0.00 C ATOM 95 O LYS A 51 -18.938 -3.951 3.517 1.00 0.00 O ATOM 96 CB LYS A 51 -19.404 -1.319 2.934 1.00 0.00 C ATOM 97 CG LYS A 51 -19.786 -1.946 1.592 1.00 0.00 C ATOM 98 CD LYS A 51 -21.310 -1.999 1.469 1.00 0.00 C ATOM 99 CE LYS A 51 -21.853 -3.138 2.334 1.00 0.00 C ATOM 100 NZ LYS A 51 -23.296 -3.236 1.976 1.00 0.00 N ATOM 0 H LYS A 51 -17.449 -1.569 1.264 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.669 -1.343 4.275 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -20.113 -1.622 3.704 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -19.452 -0.232 2.866 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -19.364 -1.363 0.773 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -19.369 -2.950 1.516 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -21.744 -1.050 1.784 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.596 -2.150 0.428 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.331 -4.073 2.130 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -21.723 -2.925 3.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.740 -3.997 2.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -23.768 -2.334 2.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.389 -3.446 0.962 1.00 0.00 H new ATOM 114 N ARG A 52 -16.745 -3.834 3.537 1.00 0.00 N ATOM 115 CA ARG A 52 -16.622 -5.313 3.690 1.00 0.00 C ATOM 116 C ARG A 52 -17.459 -6.035 2.632 1.00 0.00 C ATOM 117 O ARG A 52 -17.963 -5.431 1.706 1.00 0.00 O ATOM 118 CB ARG A 52 -17.168 -5.608 5.089 1.00 0.00 C ATOM 119 CG ARG A 52 -16.326 -6.703 5.747 1.00 0.00 C ATOM 120 CD ARG A 52 -17.203 -7.511 6.707 1.00 0.00 C ATOM 121 NE ARG A 52 -17.447 -6.596 7.861 1.00 0.00 N ATOM 122 CZ ARG A 52 -18.058 -7.024 8.942 1.00 0.00 C ATOM 123 NH1 ARG A 52 -18.469 -8.264 9.040 1.00 0.00 N ATOM 124 NH2 ARG A 52 -18.258 -6.201 9.935 1.00 0.00 N ATOM 0 H ARG A 52 -15.861 -3.327 3.497 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.594 -5.653 3.565 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.147 -4.704 5.697 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -18.209 -5.924 5.025 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -15.902 -7.358 4.986 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -15.490 -6.259 6.287 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -18.138 -7.808 6.233 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -16.702 -8.425 7.026 1.00 0.00 H new ATOM 0 HE ARG A 52 -17.135 -5.626 7.809 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.316 -8.914 8.269 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -18.942 -8.579 9.887 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -17.941 -5.234 9.868 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -18.732 -6.525 10.778 1.00 0.00 H new ATOM 138 N ARG A 53 -17.621 -7.323 2.769 1.00 0.00 N ATOM 139 CA ARG A 53 -18.429 -8.082 1.774 1.00 0.00 C ATOM 140 C ARG A 53 -19.906 -8.081 2.176 1.00 0.00 C ATOM 141 O ARG A 53 -20.332 -7.303 3.007 1.00 0.00 O ATOM 142 CB ARG A 53 -17.866 -9.503 1.816 1.00 0.00 C ATOM 143 CG ARG A 53 -17.271 -9.856 0.451 1.00 0.00 C ATOM 144 CD ARG A 53 -15.863 -10.424 0.641 1.00 0.00 C ATOM 145 NE ARG A 53 -15.486 -10.968 -0.698 1.00 0.00 N ATOM 146 CZ ARG A 53 -14.294 -11.477 -0.907 1.00 0.00 C ATOM 147 NH1 ARG A 53 -13.401 -11.523 0.051 1.00 0.00 N ATOM 148 NH2 ARG A 53 -13.993 -11.945 -2.087 1.00 0.00 N ATOM 0 H ARG A 53 -17.229 -7.882 3.527 1.00 0.00 H new ATOM 0 HA ARG A 53 -18.373 -7.646 0.777 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -17.101 -9.580 2.589 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -18.654 -10.210 2.075 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -17.903 -10.585 -0.056 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -17.235 -8.970 -0.182 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -15.165 -9.652 0.965 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -15.851 -11.204 1.402 1.00 0.00 H new ATOM 0 HE ARG A 53 -16.164 -10.944 -1.460 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.627 -11.160 0.977 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.480 -11.922 -0.129 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.682 -11.914 -2.839 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.069 -12.342 -2.258 1.00 0.00 H new ATOM 162 N GLN A 54 -20.690 -8.946 1.593 1.00 0.00 N ATOM 163 CA GLN A 54 -22.139 -8.987 1.939 1.00 0.00 C ATOM 164 C GLN A 54 -22.522 -10.357 2.504 1.00 0.00 C ATOM 165 O GLN A 54 -23.525 -10.502 3.174 1.00 0.00 O ATOM 166 CB GLN A 54 -22.864 -8.737 0.614 1.00 0.00 C ATOM 167 CG GLN A 54 -22.510 -9.846 -0.379 1.00 0.00 C ATOM 168 CD GLN A 54 -23.369 -9.698 -1.636 1.00 0.00 C ATOM 169 OE1 GLN A 54 -24.572 -9.860 -1.587 1.00 0.00 O ATOM 170 NE2 GLN A 54 -22.798 -9.395 -2.770 1.00 0.00 N ATOM 0 H GLN A 54 -20.391 -9.625 0.893 1.00 0.00 H new ATOM 0 HA GLN A 54 -22.399 -8.251 2.700 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -23.942 -8.710 0.776 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -22.578 -7.766 0.208 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -21.453 -9.792 -0.639 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -22.677 -10.823 0.075 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -21.788 -9.259 -2.812 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -23.362 -9.294 -3.614 1.00 0.00 H new ATOM 179 N ARG A 55 -21.736 -11.366 2.241 1.00 0.00 N ATOM 180 CA ARG A 55 -22.067 -12.721 2.765 1.00 0.00 C ATOM 181 C ARG A 55 -20.819 -13.607 2.790 1.00 0.00 C ATOM 182 O ARG A 55 -20.106 -13.720 1.813 1.00 0.00 O ATOM 183 CB ARG A 55 -23.097 -13.281 1.781 1.00 0.00 C ATOM 184 CG ARG A 55 -22.510 -13.278 0.367 1.00 0.00 C ATOM 185 CD ARG A 55 -22.320 -14.720 -0.112 1.00 0.00 C ATOM 186 NE ARG A 55 -20.848 -14.866 -0.317 1.00 0.00 N ATOM 187 CZ ARG A 55 -20.350 -15.932 -0.898 1.00 0.00 C ATOM 188 NH1 ARG A 55 -21.128 -16.899 -1.318 1.00 0.00 N ATOM 189 NH2 ARG A 55 -19.058 -16.031 -1.061 1.00 0.00 N ATOM 0 H ARG A 55 -20.881 -11.310 1.687 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.447 -12.684 3.786 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -23.375 -14.295 2.068 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -24.006 -12.681 1.810 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -23.174 -12.743 -0.312 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -21.555 -12.753 0.360 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -22.689 -15.433 0.625 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.868 -14.905 -1.036 1.00 0.00 H new ATOM 0 HE ARG A 55 -20.221 -14.126 -0.001 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -22.138 -16.830 -1.195 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.723 -17.720 -1.768 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -18.444 -15.283 -0.738 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.663 -16.856 -1.512 1.00 0.00 H new ATOM 203 N CYS A 56 -20.549 -14.236 3.903 1.00 0.00 N ATOM 204 CA CYS A 56 -19.350 -15.118 3.992 1.00 0.00 C ATOM 205 C CYS A 56 -18.099 -14.376 3.513 1.00 0.00 C ATOM 206 O CYS A 56 -17.685 -14.618 2.391 1.00 0.00 O ATOM 207 CB CYS A 56 -19.661 -16.294 3.064 1.00 0.00 C ATOM 208 SG CYS A 56 -20.408 -17.636 4.021 1.00 0.00 S ATOM 209 OXT CYS A 56 -17.551 -13.615 4.293 1.00 0.00 O ATOM 0 H CYS A 56 -21.108 -14.177 4.754 1.00 0.00 H new ATOM 0 HA CYS A 56 -19.151 -15.439 5.014 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -20.339 -15.977 2.272 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -18.748 -16.642 2.581 1.00 0.00 H new ATOM 0 HG CYS A 56 -20.675 -18.635 3.233 1.00 0.00 H new TER 215 CYS A 56 ATOM 216 N GLY B 715 31.544 9.855 -11.152 1.00 0.00 N ATOM 217 CA GLY B 715 30.662 8.886 -10.442 1.00 0.00 C ATOM 218 C GLY B 715 29.617 9.650 -9.627 1.00 0.00 C ATOM 219 O GLY B 715 29.887 10.121 -8.539 1.00 0.00 O ATOM 0 HA2 GLY B 715 30.170 8.231 -11.161 1.00 0.00 H new ATOM 0 HA3 GLY B 715 31.256 8.250 -9.786 1.00 0.00 H new ATOM 225 N SER B 716 28.424 9.775 -10.142 1.00 0.00 N ATOM 226 CA SER B 716 27.362 10.507 -9.397 1.00 0.00 C ATOM 227 C SER B 716 25.987 10.196 -9.992 1.00 0.00 C ATOM 228 O SER B 716 25.292 11.073 -10.465 1.00 0.00 O ATOM 229 CB SER B 716 27.700 11.986 -9.584 1.00 0.00 C ATOM 230 OG SER B 716 27.337 12.392 -10.895 1.00 0.00 O ATOM 0 H SER B 716 28.139 9.401 -11.047 1.00 0.00 H new ATOM 0 HA SER B 716 27.325 10.223 -8.345 1.00 0.00 H new ATOM 0 HB2 SER B 716 27.170 12.587 -8.846 1.00 0.00 H new ATOM 0 HB3 SER B 716 28.766 12.150 -9.423 1.00 0.00 H new ATOM 0 HG SER B 716 26.361 12.377 -10.984 1.00 0.00 H new ATOM 236 N HIS B 717 25.592 8.952 -9.976 1.00 0.00 N ATOM 237 CA HIS B 717 24.265 8.586 -10.545 1.00 0.00 C ATOM 238 C HIS B 717 23.780 7.260 -9.958 1.00 0.00 C ATOM 239 O HIS B 717 23.936 6.213 -10.554 1.00 0.00 O ATOM 240 CB HIS B 717 24.510 8.443 -12.049 1.00 0.00 C ATOM 241 CG HIS B 717 23.205 8.579 -12.784 1.00 0.00 C ATOM 242 ND1 HIS B 717 22.864 7.754 -13.843 1.00 0.00 N ATOM 243 CD2 HIS B 717 22.149 9.441 -12.623 1.00 0.00 C ATOM 244 CE1 HIS B 717 21.647 8.133 -14.276 1.00 0.00 C ATOM 245 NE2 HIS B 717 21.166 9.157 -13.567 1.00 0.00 N ATOM 0 H HIS B 717 26.131 8.175 -9.594 1.00 0.00 H new ATOM 0 HA HIS B 717 23.501 9.330 -10.319 1.00 0.00 H new ATOM 0 HB2 HIS B 717 25.212 9.205 -12.388 1.00 0.00 H new ATOM 0 HB3 HIS B 717 24.962 7.475 -12.264 1.00 0.00 H new ATOM 0 HD2 HIS B 717 22.090 10.220 -11.878 1.00 0.00 H new ATOM 0 HE1 HIS B 717 21.123 7.666 -15.097 1.00 0.00 H new ATOM 0 HE2 HIS B 717 20.271 9.630 -13.690 1.00 0.00 H new ATOM 253 N MET B 718 23.192 7.296 -8.795 1.00 0.00 N ATOM 254 CA MET B 718 22.697 6.036 -8.173 1.00 0.00 C ATOM 255 C MET B 718 21.297 5.701 -8.693 1.00 0.00 C ATOM 256 O MET B 718 20.364 6.462 -8.526 1.00 0.00 O ATOM 257 CB MET B 718 22.653 6.332 -6.673 1.00 0.00 C ATOM 258 CG MET B 718 22.631 5.015 -5.895 1.00 0.00 C ATOM 259 SD MET B 718 24.202 4.148 -6.132 1.00 0.00 S ATOM 260 CE MET B 718 23.982 2.914 -4.827 1.00 0.00 C ATOM 0 H MET B 718 23.033 8.142 -8.249 1.00 0.00 H new ATOM 0 HA MET B 718 23.333 5.182 -8.406 1.00 0.00 H new ATOM 0 HB2 MET B 718 23.521 6.924 -6.382 1.00 0.00 H new ATOM 0 HB3 MET B 718 21.769 6.923 -6.434 1.00 0.00 H new ATOM 0 HG2 MET B 718 22.467 5.209 -4.835 1.00 0.00 H new ATOM 0 HG3 MET B 718 21.804 4.392 -6.237 1.00 0.00 H new ATOM 0 HE1 MET B 718 24.853 2.259 -4.795 1.00 0.00 H new ATOM 0 HE2 MET B 718 23.870 3.416 -3.866 1.00 0.00 H new ATOM 0 HE3 MET B 718 23.090 2.322 -5.033 1.00 0.00 H new ATOM 270 N SER B 719 21.144 4.570 -9.326 1.00 0.00 N ATOM 271 CA SER B 719 19.806 4.191 -9.861 1.00 0.00 C ATOM 272 C SER B 719 18.876 3.764 -8.725 1.00 0.00 C ATOM 273 O SER B 719 19.308 3.503 -7.620 1.00 0.00 O ATOM 274 CB SER B 719 20.078 3.013 -10.798 1.00 0.00 C ATOM 275 OG SER B 719 19.486 3.267 -12.063 1.00 0.00 O ATOM 0 H SER B 719 21.887 3.893 -9.496 1.00 0.00 H new ATOM 0 HA SER B 719 19.318 5.021 -10.372 1.00 0.00 H new ATOM 0 HB2 SER B 719 21.152 2.865 -10.911 1.00 0.00 H new ATOM 0 HB3 SER B 719 19.672 2.095 -10.373 1.00 0.00 H new ATOM 0 HG SER B 719 19.662 2.513 -12.664 1.00 0.00 H new ATOM 281 N LYS B 720 17.599 3.688 -8.988 1.00 0.00 N ATOM 282 CA LYS B 720 16.641 3.278 -7.923 1.00 0.00 C ATOM 283 C LYS B 720 16.688 1.764 -7.711 1.00 0.00 C ATOM 284 O LYS B 720 15.873 1.029 -8.232 1.00 0.00 O ATOM 285 CB LYS B 720 15.269 3.699 -8.442 1.00 0.00 C ATOM 286 CG LYS B 720 14.267 3.653 -7.288 1.00 0.00 C ATOM 287 CD LYS B 720 14.150 5.043 -6.654 1.00 0.00 C ATOM 288 CE LYS B 720 15.351 5.328 -5.739 1.00 0.00 C ATOM 289 NZ LYS B 720 15.477 4.138 -4.840 1.00 0.00 N ATOM 0 H LYS B 720 17.179 3.892 -9.895 1.00 0.00 H new ATOM 0 HA LYS B 720 16.877 3.738 -6.963 1.00 0.00 H new ATOM 0 HB2 LYS B 720 15.316 4.705 -8.860 1.00 0.00 H new ATOM 0 HB3 LYS B 720 14.950 3.035 -9.245 1.00 0.00 H new ATOM 0 HG2 LYS B 720 13.293 3.325 -7.651 1.00 0.00 H new ATOM 0 HG3 LYS B 720 14.590 2.927 -6.541 1.00 0.00 H new ATOM 0 HD2 LYS B 720 14.095 5.801 -7.436 1.00 0.00 H new ATOM 0 HD3 LYS B 720 13.226 5.109 -6.080 1.00 0.00 H new ATOM 0 HE2 LYS B 720 16.260 5.474 -6.323 1.00 0.00 H new ATOM 0 HE3 LYS B 720 15.194 6.239 -5.161 1.00 0.00 H new ATOM 0 HZ1 LYS B 720 15.665 4.456 -3.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 720 14.592 3.592 -4.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 720 16.262 3.538 -5.166 1.00 0.00 H new ATOM 303 N GLU B 721 17.630 1.293 -6.941 1.00 0.00 N ATOM 304 CA GLU B 721 17.721 -0.172 -6.688 1.00 0.00 C ATOM 305 C GLU B 721 17.878 -0.443 -5.188 1.00 0.00 C ATOM 306 O GLU B 721 18.486 0.337 -4.482 1.00 0.00 O ATOM 307 CB GLU B 721 18.970 -0.626 -7.445 1.00 0.00 C ATOM 308 CG GLU B 721 18.747 -0.448 -8.948 1.00 0.00 C ATOM 309 CD GLU B 721 17.727 -1.478 -9.438 1.00 0.00 C ATOM 310 OE1 GLU B 721 17.965 -2.658 -9.240 1.00 0.00 O ATOM 311 OE2 GLU B 721 16.726 -1.069 -10.003 1.00 0.00 O ATOM 0 H GLU B 721 18.340 1.859 -6.477 1.00 0.00 H new ATOM 0 HA GLU B 721 16.827 -0.703 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU B 721 19.835 -0.045 -7.123 1.00 0.00 H new ATOM 0 HB3 GLU B 721 19.186 -1.670 -7.219 1.00 0.00 H new ATOM 0 HG2 GLU B 721 18.390 0.561 -9.157 1.00 0.00 H new ATOM 0 HG3 GLU B 721 19.689 -0.570 -9.483 1.00 0.00 H new ATOM 318 N PRO B 722 17.364 -1.568 -4.752 1.00 0.00 N ATOM 319 CA PRO B 722 17.435 -1.927 -3.319 1.00 0.00 C ATOM 320 C PRO B 722 18.736 -2.672 -2.993 1.00 0.00 C ATOM 321 O PRO B 722 18.801 -3.431 -2.047 1.00 0.00 O ATOM 322 CB PRO B 722 16.235 -2.850 -3.140 1.00 0.00 C ATOM 323 CG PRO B 722 16.014 -3.481 -4.479 1.00 0.00 C ATOM 324 CD PRO B 722 16.596 -2.558 -5.523 1.00 0.00 C ATOM 0 HA PRO B 722 17.422 -1.056 -2.663 1.00 0.00 H new ATOM 0 HB2 PRO B 722 16.430 -3.604 -2.378 1.00 0.00 H new ATOM 0 HB3 PRO B 722 15.355 -2.292 -2.819 1.00 0.00 H new ATOM 0 HG2 PRO B 722 16.492 -4.459 -4.524 1.00 0.00 H new ATOM 0 HG3 PRO B 722 14.950 -3.638 -4.657 1.00 0.00 H new ATOM 0 HD2 PRO B 722 17.235 -3.100 -6.220 1.00 0.00 H new ATOM 0 HD3 PRO B 722 15.813 -2.081 -6.112 1.00 0.00 H new ATOM 332 N ARG B 723 19.777 -2.452 -3.756 1.00 0.00 N ATOM 333 CA ARG B 723 21.076 -3.136 -3.481 1.00 0.00 C ATOM 334 C ARG B 723 20.899 -4.659 -3.469 1.00 0.00 C ATOM 335 O ARG B 723 21.102 -5.320 -4.469 1.00 0.00 O ATOM 336 CB ARG B 723 21.513 -2.628 -2.103 1.00 0.00 C ATOM 337 CG ARG B 723 22.389 -1.384 -2.271 1.00 0.00 C ATOM 338 CD ARG B 723 21.503 -0.168 -2.553 1.00 0.00 C ATOM 339 NE ARG B 723 21.433 0.566 -1.256 1.00 0.00 N ATOM 340 CZ ARG B 723 21.031 1.815 -1.209 1.00 0.00 C ATOM 341 NH1 ARG B 723 20.682 2.454 -2.298 1.00 0.00 N ATOM 342 NH2 ARG B 723 20.980 2.431 -0.059 1.00 0.00 N ATOM 0 H ARG B 723 19.782 -1.825 -4.561 1.00 0.00 H new ATOM 0 HA ARG B 723 21.819 -2.920 -4.249 1.00 0.00 H new ATOM 0 HB2 ARG B 723 20.639 -2.391 -1.497 1.00 0.00 H new ATOM 0 HB3 ARG B 723 22.065 -3.406 -1.575 1.00 0.00 H new ATOM 0 HG2 ARG B 723 22.978 -1.217 -1.369 1.00 0.00 H new ATOM 0 HG3 ARG B 723 23.094 -1.531 -3.089 1.00 0.00 H new ATOM 0 HD2 ARG B 723 21.928 0.457 -3.338 1.00 0.00 H new ATOM 0 HD3 ARG B 723 20.511 -0.471 -2.889 1.00 0.00 H new ATOM 0 HE ARG B 723 21.701 0.091 -0.394 1.00 0.00 H new ATOM 0 HH11 ARG B 723 20.720 1.981 -3.201 1.00 0.00 H new ATOM 0 HH12 ARG B 723 20.372 3.424 -2.243 1.00 0.00 H new ATOM 0 HH21 ARG B 723 21.251 1.942 0.794 1.00 0.00 H new ATOM 0 HH22 ARG B 723 20.669 3.401 -0.014 1.00 0.00 H new ATOM 356 N ASP B 724 20.543 -5.229 -2.348 1.00 0.00 N ATOM 357 CA ASP B 724 20.370 -6.708 -2.290 1.00 0.00 C ATOM 358 C ASP B 724 18.986 -7.068 -1.738 1.00 0.00 C ATOM 359 O ASP B 724 18.423 -6.327 -0.956 1.00 0.00 O ATOM 360 CB ASP B 724 21.463 -7.194 -1.335 1.00 0.00 C ATOM 361 CG ASP B 724 22.594 -7.841 -2.138 1.00 0.00 C ATOM 362 OD1 ASP B 724 23.396 -7.107 -2.691 1.00 0.00 O ATOM 363 OD2 ASP B 724 22.638 -9.059 -2.185 1.00 0.00 O ATOM 0 H ASP B 724 20.365 -4.735 -1.473 1.00 0.00 H new ATOM 0 HA ASP B 724 20.446 -7.167 -3.276 1.00 0.00 H new ATOM 0 HB2 ASP B 724 21.849 -6.358 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP B 724 21.049 -7.912 -0.627 1.00 0.00 H new ATOM 368 N PRO B 725 18.481 -8.204 -2.156 1.00 0.00 N ATOM 369 CA PRO B 725 17.148 -8.655 -1.685 1.00 0.00 C ATOM 370 C PRO B 725 17.125 -8.754 -0.158 1.00 0.00 C ATOM 371 O PRO B 725 16.245 -8.226 0.493 1.00 0.00 O ATOM 372 CB PRO B 725 16.981 -10.039 -2.315 1.00 0.00 C ATOM 373 CG PRO B 725 17.955 -10.081 -3.449 1.00 0.00 C ATOM 374 CD PRO B 725 19.088 -9.159 -3.094 1.00 0.00 C ATOM 0 HA PRO B 725 16.349 -7.968 -1.962 1.00 0.00 H new ATOM 0 HB2 PRO B 725 17.187 -10.827 -1.591 1.00 0.00 H new ATOM 0 HB3 PRO B 725 15.961 -10.189 -2.668 1.00 0.00 H new ATOM 0 HG2 PRO B 725 18.319 -11.096 -3.606 1.00 0.00 H new ATOM 0 HG3 PRO B 725 17.479 -9.766 -4.377 1.00 0.00 H new ATOM 0 HD2 PRO B 725 19.915 -9.700 -2.635 1.00 0.00 H new ATOM 0 HD3 PRO B 725 19.486 -8.656 -3.975 1.00 0.00 H new ATOM 382 N ASP B 726 18.085 -9.426 0.420 1.00 0.00 N ATOM 383 CA ASP B 726 18.120 -9.545 1.905 1.00 0.00 C ATOM 384 C ASP B 726 18.054 -8.158 2.543 1.00 0.00 C ATOM 385 O ASP B 726 17.252 -7.903 3.419 1.00 0.00 O ATOM 386 CB ASP B 726 19.460 -10.216 2.216 1.00 0.00 C ATOM 387 CG ASP B 726 19.376 -10.919 3.572 1.00 0.00 C ATOM 388 OD1 ASP B 726 18.728 -10.383 4.456 1.00 0.00 O ATOM 389 OD2 ASP B 726 19.959 -11.983 3.703 1.00 0.00 O ATOM 0 H ASP B 726 18.845 -9.897 -0.072 1.00 0.00 H new ATOM 0 HA ASP B 726 17.278 -10.116 2.296 1.00 0.00 H new ATOM 0 HB2 ASP B 726 19.708 -10.936 1.436 1.00 0.00 H new ATOM 0 HB3 ASP B 726 20.257 -9.472 2.229 1.00 0.00 H new ATOM 394 N GLN B 727 18.881 -7.252 2.097 1.00 0.00 N ATOM 395 CA GLN B 727 18.843 -5.875 2.659 1.00 0.00 C ATOM 396 C GLN B 727 17.444 -5.287 2.483 1.00 0.00 C ATOM 397 O GLN B 727 16.919 -4.628 3.358 1.00 0.00 O ATOM 398 CB GLN B 727 19.862 -5.083 1.834 1.00 0.00 C ATOM 399 CG GLN B 727 20.559 -4.056 2.728 1.00 0.00 C ATOM 400 CD GLN B 727 19.633 -2.858 2.946 1.00 0.00 C ATOM 401 OE1 GLN B 727 19.263 -2.556 4.063 1.00 0.00 O ATOM 402 NE2 GLN B 727 19.242 -2.155 1.918 1.00 0.00 N ATOM 0 H GLN B 727 19.579 -7.407 1.370 1.00 0.00 H new ATOM 0 HA GLN B 727 19.075 -5.851 3.724 1.00 0.00 H new ATOM 0 HB2 GLN B 727 20.597 -5.760 1.399 1.00 0.00 H new ATOM 0 HB3 GLN B 727 19.362 -4.580 1.006 1.00 0.00 H new ATOM 0 HG2 GLN B 727 20.818 -4.508 3.685 1.00 0.00 H new ATOM 0 HG3 GLN B 727 21.491 -3.730 2.267 1.00 0.00 H new ATOM 0 HE21 GLN B 727 19.552 -2.408 0.980 1.00 0.00 H new ATOM 0 HE22 GLN B 727 18.626 -1.353 2.053 1.00 0.00 H new ATOM 411 N LEU B 728 16.837 -5.525 1.353 1.00 0.00 N ATOM 412 CA LEU B 728 15.468 -4.993 1.110 1.00 0.00 C ATOM 413 C LEU B 728 14.416 -5.877 1.779 1.00 0.00 C ATOM 414 O LEU B 728 13.273 -5.505 1.888 1.00 0.00 O ATOM 415 CB LEU B 728 15.294 -5.038 -0.411 1.00 0.00 C ATOM 416 CG LEU B 728 14.471 -3.840 -0.879 1.00 0.00 C ATOM 417 CD1 LEU B 728 13.084 -3.921 -0.260 1.00 0.00 C ATOM 418 CD2 LEU B 728 15.152 -2.539 -0.446 1.00 0.00 C ATOM 0 H LEU B 728 17.233 -6.067 0.585 1.00 0.00 H new ATOM 0 HA LEU B 728 15.346 -3.990 1.518 1.00 0.00 H new ATOM 0 HB2 LEU B 728 16.270 -5.031 -0.897 1.00 0.00 H new ATOM 0 HB3 LEU B 728 14.799 -5.965 -0.701 1.00 0.00 H new ATOM 0 HG LEU B 728 14.393 -3.853 -1.966 1.00 0.00 H new ATOM 0 HD11 LEU B 728 12.489 -3.069 -0.589 1.00 0.00 H new ATOM 0 HD12 LEU B 728 12.599 -4.845 -0.574 1.00 0.00 H new ATOM 0 HD13 LEU B 728 13.169 -3.907 0.827 1.00 0.00 H new ATOM 0 HD21 LEU B 728 14.560 -1.688 -0.783 1.00 0.00 H new ATOM 0 HD22 LEU B 728 15.235 -2.516 0.641 1.00 0.00 H new ATOM 0 HD23 LEU B 728 16.147 -2.485 -0.887 1.00 0.00 H new ATOM 430 N TYR B 729 14.776 -7.058 2.194 1.00 0.00 N ATOM 431 CA TYR B 729 13.771 -7.949 2.836 1.00 0.00 C ATOM 432 C TYR B 729 13.222 -7.289 4.099 1.00 0.00 C ATOM 433 O TYR B 729 12.062 -6.912 4.174 1.00 0.00 O ATOM 434 CB TYR B 729 14.540 -9.224 3.188 1.00 0.00 C ATOM 435 CG TYR B 729 13.587 -10.238 3.774 1.00 0.00 C ATOM 436 CD1 TYR B 729 12.919 -11.138 2.934 1.00 0.00 C ATOM 437 CD2 TYR B 729 13.367 -10.276 5.156 1.00 0.00 C ATOM 438 CE1 TYR B 729 12.034 -12.077 3.477 1.00 0.00 C ATOM 439 CE2 TYR B 729 12.483 -11.215 5.698 1.00 0.00 C ATOM 440 CZ TYR B 729 11.816 -12.115 4.859 1.00 0.00 C ATOM 441 OH TYR B 729 10.943 -13.040 5.393 1.00 0.00 O ATOM 0 H TYR B 729 15.717 -7.444 2.117 1.00 0.00 H new ATOM 0 HA TYR B 729 12.921 -8.154 2.186 1.00 0.00 H new ATOM 0 HB2 TYR B 729 15.019 -9.631 2.297 1.00 0.00 H new ATOM 0 HB3 TYR B 729 15.333 -8.999 3.901 1.00 0.00 H new ATOM 0 HD1 TYR B 729 13.087 -11.108 1.868 1.00 0.00 H new ATOM 0 HD2 TYR B 729 13.880 -9.580 5.804 1.00 0.00 H new ATOM 0 HE1 TYR B 729 11.520 -12.772 2.830 1.00 0.00 H new ATOM 0 HE2 TYR B 729 12.315 -11.245 6.764 1.00 0.00 H new ATOM 0 HH TYR B 729 10.907 -12.932 6.366 1.00 0.00 H new ATOM 451 N SER B 730 14.049 -7.126 5.089 1.00 0.00 N ATOM 452 CA SER B 730 13.571 -6.480 6.334 1.00 0.00 C ATOM 453 C SER B 730 13.286 -4.996 6.081 1.00 0.00 C ATOM 454 O SER B 730 12.685 -4.327 6.897 1.00 0.00 O ATOM 455 CB SER B 730 14.688 -6.675 7.360 1.00 0.00 C ATOM 456 OG SER B 730 15.490 -5.504 7.445 1.00 0.00 O ATOM 0 H SER B 730 15.029 -7.410 5.089 1.00 0.00 H new ATOM 0 HA SER B 730 12.639 -6.916 6.694 1.00 0.00 H new ATOM 0 HB2 SER B 730 14.259 -6.902 8.336 1.00 0.00 H new ATOM 0 HB3 SER B 730 15.306 -7.527 7.077 1.00 0.00 H new ATOM 0 HG SER B 730 16.200 -5.641 8.106 1.00 0.00 H new ATOM 462 N THR B 731 13.697 -4.470 4.954 1.00 0.00 N ATOM 463 CA THR B 731 13.356 -3.056 4.656 1.00 0.00 C ATOM 464 C THR B 731 11.837 -2.951 4.571 1.00 0.00 C ATOM 465 O THR B 731 11.214 -2.163 5.253 1.00 0.00 O ATOM 466 CB THR B 731 13.997 -2.742 3.304 1.00 0.00 C ATOM 467 OG1 THR B 731 15.410 -2.731 3.439 1.00 0.00 O ATOM 468 CG2 THR B 731 13.518 -1.368 2.825 1.00 0.00 C ATOM 0 H THR B 731 14.244 -4.953 4.242 1.00 0.00 H new ATOM 0 HA THR B 731 13.712 -2.360 5.415 1.00 0.00 H new ATOM 0 HB THR B 731 13.710 -3.503 2.578 1.00 0.00 H new ATOM 0 HG1 THR B 731 15.724 -3.631 3.668 1.00 0.00 H new ATOM 0 HG21 THR B 731 13.973 -1.140 1.861 1.00 0.00 H new ATOM 0 HG22 THR B 731 12.433 -1.377 2.721 1.00 0.00 H new ATOM 0 HG23 THR B 731 13.807 -0.608 3.551 1.00 0.00 H new ATOM 476 N LEU B 732 11.237 -3.784 3.763 1.00 0.00 N ATOM 477 CA LEU B 732 9.752 -3.802 3.691 1.00 0.00 C ATOM 478 C LEU B 732 9.224 -4.149 5.074 1.00 0.00 C ATOM 479 O LEU B 732 8.288 -3.551 5.566 1.00 0.00 O ATOM 480 CB LEU B 732 9.384 -4.904 2.683 1.00 0.00 C ATOM 481 CG LEU B 732 10.227 -4.792 1.400 1.00 0.00 C ATOM 482 CD1 LEU B 732 9.635 -5.703 0.328 1.00 0.00 C ATOM 483 CD2 LEU B 732 10.245 -3.349 0.885 1.00 0.00 C ATOM 0 H LEU B 732 11.711 -4.450 3.153 1.00 0.00 H new ATOM 0 HA LEU B 732 9.330 -2.846 3.381 1.00 0.00 H new ATOM 0 HB2 LEU B 732 9.538 -5.882 3.138 1.00 0.00 H new ATOM 0 HB3 LEU B 732 8.326 -4.832 2.433 1.00 0.00 H new ATOM 0 HG LEU B 732 11.250 -5.093 1.627 1.00 0.00 H new ATOM 0 HD11 LEU B 732 10.229 -5.627 -0.583 1.00 0.00 H new ATOM 0 HD12 LEU B 732 9.643 -6.734 0.682 1.00 0.00 H new ATOM 0 HD13 LEU B 732 8.609 -5.400 0.119 1.00 0.00 H new ATOM 0 HD21 LEU B 732 10.847 -3.294 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU B 732 9.227 -3.028 0.665 1.00 0.00 H new ATOM 0 HD23 LEU B 732 10.675 -2.697 1.645 1.00 0.00 H new ATOM 495 N LYS B 733 9.871 -5.071 5.737 1.00 0.00 N ATOM 496 CA LYS B 733 9.466 -5.399 7.129 1.00 0.00 C ATOM 497 C LYS B 733 9.510 -4.127 7.971 1.00 0.00 C ATOM 498 O LYS B 733 8.586 -3.815 8.685 1.00 0.00 O ATOM 499 CB LYS B 733 10.515 -6.398 7.610 1.00 0.00 C ATOM 500 CG LYS B 733 10.115 -6.977 8.964 1.00 0.00 C ATOM 501 CD LYS B 733 11.162 -7.999 9.407 1.00 0.00 C ATOM 502 CE LYS B 733 10.811 -9.372 8.827 1.00 0.00 C ATOM 503 NZ LYS B 733 10.383 -10.184 10.001 1.00 0.00 N ATOM 0 H LYS B 733 10.659 -5.607 5.374 1.00 0.00 H new ATOM 0 HA LYS B 733 8.458 -5.807 7.200 1.00 0.00 H new ATOM 0 HB2 LYS B 733 10.623 -7.201 6.881 1.00 0.00 H new ATOM 0 HB3 LYS B 733 11.485 -5.907 7.689 1.00 0.00 H new ATOM 0 HG2 LYS B 733 10.033 -6.180 9.703 1.00 0.00 H new ATOM 0 HG3 LYS B 733 9.135 -7.450 8.895 1.00 0.00 H new ATOM 0 HD2 LYS B 733 12.152 -7.692 9.069 1.00 0.00 H new ATOM 0 HD3 LYS B 733 11.198 -8.050 10.495 1.00 0.00 H new ATOM 0 HE2 LYS B 733 10.014 -9.297 8.087 1.00 0.00 H new ATOM 0 HE3 LYS B 733 11.669 -9.821 8.327 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 10.125 -11.141 9.686 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 11.164 -10.243 10.685 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 9.561 -9.735 10.452 1.00 0.00 H new ATOM 517 N SER B 734 10.559 -3.362 7.849 1.00 0.00 N ATOM 518 CA SER B 734 10.637 -2.084 8.606 1.00 0.00 C ATOM 519 C SER B 734 9.471 -1.183 8.200 1.00 0.00 C ATOM 520 O SER B 734 8.582 -0.909 8.985 1.00 0.00 O ATOM 521 CB SER B 734 11.971 -1.458 8.193 1.00 0.00 C ATOM 522 OG SER B 734 12.899 -1.572 9.262 1.00 0.00 O ATOM 0 H SER B 734 11.365 -3.567 7.258 1.00 0.00 H new ATOM 0 HA SER B 734 10.579 -2.228 9.685 1.00 0.00 H new ATOM 0 HB2 SER B 734 12.360 -1.957 7.305 1.00 0.00 H new ATOM 0 HB3 SER B 734 11.828 -0.409 7.932 1.00 0.00 H new ATOM 0 HG SER B 734 13.754 -1.173 8.997 1.00 0.00 H new ATOM 528 N ILE B 735 9.433 -0.766 6.960 1.00 0.00 N ATOM 529 CA ILE B 735 8.305 0.089 6.500 1.00 0.00 C ATOM 530 C ILE B 735 6.964 -0.552 6.880 1.00 0.00 C ATOM 531 O ILE B 735 6.227 -0.042 7.695 1.00 0.00 O ATOM 532 CB ILE B 735 8.438 0.154 4.976 1.00 0.00 C ATOM 533 CG1 ILE B 735 9.773 0.799 4.594 1.00 0.00 C ATOM 534 CG2 ILE B 735 7.294 0.996 4.409 1.00 0.00 C ATOM 535 CD1 ILE B 735 10.492 -0.082 3.571 1.00 0.00 C ATOM 0 H ILE B 735 10.133 -0.981 6.251 1.00 0.00 H new ATOM 0 HA ILE B 735 8.336 1.078 6.957 1.00 0.00 H new ATOM 0 HB ILE B 735 8.398 -0.856 4.568 1.00 0.00 H new ATOM 0 HG12 ILE B 735 9.603 1.792 4.179 1.00 0.00 H new ATOM 0 HG13 ILE B 735 10.394 0.926 5.481 1.00 0.00 H new ATOM 0 HG21 ILE B 735 7.383 1.047 3.324 1.00 0.00 H new ATOM 0 HG22 ILE B 735 6.340 0.540 4.674 1.00 0.00 H new ATOM 0 HG23 ILE B 735 7.343 2.003 4.824 1.00 0.00 H new ATOM 0 HD11 ILE B 735 11.442 0.377 3.299 1.00 0.00 H new ATOM 0 HD12 ILE B 735 10.675 -1.066 4.003 1.00 0.00 H new ATOM 0 HD13 ILE B 735 9.872 -0.186 2.681 1.00 0.00 H new ATOM 547 N LEU B 736 6.658 -1.685 6.311 1.00 0.00 N ATOM 548 CA LEU B 736 5.359 -2.352 6.618 1.00 0.00 C ATOM 549 C LEU B 736 5.129 -2.451 8.130 1.00 0.00 C ATOM 550 O LEU B 736 4.071 -2.115 8.621 1.00 0.00 O ATOM 551 CB LEU B 736 5.486 -3.748 6.007 1.00 0.00 C ATOM 552 CG LEU B 736 4.096 -4.305 5.684 1.00 0.00 C ATOM 553 CD1 LEU B 736 3.261 -4.372 6.963 1.00 0.00 C ATOM 554 CD2 LEU B 736 3.401 -3.398 4.667 1.00 0.00 C ATOM 0 H LEU B 736 7.252 -2.180 5.645 1.00 0.00 H new ATOM 0 HA LEU B 736 4.513 -1.794 6.217 1.00 0.00 H new ATOM 0 HB2 LEU B 736 6.089 -3.704 5.100 1.00 0.00 H new ATOM 0 HB3 LEU B 736 6.001 -4.412 6.701 1.00 0.00 H new ATOM 0 HG LEU B 736 4.198 -5.306 5.265 1.00 0.00 H new ATOM 0 HD11 LEU B 736 2.272 -4.768 6.732 1.00 0.00 H new ATOM 0 HD12 LEU B 736 3.753 -5.023 7.685 1.00 0.00 H new ATOM 0 HD13 LEU B 736 3.161 -3.372 7.385 1.00 0.00 H new ATOM 0 HD21 LEU B 736 2.413 -3.797 4.439 1.00 0.00 H new ATOM 0 HD22 LEU B 736 3.301 -2.395 5.083 1.00 0.00 H new ATOM 0 HD23 LEU B 736 3.994 -3.354 3.753 1.00 0.00 H new ATOM 566 N GLN B 737 6.099 -2.917 8.878 1.00 0.00 N ATOM 567 CA GLN B 737 5.898 -3.042 10.357 1.00 0.00 C ATOM 568 C GLN B 737 5.306 -1.752 10.940 1.00 0.00 C ATOM 569 O GLN B 737 4.381 -1.790 11.727 1.00 0.00 O ATOM 570 CB GLN B 737 7.292 -3.298 10.937 1.00 0.00 C ATOM 571 CG GLN B 737 7.221 -3.319 12.466 1.00 0.00 C ATOM 572 CD GLN B 737 8.104 -2.205 13.033 1.00 0.00 C ATOM 573 OE1 GLN B 737 9.312 -2.330 13.070 1.00 0.00 O ATOM 574 NE2 GLN B 737 7.547 -1.111 13.478 1.00 0.00 N ATOM 0 H GLN B 737 7.012 -3.214 8.534 1.00 0.00 H new ATOM 0 HA GLN B 737 5.200 -3.844 10.599 1.00 0.00 H new ATOM 0 HB2 GLN B 737 7.681 -4.247 10.569 1.00 0.00 H new ATOM 0 HB3 GLN B 737 7.982 -2.522 10.606 1.00 0.00 H new ATOM 0 HG2 GLN B 737 6.191 -3.184 12.795 1.00 0.00 H new ATOM 0 HG3 GLN B 737 7.551 -4.287 12.843 1.00 0.00 H new ATOM 0 HE21 GLN B 737 6.533 -1.006 13.447 1.00 0.00 H new ATOM 0 HE22 GLN B 737 8.126 -0.361 13.857 1.00 0.00 H new ATOM 583 N GLN B 738 5.828 -0.611 10.570 1.00 0.00 N ATOM 584 CA GLN B 738 5.276 0.656 11.126 1.00 0.00 C ATOM 585 C GLN B 738 4.005 1.083 10.375 1.00 0.00 C ATOM 586 O GLN B 738 3.156 1.751 10.934 1.00 0.00 O ATOM 587 CB GLN B 738 6.391 1.693 10.973 1.00 0.00 C ATOM 588 CG GLN B 738 6.796 1.800 9.509 1.00 0.00 C ATOM 589 CD GLN B 738 7.511 3.125 9.273 1.00 0.00 C ATOM 590 OE1 GLN B 738 7.871 3.812 10.208 1.00 0.00 O ATOM 591 NE2 GLN B 738 7.739 3.513 8.053 1.00 0.00 N ATOM 0 H GLN B 738 6.603 -0.504 9.915 1.00 0.00 H new ATOM 0 HA GLN B 738 4.981 0.542 12.169 1.00 0.00 H new ATOM 0 HB2 GLN B 738 6.052 2.662 11.338 1.00 0.00 H new ATOM 0 HB3 GLN B 738 7.251 1.408 11.578 1.00 0.00 H new ATOM 0 HG2 GLN B 738 7.449 0.970 9.240 1.00 0.00 H new ATOM 0 HG3 GLN B 738 5.915 1.732 8.871 1.00 0.00 H new ATOM 0 HE21 GLN B 738 7.436 2.935 7.269 1.00 0.00 H new ATOM 0 HE22 GLN B 738 8.221 4.395 7.880 1.00 0.00 H new ATOM 600 N VAL B 739 3.837 0.698 9.127 1.00 0.00 N ATOM 601 CA VAL B 739 2.576 1.090 8.414 1.00 0.00 C ATOM 602 C VAL B 739 1.441 0.152 8.852 1.00 0.00 C ATOM 603 O VAL B 739 0.307 0.560 9.009 1.00 0.00 O ATOM 604 CB VAL B 739 2.835 1.007 6.878 1.00 0.00 C ATOM 605 CG1 VAL B 739 4.256 1.464 6.533 1.00 0.00 C ATOM 606 CG2 VAL B 739 2.613 -0.409 6.339 1.00 0.00 C ATOM 0 H VAL B 739 4.500 0.144 8.584 1.00 0.00 H new ATOM 0 HA VAL B 739 2.281 2.110 8.661 1.00 0.00 H new ATOM 0 HB VAL B 739 2.116 1.675 6.403 1.00 0.00 H new ATOM 0 HG11 VAL B 739 4.409 1.396 5.456 1.00 0.00 H new ATOM 0 HG12 VAL B 739 4.394 2.496 6.854 1.00 0.00 H new ATOM 0 HG13 VAL B 739 4.977 0.826 7.043 1.00 0.00 H new ATOM 0 HG21 VAL B 739 2.804 -0.424 5.266 1.00 0.00 H new ATOM 0 HG22 VAL B 739 3.293 -1.099 6.838 1.00 0.00 H new ATOM 0 HG23 VAL B 739 1.584 -0.713 6.529 1.00 0.00 H new ATOM 616 N LYS B 740 1.747 -1.099 9.063 1.00 0.00 N ATOM 617 CA LYS B 740 0.699 -2.058 9.507 1.00 0.00 C ATOM 618 C LYS B 740 0.038 -1.561 10.796 1.00 0.00 C ATOM 619 O LYS B 740 -1.151 -1.310 10.840 1.00 0.00 O ATOM 620 CB LYS B 740 1.460 -3.359 9.765 1.00 0.00 C ATOM 621 CG LYS B 740 0.519 -4.398 10.383 1.00 0.00 C ATOM 622 CD LYS B 740 0.967 -4.707 11.812 1.00 0.00 C ATOM 623 CE LYS B 740 -0.251 -5.086 12.657 1.00 0.00 C ATOM 624 NZ LYS B 740 -0.279 -6.576 12.640 1.00 0.00 N ATOM 0 H LYS B 740 2.679 -1.498 8.947 1.00 0.00 H new ATOM 0 HA LYS B 740 -0.096 -2.180 8.772 1.00 0.00 H new ATOM 0 HB2 LYS B 740 1.874 -3.740 8.831 1.00 0.00 H new ATOM 0 HB3 LYS B 740 2.300 -3.173 10.434 1.00 0.00 H new ATOM 0 HG2 LYS B 740 -0.504 -4.022 10.385 1.00 0.00 H new ATOM 0 HG3 LYS B 740 0.523 -5.309 9.785 1.00 0.00 H new ATOM 0 HD2 LYS B 740 1.690 -5.523 11.810 1.00 0.00 H new ATOM 0 HD3 LYS B 740 1.467 -3.840 12.243 1.00 0.00 H new ATOM 0 HE2 LYS B 740 -0.161 -4.704 13.674 1.00 0.00 H new ATOM 0 HE3 LYS B 740 -1.167 -4.669 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 -1.088 -6.914 13.199 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 -0.372 -6.910 11.660 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 0.603 -6.944 13.049 1.00 0.00 H new ATOM 638 N SER B 741 0.798 -1.429 11.849 1.00 0.00 N ATOM 639 CA SER B 741 0.217 -0.954 13.137 1.00 0.00 C ATOM 640 C SER B 741 -0.178 0.524 13.046 1.00 0.00 C ATOM 641 O SER B 741 -0.834 1.053 13.921 1.00 0.00 O ATOM 642 CB SER B 741 1.337 -1.141 14.163 1.00 0.00 C ATOM 643 OG SER B 741 1.898 -2.437 14.019 1.00 0.00 O ATOM 0 H SER B 741 1.798 -1.630 11.873 1.00 0.00 H new ATOM 0 HA SER B 741 -0.687 -1.502 13.402 1.00 0.00 H new ATOM 0 HB2 SER B 741 2.106 -0.382 14.020 1.00 0.00 H new ATOM 0 HB3 SER B 741 0.946 -1.012 15.172 1.00 0.00 H new ATOM 0 HG SER B 741 2.617 -2.557 14.674 1.00 0.00 H new ATOM 649 N HIS B 742 0.213 1.196 11.996 1.00 0.00 N ATOM 650 CA HIS B 742 -0.140 2.638 11.859 1.00 0.00 C ATOM 651 C HIS B 742 -1.640 2.850 12.067 1.00 0.00 C ATOM 652 O HIS B 742 -2.446 1.993 11.765 1.00 0.00 O ATOM 653 CB HIS B 742 0.246 2.994 10.425 1.00 0.00 C ATOM 654 CG HIS B 742 0.768 4.404 10.384 1.00 0.00 C ATOM 655 ND1 HIS B 742 -0.018 5.494 10.719 1.00 0.00 N ATOM 656 CD2 HIS B 742 2.000 4.916 10.057 1.00 0.00 C ATOM 657 CE1 HIS B 742 0.740 6.598 10.584 1.00 0.00 C ATOM 658 NE2 HIS B 742 1.979 6.302 10.183 1.00 0.00 N ATOM 0 H HIS B 742 0.761 0.808 11.228 1.00 0.00 H new ATOM 0 HA HIS B 742 0.370 3.256 12.597 1.00 0.00 H new ATOM 0 HB2 HIS B 742 1.005 2.303 10.059 1.00 0.00 H new ATOM 0 HB3 HIS B 742 -0.619 2.895 9.769 1.00 0.00 H new ATOM 0 HD2 HIS B 742 2.855 4.332 9.749 1.00 0.00 H new ATOM 0 HE1 HIS B 742 0.389 7.601 10.777 1.00 0.00 H new ATOM 0 HE2 HIS B 742 2.745 6.952 10.007 1.00 0.00 H new ATOM 666 N GLN B 743 -2.022 3.995 12.563 1.00 0.00 N ATOM 667 CA GLN B 743 -3.470 4.267 12.788 1.00 0.00 C ATOM 668 C GLN B 743 -4.164 4.687 11.486 1.00 0.00 C ATOM 669 O GLN B 743 -5.314 5.082 11.492 1.00 0.00 O ATOM 670 CB GLN B 743 -3.497 5.417 13.796 1.00 0.00 C ATOM 671 CG GLN B 743 -4.941 5.682 14.228 1.00 0.00 C ATOM 672 CD GLN B 743 -4.959 6.178 15.676 1.00 0.00 C ATOM 673 OE1 GLN B 743 -5.296 7.316 15.937 1.00 0.00 O ATOM 674 NE2 GLN B 743 -4.610 5.366 16.636 1.00 0.00 N ATOM 0 H GLN B 743 -1.393 4.755 12.822 1.00 0.00 H new ATOM 0 HA GLN B 743 -3.996 3.382 13.146 1.00 0.00 H new ATOM 0 HB2 GLN B 743 -2.886 5.169 14.664 1.00 0.00 H new ATOM 0 HB3 GLN B 743 -3.068 6.315 13.351 1.00 0.00 H new ATOM 0 HG2 GLN B 743 -5.397 6.424 13.573 1.00 0.00 H new ATOM 0 HG3 GLN B 743 -5.532 4.770 14.137 1.00 0.00 H new ATOM 0 HE21 GLN B 743 -4.327 4.411 16.418 1.00 0.00 H new ATOM 0 HE22 GLN B 743 -4.620 5.687 17.604 1.00 0.00 H new ATOM 683 N SER B 744 -3.488 4.609 10.368 1.00 0.00 N ATOM 684 CA SER B 744 -4.130 5.026 9.090 1.00 0.00 C ATOM 685 C SER B 744 -4.211 3.856 8.102 1.00 0.00 C ATOM 686 O SER B 744 -4.891 3.933 7.099 1.00 0.00 O ATOM 687 CB SER B 744 -3.221 6.125 8.538 1.00 0.00 C ATOM 688 OG SER B 744 -3.672 7.389 9.001 1.00 0.00 O ATOM 0 H SER B 744 -2.527 4.277 10.287 1.00 0.00 H new ATOM 0 HA SER B 744 -5.154 5.367 9.245 1.00 0.00 H new ATOM 0 HB2 SER B 744 -2.192 5.955 8.856 1.00 0.00 H new ATOM 0 HB3 SER B 744 -3.225 6.102 7.448 1.00 0.00 H new ATOM 0 HG SER B 744 -3.122 7.675 9.760 1.00 0.00 H new ATOM 694 N ALA B 745 -3.540 2.769 8.379 1.00 0.00 N ATOM 695 CA ALA B 745 -3.599 1.600 7.452 1.00 0.00 C ATOM 696 C ALA B 745 -4.907 0.815 7.632 1.00 0.00 C ATOM 697 O ALA B 745 -5.113 -0.208 7.009 1.00 0.00 O ATOM 698 CB ALA B 745 -2.408 0.725 7.854 1.00 0.00 C ATOM 0 H ALA B 745 -2.955 2.640 9.205 1.00 0.00 H new ATOM 0 HA ALA B 745 -3.563 1.912 6.408 1.00 0.00 H new ATOM 0 HB1 ALA B 745 -2.377 -0.161 7.219 1.00 0.00 H new ATOM 0 HB2 ALA B 745 -1.484 1.291 7.734 1.00 0.00 H new ATOM 0 HB3 ALA B 745 -2.515 0.421 8.895 1.00 0.00 H new ATOM 704 N TRP B 746 -5.792 1.277 8.477 1.00 0.00 N ATOM 705 CA TRP B 746 -7.065 0.537 8.706 1.00 0.00 C ATOM 706 C TRP B 746 -7.774 0.196 7.379 1.00 0.00 C ATOM 707 O TRP B 746 -8.084 -0.955 7.144 1.00 0.00 O ATOM 708 CB TRP B 746 -7.922 1.474 9.558 1.00 0.00 C ATOM 709 CG TRP B 746 -7.319 1.666 10.918 1.00 0.00 C ATOM 710 CD1 TRP B 746 -7.841 2.482 11.861 1.00 0.00 C ATOM 711 CD2 TRP B 746 -6.110 1.081 11.509 1.00 0.00 C ATOM 712 NE1 TRP B 746 -7.047 2.436 12.988 1.00 0.00 N ATOM 713 CE2 TRP B 746 -5.971 1.591 12.826 1.00 0.00 C ATOM 714 CE3 TRP B 746 -5.131 0.170 11.053 1.00 0.00 C ATOM 715 CZ2 TRP B 746 -4.913 1.214 13.653 1.00 0.00 C ATOM 716 CZ3 TRP B 746 -4.065 -0.207 11.887 1.00 0.00 C ATOM 717 CH2 TRP B 746 -3.958 0.313 13.183 1.00 0.00 C ATOM 0 H TRP B 746 -5.686 2.135 9.018 1.00 0.00 H new ATOM 0 HA TRP B 746 -6.887 -0.419 9.198 1.00 0.00 H new ATOM 0 HB2 TRP B 746 -8.018 2.439 9.059 1.00 0.00 H new ATOM 0 HB3 TRP B 746 -8.927 1.064 9.656 1.00 0.00 H new ATOM 0 HD1 TRP B 746 -8.737 3.075 11.750 1.00 0.00 H new ATOM 0 HE1 TRP B 746 -7.234 2.965 13.840 1.00 0.00 H new ATOM 0 HE3 TRP B 746 -5.203 -0.239 10.056 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 -4.834 1.618 14.652 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 -3.322 -0.903 11.526 1.00 0.00 H new ATOM 0 HH2 TRP B 746 -3.136 0.016 13.818 1.00 0.00 H new ATOM 728 N PRO B 747 -8.030 1.188 6.550 1.00 0.00 N ATOM 729 CA PRO B 747 -8.734 0.921 5.269 1.00 0.00 C ATOM 730 C PRO B 747 -7.898 0.018 4.362 1.00 0.00 C ATOM 731 O PRO B 747 -8.426 -0.730 3.563 1.00 0.00 O ATOM 732 CB PRO B 747 -8.893 2.305 4.636 1.00 0.00 C ATOM 733 CG PRO B 747 -7.886 3.167 5.323 1.00 0.00 C ATOM 734 CD PRO B 747 -7.727 2.617 6.712 1.00 0.00 C ATOM 0 HA PRO B 747 -9.685 0.409 5.419 1.00 0.00 H new ATOM 0 HB2 PRO B 747 -8.714 2.270 3.561 1.00 0.00 H new ATOM 0 HB3 PRO B 747 -9.903 2.689 4.778 1.00 0.00 H new ATOM 0 HG2 PRO B 747 -6.936 3.153 4.790 1.00 0.00 H new ATOM 0 HG3 PRO B 747 -8.220 4.204 5.353 1.00 0.00 H new ATOM 0 HD2 PRO B 747 -6.718 2.773 7.093 1.00 0.00 H new ATOM 0 HD3 PRO B 747 -8.410 3.095 7.414 1.00 0.00 H new ATOM 742 N PHE B 748 -6.599 0.090 4.461 1.00 0.00 N ATOM 743 CA PHE B 748 -5.747 -0.756 3.579 1.00 0.00 C ATOM 744 C PHE B 748 -5.647 -2.187 4.113 1.00 0.00 C ATOM 745 O PHE B 748 -5.016 -3.032 3.514 1.00 0.00 O ATOM 746 CB PHE B 748 -4.364 -0.095 3.593 1.00 0.00 C ATOM 747 CG PHE B 748 -4.461 1.383 3.262 1.00 0.00 C ATOM 748 CD1 PHE B 748 -5.512 1.883 2.475 1.00 0.00 C ATOM 749 CD2 PHE B 748 -3.471 2.250 3.729 1.00 0.00 C ATOM 750 CE1 PHE B 748 -5.576 3.251 2.181 1.00 0.00 C ATOM 751 CE2 PHE B 748 -3.533 3.616 3.433 1.00 0.00 C ATOM 752 CZ PHE B 748 -4.585 4.117 2.659 1.00 0.00 C ATOM 0 H PHE B 748 -6.094 0.694 5.110 1.00 0.00 H new ATOM 0 HA PHE B 748 -6.165 -0.824 2.575 1.00 0.00 H new ATOM 0 HB2 PHE B 748 -3.907 -0.222 4.574 1.00 0.00 H new ATOM 0 HB3 PHE B 748 -3.714 -0.590 2.872 1.00 0.00 H new ATOM 0 HD1 PHE B 748 -6.270 1.213 2.097 1.00 0.00 H new ATOM 0 HD2 PHE B 748 -2.654 1.865 4.321 1.00 0.00 H new ATOM 0 HE1 PHE B 748 -6.390 3.638 1.586 1.00 0.00 H new ATOM 0 HE2 PHE B 748 -2.769 4.284 3.802 1.00 0.00 H new ATOM 0 HZ PHE B 748 -4.633 5.171 2.430 1.00 0.00 H new ATOM 762 N MET B 749 -6.259 -2.475 5.230 1.00 0.00 N ATOM 763 CA MET B 749 -6.152 -3.851 5.790 1.00 0.00 C ATOM 764 C MET B 749 -7.390 -4.687 5.457 1.00 0.00 C ATOM 765 O MET B 749 -7.725 -5.616 6.165 1.00 0.00 O ATOM 766 CB MET B 749 -6.047 -3.647 7.297 1.00 0.00 C ATOM 767 CG MET B 749 -4.682 -3.049 7.640 1.00 0.00 C ATOM 768 SD MET B 749 -3.457 -4.373 7.760 1.00 0.00 S ATOM 769 CE MET B 749 -2.340 -3.535 8.910 1.00 0.00 C ATOM 0 H MET B 749 -6.824 -1.823 5.774 1.00 0.00 H new ATOM 0 HA MET B 749 -5.299 -4.388 5.375 1.00 0.00 H new ATOM 0 HB2 MET B 749 -6.842 -2.985 7.641 1.00 0.00 H new ATOM 0 HB3 MET B 749 -6.179 -4.598 7.813 1.00 0.00 H new ATOM 0 HG2 MET B 749 -4.384 -2.332 6.875 1.00 0.00 H new ATOM 0 HG3 MET B 749 -4.738 -2.504 8.583 1.00 0.00 H new ATOM 0 HE1 MET B 749 -1.310 -3.804 8.677 1.00 0.00 H new ATOM 0 HE2 MET B 749 -2.464 -2.456 8.816 1.00 0.00 H new ATOM 0 HE3 MET B 749 -2.573 -3.840 9.930 1.00 0.00 H new ATOM 779 N GLU B 750 -8.066 -4.383 4.385 1.00 0.00 N ATOM 780 CA GLU B 750 -9.259 -5.194 4.013 1.00 0.00 C ATOM 781 C GLU B 750 -9.209 -5.556 2.524 1.00 0.00 C ATOM 782 O GLU B 750 -8.596 -4.857 1.742 1.00 0.00 O ATOM 783 CB GLU B 750 -10.465 -4.304 4.306 1.00 0.00 C ATOM 784 CG GLU B 750 -10.714 -4.263 5.815 1.00 0.00 C ATOM 785 CD GLU B 750 -10.347 -2.880 6.355 1.00 0.00 C ATOM 786 OE1 GLU B 750 -10.795 -1.903 5.779 1.00 0.00 O ATOM 787 OE2 GLU B 750 -9.623 -2.822 7.336 1.00 0.00 O ATOM 0 H GLU B 750 -7.846 -3.613 3.753 1.00 0.00 H new ATOM 0 HA GLU B 750 -9.305 -6.130 4.569 1.00 0.00 H new ATOM 0 HB2 GLU B 750 -10.288 -3.297 3.928 1.00 0.00 H new ATOM 0 HB3 GLU B 750 -11.346 -4.687 3.791 1.00 0.00 H new ATOM 0 HG2 GLU B 750 -11.760 -4.482 6.028 1.00 0.00 H new ATOM 0 HG3 GLU B 750 -10.120 -5.029 6.313 1.00 0.00 H new ATOM 794 N PRO B 751 -9.870 -6.632 2.174 1.00 0.00 N ATOM 795 CA PRO B 751 -9.857 -7.104 0.779 1.00 0.00 C ATOM 796 C PRO B 751 -11.059 -6.563 0.001 1.00 0.00 C ATOM 797 O PRO B 751 -12.076 -7.219 -0.115 1.00 0.00 O ATOM 798 CB PRO B 751 -9.969 -8.618 0.938 1.00 0.00 C ATOM 799 CG PRO B 751 -10.676 -8.837 2.248 1.00 0.00 C ATOM 800 CD PRO B 751 -10.611 -7.552 3.042 1.00 0.00 C ATOM 0 HA PRO B 751 -8.975 -6.781 0.227 1.00 0.00 H new ATOM 0 HB2 PRO B 751 -10.528 -9.058 0.113 1.00 0.00 H new ATOM 0 HB3 PRO B 751 -8.984 -9.086 0.941 1.00 0.00 H new ATOM 0 HG2 PRO B 751 -11.713 -9.125 2.076 1.00 0.00 H new ATOM 0 HG3 PRO B 751 -10.206 -9.650 2.802 1.00 0.00 H new ATOM 0 HD2 PRO B 751 -11.607 -7.172 3.267 1.00 0.00 H new ATOM 0 HD3 PRO B 751 -10.102 -7.698 3.995 1.00 0.00 H new ATOM 808 N VAL B 752 -10.954 -5.383 -0.550 1.00 0.00 N ATOM 809 CA VAL B 752 -12.100 -4.831 -1.330 1.00 0.00 C ATOM 810 C VAL B 752 -12.417 -5.742 -2.514 1.00 0.00 C ATOM 811 O VAL B 752 -11.651 -6.617 -2.864 1.00 0.00 O ATOM 812 CB VAL B 752 -11.642 -3.456 -1.828 1.00 0.00 C ATOM 813 CG1 VAL B 752 -10.359 -3.604 -2.646 1.00 0.00 C ATOM 814 CG2 VAL B 752 -12.734 -2.847 -2.706 1.00 0.00 C ATOM 0 H VAL B 752 -10.132 -4.782 -0.495 1.00 0.00 H new ATOM 0 HA VAL B 752 -13.003 -4.758 -0.723 1.00 0.00 H new ATOM 0 HB VAL B 752 -11.452 -2.807 -0.973 1.00 0.00 H new ATOM 0 HG11 VAL B 752 -10.037 -2.624 -2.998 1.00 0.00 H new ATOM 0 HG12 VAL B 752 -9.578 -4.040 -2.023 1.00 0.00 H new ATOM 0 HG13 VAL B 752 -10.546 -4.253 -3.501 1.00 0.00 H new ATOM 0 HG21 VAL B 752 -12.411 -1.869 -3.062 1.00 0.00 H new ATOM 0 HG22 VAL B 752 -12.921 -3.500 -3.559 1.00 0.00 H new ATOM 0 HG23 VAL B 752 -13.650 -2.738 -2.125 1.00 0.00 H new ATOM 824 N LYS B 753 -13.542 -5.535 -3.135 1.00 0.00 N ATOM 825 CA LYS B 753 -13.929 -6.391 -4.292 1.00 0.00 C ATOM 826 C LYS B 753 -14.649 -5.559 -5.358 1.00 0.00 C ATOM 827 O LYS B 753 -14.612 -4.345 -5.341 1.00 0.00 O ATOM 828 CB LYS B 753 -14.871 -7.464 -3.715 1.00 0.00 C ATOM 829 CG LYS B 753 -15.886 -6.844 -2.745 1.00 0.00 C ATOM 830 CD LYS B 753 -15.349 -6.938 -1.315 1.00 0.00 C ATOM 831 CE LYS B 753 -16.446 -6.530 -0.329 1.00 0.00 C ATOM 832 NZ LYS B 753 -16.223 -5.076 -0.092 1.00 0.00 N ATOM 0 H LYS B 753 -14.214 -4.807 -2.891 1.00 0.00 H new ATOM 0 HA LYS B 753 -13.059 -6.836 -4.774 1.00 0.00 H new ATOM 0 HB2 LYS B 753 -15.398 -7.964 -4.527 1.00 0.00 H new ATOM 0 HB3 LYS B 753 -14.287 -8.225 -3.198 1.00 0.00 H new ATOM 0 HG2 LYS B 753 -16.068 -5.802 -3.009 1.00 0.00 H new ATOM 0 HG3 LYS B 753 -16.841 -7.363 -2.821 1.00 0.00 H new ATOM 0 HD2 LYS B 753 -15.018 -7.955 -1.106 1.00 0.00 H new ATOM 0 HD3 LYS B 753 -14.481 -6.289 -1.198 1.00 0.00 H new ATOM 0 HE2 LYS B 753 -17.438 -6.716 -0.741 1.00 0.00 H new ATOM 0 HE3 LYS B 753 -16.375 -7.098 0.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 753 -16.858 -4.746 0.662 1.00 0.00 H new ATOM 0 HZ2 LYS B 753 -15.235 -4.918 0.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 753 -16.419 -4.548 -0.966 1.00 0.00 H new ATOM 846 N ARG B 754 -15.287 -6.203 -6.297 1.00 0.00 N ATOM 847 CA ARG B 754 -16.010 -5.449 -7.360 1.00 0.00 C ATOM 848 C ARG B 754 -17.516 -5.687 -7.241 1.00 0.00 C ATOM 849 O ARG B 754 -18.319 -4.833 -7.559 1.00 0.00 O ATOM 850 CB ARG B 754 -15.484 -6.025 -8.678 1.00 0.00 C ATOM 851 CG ARG B 754 -13.967 -5.841 -8.749 1.00 0.00 C ATOM 852 CD ARG B 754 -13.458 -6.330 -10.106 1.00 0.00 C ATOM 853 NE ARG B 754 -12.135 -5.661 -10.283 1.00 0.00 N ATOM 854 CZ ARG B 754 -11.068 -6.097 -9.654 1.00 0.00 C ATOM 855 NH1 ARG B 754 -11.131 -7.132 -8.853 1.00 0.00 N ATOM 856 NH2 ARG B 754 -9.926 -5.490 -9.830 1.00 0.00 N ATOM 0 H ARG B 754 -15.339 -7.219 -6.374 1.00 0.00 H new ATOM 0 HA ARG B 754 -15.848 -4.373 -7.288 1.00 0.00 H new ATOM 0 HB2 ARG B 754 -15.736 -7.083 -8.750 1.00 0.00 H new ATOM 0 HB3 ARG B 754 -15.961 -5.525 -9.521 1.00 0.00 H new ATOM 0 HG2 ARG B 754 -13.710 -4.791 -8.609 1.00 0.00 H new ATOM 0 HG3 ARG B 754 -13.484 -6.397 -7.945 1.00 0.00 H new ATOM 0 HD2 ARG B 754 -13.357 -7.415 -10.123 1.00 0.00 H new ATOM 0 HD3 ARG B 754 -14.147 -6.061 -10.907 1.00 0.00 H new ATOM 0 HE ARG B 754 -12.059 -4.854 -10.902 1.00 0.00 H new ATOM 0 HH11 ARG B 754 -12.019 -7.613 -8.710 1.00 0.00 H new ATOM 0 HH12 ARG B 754 -10.292 -7.457 -8.373 1.00 0.00 H new ATOM 0 HH21 ARG B 754 -9.868 -4.684 -10.452 1.00 0.00 H new ATOM 0 HH22 ARG B 754 -9.092 -5.822 -9.345 1.00 0.00 H new ATOM 870 N THR B 755 -17.901 -6.844 -6.776 1.00 0.00 N ATOM 871 CA THR B 755 -19.353 -7.153 -6.641 1.00 0.00 C ATOM 872 C THR B 755 -19.986 -6.314 -5.526 1.00 0.00 C ATOM 873 O THR B 755 -21.117 -5.883 -5.628 1.00 0.00 O ATOM 874 CB THR B 755 -19.401 -8.641 -6.280 1.00 0.00 C ATOM 875 OG1 THR B 755 -20.754 -9.066 -6.209 1.00 0.00 O ATOM 876 CG2 THR B 755 -18.725 -8.867 -4.923 1.00 0.00 C ATOM 0 H THR B 755 -17.271 -7.591 -6.483 1.00 0.00 H new ATOM 0 HA THR B 755 -19.906 -6.927 -7.553 1.00 0.00 H new ATOM 0 HB THR B 755 -18.876 -9.214 -7.044 1.00 0.00 H new ATOM 0 HG1 THR B 755 -20.786 -10.018 -5.980 1.00 0.00 H new ATOM 0 HG21 THR B 755 -18.762 -9.927 -4.670 1.00 0.00 H new ATOM 0 HG22 THR B 755 -17.686 -8.542 -4.976 1.00 0.00 H new ATOM 0 HG23 THR B 755 -19.246 -8.293 -4.157 1.00 0.00 H new ATOM 884 N GLU B 756 -19.273 -6.099 -4.455 1.00 0.00 N ATOM 885 CA GLU B 756 -19.842 -5.311 -3.326 1.00 0.00 C ATOM 886 C GLU B 756 -19.139 -3.959 -3.194 1.00 0.00 C ATOM 887 O GLU B 756 -19.611 -3.069 -2.514 1.00 0.00 O ATOM 888 CB GLU B 756 -19.573 -6.167 -2.088 1.00 0.00 C ATOM 889 CG GLU B 756 -20.877 -6.812 -1.621 1.00 0.00 C ATOM 890 CD GLU B 756 -21.854 -5.722 -1.177 1.00 0.00 C ATOM 891 OE1 GLU B 756 -21.413 -4.792 -0.522 1.00 0.00 O ATOM 892 OE2 GLU B 756 -23.024 -5.834 -1.501 1.00 0.00 O ATOM 0 H GLU B 756 -18.321 -6.435 -4.313 1.00 0.00 H new ATOM 0 HA GLU B 756 -20.901 -5.098 -3.470 1.00 0.00 H new ATOM 0 HB2 GLU B 756 -18.836 -6.937 -2.318 1.00 0.00 H new ATOM 0 HB3 GLU B 756 -19.154 -5.552 -1.292 1.00 0.00 H new ATOM 0 HG2 GLU B 756 -21.314 -7.400 -2.428 1.00 0.00 H new ATOM 0 HG3 GLU B 756 -20.681 -7.498 -0.797 1.00 0.00 H new ATOM 899 N ALA B 757 -18.010 -3.799 -3.826 1.00 0.00 N ATOM 900 CA ALA B 757 -17.274 -2.509 -3.717 1.00 0.00 C ATOM 901 C ALA B 757 -17.366 -1.722 -5.032 1.00 0.00 C ATOM 902 O ALA B 757 -16.386 -1.582 -5.736 1.00 0.00 O ATOM 903 CB ALA B 757 -15.825 -2.918 -3.435 1.00 0.00 C ATOM 0 H ALA B 757 -17.565 -4.505 -4.413 1.00 0.00 H new ATOM 0 HA ALA B 757 -17.682 -1.862 -2.940 1.00 0.00 H new ATOM 0 HB1 ALA B 757 -15.207 -2.025 -3.339 1.00 0.00 H new ATOM 0 HB2 ALA B 757 -15.782 -3.490 -2.508 1.00 0.00 H new ATOM 0 HB3 ALA B 757 -15.453 -3.530 -4.257 1.00 0.00 H new ATOM 909 N PRO B 758 -18.546 -1.227 -5.326 1.00 0.00 N ATOM 910 CA PRO B 758 -18.743 -0.439 -6.567 1.00 0.00 C ATOM 911 C PRO B 758 -17.870 0.817 -6.537 1.00 0.00 C ATOM 912 O PRO B 758 -17.365 1.208 -5.504 1.00 0.00 O ATOM 913 CB PRO B 758 -20.228 -0.068 -6.549 1.00 0.00 C ATOM 914 CG PRO B 758 -20.683 -0.291 -5.140 1.00 0.00 C ATOM 915 CD PRO B 758 -19.781 -1.335 -4.539 1.00 0.00 C ATOM 0 HA PRO B 758 -18.467 -0.990 -7.466 1.00 0.00 H new ATOM 0 HB2 PRO B 758 -20.376 0.969 -6.849 1.00 0.00 H new ATOM 0 HB3 PRO B 758 -20.795 -0.685 -7.246 1.00 0.00 H new ATOM 0 HG2 PRO B 758 -20.632 0.636 -4.569 1.00 0.00 H new ATOM 0 HG3 PRO B 758 -21.721 -0.622 -5.119 1.00 0.00 H new ATOM 0 HD2 PRO B 758 -19.599 -1.145 -3.481 1.00 0.00 H new ATOM 0 HD3 PRO B 758 -20.217 -2.331 -4.614 1.00 0.00 H new ATOM 923 N GLY B 759 -17.668 1.440 -7.666 1.00 0.00 N ATOM 924 CA GLY B 759 -16.797 2.650 -7.704 1.00 0.00 C ATOM 925 C GLY B 759 -15.378 2.224 -8.088 1.00 0.00 C ATOM 926 O GLY B 759 -14.706 2.884 -8.856 1.00 0.00 O ATOM 0 H GLY B 759 -18.068 1.164 -8.563 1.00 0.00 H new ATOM 0 HA2 GLY B 759 -17.183 3.370 -8.425 1.00 0.00 H new ATOM 0 HA3 GLY B 759 -16.793 3.143 -6.732 1.00 0.00 H new ATOM 930 N TYR B 760 -14.928 1.116 -7.566 1.00 0.00 N ATOM 931 CA TYR B 760 -13.570 0.611 -7.913 1.00 0.00 C ATOM 932 C TYR B 760 -13.468 0.389 -9.426 1.00 0.00 C ATOM 933 O TYR B 760 -14.252 0.915 -10.191 1.00 0.00 O ATOM 934 CB TYR B 760 -13.472 -0.735 -7.177 1.00 0.00 C ATOM 935 CG TYR B 760 -12.518 -0.636 -6.009 1.00 0.00 C ATOM 936 CD1 TYR B 760 -12.692 0.357 -5.037 1.00 0.00 C ATOM 937 CD2 TYR B 760 -11.488 -1.575 -5.874 1.00 0.00 C ATOM 938 CE1 TYR B 760 -11.817 0.428 -3.944 1.00 0.00 C ATOM 939 CE2 TYR B 760 -10.614 -1.506 -4.783 1.00 0.00 C ATOM 940 CZ TYR B 760 -10.779 -0.507 -3.816 1.00 0.00 C ATOM 941 OH TYR B 760 -9.910 -0.437 -2.748 1.00 0.00 O ATOM 0 H TYR B 760 -15.448 0.534 -6.909 1.00 0.00 H new ATOM 0 HA TYR B 760 -12.776 1.304 -7.633 1.00 0.00 H new ATOM 0 HB2 TYR B 760 -14.458 -1.034 -6.823 1.00 0.00 H new ATOM 0 HB3 TYR B 760 -13.132 -1.508 -7.866 1.00 0.00 H new ATOM 0 HD1 TYR B 760 -13.500 1.068 -5.129 1.00 0.00 H new ATOM 0 HD2 TYR B 760 -11.368 -2.354 -6.613 1.00 0.00 H new ATOM 0 HE1 TYR B 760 -11.942 1.202 -3.201 1.00 0.00 H new ATOM 0 HE2 TYR B 760 -9.812 -2.223 -4.687 1.00 0.00 H new ATOM 0 HH TYR B 760 -9.159 0.150 -2.975 1.00 0.00 H new ATOM 951 N TYR B 761 -12.529 -0.415 -9.863 1.00 0.00 N ATOM 952 CA TYR B 761 -12.386 -0.725 -11.328 1.00 0.00 C ATOM 953 C TYR B 761 -11.940 0.499 -12.140 1.00 0.00 C ATOM 954 O TYR B 761 -10.982 0.431 -12.886 1.00 0.00 O ATOM 955 CB TYR B 761 -13.769 -1.197 -11.798 1.00 0.00 C ATOM 956 CG TYR B 761 -13.627 -1.949 -13.099 1.00 0.00 C ATOM 957 CD1 TYR B 761 -12.911 -3.151 -13.138 1.00 0.00 C ATOM 958 CD2 TYR B 761 -14.209 -1.442 -14.266 1.00 0.00 C ATOM 959 CE1 TYR B 761 -12.778 -3.847 -14.346 1.00 0.00 C ATOM 960 CE2 TYR B 761 -14.078 -2.138 -15.473 1.00 0.00 C ATOM 961 CZ TYR B 761 -13.362 -3.341 -15.513 1.00 0.00 C ATOM 962 OH TYR B 761 -13.232 -4.027 -16.704 1.00 0.00 O ATOM 0 H TYR B 761 -11.846 -0.877 -9.263 1.00 0.00 H new ATOM 0 HA TYR B 761 -11.618 -1.483 -11.479 1.00 0.00 H new ATOM 0 HB2 TYR B 761 -14.223 -1.838 -11.042 1.00 0.00 H new ATOM 0 HB3 TYR B 761 -14.432 -0.342 -11.930 1.00 0.00 H new ATOM 0 HD1 TYR B 761 -12.461 -3.542 -12.237 1.00 0.00 H new ATOM 0 HD2 TYR B 761 -14.759 -0.513 -14.235 1.00 0.00 H new ATOM 0 HE1 TYR B 761 -12.225 -4.774 -14.377 1.00 0.00 H new ATOM 0 HE2 TYR B 761 -14.529 -1.748 -16.373 1.00 0.00 H new ATOM 0 HH TYR B 761 -13.698 -3.539 -17.415 1.00 0.00 H new ATOM 972 N GLU B 762 -12.648 1.596 -12.062 1.00 0.00 N ATOM 973 CA GLU B 762 -12.256 2.783 -12.873 1.00 0.00 C ATOM 974 C GLU B 762 -11.455 3.762 -12.027 1.00 0.00 C ATOM 975 O GLU B 762 -11.416 4.946 -12.295 1.00 0.00 O ATOM 976 CB GLU B 762 -13.578 3.414 -13.316 1.00 0.00 C ATOM 977 CG GLU B 762 -13.999 2.829 -14.666 1.00 0.00 C ATOM 978 CD GLU B 762 -15.397 3.334 -15.028 1.00 0.00 C ATOM 979 OE1 GLU B 762 -16.116 3.727 -14.125 1.00 0.00 O ATOM 980 OE2 GLU B 762 -15.725 3.319 -16.204 1.00 0.00 O ATOM 0 H GLU B 762 -13.474 1.719 -11.476 1.00 0.00 H new ATOM 0 HA GLU B 762 -11.628 2.512 -13.721 1.00 0.00 H new ATOM 0 HB2 GLU B 762 -14.350 3.226 -12.570 1.00 0.00 H new ATOM 0 HB3 GLU B 762 -13.468 4.496 -13.395 1.00 0.00 H new ATOM 0 HG2 GLU B 762 -13.285 3.118 -15.438 1.00 0.00 H new ATOM 0 HG3 GLU B 762 -13.995 1.740 -14.619 1.00 0.00 H new ATOM 987 N VAL B 763 -10.802 3.270 -11.019 1.00 0.00 N ATOM 988 CA VAL B 763 -9.994 4.158 -10.144 1.00 0.00 C ATOM 989 C VAL B 763 -8.860 3.357 -9.495 1.00 0.00 C ATOM 990 O VAL B 763 -7.728 3.791 -9.430 1.00 0.00 O ATOM 991 CB VAL B 763 -10.983 4.683 -9.087 1.00 0.00 C ATOM 992 CG1 VAL B 763 -11.994 5.614 -9.747 1.00 0.00 C ATOM 993 CG2 VAL B 763 -11.749 3.533 -8.424 1.00 0.00 C ATOM 0 H VAL B 763 -10.792 2.283 -10.760 1.00 0.00 H new ATOM 0 HA VAL B 763 -9.526 4.976 -10.691 1.00 0.00 H new ATOM 0 HB VAL B 763 -10.408 5.214 -8.328 1.00 0.00 H new ATOM 0 HG11 VAL B 763 -12.692 5.984 -8.996 1.00 0.00 H new ATOM 0 HG12 VAL B 763 -11.471 6.455 -10.202 1.00 0.00 H new ATOM 0 HG13 VAL B 763 -12.542 5.069 -10.516 1.00 0.00 H new ATOM 0 HG21 VAL B 763 -12.439 3.935 -7.683 1.00 0.00 H new ATOM 0 HG22 VAL B 763 -12.309 2.985 -9.181 1.00 0.00 H new ATOM 0 HG23 VAL B 763 -11.044 2.860 -7.936 1.00 0.00 H new ATOM 1003 N ILE B 764 -9.155 2.164 -9.076 1.00 0.00 N ATOM 1004 CA ILE B 764 -8.125 1.293 -8.437 1.00 0.00 C ATOM 1005 C ILE B 764 -7.466 0.404 -9.494 1.00 0.00 C ATOM 1006 O ILE B 764 -7.940 -0.675 -9.789 1.00 0.00 O ATOM 1007 CB ILE B 764 -8.898 0.414 -7.430 1.00 0.00 C ATOM 1008 CG1 ILE B 764 -9.982 1.223 -6.701 1.00 0.00 C ATOM 1009 CG2 ILE B 764 -7.930 -0.161 -6.395 1.00 0.00 C ATOM 1010 CD1 ILE B 764 -9.399 2.537 -6.171 1.00 0.00 C ATOM 0 H ILE B 764 -10.082 1.744 -9.148 1.00 0.00 H new ATOM 0 HA ILE B 764 -7.341 1.878 -7.956 1.00 0.00 H new ATOM 0 HB ILE B 764 -9.377 -0.391 -7.988 1.00 0.00 H new ATOM 0 HG12 ILE B 764 -10.808 1.432 -7.381 1.00 0.00 H new ATOM 0 HG13 ILE B 764 -10.388 0.638 -5.876 1.00 0.00 H new ATOM 0 HG21 ILE B 764 -8.480 -0.780 -5.687 1.00 0.00 H new ATOM 0 HG22 ILE B 764 -7.177 -0.767 -6.898 1.00 0.00 H new ATOM 0 HG23 ILE B 764 -7.442 0.654 -5.861 1.00 0.00 H new ATOM 0 HD11 ILE B 764 -10.178 3.100 -5.657 1.00 0.00 H new ATOM 0 HD12 ILE B 764 -8.588 2.321 -5.475 1.00 0.00 H new ATOM 0 HD13 ILE B 764 -9.015 3.127 -7.003 1.00 0.00 H new ATOM 1022 N ARG B 765 -6.384 0.844 -10.073 1.00 0.00 N ATOM 1023 CA ARG B 765 -5.707 0.007 -11.104 1.00 0.00 C ATOM 1024 C ARG B 765 -5.392 -1.374 -10.535 1.00 0.00 C ATOM 1025 O ARG B 765 -5.831 -2.385 -11.047 1.00 0.00 O ATOM 1026 CB ARG B 765 -4.409 0.747 -11.424 1.00 0.00 C ATOM 1027 CG ARG B 765 -4.730 2.178 -11.861 1.00 0.00 C ATOM 1028 CD ARG B 765 -4.266 3.161 -10.784 1.00 0.00 C ATOM 1029 NE ARG B 765 -5.217 4.308 -10.884 1.00 0.00 N ATOM 1030 CZ ARG B 765 -4.911 5.485 -10.390 1.00 0.00 C ATOM 1031 NH1 ARG B 765 -3.763 5.689 -9.793 1.00 0.00 N ATOM 1032 NH2 ARG B 765 -5.764 6.467 -10.495 1.00 0.00 N ATOM 0 H ARG B 765 -5.941 1.742 -9.879 1.00 0.00 H new ATOM 0 HA ARG B 765 -6.329 -0.139 -11.987 1.00 0.00 H new ATOM 0 HB2 ARG B 765 -3.760 0.760 -10.548 1.00 0.00 H new ATOM 0 HB3 ARG B 765 -3.867 0.227 -12.214 1.00 0.00 H new ATOM 0 HG2 ARG B 765 -4.236 2.399 -12.807 1.00 0.00 H new ATOM 0 HG3 ARG B 765 -5.802 2.286 -12.029 1.00 0.00 H new ATOM 0 HD2 ARG B 765 -4.296 2.707 -9.794 1.00 0.00 H new ATOM 0 HD3 ARG B 765 -3.239 3.482 -10.957 1.00 0.00 H new ATOM 0 HE ARG B 765 -6.118 4.175 -11.343 1.00 0.00 H new ATOM 0 HH11 ARG B 765 -3.091 4.927 -9.706 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -3.541 6.610 -9.415 1.00 0.00 H new ATOM 0 HH21 ARG B 765 -6.660 6.317 -10.958 1.00 0.00 H new ATOM 0 HH22 ARG B 765 -5.534 7.385 -10.114 1.00 0.00 H new ATOM 1046 N PHE B 766 -4.628 -1.423 -9.479 1.00 0.00 N ATOM 1047 CA PHE B 766 -4.285 -2.735 -8.867 1.00 0.00 C ATOM 1048 C PHE B 766 -4.799 -2.795 -7.425 1.00 0.00 C ATOM 1049 O PHE B 766 -4.050 -2.567 -6.495 1.00 0.00 O ATOM 1050 CB PHE B 766 -2.759 -2.794 -8.887 1.00 0.00 C ATOM 1051 CG PHE B 766 -2.310 -3.813 -9.906 1.00 0.00 C ATOM 1052 CD1 PHE B 766 -2.574 -3.607 -11.265 1.00 0.00 C ATOM 1053 CD2 PHE B 766 -1.632 -4.966 -9.491 1.00 0.00 C ATOM 1054 CE1 PHE B 766 -2.158 -4.553 -12.210 1.00 0.00 C ATOM 1055 CE2 PHE B 766 -1.217 -5.912 -10.436 1.00 0.00 C ATOM 1056 CZ PHE B 766 -1.480 -5.705 -11.795 1.00 0.00 C ATOM 0 H PHE B 766 -4.226 -0.609 -9.014 1.00 0.00 H new ATOM 0 HA PHE B 766 -4.735 -3.570 -9.404 1.00 0.00 H new ATOM 0 HB2 PHE B 766 -2.349 -1.814 -9.132 1.00 0.00 H new ATOM 0 HB3 PHE B 766 -2.381 -3.060 -7.900 1.00 0.00 H new ATOM 0 HD1 PHE B 766 -3.098 -2.719 -11.585 1.00 0.00 H new ATOM 0 HD2 PHE B 766 -1.429 -5.125 -8.442 1.00 0.00 H new ATOM 0 HE1 PHE B 766 -2.360 -4.394 -13.259 1.00 0.00 H new ATOM 0 HE2 PHE B 766 -0.694 -6.801 -10.116 1.00 0.00 H new ATOM 0 HZ PHE B 766 -1.160 -6.435 -12.524 1.00 0.00 H new ATOM 1066 N PRO B 767 -6.069 -3.091 -7.281 1.00 0.00 N ATOM 1067 CA PRO B 767 -6.688 -3.194 -5.936 1.00 0.00 C ATOM 1068 C PRO B 767 -5.793 -3.978 -4.972 1.00 0.00 C ATOM 1069 O PRO B 767 -5.866 -5.187 -4.881 1.00 0.00 O ATOM 1070 CB PRO B 767 -8.001 -3.950 -6.193 1.00 0.00 C ATOM 1071 CG PRO B 767 -7.976 -4.338 -7.644 1.00 0.00 C ATOM 1072 CD PRO B 767 -7.040 -3.389 -8.332 1.00 0.00 C ATOM 0 HA PRO B 767 -6.841 -2.219 -5.473 1.00 0.00 H new ATOM 0 HB2 PRO B 767 -8.076 -4.830 -5.555 1.00 0.00 H new ATOM 0 HB3 PRO B 767 -8.863 -3.321 -5.972 1.00 0.00 H new ATOM 0 HG2 PRO B 767 -7.638 -5.368 -7.763 1.00 0.00 H new ATOM 0 HG3 PRO B 767 -8.974 -4.278 -8.077 1.00 0.00 H new ATOM 0 HD2 PRO B 767 -6.569 -3.843 -9.204 1.00 0.00 H new ATOM 0 HD3 PRO B 767 -7.553 -2.492 -8.678 1.00 0.00 H new ATOM 1080 N MET B 768 -4.953 -3.291 -4.247 1.00 0.00 N ATOM 1081 CA MET B 768 -4.056 -3.983 -3.280 1.00 0.00 C ATOM 1082 C MET B 768 -4.358 -3.511 -1.857 1.00 0.00 C ATOM 1083 O MET B 768 -4.988 -2.492 -1.656 1.00 0.00 O ATOM 1084 CB MET B 768 -2.643 -3.566 -3.693 1.00 0.00 C ATOM 1085 CG MET B 768 -1.645 -4.643 -3.263 1.00 0.00 C ATOM 1086 SD MET B 768 -1.369 -5.792 -4.634 1.00 0.00 S ATOM 1087 CE MET B 768 -2.771 -6.885 -4.299 1.00 0.00 C ATOM 0 H MET B 768 -4.849 -2.277 -4.283 1.00 0.00 H new ATOM 0 HA MET B 768 -4.184 -5.065 -3.292 1.00 0.00 H new ATOM 0 HB2 MET B 768 -2.596 -3.422 -4.772 1.00 0.00 H new ATOM 0 HB3 MET B 768 -2.385 -2.612 -3.233 1.00 0.00 H new ATOM 0 HG2 MET B 768 -0.703 -4.183 -2.965 1.00 0.00 H new ATOM 0 HG3 MET B 768 -2.026 -5.181 -2.395 1.00 0.00 H new ATOM 0 HE1 MET B 768 -2.538 -7.892 -4.645 1.00 0.00 H new ATOM 0 HE2 MET B 768 -2.968 -6.906 -3.227 1.00 0.00 H new ATOM 0 HE3 MET B 768 -3.653 -6.516 -4.822 1.00 0.00 H new ATOM 1097 N ASP B 769 -3.917 -4.239 -0.868 1.00 0.00 N ATOM 1098 CA ASP B 769 -4.189 -3.827 0.538 1.00 0.00 C ATOM 1099 C ASP B 769 -3.320 -4.628 1.509 1.00 0.00 C ATOM 1100 O ASP B 769 -3.054 -5.795 1.296 1.00 0.00 O ATOM 1101 CB ASP B 769 -5.667 -4.157 0.760 1.00 0.00 C ATOM 1102 CG ASP B 769 -6.519 -2.916 0.486 1.00 0.00 C ATOM 1103 OD1 ASP B 769 -6.013 -1.821 0.670 1.00 0.00 O ATOM 1104 OD2 ASP B 769 -7.660 -3.083 0.088 1.00 0.00 O ATOM 0 H ASP B 769 -3.381 -5.100 -0.973 1.00 0.00 H new ATOM 0 HA ASP B 769 -3.966 -2.774 0.708 1.00 0.00 H new ATOM 0 HB2 ASP B 769 -5.971 -4.971 0.102 1.00 0.00 H new ATOM 0 HB3 ASP B 769 -5.824 -4.499 1.783 1.00 0.00 H new ATOM 1109 N LEU B 770 -2.895 -4.020 2.589 1.00 0.00 N ATOM 1110 CA LEU B 770 -2.064 -4.757 3.590 1.00 0.00 C ATOM 1111 C LEU B 770 -2.719 -6.098 3.927 1.00 0.00 C ATOM 1112 O LEU B 770 -2.054 -7.073 4.213 1.00 0.00 O ATOM 1113 CB LEU B 770 -2.034 -3.852 4.825 1.00 0.00 C ATOM 1114 CG LEU B 770 -1.298 -2.549 4.494 1.00 0.00 C ATOM 1115 CD1 LEU B 770 -1.217 -1.682 5.752 1.00 0.00 C ATOM 1116 CD2 LEU B 770 0.116 -2.864 3.999 1.00 0.00 C ATOM 0 H LEU B 770 -3.088 -3.045 2.820 1.00 0.00 H new ATOM 0 HA LEU B 770 -1.062 -4.972 3.219 1.00 0.00 H new ATOM 0 HB2 LEU B 770 -3.051 -3.634 5.152 1.00 0.00 H new ATOM 0 HB3 LEU B 770 -1.536 -4.362 5.650 1.00 0.00 H new ATOM 0 HG LEU B 770 -1.840 -2.015 3.714 1.00 0.00 H new ATOM 0 HD11 LEU B 770 -0.694 -0.754 5.521 1.00 0.00 H new ATOM 0 HD12 LEU B 770 -2.224 -1.454 6.102 1.00 0.00 H new ATOM 0 HD13 LEU B 770 -0.675 -2.220 6.530 1.00 0.00 H new ATOM 0 HD21 LEU B 770 0.635 -1.935 3.765 1.00 0.00 H new ATOM 0 HD22 LEU B 770 0.663 -3.399 4.775 1.00 0.00 H new ATOM 0 HD23 LEU B 770 0.059 -3.483 3.104 1.00 0.00 H new ATOM 1128 N LYS B 771 -4.024 -6.158 3.842 1.00 0.00 N ATOM 1129 CA LYS B 771 -4.752 -7.435 4.102 1.00 0.00 C ATOM 1130 C LYS B 771 -4.069 -8.599 3.374 1.00 0.00 C ATOM 1131 O LYS B 771 -3.916 -9.679 3.908 1.00 0.00 O ATOM 1132 CB LYS B 771 -6.142 -7.191 3.511 1.00 0.00 C ATOM 1133 CG LYS B 771 -7.203 -7.915 4.342 1.00 0.00 C ATOM 1134 CD LYS B 771 -6.962 -9.428 4.298 1.00 0.00 C ATOM 1135 CE LYS B 771 -6.895 -9.908 2.844 1.00 0.00 C ATOM 1136 NZ LYS B 771 -7.678 -11.175 2.821 1.00 0.00 N ATOM 0 H LYS B 771 -4.622 -5.367 3.601 1.00 0.00 H new ATOM 0 HA LYS B 771 -4.777 -7.696 5.160 1.00 0.00 H new ATOM 0 HB2 LYS B 771 -6.354 -6.122 3.489 1.00 0.00 H new ATOM 0 HB3 LYS B 771 -6.174 -7.543 2.480 1.00 0.00 H new ATOM 0 HG2 LYS B 771 -7.171 -7.563 5.373 1.00 0.00 H new ATOM 0 HG3 LYS B 771 -8.197 -7.686 3.957 1.00 0.00 H new ATOM 0 HD2 LYS B 771 -6.032 -9.671 4.813 1.00 0.00 H new ATOM 0 HD3 LYS B 771 -7.763 -9.947 4.824 1.00 0.00 H new ATOM 0 HE2 LYS B 771 -7.319 -9.169 2.164 1.00 0.00 H new ATOM 0 HE3 LYS B 771 -5.865 -10.075 2.530 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 -7.823 -11.476 1.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 -7.158 -11.914 3.336 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 -8.601 -11.021 3.275 1.00 0.00 H new ATOM 1150 N THR B 772 -3.637 -8.370 2.163 1.00 0.00 N ATOM 1151 CA THR B 772 -2.954 -9.447 1.391 1.00 0.00 C ATOM 1152 C THR B 772 -1.544 -9.005 0.982 1.00 0.00 C ATOM 1153 O THR B 772 -0.700 -9.818 0.665 1.00 0.00 O ATOM 1154 CB THR B 772 -3.824 -9.652 0.150 1.00 0.00 C ATOM 1155 OG1 THR B 772 -3.212 -10.607 -0.704 1.00 0.00 O ATOM 1156 CG2 THR B 772 -3.970 -8.323 -0.594 1.00 0.00 C ATOM 0 H THR B 772 -3.728 -7.480 1.674 1.00 0.00 H new ATOM 0 HA THR B 772 -2.842 -10.361 1.975 1.00 0.00 H new ATOM 0 HB THR B 772 -4.808 -10.011 0.451 1.00 0.00 H new ATOM 0 HG1 THR B 772 -3.770 -10.740 -1.499 1.00 0.00 H new ATOM 0 HG21 THR B 772 -4.590 -8.468 -1.479 1.00 0.00 H new ATOM 0 HG22 THR B 772 -4.439 -7.589 0.061 1.00 0.00 H new ATOM 0 HG23 THR B 772 -2.986 -7.965 -0.895 1.00 0.00 H new ATOM 1164 N MET B 773 -1.283 -7.724 0.976 1.00 0.00 N ATOM 1165 CA MET B 773 0.073 -7.246 0.585 1.00 0.00 C ATOM 1166 C MET B 773 1.108 -7.686 1.620 1.00 0.00 C ATOM 1167 O MET B 773 2.257 -7.921 1.301 1.00 0.00 O ATOM 1168 CB MET B 773 -0.038 -5.721 0.552 1.00 0.00 C ATOM 1169 CG MET B 773 0.746 -5.181 -0.645 1.00 0.00 C ATOM 1170 SD MET B 773 2.507 -5.530 -0.419 1.00 0.00 S ATOM 1171 CE MET B 773 2.826 -4.279 0.849 1.00 0.00 C ATOM 0 H MET B 773 -1.948 -6.992 1.224 1.00 0.00 H new ATOM 0 HA MET B 773 0.392 -7.652 -0.375 1.00 0.00 H new ATOM 0 HB2 MET B 773 -1.084 -5.423 0.480 1.00 0.00 H new ATOM 0 HB3 MET B 773 0.352 -5.297 1.477 1.00 0.00 H new ATOM 0 HG2 MET B 773 0.388 -5.642 -1.566 1.00 0.00 H new ATOM 0 HG3 MET B 773 0.587 -4.107 -0.743 1.00 0.00 H new ATOM 0 HE1 MET B 773 3.472 -3.502 0.439 1.00 0.00 H new ATOM 0 HE2 MET B 773 1.883 -3.836 1.168 1.00 0.00 H new ATOM 0 HE3 MET B 773 3.316 -4.744 1.704 1.00 0.00 H new ATOM 1181 N SER B 774 0.710 -7.808 2.856 1.00 0.00 N ATOM 1182 CA SER B 774 1.670 -8.252 3.905 1.00 0.00 C ATOM 1183 C SER B 774 1.864 -9.767 3.830 1.00 0.00 C ATOM 1184 O SER B 774 2.859 -10.299 4.279 1.00 0.00 O ATOM 1185 CB SER B 774 1.012 -7.864 5.230 1.00 0.00 C ATOM 1186 OG SER B 774 -0.012 -8.796 5.542 1.00 0.00 O ATOM 0 H SER B 774 -0.237 -7.620 3.185 1.00 0.00 H new ATOM 0 HA SER B 774 2.653 -7.797 3.788 1.00 0.00 H new ATOM 0 HB2 SER B 774 1.756 -7.846 6.026 1.00 0.00 H new ATOM 0 HB3 SER B 774 0.595 -6.859 5.160 1.00 0.00 H new ATOM 0 HG SER B 774 -0.869 -8.467 5.200 1.00 0.00 H new ATOM 1192 N GLU B 775 0.919 -10.465 3.260 1.00 0.00 N ATOM 1193 CA GLU B 775 1.050 -11.943 3.149 1.00 0.00 C ATOM 1194 C GLU B 775 2.247 -12.302 2.265 1.00 0.00 C ATOM 1195 O GLU B 775 2.803 -13.378 2.361 1.00 0.00 O ATOM 1196 CB GLU B 775 -0.253 -12.402 2.502 1.00 0.00 C ATOM 1197 CG GLU B 775 -1.256 -12.723 3.591 1.00 0.00 C ATOM 1198 CD GLU B 775 -2.087 -13.943 3.190 1.00 0.00 C ATOM 1199 OE1 GLU B 775 -2.431 -14.044 2.024 1.00 0.00 O ATOM 1200 OE2 GLU B 775 -2.365 -14.757 4.056 1.00 0.00 O ATOM 0 H GLU B 775 0.063 -10.074 2.867 1.00 0.00 H new ATOM 0 HA GLU B 775 1.217 -12.420 4.115 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.644 -11.623 1.848 1.00 0.00 H new ATOM 0 HB3 GLU B 775 -0.077 -13.281 1.881 1.00 0.00 H new ATOM 0 HG2 GLU B 775 -0.737 -12.918 4.529 1.00 0.00 H new ATOM 0 HG3 GLU B 775 -1.909 -11.867 3.760 1.00 0.00 H new ATOM 1207 N ARG B 776 2.649 -11.404 1.405 1.00 0.00 N ATOM 1208 CA ARG B 776 3.814 -11.685 0.519 1.00 0.00 C ATOM 1209 C ARG B 776 5.112 -11.642 1.326 1.00 0.00 C ATOM 1210 O ARG B 776 5.907 -12.560 1.291 1.00 0.00 O ATOM 1211 CB ARG B 776 3.794 -10.565 -0.522 1.00 0.00 C ATOM 1212 CG ARG B 776 2.462 -10.594 -1.273 1.00 0.00 C ATOM 1213 CD ARG B 776 2.622 -11.403 -2.562 1.00 0.00 C ATOM 1214 NE ARG B 776 2.187 -12.786 -2.206 1.00 0.00 N ATOM 1215 CZ ARG B 776 0.912 -13.084 -2.091 1.00 0.00 C ATOM 1216 NH1 ARG B 776 -0.013 -12.177 -2.284 1.00 0.00 N ATOM 1217 NH2 ARG B 776 0.562 -14.302 -1.780 1.00 0.00 N ATOM 0 H ARG B 776 2.220 -10.487 1.279 1.00 0.00 H new ATOM 0 HA ARG B 776 3.758 -12.672 0.060 1.00 0.00 H new ATOM 0 HB2 ARG B 776 3.929 -9.599 -0.036 1.00 0.00 H new ATOM 0 HB3 ARG B 776 4.621 -10.688 -1.221 1.00 0.00 H new ATOM 0 HG2 ARG B 776 1.688 -11.037 -0.646 1.00 0.00 H new ATOM 0 HG3 ARG B 776 2.141 -9.579 -1.505 1.00 0.00 H new ATOM 0 HD2 ARG B 776 2.011 -10.991 -3.365 1.00 0.00 H new ATOM 0 HD3 ARG B 776 3.655 -11.391 -2.910 1.00 0.00 H new ATOM 0 HE ARG B 776 2.889 -13.510 -2.050 1.00 0.00 H new ATOM 0 HH11 ARG B 776 0.252 -11.223 -2.528 1.00 0.00 H new ATOM 0 HH12 ARG B 776 -0.998 -12.425 -2.191 1.00 0.00 H new ATOM 0 HH21 ARG B 776 1.276 -15.015 -1.628 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -0.425 -14.541 -1.689 1.00 0.00 H new ATOM 1231 N LEU B 777 5.325 -10.588 2.070 1.00 0.00 N ATOM 1232 CA LEU B 777 6.560 -10.493 2.903 1.00 0.00 C ATOM 1233 C LEU B 777 6.733 -11.770 3.728 1.00 0.00 C ATOM 1234 O LEU B 777 7.831 -12.243 3.943 1.00 0.00 O ATOM 1235 CB LEU B 777 6.312 -9.291 3.818 1.00 0.00 C ATOM 1236 CG LEU B 777 7.609 -8.501 4.006 1.00 0.00 C ATOM 1237 CD1 LEU B 777 8.671 -9.398 4.647 1.00 0.00 C ATOM 1238 CD2 LEU B 777 8.109 -8.006 2.646 1.00 0.00 C ATOM 0 H LEU B 777 4.696 -9.788 2.137 1.00 0.00 H new ATOM 0 HA LEU B 777 7.464 -10.376 2.306 1.00 0.00 H new ATOM 0 HB2 LEU B 777 5.544 -8.648 3.388 1.00 0.00 H new ATOM 0 HB3 LEU B 777 5.939 -9.630 4.785 1.00 0.00 H new ATOM 0 HG LEU B 777 7.420 -7.647 4.656 1.00 0.00 H new ATOM 0 HD11 LEU B 777 9.593 -8.832 4.779 1.00 0.00 H new ATOM 0 HD12 LEU B 777 8.316 -9.746 5.617 1.00 0.00 H new ATOM 0 HD13 LEU B 777 8.861 -10.255 4.001 1.00 0.00 H new ATOM 0 HD21 LEU B 777 9.033 -7.443 2.781 1.00 0.00 H new ATOM 0 HD22 LEU B 777 8.296 -8.860 1.994 1.00 0.00 H new ATOM 0 HD23 LEU B 777 7.355 -7.362 2.193 1.00 0.00 H new ATOM 1250 N LYS B 778 5.647 -12.343 4.165 1.00 0.00 N ATOM 1251 CA LYS B 778 5.729 -13.613 4.935 1.00 0.00 C ATOM 1252 C LYS B 778 5.974 -14.777 3.975 1.00 0.00 C ATOM 1253 O LYS B 778 6.524 -15.797 4.341 1.00 0.00 O ATOM 1254 CB LYS B 778 4.358 -13.749 5.600 1.00 0.00 C ATOM 1255 CG LYS B 778 4.475 -14.620 6.851 1.00 0.00 C ATOM 1256 CD LYS B 778 3.350 -14.271 7.817 1.00 0.00 C ATOM 1257 CE LYS B 778 2.079 -15.021 7.413 1.00 0.00 C ATOM 1258 NZ LYS B 778 2.160 -16.325 8.128 1.00 0.00 N ATOM 0 H LYS B 778 4.703 -11.984 4.021 1.00 0.00 H new ATOM 0 HA LYS B 778 6.540 -13.616 5.664 1.00 0.00 H new ATOM 0 HB2 LYS B 778 3.973 -12.764 5.866 1.00 0.00 H new ATOM 0 HB3 LYS B 778 3.647 -14.192 4.902 1.00 0.00 H new ATOM 0 HG2 LYS B 778 4.422 -15.674 6.580 1.00 0.00 H new ATOM 0 HG3 LYS B 778 5.442 -14.462 7.329 1.00 0.00 H new ATOM 0 HD2 LYS B 778 3.634 -14.538 8.835 1.00 0.00 H new ATOM 0 HD3 LYS B 778 3.169 -13.196 7.808 1.00 0.00 H new ATOM 0 HE2 LYS B 778 1.185 -14.467 7.701 1.00 0.00 H new ATOM 0 HE3 LYS B 778 2.031 -15.165 6.334 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 1.322 -16.898 7.902 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 3.017 -16.832 7.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 2.197 -16.157 9.154 1.00 0.00 H new ATOM 1272 N ASN B 779 5.578 -14.621 2.740 1.00 0.00 N ATOM 1273 CA ASN B 779 5.781 -15.704 1.740 1.00 0.00 C ATOM 1274 C ASN B 779 6.994 -15.407 0.853 1.00 0.00 C ATOM 1275 O ASN B 779 7.230 -16.081 -0.130 1.00 0.00 O ATOM 1276 CB ASN B 779 4.505 -15.685 0.899 1.00 0.00 C ATOM 1277 CG ASN B 779 4.144 -17.112 0.489 1.00 0.00 C ATOM 1278 OD1 ASN B 779 4.459 -17.542 -0.603 1.00 0.00 O ATOM 1279 ND2 ASN B 779 3.494 -17.872 1.327 1.00 0.00 N ATOM 0 H ASN B 779 5.120 -13.784 2.381 1.00 0.00 H new ATOM 0 HA ASN B 779 5.966 -16.669 2.212 1.00 0.00 H new ATOM 0 HB2 ASN B 779 3.688 -15.241 1.468 1.00 0.00 H new ATOM 0 HB3 ASN B 779 4.650 -15.066 0.013 1.00 0.00 H new ATOM 0 HD21 ASN B 779 3.250 -18.827 1.066 1.00 0.00 H new ATOM 0 HD22 ASN B 779 3.230 -17.511 2.244 1.00 0.00 H new ATOM 1286 N ARG B 780 7.753 -14.392 1.171 1.00 0.00 N ATOM 1287 CA ARG B 780 8.928 -14.048 0.321 1.00 0.00 C ATOM 1288 C ARG B 780 8.495 -13.896 -1.138 1.00 0.00 C ATOM 1289 O ARG B 780 8.627 -14.804 -1.934 1.00 0.00 O ATOM 1290 CB ARG B 780 9.888 -15.228 0.469 1.00 0.00 C ATOM 1291 CG ARG B 780 11.127 -14.979 -0.393 1.00 0.00 C ATOM 1292 CD ARG B 780 11.132 -15.952 -1.574 1.00 0.00 C ATOM 1293 NE ARG B 780 12.357 -16.783 -1.383 1.00 0.00 N ATOM 1294 CZ ARG B 780 12.545 -17.878 -2.083 1.00 0.00 C ATOM 1295 NH1 ARG B 780 11.664 -18.273 -2.969 1.00 0.00 N ATOM 1296 NH2 ARG B 780 13.625 -18.584 -1.893 1.00 0.00 N ATOM 0 H ARG B 780 7.610 -13.788 1.981 1.00 0.00 H new ATOM 0 HA ARG B 780 9.390 -13.107 0.620 1.00 0.00 H new ATOM 0 HB2 ARG B 780 10.175 -15.350 1.513 1.00 0.00 H new ATOM 0 HB3 ARG B 780 9.397 -16.152 0.163 1.00 0.00 H new ATOM 0 HG2 ARG B 780 11.130 -13.951 -0.755 1.00 0.00 H new ATOM 0 HG3 ARG B 780 12.030 -15.110 0.203 1.00 0.00 H new ATOM 0 HD2 ARG B 780 10.233 -16.569 -1.581 1.00 0.00 H new ATOM 0 HD3 ARG B 780 11.160 -15.419 -2.525 1.00 0.00 H new ATOM 0 HE ARG B 780 13.058 -16.496 -0.699 1.00 0.00 H new ATOM 0 HH11 ARG B 780 10.816 -17.727 -3.124 1.00 0.00 H new ATOM 0 HH12 ARG B 780 11.826 -19.126 -3.504 1.00 0.00 H new ATOM 0 HH21 ARG B 780 14.316 -18.284 -1.205 1.00 0.00 H new ATOM 0 HH22 ARG B 780 13.779 -19.436 -2.432 1.00 0.00 H new ATOM 1310 N TYR B 781 7.958 -12.761 -1.486 1.00 0.00 N ATOM 1311 CA TYR B 781 7.508 -12.547 -2.890 1.00 0.00 C ATOM 1312 C TYR B 781 7.849 -11.126 -3.330 1.00 0.00 C ATOM 1313 O TYR B 781 8.444 -10.910 -4.366 1.00 0.00 O ATOM 1314 CB TYR B 781 5.992 -12.746 -2.852 1.00 0.00 C ATOM 1315 CG TYR B 781 5.624 -13.959 -3.673 1.00 0.00 C ATOM 1316 CD1 TYR B 781 5.995 -14.029 -5.022 1.00 0.00 C ATOM 1317 CD2 TYR B 781 4.914 -15.013 -3.087 1.00 0.00 C ATOM 1318 CE1 TYR B 781 5.655 -15.153 -5.784 1.00 0.00 C ATOM 1319 CE2 TYR B 781 4.574 -16.138 -3.849 1.00 0.00 C ATOM 1320 CZ TYR B 781 4.945 -16.208 -5.197 1.00 0.00 C ATOM 1321 OH TYR B 781 4.609 -17.316 -5.949 1.00 0.00 O ATOM 0 H TYR B 781 7.811 -11.971 -0.858 1.00 0.00 H new ATOM 0 HA TYR B 781 7.990 -13.227 -3.592 1.00 0.00 H new ATOM 0 HB2 TYR B 781 5.657 -12.875 -1.823 1.00 0.00 H new ATOM 0 HB3 TYR B 781 5.488 -11.862 -3.243 1.00 0.00 H new ATOM 0 HD1 TYR B 781 6.543 -13.216 -5.474 1.00 0.00 H new ATOM 0 HD2 TYR B 781 4.628 -14.959 -2.047 1.00 0.00 H new ATOM 0 HE1 TYR B 781 5.940 -15.207 -6.824 1.00 0.00 H new ATOM 0 HE2 TYR B 781 4.026 -16.951 -3.397 1.00 0.00 H new ATOM 0 HH TYR B 781 4.119 -17.955 -5.390 1.00 0.00 H new ATOM 1331 N TYR B 782 7.480 -10.154 -2.543 1.00 0.00 N ATOM 1332 CA TYR B 782 7.814 -8.746 -2.895 1.00 0.00 C ATOM 1333 C TYR B 782 9.015 -8.289 -2.071 1.00 0.00 C ATOM 1334 O TYR B 782 8.886 -7.949 -0.914 1.00 0.00 O ATOM 1335 CB TYR B 782 6.572 -7.933 -2.522 1.00 0.00 C ATOM 1336 CG TYR B 782 5.635 -7.870 -3.705 1.00 0.00 C ATOM 1337 CD1 TYR B 782 5.225 -9.049 -4.338 1.00 0.00 C ATOM 1338 CD2 TYR B 782 5.175 -6.631 -4.169 1.00 0.00 C ATOM 1339 CE1 TYR B 782 4.357 -8.991 -5.434 1.00 0.00 C ATOM 1340 CE2 TYR B 782 4.306 -6.572 -5.265 1.00 0.00 C ATOM 1341 CZ TYR B 782 3.897 -7.753 -5.897 1.00 0.00 C ATOM 1342 OH TYR B 782 3.040 -7.695 -6.977 1.00 0.00 O ATOM 0 H TYR B 782 6.962 -10.274 -1.672 1.00 0.00 H new ATOM 0 HA TYR B 782 8.071 -8.627 -3.948 1.00 0.00 H new ATOM 0 HB2 TYR B 782 6.068 -8.389 -1.670 1.00 0.00 H new ATOM 0 HB3 TYR B 782 6.861 -6.926 -2.220 1.00 0.00 H new ATOM 0 HD1 TYR B 782 5.579 -10.005 -3.980 1.00 0.00 H new ATOM 0 HD2 TYR B 782 5.491 -5.721 -3.681 1.00 0.00 H new ATOM 0 HE1 TYR B 782 4.042 -9.901 -5.922 1.00 0.00 H new ATOM 0 HE2 TYR B 782 3.951 -5.617 -5.623 1.00 0.00 H new ATOM 0 HH TYR B 782 2.817 -6.760 -7.168 1.00 0.00 H new ATOM 1352 N VAL B 783 10.187 -8.308 -2.643 1.00 0.00 N ATOM 1353 CA VAL B 783 11.392 -7.907 -1.868 1.00 0.00 C ATOM 1354 C VAL B 783 12.219 -6.875 -2.640 1.00 0.00 C ATOM 1355 O VAL B 783 13.433 -6.920 -2.648 1.00 0.00 O ATOM 1356 CB VAL B 783 12.180 -9.207 -1.688 1.00 0.00 C ATOM 1357 CG1 VAL B 783 12.568 -9.774 -3.056 1.00 0.00 C ATOM 1358 CG2 VAL B 783 13.442 -8.928 -0.875 1.00 0.00 C ATOM 0 H VAL B 783 10.361 -8.583 -3.610 1.00 0.00 H new ATOM 0 HA VAL B 783 11.135 -7.441 -0.917 1.00 0.00 H new ATOM 0 HB VAL B 783 11.560 -9.933 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL B 783 13.129 -10.699 -2.921 1.00 0.00 H new ATOM 0 HG12 VAL B 783 11.667 -9.977 -3.635 1.00 0.00 H new ATOM 0 HG13 VAL B 783 13.185 -9.050 -3.588 1.00 0.00 H new ATOM 0 HG21 VAL B 783 14.004 -9.853 -0.746 1.00 0.00 H new ATOM 0 HG22 VAL B 783 14.059 -8.199 -1.400 1.00 0.00 H new ATOM 0 HG23 VAL B 783 13.165 -8.533 0.102 1.00 0.00 H new ATOM 1368 N SER B 784 11.574 -5.936 -3.277 1.00 0.00 N ATOM 1369 CA SER B 784 12.329 -4.895 -4.031 1.00 0.00 C ATOM 1370 C SER B 784 11.487 -3.625 -4.173 1.00 0.00 C ATOM 1371 O SER B 784 10.291 -3.632 -3.956 1.00 0.00 O ATOM 1372 CB SER B 784 12.603 -5.516 -5.401 1.00 0.00 C ATOM 1373 OG SER B 784 13.087 -6.841 -5.231 1.00 0.00 O ATOM 0 H SER B 784 10.559 -5.845 -3.308 1.00 0.00 H new ATOM 0 HA SER B 784 13.250 -4.607 -3.524 1.00 0.00 H new ATOM 0 HB2 SER B 784 11.691 -5.524 -5.998 1.00 0.00 H new ATOM 0 HB3 SER B 784 13.334 -4.917 -5.944 1.00 0.00 H new ATOM 0 HG SER B 784 13.262 -7.241 -6.109 1.00 0.00 H new ATOM 1379 N LYS B 785 12.104 -2.534 -4.538 1.00 0.00 N ATOM 1380 CA LYS B 785 11.352 -1.246 -4.646 1.00 0.00 C ATOM 1381 C LYS B 785 10.181 -1.341 -5.639 1.00 0.00 C ATOM 1382 O LYS B 785 9.042 -1.125 -5.274 1.00 0.00 O ATOM 1383 CB LYS B 785 12.377 -0.183 -5.095 1.00 0.00 C ATOM 1384 CG LYS B 785 13.275 -0.700 -6.231 1.00 0.00 C ATOM 1385 CD LYS B 785 12.989 0.096 -7.506 1.00 0.00 C ATOM 1386 CE LYS B 785 13.419 -0.720 -8.727 1.00 0.00 C ATOM 1387 NZ LYS B 785 13.392 0.246 -9.861 1.00 0.00 N ATOM 0 H LYS B 785 13.096 -2.477 -4.767 1.00 0.00 H new ATOM 0 HA LYS B 785 10.902 -0.986 -3.688 1.00 0.00 H new ATOM 0 HB2 LYS B 785 11.851 0.712 -5.426 1.00 0.00 H new ATOM 0 HB3 LYS B 785 12.996 0.107 -4.246 1.00 0.00 H new ATOM 0 HG2 LYS B 785 14.325 -0.600 -5.954 1.00 0.00 H new ATOM 0 HG3 LYS B 785 13.090 -1.761 -6.402 1.00 0.00 H new ATOM 0 HD2 LYS B 785 11.927 0.332 -7.569 1.00 0.00 H new ATOM 0 HD3 LYS B 785 13.525 1.045 -7.483 1.00 0.00 H new ATOM 0 HE2 LYS B 785 14.415 -1.141 -8.590 1.00 0.00 H new ATOM 0 HE3 LYS B 785 12.741 -1.555 -8.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 13.321 -0.274 -10.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 12.571 0.877 -9.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 14.265 0.811 -9.857 1.00 0.00 H new ATOM 1401 N LYS B 786 10.436 -1.627 -6.888 1.00 0.00 N ATOM 1402 CA LYS B 786 9.322 -1.686 -7.879 1.00 0.00 C ATOM 1403 C LYS B 786 8.233 -2.661 -7.423 1.00 0.00 C ATOM 1404 O LYS B 786 7.078 -2.520 -7.773 1.00 0.00 O ATOM 1405 CB LYS B 786 9.975 -2.184 -9.169 1.00 0.00 C ATOM 1406 CG LYS B 786 8.967 -2.104 -10.316 1.00 0.00 C ATOM 1407 CD LYS B 786 8.811 -0.647 -10.756 1.00 0.00 C ATOM 1408 CE LYS B 786 10.073 -0.201 -11.499 1.00 0.00 C ATOM 1409 NZ LYS B 786 9.589 0.754 -12.534 1.00 0.00 N ATOM 0 H LYS B 786 11.364 -1.822 -7.264 1.00 0.00 H new ATOM 0 HA LYS B 786 8.837 -0.718 -8.003 1.00 0.00 H new ATOM 0 HB2 LYS B 786 10.853 -1.582 -9.400 1.00 0.00 H new ATOM 0 HB3 LYS B 786 10.317 -3.211 -9.043 1.00 0.00 H new ATOM 0 HG2 LYS B 786 9.304 -2.714 -11.154 1.00 0.00 H new ATOM 0 HG3 LYS B 786 8.004 -2.504 -9.997 1.00 0.00 H new ATOM 0 HD2 LYS B 786 7.939 -0.542 -11.402 1.00 0.00 H new ATOM 0 HD3 LYS B 786 8.643 -0.010 -9.888 1.00 0.00 H new ATOM 0 HE2 LYS B 786 10.783 0.275 -10.822 1.00 0.00 H new ATOM 0 HE3 LYS B 786 10.585 -1.049 -11.953 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 10.397 1.105 -13.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 8.920 0.270 -13.167 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 9.111 1.554 -12.072 1.00 0.00 H new ATOM 1423 N LEU B 787 8.594 -3.666 -6.676 1.00 0.00 N ATOM 1424 CA LEU B 787 7.577 -4.654 -6.213 1.00 0.00 C ATOM 1425 C LEU B 787 6.819 -4.118 -5.000 1.00 0.00 C ATOM 1426 O LEU B 787 5.630 -3.877 -5.050 1.00 0.00 O ATOM 1427 CB LEU B 787 8.384 -5.893 -5.822 1.00 0.00 C ATOM 1428 CG LEU B 787 8.735 -6.691 -7.079 1.00 0.00 C ATOM 1429 CD1 LEU B 787 9.694 -5.874 -7.944 1.00 0.00 C ATOM 1430 CD2 LEU B 787 9.404 -8.007 -6.678 1.00 0.00 C ATOM 0 H LEU B 787 9.548 -3.847 -6.365 1.00 0.00 H new ATOM 0 HA LEU B 787 6.835 -4.866 -6.983 1.00 0.00 H new ATOM 0 HB2 LEU B 787 9.294 -5.597 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU B 787 7.809 -6.512 -5.134 1.00 0.00 H new ATOM 0 HG LEU B 787 7.826 -6.904 -7.642 1.00 0.00 H new ATOM 0 HD11 LEU B 787 9.947 -6.440 -8.841 1.00 0.00 H new ATOM 0 HD12 LEU B 787 9.218 -4.936 -8.229 1.00 0.00 H new ATOM 0 HD13 LEU B 787 10.603 -5.663 -7.380 1.00 0.00 H new ATOM 0 HD21 LEU B 787 9.654 -8.576 -7.574 1.00 0.00 H new ATOM 0 HD22 LEU B 787 10.314 -7.796 -6.116 1.00 0.00 H new ATOM 0 HD23 LEU B 787 8.721 -8.588 -6.058 1.00 0.00 H new ATOM 1442 N PHE B 788 7.500 -3.952 -3.903 1.00 0.00 N ATOM 1443 CA PHE B 788 6.833 -3.455 -2.670 1.00 0.00 C ATOM 1444 C PHE B 788 6.220 -2.077 -2.892 1.00 0.00 C ATOM 1445 O PHE B 788 5.035 -1.875 -2.716 1.00 0.00 O ATOM 1446 CB PHE B 788 7.960 -3.342 -1.650 1.00 0.00 C ATOM 1447 CG PHE B 788 7.374 -3.100 -0.282 1.00 0.00 C ATOM 1448 CD1 PHE B 788 6.603 -4.090 0.340 1.00 0.00 C ATOM 1449 CD2 PHE B 788 7.592 -1.878 0.359 1.00 0.00 C ATOM 1450 CE1 PHE B 788 6.060 -3.858 1.610 1.00 0.00 C ATOM 1451 CE2 PHE B 788 7.055 -1.647 1.629 1.00 0.00 C ATOM 1452 CZ PHE B 788 6.286 -2.636 2.254 1.00 0.00 C ATOM 0 H PHE B 788 8.498 -4.141 -3.807 1.00 0.00 H new ATOM 0 HA PHE B 788 6.026 -4.117 -2.356 1.00 0.00 H new ATOM 0 HB2 PHE B 788 8.555 -4.255 -1.647 1.00 0.00 H new ATOM 0 HB3 PHE B 788 8.630 -2.526 -1.921 1.00 0.00 H new ATOM 0 HD1 PHE B 788 6.427 -5.031 -0.159 1.00 0.00 H new ATOM 0 HD2 PHE B 788 8.176 -1.111 -0.127 1.00 0.00 H new ATOM 0 HE1 PHE B 788 5.467 -4.621 2.092 1.00 0.00 H new ATOM 0 HE2 PHE B 788 7.233 -0.706 2.128 1.00 0.00 H new ATOM 0 HZ PHE B 788 5.867 -2.456 3.233 1.00 0.00 H new ATOM 1462 N MET B 789 7.034 -1.112 -3.217 1.00 0.00 N ATOM 1463 CA MET B 789 6.513 0.269 -3.397 1.00 0.00 C ATOM 1464 C MET B 789 5.349 0.278 -4.382 1.00 0.00 C ATOM 1465 O MET B 789 4.445 1.081 -4.281 1.00 0.00 O ATOM 1466 CB MET B 789 7.693 1.086 -3.942 1.00 0.00 C ATOM 1467 CG MET B 789 8.929 0.959 -3.026 1.00 0.00 C ATOM 1468 SD MET B 789 8.476 1.193 -1.284 1.00 0.00 S ATOM 1469 CE MET B 789 7.494 2.690 -1.500 1.00 0.00 C ATOM 0 H MET B 789 8.037 -1.221 -3.365 1.00 0.00 H new ATOM 0 HA MET B 789 6.135 0.684 -2.463 1.00 0.00 H new ATOM 0 HB2 MET B 789 7.944 0.743 -4.946 1.00 0.00 H new ATOM 0 HB3 MET B 789 7.405 2.134 -4.026 1.00 0.00 H new ATOM 0 HG2 MET B 789 9.384 -0.022 -3.158 1.00 0.00 H new ATOM 0 HG3 MET B 789 9.676 1.699 -3.313 1.00 0.00 H new ATOM 0 HE1 MET B 789 7.438 3.228 -0.554 1.00 0.00 H new ATOM 0 HE2 MET B 789 7.961 3.326 -2.252 1.00 0.00 H new ATOM 0 HE3 MET B 789 6.489 2.422 -1.825 1.00 0.00 H new ATOM 1479 N ALA B 790 5.350 -0.621 -5.322 1.00 0.00 N ATOM 1480 CA ALA B 790 4.215 -0.676 -6.284 1.00 0.00 C ATOM 1481 C ALA B 790 2.920 -0.961 -5.527 1.00 0.00 C ATOM 1482 O ALA B 790 2.056 -0.116 -5.413 1.00 0.00 O ATOM 1483 CB ALA B 790 4.537 -1.835 -7.227 1.00 0.00 C ATOM 0 H ALA B 790 6.082 -1.317 -5.467 1.00 0.00 H new ATOM 0 HA ALA B 790 4.086 0.261 -6.826 1.00 0.00 H new ATOM 0 HB1 ALA B 790 3.741 -1.935 -7.965 1.00 0.00 H new ATOM 0 HB2 ALA B 790 5.481 -1.639 -7.735 1.00 0.00 H new ATOM 0 HB3 ALA B 790 4.619 -2.759 -6.654 1.00 0.00 H new ATOM 1489 N ASP B 791 2.794 -2.143 -4.987 1.00 0.00 N ATOM 1490 CA ASP B 791 1.563 -2.492 -4.225 1.00 0.00 C ATOM 1491 C ASP B 791 1.300 -1.458 -3.129 1.00 0.00 C ATOM 1492 O ASP B 791 0.207 -0.943 -2.998 1.00 0.00 O ATOM 1493 CB ASP B 791 1.864 -3.860 -3.608 1.00 0.00 C ATOM 1494 CG ASP B 791 1.627 -4.960 -4.647 1.00 0.00 C ATOM 1495 OD1 ASP B 791 1.477 -4.630 -5.813 1.00 0.00 O ATOM 1496 OD2 ASP B 791 1.604 -6.117 -4.259 1.00 0.00 O ATOM 0 H ASP B 791 3.493 -2.884 -5.042 1.00 0.00 H new ATOM 0 HA ASP B 791 0.676 -2.509 -4.858 1.00 0.00 H new ATOM 0 HB2 ASP B 791 2.896 -3.893 -3.259 1.00 0.00 H new ATOM 0 HB3 ASP B 791 1.228 -4.025 -2.738 1.00 0.00 H new ATOM 1501 N LEU B 792 2.290 -1.151 -2.333 1.00 0.00 N ATOM 1502 CA LEU B 792 2.083 -0.143 -1.254 1.00 0.00 C ATOM 1503 C LEU B 792 1.586 1.168 -1.861 1.00 0.00 C ATOM 1504 O LEU B 792 0.565 1.697 -1.469 1.00 0.00 O ATOM 1505 CB LEU B 792 3.458 0.047 -0.611 1.00 0.00 C ATOM 1506 CG LEU B 792 3.308 0.041 0.913 1.00 0.00 C ATOM 1507 CD1 LEU B 792 3.045 -1.386 1.394 1.00 0.00 C ATOM 1508 CD2 LEU B 792 4.593 0.565 1.557 1.00 0.00 C ATOM 0 H LEU B 792 3.227 -1.552 -2.383 1.00 0.00 H new ATOM 0 HA LEU B 792 1.340 -0.462 -0.523 1.00 0.00 H new ATOM 0 HB2 LEU B 792 4.132 -0.750 -0.925 1.00 0.00 H new ATOM 0 HB3 LEU B 792 3.900 0.987 -0.941 1.00 0.00 H new ATOM 0 HG LEU B 792 2.473 0.681 1.196 1.00 0.00 H new ATOM 0 HD11 LEU B 792 2.938 -1.390 2.479 1.00 0.00 H new ATOM 0 HD12 LEU B 792 2.129 -1.761 0.938 1.00 0.00 H new ATOM 0 HD13 LEU B 792 3.880 -2.026 1.109 1.00 0.00 H new ATOM 0 HD21 LEU B 792 4.485 0.560 2.642 1.00 0.00 H new ATOM 0 HD22 LEU B 792 5.429 -0.074 1.273 1.00 0.00 H new ATOM 0 HD23 LEU B 792 4.782 1.583 1.216 1.00 0.00 H new ATOM 1520 N GLN B 793 2.287 1.686 -2.831 1.00 0.00 N ATOM 1521 CA GLN B 793 1.832 2.943 -3.486 1.00 0.00 C ATOM 1522 C GLN B 793 0.432 2.740 -4.062 1.00 0.00 C ATOM 1523 O GLN B 793 -0.422 3.596 -3.961 1.00 0.00 O ATOM 1524 CB GLN B 793 2.841 3.193 -4.610 1.00 0.00 C ATOM 1525 CG GLN B 793 2.491 4.495 -5.332 1.00 0.00 C ATOM 1526 CD GLN B 793 2.413 4.237 -6.838 1.00 0.00 C ATOM 1527 OE1 GLN B 793 2.944 3.260 -7.327 1.00 0.00 O ATOM 1528 NE2 GLN B 793 1.770 5.079 -7.600 1.00 0.00 N ATOM 0 H GLN B 793 3.154 1.293 -3.198 1.00 0.00 H new ATOM 0 HA GLN B 793 1.782 3.783 -2.793 1.00 0.00 H new ATOM 0 HB2 GLN B 793 3.850 3.252 -4.201 1.00 0.00 H new ATOM 0 HB3 GLN B 793 2.831 2.361 -5.314 1.00 0.00 H new ATOM 0 HG2 GLN B 793 1.539 4.880 -4.968 1.00 0.00 H new ATOM 0 HG3 GLN B 793 3.244 5.254 -5.121 1.00 0.00 H new ATOM 0 HE21 GLN B 793 1.324 5.900 -7.190 1.00 0.00 H new ATOM 0 HE22 GLN B 793 1.714 4.916 -8.605 1.00 0.00 H new ATOM 1537 N ARG B 794 0.187 1.602 -4.652 1.00 0.00 N ATOM 1538 CA ARG B 794 -1.161 1.332 -5.221 1.00 0.00 C ATOM 1539 C ARG B 794 -2.217 1.399 -4.115 1.00 0.00 C ATOM 1540 O ARG B 794 -3.370 1.678 -4.362 1.00 0.00 O ATOM 1541 CB ARG B 794 -1.070 -0.082 -5.801 1.00 0.00 C ATOM 1542 CG ARG B 794 -1.401 -0.044 -7.294 1.00 0.00 C ATOM 1543 CD ARG B 794 -0.417 0.882 -8.013 1.00 0.00 C ATOM 1544 NE ARG B 794 0.381 -0.018 -8.898 1.00 0.00 N ATOM 1545 CZ ARG B 794 -0.120 -0.475 -10.023 1.00 0.00 C ATOM 1546 NH1 ARG B 794 -1.334 -0.158 -10.400 1.00 0.00 N ATOM 1547 NH2 ARG B 794 0.603 -1.259 -10.776 1.00 0.00 N ATOM 0 H ARG B 794 0.864 0.847 -4.764 1.00 0.00 H new ATOM 0 HA ARG B 794 -1.449 2.061 -5.979 1.00 0.00 H new ATOM 0 HB2 ARG B 794 -0.068 -0.485 -5.650 1.00 0.00 H new ATOM 0 HB3 ARG B 794 -1.762 -0.745 -5.281 1.00 0.00 H new ATOM 0 HG2 ARG B 794 -1.346 -1.048 -7.715 1.00 0.00 H new ATOM 0 HG3 ARG B 794 -2.422 0.308 -7.442 1.00 0.00 H new ATOM 0 HD2 ARG B 794 -0.941 1.642 -8.592 1.00 0.00 H new ATOM 0 HD3 ARG B 794 0.223 1.407 -7.303 1.00 0.00 H new ATOM 0 HE ARG B 794 1.328 -0.281 -8.625 1.00 0.00 H new ATOM 0 HH11 ARG B 794 -1.906 0.453 -9.817 1.00 0.00 H new ATOM 0 HH12 ARG B 794 -1.707 -0.522 -11.277 1.00 0.00 H new ATOM 0 HH21 ARG B 794 1.549 -1.512 -10.489 1.00 0.00 H new ATOM 0 HH22 ARG B 794 0.222 -1.619 -11.651 1.00 0.00 H new ATOM 1561 N VAL B 795 -1.830 1.156 -2.893 1.00 0.00 N ATOM 1562 CA VAL B 795 -2.807 1.249 -1.774 1.00 0.00 C ATOM 1563 C VAL B 795 -2.991 2.720 -1.387 1.00 0.00 C ATOM 1564 O VAL B 795 -4.064 3.146 -1.018 1.00 0.00 O ATOM 1565 CB VAL B 795 -2.180 0.444 -0.623 1.00 0.00 C ATOM 1566 CG1 VAL B 795 -2.929 0.720 0.686 1.00 0.00 C ATOM 1567 CG2 VAL B 795 -2.274 -1.049 -0.942 1.00 0.00 C ATOM 0 H VAL B 795 -0.881 0.898 -2.622 1.00 0.00 H new ATOM 0 HA VAL B 795 -3.791 0.859 -2.034 1.00 0.00 H new ATOM 0 HB VAL B 795 -1.137 0.741 -0.511 1.00 0.00 H new ATOM 0 HG11 VAL B 795 -2.476 0.144 1.493 1.00 0.00 H new ATOM 0 HG12 VAL B 795 -2.871 1.783 0.921 1.00 0.00 H new ATOM 0 HG13 VAL B 795 -3.974 0.429 0.576 1.00 0.00 H new ATOM 0 HG21 VAL B 795 -1.831 -1.623 -0.129 1.00 0.00 H new ATOM 0 HG22 VAL B 795 -3.320 -1.331 -1.057 1.00 0.00 H new ATOM 0 HG23 VAL B 795 -1.738 -1.258 -1.868 1.00 0.00 H new ATOM 1577 N PHE B 796 -1.935 3.484 -1.431 1.00 0.00 N ATOM 1578 CA PHE B 796 -2.040 4.932 -1.090 1.00 0.00 C ATOM 1579 C PHE B 796 -2.551 5.719 -2.296 1.00 0.00 C ATOM 1580 O PHE B 796 -3.161 6.761 -2.162 1.00 0.00 O ATOM 1581 CB PHE B 796 -0.615 5.365 -0.741 1.00 0.00 C ATOM 1582 CG PHE B 796 -0.089 4.517 0.392 1.00 0.00 C ATOM 1583 CD1 PHE B 796 -0.847 4.360 1.559 1.00 0.00 C ATOM 1584 CD2 PHE B 796 1.159 3.893 0.279 1.00 0.00 C ATOM 1585 CE1 PHE B 796 -0.357 3.575 2.610 1.00 0.00 C ATOM 1586 CE2 PHE B 796 1.648 3.109 1.330 1.00 0.00 C ATOM 1587 CZ PHE B 796 0.890 2.950 2.496 1.00 0.00 C ATOM 0 H PHE B 796 -1.000 3.167 -1.689 1.00 0.00 H new ATOM 0 HA PHE B 796 -2.734 5.112 -0.269 1.00 0.00 H new ATOM 0 HB2 PHE B 796 0.030 5.264 -1.614 1.00 0.00 H new ATOM 0 HB3 PHE B 796 -0.604 6.417 -0.456 1.00 0.00 H new ATOM 0 HD1 PHE B 796 -1.808 4.844 1.648 1.00 0.00 H new ATOM 0 HD2 PHE B 796 1.745 4.017 -0.620 1.00 0.00 H new ATOM 0 HE1 PHE B 796 -0.942 3.452 3.509 1.00 0.00 H new ATOM 0 HE2 PHE B 796 2.610 2.627 1.241 1.00 0.00 H new ATOM 0 HZ PHE B 796 1.267 2.345 3.307 1.00 0.00 H new ATOM 1597 N THR B 797 -2.270 5.243 -3.477 1.00 0.00 N ATOM 1598 CA THR B 797 -2.730 5.955 -4.702 1.00 0.00 C ATOM 1599 C THR B 797 -4.209 5.669 -4.939 1.00 0.00 C ATOM 1600 O THR B 797 -5.023 6.569 -4.996 1.00 0.00 O ATOM 1601 CB THR B 797 -1.885 5.377 -5.839 1.00 0.00 C ATOM 1602 OG1 THR B 797 -0.509 5.463 -5.502 1.00 0.00 O ATOM 1603 CG2 THR B 797 -2.137 6.172 -7.118 1.00 0.00 C ATOM 0 H THR B 797 -1.740 4.388 -3.647 1.00 0.00 H new ATOM 0 HA THR B 797 -2.617 7.036 -4.623 1.00 0.00 H new ATOM 0 HB THR B 797 -2.159 4.334 -5.995 1.00 0.00 H new ATOM 0 HG1 THR B 797 -0.332 4.916 -4.708 1.00 0.00 H new ATOM 0 HG21 THR B 797 -1.535 5.760 -7.927 1.00 0.00 H new ATOM 0 HG22 THR B 797 -3.192 6.110 -7.383 1.00 0.00 H new ATOM 0 HG23 THR B 797 -1.864 7.215 -6.958 1.00 0.00 H new ATOM 1611 N ASN B 798 -4.570 4.419 -5.055 1.00 0.00 N ATOM 1612 CA ASN B 798 -6.008 4.086 -5.252 1.00 0.00 C ATOM 1613 C ASN B 798 -6.825 4.700 -4.103 1.00 0.00 C ATOM 1614 O ASN B 798 -7.884 5.259 -4.302 1.00 0.00 O ATOM 1615 CB ASN B 798 -6.054 2.538 -5.275 1.00 0.00 C ATOM 1616 CG ASN B 798 -6.415 1.947 -3.901 1.00 0.00 C ATOM 1617 OD1 ASN B 798 -7.532 1.522 -3.683 1.00 0.00 O ATOM 1618 ND2 ASN B 798 -5.512 1.912 -2.964 1.00 0.00 N ATOM 0 H ASN B 798 -3.936 3.621 -5.022 1.00 0.00 H new ATOM 0 HA ASN B 798 -6.438 4.486 -6.170 1.00 0.00 H new ATOM 0 HB2 ASN B 798 -6.785 2.209 -6.014 1.00 0.00 H new ATOM 0 HB3 ASN B 798 -5.085 2.152 -5.591 1.00 0.00 H new ATOM 0 HD21 ASN B 798 -5.743 1.528 -2.048 1.00 0.00 H new ATOM 0 HD22 ASN B 798 -4.574 2.269 -3.146 1.00 0.00 H new ATOM 1625 N CYS B 799 -6.301 4.622 -2.908 1.00 0.00 N ATOM 1626 CA CYS B 799 -6.988 5.222 -1.724 1.00 0.00 C ATOM 1627 C CYS B 799 -7.386 6.665 -2.040 1.00 0.00 C ATOM 1628 O CYS B 799 -8.503 7.081 -1.803 1.00 0.00 O ATOM 1629 CB CYS B 799 -5.929 5.158 -0.606 1.00 0.00 C ATOM 1630 SG CYS B 799 -6.402 6.190 0.811 1.00 0.00 S ATOM 0 H CYS B 799 -5.415 4.162 -2.699 1.00 0.00 H new ATOM 0 HA CYS B 799 -7.905 4.705 -1.441 1.00 0.00 H new ATOM 0 HB2 CYS B 799 -5.803 4.125 -0.280 1.00 0.00 H new ATOM 0 HB3 CYS B 799 -4.966 5.490 -0.995 1.00 0.00 H new ATOM 0 HG CYS B 799 -6.185 5.538 1.914 1.00 0.00 H new ATOM 1636 N LYS B 800 -6.483 7.423 -2.596 1.00 0.00 N ATOM 1637 CA LYS B 800 -6.811 8.827 -2.963 1.00 0.00 C ATOM 1638 C LYS B 800 -7.548 8.888 -4.302 1.00 0.00 C ATOM 1639 O LYS B 800 -7.746 9.950 -4.859 1.00 0.00 O ATOM 1640 CB LYS B 800 -5.454 9.526 -3.071 1.00 0.00 C ATOM 1641 CG LYS B 800 -4.778 9.541 -1.699 1.00 0.00 C ATOM 1642 CD LYS B 800 -4.109 10.898 -1.478 1.00 0.00 C ATOM 1643 CE LYS B 800 -2.599 10.762 -1.685 1.00 0.00 C ATOM 1644 NZ LYS B 800 -2.109 12.159 -1.856 1.00 0.00 N ATOM 0 H LYS B 800 -5.530 7.130 -2.812 1.00 0.00 H new ATOM 0 HA LYS B 800 -7.467 9.296 -2.230 1.00 0.00 H new ATOM 0 HB2 LYS B 800 -4.823 9.009 -3.794 1.00 0.00 H new ATOM 0 HB3 LYS B 800 -5.586 10.545 -3.435 1.00 0.00 H new ATOM 0 HG2 LYS B 800 -5.514 9.354 -0.917 1.00 0.00 H new ATOM 0 HG3 LYS B 800 -4.037 8.744 -1.637 1.00 0.00 H new ATOM 0 HD2 LYS B 800 -4.517 11.634 -2.171 1.00 0.00 H new ATOM 0 HD3 LYS B 800 -4.318 11.259 -0.471 1.00 0.00 H new ATOM 0 HE2 LYS B 800 -2.125 10.279 -0.831 1.00 0.00 H new ATOM 0 HE3 LYS B 800 -2.373 10.154 -2.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 -1.673 12.261 -2.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 -2.908 12.820 -1.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 -1.404 12.372 -1.122 1.00 0.00 H new ATOM 1658 N GLU B 801 -7.962 7.767 -4.828 1.00 0.00 N ATOM 1659 CA GLU B 801 -8.661 7.783 -6.134 1.00 0.00 C ATOM 1660 C GLU B 801 -10.183 7.779 -5.946 1.00 0.00 C ATOM 1661 O GLU B 801 -10.922 8.163 -6.829 1.00 0.00 O ATOM 1662 CB GLU B 801 -8.212 6.493 -6.831 1.00 0.00 C ATOM 1663 CG GLU B 801 -7.801 6.796 -8.278 1.00 0.00 C ATOM 1664 CD GLU B 801 -8.919 7.554 -9.001 1.00 0.00 C ATOM 1665 OE1 GLU B 801 -9.043 8.747 -8.775 1.00 0.00 O ATOM 1666 OE2 GLU B 801 -9.625 6.933 -9.773 1.00 0.00 O ATOM 0 H GLU B 801 -7.844 6.845 -4.407 1.00 0.00 H new ATOM 0 HA GLU B 801 -8.423 8.678 -6.709 1.00 0.00 H new ATOM 0 HB2 GLU B 801 -7.375 6.050 -6.291 1.00 0.00 H new ATOM 0 HB3 GLU B 801 -9.021 5.763 -6.819 1.00 0.00 H new ATOM 0 HG2 GLU B 801 -6.886 7.388 -8.287 1.00 0.00 H new ATOM 0 HG3 GLU B 801 -7.584 5.866 -8.804 1.00 0.00 H new ATOM 1673 N TYR B 802 -10.663 7.343 -4.810 1.00 0.00 N ATOM 1674 CA TYR B 802 -12.144 7.296 -4.608 1.00 0.00 C ATOM 1675 C TYR B 802 -12.549 7.862 -3.245 1.00 0.00 C ATOM 1676 O TYR B 802 -13.584 8.483 -3.106 1.00 0.00 O ATOM 1677 CB TYR B 802 -12.496 5.809 -4.668 1.00 0.00 C ATOM 1678 CG TYR B 802 -11.731 5.077 -3.592 1.00 0.00 C ATOM 1679 CD1 TYR B 802 -10.433 4.626 -3.847 1.00 0.00 C ATOM 1680 CD2 TYR B 802 -12.310 4.862 -2.335 1.00 0.00 C ATOM 1681 CE1 TYR B 802 -9.717 3.955 -2.851 1.00 0.00 C ATOM 1682 CE2 TYR B 802 -11.594 4.195 -1.341 1.00 0.00 C ATOM 1683 CZ TYR B 802 -10.297 3.737 -1.598 1.00 0.00 C ATOM 1684 OH TYR B 802 -9.587 3.077 -0.616 1.00 0.00 O ATOM 0 H TYR B 802 -10.102 7.021 -4.021 1.00 0.00 H new ATOM 0 HA TYR B 802 -12.663 7.894 -5.358 1.00 0.00 H new ATOM 0 HB2 TYR B 802 -13.568 5.670 -4.528 1.00 0.00 H new ATOM 0 HB3 TYR B 802 -12.248 5.403 -5.649 1.00 0.00 H new ATOM 0 HD1 TYR B 802 -9.983 4.796 -4.814 1.00 0.00 H new ATOM 0 HD2 TYR B 802 -13.312 5.213 -2.135 1.00 0.00 H new ATOM 0 HE1 TYR B 802 -8.715 3.605 -3.050 1.00 0.00 H new ATOM 0 HE2 TYR B 802 -12.041 4.032 -0.372 1.00 0.00 H new ATOM 0 HH TYR B 802 -8.815 2.626 -1.018 1.00 0.00 H new ATOM 1694 N ASN B 803 -11.771 7.613 -2.229 1.00 0.00 N ATOM 1695 CA ASN B 803 -12.145 8.082 -0.862 1.00 0.00 C ATOM 1696 C ASN B 803 -12.600 9.548 -0.865 1.00 0.00 C ATOM 1697 O ASN B 803 -12.409 10.255 -1.835 1.00 0.00 O ATOM 1698 CB ASN B 803 -10.875 7.921 -0.031 1.00 0.00 C ATOM 1699 CG ASN B 803 -10.729 6.456 0.382 1.00 0.00 C ATOM 1700 OD1 ASN B 803 -11.683 5.833 0.805 1.00 0.00 O ATOM 1701 ND2 ASN B 803 -9.570 5.876 0.265 1.00 0.00 N ATOM 0 H ASN B 803 -10.889 7.103 -2.285 1.00 0.00 H new ATOM 0 HA ASN B 803 -12.984 7.511 -0.464 1.00 0.00 H new ATOM 0 HB2 ASN B 803 -10.006 8.237 -0.608 1.00 0.00 H new ATOM 0 HB3 ASN B 803 -10.921 8.558 0.852 1.00 0.00 H new ATOM 0 HD21 ASN B 803 -9.461 4.897 0.528 1.00 0.00 H new ATOM 0 HD22 ASN B 803 -8.771 6.401 -0.090 1.00 0.00 H new ATOM 1708 N PRO B 804 -13.201 9.951 0.232 1.00 0.00 N ATOM 1709 CA PRO B 804 -13.711 11.340 0.360 1.00 0.00 C ATOM 1710 C PRO B 804 -12.588 12.362 0.156 1.00 0.00 C ATOM 1711 O PRO B 804 -11.437 12.065 0.397 1.00 0.00 O ATOM 1712 CB PRO B 804 -14.230 11.408 1.796 1.00 0.00 C ATOM 1713 CG PRO B 804 -14.458 9.989 2.204 1.00 0.00 C ATOM 1714 CD PRO B 804 -13.475 9.153 1.437 1.00 0.00 C ATOM 0 HA PRO B 804 -14.473 11.571 -0.385 1.00 0.00 H new ATOM 0 HB2 PRO B 804 -13.508 11.894 2.452 1.00 0.00 H new ATOM 0 HB3 PRO B 804 -15.152 11.986 1.853 1.00 0.00 H new ATOM 0 HG2 PRO B 804 -14.314 9.868 3.278 1.00 0.00 H new ATOM 0 HG3 PRO B 804 -15.481 9.683 1.983 1.00 0.00 H new ATOM 0 HD2 PRO B 804 -12.567 8.974 2.013 1.00 0.00 H new ATOM 0 HD3 PRO B 804 -13.891 8.177 1.185 1.00 0.00 H new ATOM 1722 N PRO B 805 -12.960 13.548 -0.263 1.00 0.00 N ATOM 1723 CA PRO B 805 -11.958 14.620 -0.471 1.00 0.00 C ATOM 1724 C PRO B 805 -11.319 15.005 0.865 1.00 0.00 C ATOM 1725 O PRO B 805 -11.643 16.020 1.448 1.00 0.00 O ATOM 1726 CB PRO B 805 -12.768 15.793 -1.032 1.00 0.00 C ATOM 1727 CG PRO B 805 -14.103 15.228 -1.409 1.00 0.00 C ATOM 1728 CD PRO B 805 -14.322 14.002 -0.569 1.00 0.00 C ATOM 0 HA PRO B 805 -11.149 14.318 -1.136 1.00 0.00 H new ATOM 0 HB2 PRO B 805 -12.874 16.584 -0.290 1.00 0.00 H new ATOM 0 HB3 PRO B 805 -12.271 16.232 -1.897 1.00 0.00 H new ATOM 0 HG2 PRO B 805 -14.893 15.959 -1.235 1.00 0.00 H new ATOM 0 HG3 PRO B 805 -14.129 14.977 -2.469 1.00 0.00 H new ATOM 0 HD2 PRO B 805 -14.882 14.232 0.338 1.00 0.00 H new ATOM 0 HD3 PRO B 805 -14.887 13.242 -1.108 1.00 0.00 H new ATOM 1736 N GLU B 806 -10.425 14.193 1.361 1.00 0.00 N ATOM 1737 CA GLU B 806 -9.775 14.499 2.668 1.00 0.00 C ATOM 1738 C GLU B 806 -10.830 14.689 3.758 1.00 0.00 C ATOM 1739 O GLU B 806 -10.788 15.638 4.517 1.00 0.00 O ATOM 1740 CB GLU B 806 -9.000 15.800 2.442 1.00 0.00 C ATOM 1741 CG GLU B 806 -8.197 16.139 3.700 1.00 0.00 C ATOM 1742 CD GLU B 806 -8.474 17.587 4.109 1.00 0.00 C ATOM 1743 OE1 GLU B 806 -8.613 18.415 3.224 1.00 0.00 O ATOM 1744 OE2 GLU B 806 -8.541 17.843 5.300 1.00 0.00 O ATOM 0 H GLU B 806 -10.116 13.329 0.916 1.00 0.00 H new ATOM 0 HA GLU B 806 -9.123 13.690 2.995 1.00 0.00 H new ATOM 0 HB2 GLU B 806 -8.331 15.694 1.588 1.00 0.00 H new ATOM 0 HB3 GLU B 806 -9.690 16.611 2.208 1.00 0.00 H new ATOM 0 HG2 GLU B 806 -8.469 15.463 4.511 1.00 0.00 H new ATOM 0 HG3 GLU B 806 -7.132 16.000 3.513 1.00 0.00 H new ATOM 1751 N SER B 807 -11.774 13.792 3.850 1.00 0.00 N ATOM 1752 CA SER B 807 -12.815 13.918 4.909 1.00 0.00 C ATOM 1753 C SER B 807 -12.525 12.941 6.046 1.00 0.00 C ATOM 1754 O SER B 807 -12.489 13.314 7.202 1.00 0.00 O ATOM 1755 CB SER B 807 -14.138 13.566 4.224 1.00 0.00 C ATOM 1756 OG SER B 807 -14.199 14.198 2.952 1.00 0.00 O ATOM 0 H SER B 807 -11.869 12.980 3.240 1.00 0.00 H new ATOM 0 HA SER B 807 -12.840 14.918 5.342 1.00 0.00 H new ATOM 0 HB2 SER B 807 -14.223 12.485 4.109 1.00 0.00 H new ATOM 0 HB3 SER B 807 -14.976 13.888 4.842 1.00 0.00 H new ATOM 0 HG SER B 807 -15.102 14.104 2.583 1.00 0.00 H new ATOM 1762 N GLU B 808 -12.297 11.698 5.729 1.00 0.00 N ATOM 1763 CA GLU B 808 -12.000 10.707 6.801 1.00 0.00 C ATOM 1764 C GLU B 808 -11.245 9.507 6.229 1.00 0.00 C ATOM 1765 O GLU B 808 -10.285 9.032 6.805 1.00 0.00 O ATOM 1766 CB GLU B 808 -13.370 10.277 7.323 1.00 0.00 C ATOM 1767 CG GLU B 808 -13.449 10.543 8.827 1.00 0.00 C ATOM 1768 CD GLU B 808 -12.748 9.412 9.582 1.00 0.00 C ATOM 1769 OE1 GLU B 808 -13.218 8.289 9.497 1.00 0.00 O ATOM 1770 OE2 GLU B 808 -11.753 9.687 10.233 1.00 0.00 O ATOM 0 H GLU B 808 -12.303 11.326 4.779 1.00 0.00 H new ATOM 0 HA GLU B 808 -11.371 11.126 7.586 1.00 0.00 H new ATOM 0 HB2 GLU B 808 -14.157 10.824 6.804 1.00 0.00 H new ATOM 0 HB3 GLU B 808 -13.532 9.218 7.121 1.00 0.00 H new ATOM 0 HG2 GLU B 808 -12.980 11.498 9.063 1.00 0.00 H new ATOM 0 HG3 GLU B 808 -14.491 10.613 9.141 1.00 0.00 H new ATOM 1777 N TYR B 809 -11.688 8.996 5.116 1.00 0.00 N ATOM 1778 CA TYR B 809 -11.001 7.818 4.509 1.00 0.00 C ATOM 1779 C TYR B 809 -9.763 8.259 3.722 1.00 0.00 C ATOM 1780 O TYR B 809 -8.786 7.545 3.634 1.00 0.00 O ATOM 1781 CB TYR B 809 -12.040 7.201 3.571 1.00 0.00 C ATOM 1782 CG TYR B 809 -12.456 5.848 4.097 1.00 0.00 C ATOM 1783 CD1 TYR B 809 -13.339 5.760 5.181 1.00 0.00 C ATOM 1784 CD2 TYR B 809 -11.965 4.681 3.499 1.00 0.00 C ATOM 1785 CE1 TYR B 809 -13.728 4.507 5.668 1.00 0.00 C ATOM 1786 CE2 TYR B 809 -12.354 3.428 3.987 1.00 0.00 C ATOM 1787 CZ TYR B 809 -13.235 3.341 5.071 1.00 0.00 C ATOM 1788 OH TYR B 809 -13.618 2.105 5.552 1.00 0.00 O ATOM 0 H TYR B 809 -12.496 9.341 4.598 1.00 0.00 H new ATOM 0 HA TYR B 809 -10.654 7.112 5.264 1.00 0.00 H new ATOM 0 HB2 TYR B 809 -12.909 7.855 3.493 1.00 0.00 H new ATOM 0 HB3 TYR B 809 -11.625 7.101 2.568 1.00 0.00 H new ATOM 0 HD1 TYR B 809 -13.720 6.660 5.641 1.00 0.00 H new ATOM 0 HD2 TYR B 809 -11.286 4.748 2.661 1.00 0.00 H new ATOM 0 HE1 TYR B 809 -14.408 4.440 6.504 1.00 0.00 H new ATOM 0 HE2 TYR B 809 -11.974 2.528 3.527 1.00 0.00 H new ATOM 0 HH TYR B 809 -13.186 1.401 5.025 1.00 0.00 H new ATOM 1798 N TYR B 810 -9.808 9.417 3.127 1.00 0.00 N ATOM 1799 CA TYR B 810 -8.638 9.902 2.337 1.00 0.00 C ATOM 1800 C TYR B 810 -7.569 10.499 3.260 1.00 0.00 C ATOM 1801 O TYR B 810 -6.435 10.691 2.868 1.00 0.00 O ATOM 1802 CB TYR B 810 -9.224 10.984 1.424 1.00 0.00 C ATOM 1803 CG TYR B 810 -8.123 11.667 0.645 1.00 0.00 C ATOM 1804 CD1 TYR B 810 -7.318 12.629 1.267 1.00 0.00 C ATOM 1805 CD2 TYR B 810 -7.931 11.365 -0.708 1.00 0.00 C ATOM 1806 CE1 TYR B 810 -6.306 13.270 0.544 1.00 0.00 C ATOM 1807 CE2 TYR B 810 -6.921 12.009 -1.433 1.00 0.00 C ATOM 1808 CZ TYR B 810 -6.108 12.961 -0.806 1.00 0.00 C ATOM 1809 OH TYR B 810 -5.112 13.597 -1.520 1.00 0.00 O ATOM 0 H TYR B 810 -10.606 10.052 3.152 1.00 0.00 H new ATOM 0 HA TYR B 810 -8.151 9.101 1.781 1.00 0.00 H new ATOM 0 HB2 TYR B 810 -9.943 10.539 0.736 1.00 0.00 H new ATOM 0 HB3 TYR B 810 -9.766 11.718 2.020 1.00 0.00 H new ATOM 0 HD1 TYR B 810 -7.478 12.877 2.306 1.00 0.00 H new ATOM 0 HD2 TYR B 810 -8.562 10.635 -1.193 1.00 0.00 H new ATOM 0 HE1 TYR B 810 -5.678 14.003 1.028 1.00 0.00 H new ATOM 0 HE2 TYR B 810 -6.769 11.771 -2.476 1.00 0.00 H new ATOM 0 HH TYR B 810 -4.497 14.041 -0.899 1.00 0.00 H new ATOM 1819 N LYS B 811 -7.919 10.796 4.483 1.00 0.00 N ATOM 1820 CA LYS B 811 -6.935 11.429 5.407 1.00 0.00 C ATOM 1821 C LYS B 811 -5.896 10.420 5.911 1.00 0.00 C ATOM 1822 O LYS B 811 -4.795 10.791 6.269 1.00 0.00 O ATOM 1823 CB LYS B 811 -7.780 11.951 6.571 1.00 0.00 C ATOM 1824 CG LYS B 811 -8.567 13.182 6.114 1.00 0.00 C ATOM 1825 CD LYS B 811 -9.351 13.758 7.295 1.00 0.00 C ATOM 1826 CE LYS B 811 -8.374 14.245 8.367 1.00 0.00 C ATOM 1827 NZ LYS B 811 -8.816 15.633 8.684 1.00 0.00 N ATOM 0 H LYS B 811 -8.843 10.628 4.881 1.00 0.00 H new ATOM 0 HA LYS B 811 -6.368 12.215 4.909 1.00 0.00 H new ATOM 0 HB2 LYS B 811 -8.464 11.175 6.915 1.00 0.00 H new ATOM 0 HB3 LYS B 811 -7.139 12.208 7.414 1.00 0.00 H new ATOM 0 HG2 LYS B 811 -7.886 13.934 5.715 1.00 0.00 H new ATOM 0 HG3 LYS B 811 -9.250 12.911 5.309 1.00 0.00 H new ATOM 0 HD2 LYS B 811 -9.980 14.582 6.960 1.00 0.00 H new ATOM 0 HD3 LYS B 811 -10.014 12.999 7.710 1.00 0.00 H new ATOM 0 HE2 LYS B 811 -8.407 13.608 9.251 1.00 0.00 H new ATOM 0 HE3 LYS B 811 -7.347 14.231 8.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 -8.194 16.037 9.413 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 -8.768 16.217 7.825 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 -9.795 15.614 9.035 1.00 0.00 H new ATOM 1841 N CYS B 812 -6.223 9.155 5.959 1.00 0.00 N ATOM 1842 CA CYS B 812 -5.225 8.161 6.458 1.00 0.00 C ATOM 1843 C CYS B 812 -4.120 7.947 5.424 1.00 0.00 C ATOM 1844 O CYS B 812 -2.973 7.740 5.767 1.00 0.00 O ATOM 1845 CB CYS B 812 -6.003 6.862 6.684 1.00 0.00 C ATOM 1846 SG CYS B 812 -6.714 6.290 5.121 1.00 0.00 S ATOM 0 H CYS B 812 -7.125 8.770 5.679 1.00 0.00 H new ATOM 0 HA CYS B 812 -4.744 8.504 7.374 1.00 0.00 H new ATOM 0 HB2 CYS B 812 -5.342 6.098 7.094 1.00 0.00 H new ATOM 0 HB3 CYS B 812 -6.794 7.024 7.416 1.00 0.00 H new ATOM 0 HG CYS B 812 -7.581 7.160 4.695 1.00 0.00 H new ATOM 1852 N ALA B 813 -4.450 7.988 4.161 1.00 0.00 N ATOM 1853 CA ALA B 813 -3.402 7.792 3.125 1.00 0.00 C ATOM 1854 C ALA B 813 -2.279 8.805 3.327 1.00 0.00 C ATOM 1855 O ALA B 813 -1.147 8.445 3.553 1.00 0.00 O ATOM 1856 CB ALA B 813 -4.105 8.035 1.790 1.00 0.00 C ATOM 0 H ALA B 813 -5.393 8.148 3.806 1.00 0.00 H new ATOM 0 HA ALA B 813 -2.956 6.799 3.171 1.00 0.00 H new ATOM 0 HB1 ALA B 813 -3.392 7.908 0.975 1.00 0.00 H new ATOM 0 HB2 ALA B 813 -4.921 7.322 1.673 1.00 0.00 H new ATOM 0 HB3 ALA B 813 -4.504 9.049 1.768 1.00 0.00 H new ATOM 1862 N ASN B 814 -2.595 10.072 3.289 1.00 0.00 N ATOM 1863 CA ASN B 814 -1.545 11.115 3.483 1.00 0.00 C ATOM 1864 C ASN B 814 -0.690 10.805 4.717 1.00 0.00 C ATOM 1865 O ASN B 814 0.522 10.886 4.682 1.00 0.00 O ATOM 1866 CB ASN B 814 -2.323 12.416 3.689 1.00 0.00 C ATOM 1867 CG ASN B 814 -1.371 13.607 3.569 1.00 0.00 C ATOM 1868 OD1 ASN B 814 -0.308 13.494 2.991 1.00 0.00 O ATOM 1869 ND2 ASN B 814 -1.709 14.752 4.094 1.00 0.00 N ATOM 0 H ASN B 814 -3.537 10.431 3.132 1.00 0.00 H new ATOM 0 HA ASN B 814 -0.861 11.168 2.636 1.00 0.00 H new ATOM 0 HB2 ASN B 814 -3.118 12.497 2.948 1.00 0.00 H new ATOM 0 HB3 ASN B 814 -2.799 12.415 4.669 1.00 0.00 H new ATOM 0 HD21 ASN B 814 -1.081 15.552 4.019 1.00 0.00 H new ATOM 0 HD22 ASN B 814 -2.601 14.847 4.579 1.00 0.00 H new ATOM 1876 N ILE B 815 -1.313 10.442 5.804 1.00 0.00 N ATOM 1877 CA ILE B 815 -0.537 10.126 7.036 1.00 0.00 C ATOM 1878 C ILE B 815 0.286 8.851 6.836 1.00 0.00 C ATOM 1879 O ILE B 815 1.501 8.876 6.850 1.00 0.00 O ATOM 1880 CB ILE B 815 -1.597 9.910 8.120 1.00 0.00 C ATOM 1881 CG1 ILE B 815 -2.348 11.219 8.369 1.00 0.00 C ATOM 1882 CG2 ILE B 815 -0.922 9.455 9.417 1.00 0.00 C ATOM 1883 CD1 ILE B 815 -3.436 10.991 9.420 1.00 0.00 C ATOM 0 H ILE B 815 -2.325 10.351 5.892 1.00 0.00 H new ATOM 0 HA ILE B 815 0.165 10.918 7.296 1.00 0.00 H new ATOM 0 HB ILE B 815 -2.299 9.145 7.790 1.00 0.00 H new ATOM 0 HG12 ILE B 815 -1.655 11.989 8.708 1.00 0.00 H new ATOM 0 HG13 ILE B 815 -2.793 11.577 7.441 1.00 0.00 H new ATOM 0 HG21 ILE B 815 -1.679 9.302 10.187 1.00 0.00 H new ATOM 0 HG22 ILE B 815 -0.389 8.521 9.241 1.00 0.00 H new ATOM 0 HG23 ILE B 815 -0.217 10.218 9.748 1.00 0.00 H new ATOM 0 HD11 ILE B 815 -3.971 11.924 9.598 1.00 0.00 H new ATOM 0 HD12 ILE B 815 -4.134 10.234 9.063 1.00 0.00 H new ATOM 0 HD13 ILE B 815 -2.979 10.652 10.350 1.00 0.00 H new ATOM 1895 N LEU B 816 -0.367 7.735 6.661 1.00 0.00 N ATOM 1896 CA LEU B 816 0.377 6.457 6.482 1.00 0.00 C ATOM 1897 C LEU B 816 1.298 6.530 5.259 1.00 0.00 C ATOM 1898 O LEU B 816 2.235 5.767 5.133 1.00 0.00 O ATOM 1899 CB LEU B 816 -0.714 5.400 6.277 1.00 0.00 C ATOM 1900 CG LEU B 816 -0.082 4.044 5.942 1.00 0.00 C ATOM 1901 CD1 LEU B 816 0.951 3.665 7.008 1.00 0.00 C ATOM 1902 CD2 LEU B 816 -1.176 2.978 5.897 1.00 0.00 C ATOM 0 H LEU B 816 -1.383 7.653 6.634 1.00 0.00 H new ATOM 0 HA LEU B 816 1.018 6.230 7.334 1.00 0.00 H new ATOM 0 HB2 LEU B 816 -1.321 5.314 7.178 1.00 0.00 H new ATOM 0 HB3 LEU B 816 -1.381 5.707 5.472 1.00 0.00 H new ATOM 0 HG LEU B 816 0.415 4.110 4.974 1.00 0.00 H new ATOM 0 HD11 LEU B 816 1.393 2.700 6.759 1.00 0.00 H new ATOM 0 HD12 LEU B 816 1.733 4.424 7.043 1.00 0.00 H new ATOM 0 HD13 LEU B 816 0.463 3.601 7.981 1.00 0.00 H new ATOM 0 HD21 LEU B 816 -0.732 2.011 5.659 1.00 0.00 H new ATOM 0 HD22 LEU B 816 -1.669 2.922 6.867 1.00 0.00 H new ATOM 0 HD23 LEU B 816 -1.908 3.239 5.132 1.00 0.00 H new ATOM 1914 N GLU B 817 1.040 7.436 4.355 1.00 0.00 N ATOM 1915 CA GLU B 817 1.919 7.559 3.154 1.00 0.00 C ATOM 1916 C GLU B 817 3.179 8.357 3.503 1.00 0.00 C ATOM 1917 O GLU B 817 4.233 8.146 2.940 1.00 0.00 O ATOM 1918 CB GLU B 817 1.074 8.304 2.109 1.00 0.00 C ATOM 1919 CG GLU B 817 1.951 8.714 0.920 1.00 0.00 C ATOM 1920 CD GLU B 817 1.137 9.591 -0.034 1.00 0.00 C ATOM 1921 OE1 GLU B 817 0.403 9.036 -0.836 1.00 0.00 O ATOM 1922 OE2 GLU B 817 1.260 10.801 0.055 1.00 0.00 O ATOM 0 H GLU B 817 0.262 8.094 4.395 1.00 0.00 H new ATOM 0 HA GLU B 817 2.251 6.589 2.784 1.00 0.00 H new ATOM 0 HB2 GLU B 817 0.259 7.666 1.767 1.00 0.00 H new ATOM 0 HB3 GLU B 817 0.621 9.187 2.559 1.00 0.00 H new ATOM 0 HG2 GLU B 817 2.828 9.257 1.271 1.00 0.00 H new ATOM 0 HG3 GLU B 817 2.312 7.828 0.398 1.00 0.00 H new ATOM 1929 N LYS B 818 3.073 9.291 4.402 1.00 0.00 N ATOM 1930 CA LYS B 818 4.264 10.110 4.757 1.00 0.00 C ATOM 1931 C LYS B 818 5.173 9.348 5.723 1.00 0.00 C ATOM 1932 O LYS B 818 6.383 9.400 5.626 1.00 0.00 O ATOM 1933 CB LYS B 818 3.691 11.350 5.433 1.00 0.00 C ATOM 1934 CG LYS B 818 3.849 12.557 4.507 1.00 0.00 C ATOM 1935 CD LYS B 818 2.683 12.594 3.517 1.00 0.00 C ATOM 1936 CE LYS B 818 3.177 13.112 2.167 1.00 0.00 C ATOM 1937 NZ LYS B 818 3.171 14.596 2.301 1.00 0.00 N ATOM 0 H LYS B 818 2.217 9.523 4.906 1.00 0.00 H new ATOM 0 HA LYS B 818 4.871 10.355 3.885 1.00 0.00 H new ATOM 0 HB2 LYS B 818 2.638 11.195 5.669 1.00 0.00 H new ATOM 0 HB3 LYS B 818 4.205 11.533 6.377 1.00 0.00 H new ATOM 0 HG2 LYS B 818 3.874 13.477 5.091 1.00 0.00 H new ATOM 0 HG3 LYS B 818 4.795 12.495 3.969 1.00 0.00 H new ATOM 0 HD2 LYS B 818 2.258 11.597 3.402 1.00 0.00 H new ATOM 0 HD3 LYS B 818 1.890 13.237 3.897 1.00 0.00 H new ATOM 0 HE2 LYS B 818 4.176 12.740 1.943 1.00 0.00 H new ATOM 0 HE3 LYS B 818 2.526 12.786 1.356 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 3.499 15.026 1.413 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 2.205 14.922 2.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 3.805 14.877 3.076 1.00 0.00 H new ATOM 1951 N PHE B 819 4.598 8.645 6.659 1.00 0.00 N ATOM 1952 CA PHE B 819 5.426 7.891 7.641 1.00 0.00 C ATOM 1953 C PHE B 819 6.337 6.892 6.929 1.00 0.00 C ATOM 1954 O PHE B 819 7.529 6.856 7.159 1.00 0.00 O ATOM 1955 CB PHE B 819 4.414 7.154 8.521 1.00 0.00 C ATOM 1956 CG PHE B 819 4.833 7.261 9.967 1.00 0.00 C ATOM 1957 CD1 PHE B 819 4.754 8.492 10.629 1.00 0.00 C ATOM 1958 CD2 PHE B 819 5.302 6.130 10.645 1.00 0.00 C ATOM 1959 CE1 PHE B 819 5.143 8.592 11.970 1.00 0.00 C ATOM 1960 CE2 PHE B 819 5.692 6.230 11.986 1.00 0.00 C ATOM 1961 CZ PHE B 819 5.612 7.461 12.649 1.00 0.00 C ATOM 0 H PHE B 819 3.590 8.560 6.786 1.00 0.00 H new ATOM 0 HA PHE B 819 6.076 8.550 8.217 1.00 0.00 H new ATOM 0 HB2 PHE B 819 3.420 7.581 8.387 1.00 0.00 H new ATOM 0 HB3 PHE B 819 4.354 6.107 8.225 1.00 0.00 H new ATOM 0 HD1 PHE B 819 4.393 9.365 10.105 1.00 0.00 H new ATOM 0 HD2 PHE B 819 5.363 5.180 10.134 1.00 0.00 H new ATOM 0 HE1 PHE B 819 5.081 9.542 12.481 1.00 0.00 H new ATOM 0 HE2 PHE B 819 6.055 5.358 12.509 1.00 0.00 H new ATOM 0 HZ PHE B 819 5.912 7.538 13.684 1.00 0.00 H new ATOM 1971 N PHE B 820 5.790 6.069 6.075 1.00 0.00 N ATOM 1972 CA PHE B 820 6.642 5.071 5.371 1.00 0.00 C ATOM 1973 C PHE B 820 7.511 5.773 4.314 1.00 0.00 C ATOM 1974 O PHE B 820 8.606 5.342 4.018 1.00 0.00 O ATOM 1975 CB PHE B 820 5.647 4.047 4.766 1.00 0.00 C ATOM 1976 CG PHE B 820 5.295 4.366 3.324 1.00 0.00 C ATOM 1977 CD1 PHE B 820 4.527 5.494 3.023 1.00 0.00 C ATOM 1978 CD2 PHE B 820 5.733 3.522 2.296 1.00 0.00 C ATOM 1979 CE1 PHE B 820 4.202 5.785 1.691 1.00 0.00 C ATOM 1980 CE2 PHE B 820 5.408 3.812 0.965 1.00 0.00 C ATOM 1981 CZ PHE B 820 4.642 4.943 0.663 1.00 0.00 C ATOM 0 H PHE B 820 4.799 6.045 5.837 1.00 0.00 H new ATOM 0 HA PHE B 820 7.348 4.564 6.029 1.00 0.00 H new ATOM 0 HB2 PHE B 820 6.080 3.048 4.819 1.00 0.00 H new ATOM 0 HB3 PHE B 820 4.736 4.032 5.365 1.00 0.00 H new ATOM 0 HD1 PHE B 820 4.184 6.141 3.817 1.00 0.00 H new ATOM 0 HD2 PHE B 820 6.322 2.647 2.530 1.00 0.00 H new ATOM 0 HE1 PHE B 820 3.612 6.659 1.458 1.00 0.00 H new ATOM 0 HE2 PHE B 820 5.749 3.163 0.172 1.00 0.00 H new ATOM 0 HZ PHE B 820 4.390 5.166 -0.363 1.00 0.00 H new ATOM 1991 N PHE B 821 7.037 6.862 3.767 1.00 0.00 N ATOM 1992 CA PHE B 821 7.844 7.600 2.751 1.00 0.00 C ATOM 1993 C PHE B 821 9.225 7.933 3.323 1.00 0.00 C ATOM 1994 O PHE B 821 10.174 8.153 2.596 1.00 0.00 O ATOM 1995 CB PHE B 821 7.052 8.884 2.475 1.00 0.00 C ATOM 1996 CG PHE B 821 7.859 9.807 1.589 1.00 0.00 C ATOM 1997 CD1 PHE B 821 7.843 9.637 0.199 1.00 0.00 C ATOM 1998 CD2 PHE B 821 8.624 10.830 2.161 1.00 0.00 C ATOM 1999 CE1 PHE B 821 8.592 10.493 -0.618 1.00 0.00 C ATOM 2000 CE2 PHE B 821 9.373 11.684 1.344 1.00 0.00 C ATOM 2001 CZ PHE B 821 9.357 11.516 -0.046 1.00 0.00 C ATOM 0 H PHE B 821 6.127 7.272 3.980 1.00 0.00 H new ATOM 0 HA PHE B 821 8.005 7.018 1.843 1.00 0.00 H new ATOM 0 HB2 PHE B 821 6.105 8.641 1.994 1.00 0.00 H new ATOM 0 HB3 PHE B 821 6.814 9.384 3.414 1.00 0.00 H new ATOM 0 HD1 PHE B 821 7.254 8.847 -0.242 1.00 0.00 H new ATOM 0 HD2 PHE B 821 8.636 10.960 3.233 1.00 0.00 H new ATOM 0 HE1 PHE B 821 8.579 10.364 -1.690 1.00 0.00 H new ATOM 0 HE2 PHE B 821 9.964 12.473 1.786 1.00 0.00 H new ATOM 0 HZ PHE B 821 9.935 12.176 -0.677 1.00 0.00 H new ATOM 2011 N SER B 822 9.339 7.985 4.621 1.00 0.00 N ATOM 2012 CA SER B 822 10.650 8.316 5.242 1.00 0.00 C ATOM 2013 C SER B 822 11.569 7.096 5.241 1.00 0.00 C ATOM 2014 O SER B 822 12.758 7.213 5.035 1.00 0.00 O ATOM 2015 CB SER B 822 10.312 8.722 6.677 1.00 0.00 C ATOM 2016 OG SER B 822 11.503 8.762 7.450 1.00 0.00 O ATOM 0 H SER B 822 8.579 7.812 5.279 1.00 0.00 H new ATOM 0 HA SER B 822 11.172 9.104 4.699 1.00 0.00 H new ATOM 0 HB2 SER B 822 9.827 9.698 6.686 1.00 0.00 H new ATOM 0 HB3 SER B 822 9.608 8.012 7.111 1.00 0.00 H new ATOM 0 HG SER B 822 11.288 9.024 8.370 1.00 0.00 H new ATOM 2022 N LYS B 823 11.035 5.930 5.486 1.00 0.00 N ATOM 2023 CA LYS B 823 11.898 4.712 5.520 1.00 0.00 C ATOM 2024 C LYS B 823 12.189 4.212 4.105 1.00 0.00 C ATOM 2025 O LYS B 823 13.259 3.715 3.834 1.00 0.00 O ATOM 2026 CB LYS B 823 11.102 3.655 6.301 1.00 0.00 C ATOM 2027 CG LYS B 823 10.608 4.244 7.627 1.00 0.00 C ATOM 2028 CD LYS B 823 11.809 4.654 8.482 1.00 0.00 C ATOM 2029 CE LYS B 823 11.844 3.806 9.756 1.00 0.00 C ATOM 2030 NZ LYS B 823 13.198 3.184 9.762 1.00 0.00 N ATOM 0 H LYS B 823 10.044 5.767 5.663 1.00 0.00 H new ATOM 0 HA LYS B 823 12.860 4.924 5.987 1.00 0.00 H new ATOM 0 HB2 LYS B 823 10.254 3.314 5.707 1.00 0.00 H new ATOM 0 HB3 LYS B 823 11.729 2.784 6.492 1.00 0.00 H new ATOM 0 HG2 LYS B 823 9.970 5.108 7.438 1.00 0.00 H new ATOM 0 HG3 LYS B 823 10.002 3.511 8.160 1.00 0.00 H new ATOM 0 HD2 LYS B 823 12.732 4.520 7.918 1.00 0.00 H new ATOM 0 HD3 LYS B 823 11.742 5.711 8.738 1.00 0.00 H new ATOM 0 HE2 LYS B 823 11.686 4.419 10.644 1.00 0.00 H new ATOM 0 HE3 LYS B 823 11.061 3.048 9.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 13.301 2.585 10.606 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 13.316 2.602 8.908 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 13.923 3.930 9.776 1.00 0.00 H new ATOM 2044 N ILE B 824 11.249 4.316 3.201 1.00 0.00 N ATOM 2045 CA ILE B 824 11.512 3.834 1.813 1.00 0.00 C ATOM 2046 C ILE B 824 12.520 4.754 1.122 1.00 0.00 C ATOM 2047 O ILE B 824 13.301 4.326 0.299 1.00 0.00 O ATOM 2048 CB ILE B 824 10.155 3.854 1.101 1.00 0.00 C ATOM 2049 CG1 ILE B 824 9.586 5.262 1.044 1.00 0.00 C ATOM 2050 CG2 ILE B 824 9.182 2.950 1.839 1.00 0.00 C ATOM 2051 CD1 ILE B 824 8.796 5.412 -0.253 1.00 0.00 C ATOM 0 H ILE B 824 10.321 4.709 3.361 1.00 0.00 H new ATOM 0 HA ILE B 824 11.942 2.833 1.798 1.00 0.00 H new ATOM 0 HB ILE B 824 10.300 3.498 0.081 1.00 0.00 H new ATOM 0 HG12 ILE B 824 8.941 5.445 1.904 1.00 0.00 H new ATOM 0 HG13 ILE B 824 10.389 5.997 1.086 1.00 0.00 H new ATOM 0 HG21 ILE B 824 8.217 2.964 1.333 1.00 0.00 H new ATOM 0 HG22 ILE B 824 9.570 1.931 1.852 1.00 0.00 H new ATOM 0 HG23 ILE B 824 9.060 3.305 2.862 1.00 0.00 H new ATOM 0 HD11 ILE B 824 8.380 6.418 -0.311 1.00 0.00 H new ATOM 0 HD12 ILE B 824 9.457 5.243 -1.103 1.00 0.00 H new ATOM 0 HD13 ILE B 824 7.986 4.682 -0.272 1.00 0.00 H new ATOM 2063 N LYS B 825 12.541 6.006 1.479 1.00 0.00 N ATOM 2064 CA LYS B 825 13.548 6.925 0.894 1.00 0.00 C ATOM 2065 C LYS B 825 14.872 6.669 1.600 1.00 0.00 C ATOM 2066 O LYS B 825 15.938 6.699 1.016 1.00 0.00 O ATOM 2067 CB LYS B 825 13.034 8.327 1.222 1.00 0.00 C ATOM 2068 CG LYS B 825 13.761 9.353 0.356 1.00 0.00 C ATOM 2069 CD LYS B 825 14.447 10.383 1.250 1.00 0.00 C ATOM 2070 CE LYS B 825 15.458 9.682 2.159 1.00 0.00 C ATOM 2071 NZ LYS B 825 16.465 10.729 2.491 1.00 0.00 N ATOM 0 H LYS B 825 11.903 6.431 2.152 1.00 0.00 H new ATOM 0 HA LYS B 825 13.693 6.796 -0.179 1.00 0.00 H new ATOM 0 HB2 LYS B 825 11.960 8.382 1.045 1.00 0.00 H new ATOM 0 HB3 LYS B 825 13.195 8.547 2.277 1.00 0.00 H new ATOM 0 HG2 LYS B 825 14.498 8.855 -0.274 1.00 0.00 H new ATOM 0 HG3 LYS B 825 13.054 9.848 -0.310 1.00 0.00 H new ATOM 0 HD2 LYS B 825 14.951 11.132 0.639 1.00 0.00 H new ATOM 0 HD3 LYS B 825 13.705 10.909 1.851 1.00 0.00 H new ATOM 0 HE2 LYS B 825 14.979 9.295 3.058 1.00 0.00 H new ATOM 0 HE3 LYS B 825 15.921 8.834 1.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 17.194 10.325 3.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 16.909 11.074 1.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 15.996 11.520 2.976 1.00 0.00 H new ATOM 2085 N GLU B 826 14.779 6.378 2.865 1.00 0.00 N ATOM 2086 CA GLU B 826 15.982 6.071 3.682 1.00 0.00 C ATOM 2087 C GLU B 826 16.452 4.637 3.425 1.00 0.00 C ATOM 2088 O GLU B 826 17.580 4.281 3.703 1.00 0.00 O ATOM 2089 CB GLU B 826 15.475 6.199 5.121 1.00 0.00 C ATOM 2090 CG GLU B 826 15.584 7.656 5.575 1.00 0.00 C ATOM 2091 CD GLU B 826 16.549 7.755 6.757 1.00 0.00 C ATOM 2092 OE1 GLU B 826 17.704 7.398 6.586 1.00 0.00 O ATOM 2093 OE2 GLU B 826 16.119 8.187 7.814 1.00 0.00 O ATOM 0 H GLU B 826 13.898 6.339 3.378 1.00 0.00 H new ATOM 0 HA GLU B 826 16.825 6.725 3.457 1.00 0.00 H new ATOM 0 HB2 GLU B 826 14.440 5.864 5.184 1.00 0.00 H new ATOM 0 HB3 GLU B 826 16.058 5.557 5.781 1.00 0.00 H new ATOM 0 HG2 GLU B 826 15.936 8.278 4.752 1.00 0.00 H new ATOM 0 HG3 GLU B 826 14.602 8.032 5.862 1.00 0.00 H new ATOM 2100 N ALA B 827 15.581 3.808 2.920 1.00 0.00 N ATOM 2101 CA ALA B 827 15.942 2.383 2.688 1.00 0.00 C ATOM 2102 C ALA B 827 16.510 2.183 1.283 1.00 0.00 C ATOM 2103 O ALA B 827 17.263 1.262 1.034 1.00 0.00 O ATOM 2104 CB ALA B 827 14.617 1.632 2.827 1.00 0.00 C ATOM 0 H ALA B 827 14.628 4.059 2.657 1.00 0.00 H new ATOM 0 HA ALA B 827 16.705 2.036 3.384 1.00 0.00 H new ATOM 0 HB1 ALA B 827 14.785 0.566 2.671 1.00 0.00 H new ATOM 0 HB2 ALA B 827 14.210 1.793 3.825 1.00 0.00 H new ATOM 0 HB3 ALA B 827 13.910 2.001 2.084 1.00 0.00 H new ATOM 2110 N GLY B 828 16.132 3.015 0.357 1.00 0.00 N ATOM 2111 CA GLY B 828 16.640 2.856 -1.033 1.00 0.00 C ATOM 2112 C GLY B 828 15.465 2.605 -1.982 1.00 0.00 C ATOM 2113 O GLY B 828 15.624 2.033 -3.042 1.00 0.00 O ATOM 0 H GLY B 828 15.494 3.798 0.501 1.00 0.00 H new ATOM 0 HA2 GLY B 828 17.182 3.751 -1.338 1.00 0.00 H new ATOM 0 HA3 GLY B 828 17.344 2.025 -1.081 1.00 0.00 H new ATOM 2117 N LEU B 829 14.283 3.010 -1.604 1.00 0.00 N ATOM 2118 CA LEU B 829 13.113 2.839 -2.489 1.00 0.00 C ATOM 2119 C LEU B 829 12.805 4.177 -3.126 1.00 0.00 C ATOM 2120 O LEU B 829 12.367 4.273 -4.254 1.00 0.00 O ATOM 2121 CB LEU B 829 11.979 2.458 -1.549 1.00 0.00 C ATOM 2122 CG LEU B 829 12.369 1.217 -0.750 1.00 0.00 C ATOM 2123 CD1 LEU B 829 11.194 0.773 0.096 1.00 0.00 C ATOM 2124 CD2 LEU B 829 12.731 0.090 -1.706 1.00 0.00 C ATOM 0 H LEU B 829 14.084 3.456 -0.709 1.00 0.00 H new ATOM 0 HA LEU B 829 13.268 2.100 -3.275 1.00 0.00 H new ATOM 0 HB2 LEU B 829 11.761 3.284 -0.873 1.00 0.00 H new ATOM 0 HB3 LEU B 829 11.070 2.265 -2.119 1.00 0.00 H new ATOM 0 HG LEU B 829 13.221 1.454 -0.113 1.00 0.00 H new ATOM 0 HD11 LEU B 829 11.471 -0.113 0.667 1.00 0.00 H new ATOM 0 HD12 LEU B 829 10.916 1.574 0.781 1.00 0.00 H new ATOM 0 HD13 LEU B 829 10.348 0.538 -0.550 1.00 0.00 H new ATOM 0 HD21 LEU B 829 13.009 -0.796 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU B 829 11.874 -0.140 -2.338 1.00 0.00 H new ATOM 0 HD23 LEU B 829 13.570 0.398 -2.330 1.00 0.00 H new ATOM 2136 N ILE B 830 13.037 5.218 -2.379 1.00 0.00 N ATOM 2137 CA ILE B 830 12.693 6.570 -2.843 1.00 0.00 C ATOM 2138 C ILE B 830 13.821 7.546 -2.480 1.00 0.00 C ATOM 2139 O ILE B 830 13.632 8.742 -2.380 1.00 0.00 O ATOM 2140 CB ILE B 830 11.359 6.816 -2.113 1.00 0.00 C ATOM 2141 CG1 ILE B 830 10.259 6.405 -3.068 1.00 0.00 C ATOM 2142 CG2 ILE B 830 11.141 8.277 -1.729 1.00 0.00 C ATOM 2143 CD1 ILE B 830 9.995 4.911 -2.964 1.00 0.00 C ATOM 0 H ILE B 830 13.459 5.178 -1.451 1.00 0.00 H new ATOM 0 HA ILE B 830 12.585 6.700 -3.920 1.00 0.00 H new ATOM 0 HB ILE B 830 11.363 6.244 -1.185 1.00 0.00 H new ATOM 0 HG12 ILE B 830 9.347 6.958 -2.842 1.00 0.00 H new ATOM 0 HG13 ILE B 830 10.542 6.660 -4.089 1.00 0.00 H new ATOM 0 HG21 ILE B 830 10.183 8.380 -1.219 1.00 0.00 H new ATOM 0 HG22 ILE B 830 11.942 8.602 -1.066 1.00 0.00 H new ATOM 0 HG23 ILE B 830 11.141 8.893 -2.628 1.00 0.00 H new ATOM 0 HD11 ILE B 830 9.201 4.633 -3.657 1.00 0.00 H new ATOM 0 HD12 ILE B 830 10.903 4.363 -3.213 1.00 0.00 H new ATOM 0 HD13 ILE B 830 9.691 4.665 -1.947 1.00 0.00 H new ATOM 2155 N ASP B 831 15.024 7.045 -2.399 1.00 0.00 N ATOM 2156 CA ASP B 831 16.186 7.932 -2.129 1.00 0.00 C ATOM 2157 C ASP B 831 16.229 9.065 -3.156 1.00 0.00 C ATOM 2158 O ASP B 831 16.827 10.099 -2.933 1.00 0.00 O ATOM 2159 CB ASP B 831 17.413 7.029 -2.282 1.00 0.00 C ATOM 2160 CG ASP B 831 18.554 7.565 -1.415 1.00 0.00 C ATOM 2161 OD1 ASP B 831 18.331 7.759 -0.231 1.00 0.00 O ATOM 2162 OD2 ASP B 831 19.631 7.771 -1.949 1.00 0.00 O ATOM 0 H ASP B 831 15.250 6.056 -2.509 1.00 0.00 H new ATOM 0 HA ASP B 831 16.137 8.393 -1.143 1.00 0.00 H new ATOM 0 HB2 ASP B 831 17.166 6.009 -1.987 1.00 0.00 H new ATOM 0 HB3 ASP B 831 17.722 6.992 -3.327 1.00 0.00 H new ATOM 2167 N LYS B 832 15.593 8.879 -4.282 1.00 0.00 N ATOM 2168 CA LYS B 832 15.592 9.946 -5.323 1.00 0.00 C ATOM 2169 C LYS B 832 14.343 9.831 -6.201 1.00 0.00 C ATOM 2170 O LYS B 832 14.331 10.436 -7.261 1.00 0.00 O ATOM 2171 CB LYS B 832 16.852 9.689 -6.153 1.00 0.00 C ATOM 2172 CG LYS B 832 16.765 8.305 -6.800 1.00 0.00 C ATOM 2173 CD LYS B 832 18.096 7.974 -7.479 1.00 0.00 C ATOM 2174 CE LYS B 832 17.952 8.138 -8.993 1.00 0.00 C ATOM 2175 NZ LYS B 832 18.309 9.560 -9.261 1.00 0.00 N ATOM 2176 OXT LYS B 832 13.421 9.142 -5.799 1.00 0.00 O ATOM 0 H LYS B 832 15.075 8.035 -4.525 1.00 0.00 H new ATOM 0 HA LYS B 832 15.584 10.945 -4.888 1.00 0.00 H new ATOM 0 HB2 LYS B 832 16.956 10.455 -6.921 1.00 0.00 H new ATOM 0 HB3 LYS B 832 17.737 9.751 -5.519 1.00 0.00 H new ATOM 0 HG2 LYS B 832 16.533 7.553 -6.046 1.00 0.00 H new ATOM 0 HG3 LYS B 832 15.957 8.284 -7.531 1.00 0.00 H new ATOM 0 HD2 LYS B 832 18.881 8.631 -7.104 1.00 0.00 H new ATOM 0 HD3 LYS B 832 18.394 6.953 -7.240 1.00 0.00 H new ATOM 0 HE2 LYS B 832 18.613 7.457 -9.529 1.00 0.00 H new ATOM 0 HE3 LYS B 832 16.936 7.918 -9.319 1.00 0.00 H new ATOM 0 HZ1 LYS B 832 17.540 10.017 -9.791 1.00 0.00 H new ATOM 0 HZ2 LYS B 832 18.451 10.058 -8.359 1.00 0.00 H new ATOM 0 HZ3 LYS B 832 19.185 9.599 -9.820 1.00 0.00 H new TER 2190 LYS B 832