USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=39 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+ -134:sc= 1.62 (180deg=-0.0923) USER MOD Set 1.2: B 810 TYR OH : rot 180:sc= 0.713 USER MOD Set 1.3: B 814 ASN :FLIP amide:sc= -2.04! F(o=-0.96,f=0.3!) USER MOD Set 2.1: B 798 ASN : amide:sc= -11.4! C(o=-12!,f=-25!) USER MOD Set 2.2: B 799 CYS SG : rot -167:sc= -0.692 USER MOD Set 3.1: B 744 SER OG : rot 120:sc= -1.13 USER MOD Set 3.2: B 812 CYS SG : rot 84:sc= 0.255 USER MOD Set 4.1: B 729 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: B 733 LYS NZ :NH3+ -122:sc= -0.0477 (180deg=-1.01) USER MOD Single : A 46 SER OG : rot 180:sc= 0 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= -9.19! C(o=-9.2!,f=-24!) USER MOD Single : A 56 CYS SG : rot 180:sc= 0 USER MOD Single : B 716 SER OG : rot 50:sc= 0.175 USER MOD Single : B 717 HIS : no HD1:sc= -0.0971 X(o=-0.097,f=-0.0066) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 727 GLN : amide:sc= -0.311 X(o=-0.31,f=-0.37) USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 77:sc= 1.09 USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 737 GLN :FLIP amide:sc= -0.613 F(o=-2.1,f=-0.61) USER MOD Single : B 738 GLN : amide:sc= -10.8! C(o=-11!,f=-20!) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot 180:sc= 0 USER MOD Single : B 742 HIS : no HD1:sc= -0.641 K(o=-0.64,f=-11!) USER MOD Single : B 743 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 749 MET CE :methyl -121:sc= -3.41! (180deg=-6.83!) USER MOD Single : B 753 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.167) USER MOD Single : B 755 THR OG1 : rot -83:sc= 0.34 USER MOD Single : B 760 TYR OH : rot -151:sc= -5.41! USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl -149:sc= -3.51! (180deg=-7.11!) USER MOD Single : B 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 772 THR OG1 : rot 180:sc= 0.032 USER MOD Single : B 773 MET CE :methyl -122:sc= -8.07! (180deg=-10.7!) USER MOD Single : B 774 SER OG : rot -92:sc= 0.917 USER MOD Single : B 778 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 779 ASN :FLIP amide:sc= 1.01 F(o=-0.0064,f=1) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot -112:sc= 0.182 USER MOD Single : B 784 SER OG : rot -31:sc= -0.405! USER MOD Single : B 785 LYS NZ :NH3+ 161:sc= 1.01 (180deg=0.868) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl 140:sc= -6.35! (180deg=-9.51!) USER MOD Single : B 793 GLN : amide:sc= -1.55 K(o=-1.6,f=-5.6!) USER MOD Single : B 797 THR OG1 : rot 180:sc= 0 USER MOD Single : B 802 TYR OH : rot 136:sc= -4.11! USER MOD Single : B 803 ASN : amide:sc= -7.63! C(o=-7.6!,f=-14!) USER MOD Single : B 807 SER OG : rot 180:sc= 0 USER MOD Single : B 809 TYR OH : rot -38:sc= 0.095 USER MOD Single : B 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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=-0.00154 (180deg=-0.00154) USER MOD Single : B 825 LYS NZ :NH3+ 177:sc= -1.14 (180deg=-1.17) USER MOD Single : B 832 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 46 -20.306 5.409 -9.797 1.00 0.00 N ATOM 2 CA SER A 46 -19.814 5.562 -8.399 1.00 0.00 C ATOM 3 C SER A 46 -18.298 5.360 -8.341 1.00 0.00 C ATOM 4 O SER A 46 -17.685 4.913 -9.291 1.00 0.00 O ATOM 5 CB SER A 46 -20.529 4.463 -7.612 1.00 0.00 C ATOM 6 OG SER A 46 -21.751 4.970 -7.096 1.00 0.00 O ATOM 0 HA SER A 46 -20.015 6.555 -7.997 1.00 0.00 H new ATOM 0 HB2 SER A 46 -20.722 3.606 -8.257 1.00 0.00 H new ATOM 0 HB3 SER A 46 -19.895 4.113 -6.797 1.00 0.00 H new ATOM 0 HG SER A 46 -22.211 4.266 -6.593 1.00 0.00 H new ATOM 14 N TYR A 47 -17.688 5.686 -7.234 1.00 0.00 N ATOM 15 CA TYR A 47 -16.212 5.514 -7.118 1.00 0.00 C ATOM 16 C TYR A 47 -15.881 4.352 -6.180 1.00 0.00 C ATOM 17 O TYR A 47 -16.718 3.525 -5.883 1.00 0.00 O ATOM 18 CB TYR A 47 -15.708 6.833 -6.528 1.00 0.00 C ATOM 19 CG TYR A 47 -14.920 7.582 -7.575 1.00 0.00 C ATOM 20 CD1 TYR A 47 -15.544 7.993 -8.758 1.00 0.00 C ATOM 21 CD2 TYR A 47 -13.565 7.865 -7.362 1.00 0.00 C ATOM 22 CE1 TYR A 47 -14.814 8.688 -9.730 1.00 0.00 C ATOM 23 CE2 TYR A 47 -12.835 8.560 -8.334 1.00 0.00 C ATOM 24 CZ TYR A 47 -13.460 8.971 -9.518 1.00 0.00 C ATOM 25 OH TYR A 47 -12.741 9.656 -10.476 1.00 0.00 O ATOM 0 H TYR A 47 -18.148 6.064 -6.405 1.00 0.00 H new ATOM 0 HA TYR A 47 -15.749 5.287 -8.078 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -16.549 7.437 -6.189 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -15.083 6.639 -5.656 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -16.589 7.774 -8.921 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -13.084 7.547 -6.449 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -15.296 9.006 -10.643 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -11.790 8.779 -8.171 1.00 0.00 H new ATOM 0 HH TYR A 47 -11.817 9.771 -10.171 1.00 0.00 H new ATOM 35 N GLY A 48 -14.665 4.297 -5.700 1.00 0.00 N ATOM 36 CA GLY A 48 -14.254 3.186 -4.785 1.00 0.00 C ATOM 37 C GLY A 48 -15.307 2.974 -3.694 1.00 0.00 C ATOM 38 O GLY A 48 -16.214 3.765 -3.525 1.00 0.00 O ATOM 0 H GLY A 48 -13.933 4.978 -5.903 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -14.123 2.267 -5.356 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -13.291 3.419 -4.330 1.00 0.00 H new ATOM 42 N ARG A 49 -15.191 1.907 -2.956 1.00 0.00 N ATOM 43 CA ARG A 49 -16.180 1.628 -1.880 1.00 0.00 C ATOM 44 C ARG A 49 -15.741 0.404 -1.082 1.00 0.00 C ATOM 45 O ARG A 49 -15.715 -0.700 -1.587 1.00 0.00 O ATOM 46 CB ARG A 49 -17.492 1.345 -2.612 1.00 0.00 C ATOM 47 CG ARG A 49 -18.668 1.784 -1.738 1.00 0.00 C ATOM 48 CD ARG A 49 -19.648 2.603 -2.579 1.00 0.00 C ATOM 49 NE ARG A 49 -19.455 4.012 -2.127 1.00 0.00 N ATOM 50 CZ ARG A 49 -19.896 4.412 -0.956 1.00 0.00 C ATOM 51 NH1 ARG A 49 -20.519 3.586 -0.151 1.00 0.00 N ATOM 52 NH2 ARG A 49 -19.712 5.650 -0.589 1.00 0.00 N ATOM 0 H ARG A 49 -14.450 1.213 -3.052 1.00 0.00 H new ATOM 0 HA ARG A 49 -16.278 2.456 -1.177 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -17.513 1.878 -3.563 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -17.572 0.282 -2.840 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -19.171 0.912 -1.321 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -18.309 2.378 -0.897 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -19.440 2.497 -3.644 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -20.675 2.274 -2.421 1.00 0.00 H new ATOM 0 HE ARG A 49 -18.974 4.674 -2.736 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -20.668 2.616 -0.430 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -20.855 3.913 0.755 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -19.229 6.299 -1.210 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -20.051 5.969 0.319 1.00 0.00 H new HETATM 66 OH ALY A 50 -10.417 -2.344 -0.015 1.00 0.00 O HETATM 67 CH ALY A 50 -9.764 -1.322 0.037 1.00 0.00 C HETATM 68 CH3 ALY A 50 -8.457 -1.256 0.829 1.00 0.00 C HETATM 69 NZ ALY A 50 -10.156 -0.233 -0.567 1.00 0.00 N HETATM 70 CE ALY A 50 -11.300 -0.282 -1.520 1.00 0.00 C HETATM 71 CD ALY A 50 -12.532 -0.583 -0.662 1.00 0.00 C HETATM 72 CG ALY A 50 -12.652 0.442 0.475 1.00 0.00 C HETATM 73 CB ALY A 50 -13.579 -0.104 1.578 1.00 0.00 C HETATM 74 CA ALY A 50 -14.908 -0.568 0.963 1.00 0.00 C HETATM 75 N ALY A 50 -15.377 0.589 0.153 1.00 0.00 N HETATM 76 C ALY A 50 -15.932 -0.910 2.047 1.00 0.00 C HETATM 77 O ALY A 50 -15.998 -0.274 3.080 1.00 0.00 O HETATM 0 HH33 ALY A 50 -8.655 -1.481 1.877 1.00 0.00 H new HETATM 0 HH32 ALY A 50 -7.752 -1.984 0.429 1.00 0.00 H new HETATM 0 HH31 ALY A 50 -8.032 -0.256 0.747 1.00 0.00 H new HETATM 0 HZ ALY A 50 -9.679 0.651 -0.387 1.00 0.00 H new HETATM 0 HG3 ALY A 50 -13.046 1.382 0.089 1.00 0.00 H new HETATM 0 HG2 ALY A 50 -11.667 0.656 0.889 1.00 0.00 H new HETATM 0 HE3 ALY A 50 -11.149 -1.053 -2.275 1.00 0.00 H new HETATM 0 HE2 ALY A 50 -11.411 0.665 -2.049 1.00 0.00 H new HETATM 0 HD3 ALY A 50 -12.459 -1.589 -0.248 1.00 0.00 H new HETATM 0 HD2 ALY A 50 -13.429 -0.557 -1.280 1.00 0.00 H new HETATM 0 HCA ALY A 50 -14.782 -1.472 0.367 1.00 0.00 H new HETATM 0 HB3 ALY A 50 -13.764 0.668 2.325 1.00 0.00 H new HETATM 0 HB2 ALY A 50 -13.096 -0.935 2.092 1.00 0.00 H new HETATM 0 H ALY A 50 -14.821 1.443 0.114 1.00 0.00 H new ATOM 92 N LYS A 51 -16.742 -1.907 1.806 1.00 0.00 N ATOM 93 CA LYS A 51 -17.777 -2.291 2.807 1.00 0.00 C ATOM 94 C LYS A 51 -18.233 -3.734 2.576 1.00 0.00 C ATOM 95 O LYS A 51 -17.885 -4.355 1.592 1.00 0.00 O ATOM 96 CB LYS A 51 -18.935 -1.321 2.556 1.00 0.00 C ATOM 97 CG LYS A 51 -19.469 -1.518 1.134 1.00 0.00 C ATOM 98 CD LYS A 51 -20.782 -0.751 0.972 1.00 0.00 C ATOM 99 CE LYS A 51 -21.957 -1.700 1.213 1.00 0.00 C ATOM 100 NZ LYS A 51 -23.099 -0.812 1.568 1.00 0.00 N ATOM 0 H LYS A 51 -16.730 -2.472 0.957 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.404 -2.238 3.830 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.730 -1.492 3.281 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -18.598 -0.293 2.690 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -18.737 -1.165 0.407 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -19.628 -2.578 0.937 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -20.820 0.079 1.677 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -20.845 -0.323 -0.028 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -22.177 -2.290 0.324 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -21.739 -2.403 2.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.945 -1.390 1.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -22.863 -0.267 2.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.288 -0.158 0.782 1.00 0.00 H new ATOM 114 N ARG A 52 -19.018 -4.269 3.472 1.00 0.00 N ATOM 115 CA ARG A 52 -19.507 -5.666 3.296 1.00 0.00 C ATOM 116 C ARG A 52 -20.761 -5.677 2.419 1.00 0.00 C ATOM 117 O ARG A 52 -21.517 -4.727 2.392 1.00 0.00 O ATOM 118 CB ARG A 52 -19.842 -6.148 4.709 1.00 0.00 C ATOM 119 CG ARG A 52 -19.498 -7.634 4.837 1.00 0.00 C ATOM 120 CD ARG A 52 -17.979 -7.803 4.884 1.00 0.00 C ATOM 121 NE ARG A 52 -17.763 -9.274 5.025 1.00 0.00 N ATOM 122 CZ ARG A 52 -17.992 -9.883 6.165 1.00 0.00 C ATOM 123 NH1 ARG A 52 -18.417 -9.219 7.212 1.00 0.00 N ATOM 124 NH2 ARG A 52 -17.794 -11.169 6.257 1.00 0.00 N ATOM 0 H ARG A 52 -19.341 -3.799 4.318 1.00 0.00 H new ATOM 0 HA ARG A 52 -18.770 -6.305 2.810 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -19.282 -5.570 5.444 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -20.900 -5.990 4.917 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.949 -8.046 5.740 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -19.910 -8.188 3.994 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -17.510 -7.419 3.978 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -17.546 -7.257 5.722 1.00 0.00 H new ATOM 0 HE ARG A 52 -17.433 -9.813 4.224 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.575 -8.213 7.149 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -18.590 -9.708 8.090 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -17.464 -11.693 5.447 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -17.969 -11.650 7.139 1.00 0.00 H new ATOM 138 N ARG A 53 -20.989 -6.742 1.699 1.00 0.00 N ATOM 139 CA ARG A 53 -22.194 -6.799 0.825 1.00 0.00 C ATOM 140 C ARG A 53 -22.543 -8.248 0.476 1.00 0.00 C ATOM 141 O ARG A 53 -23.671 -8.675 0.617 1.00 0.00 O ATOM 142 CB ARG A 53 -21.799 -6.030 -0.437 1.00 0.00 C ATOM 143 CG ARG A 53 -23.025 -5.866 -1.338 1.00 0.00 C ATOM 144 CD ARG A 53 -24.071 -5.006 -0.625 1.00 0.00 C ATOM 145 NE ARG A 53 -24.687 -4.182 -1.707 1.00 0.00 N ATOM 146 CZ ARG A 53 -25.514 -4.718 -2.575 1.00 0.00 C ATOM 147 NH1 ARG A 53 -25.823 -5.990 -2.517 1.00 0.00 N ATOM 148 NH2 ARG A 53 -26.037 -3.973 -3.510 1.00 0.00 N ATOM 0 H ARG A 53 -20.395 -7.571 1.678 1.00 0.00 H new ATOM 0 HA ARG A 53 -23.072 -6.375 1.313 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -21.397 -5.053 -0.170 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -21.012 -6.563 -0.969 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -22.737 -5.400 -2.281 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -23.445 -6.842 -1.580 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -24.817 -5.624 -0.125 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -23.613 -4.378 0.139 1.00 0.00 H new ATOM 0 HE ARG A 53 -24.462 -3.189 -1.773 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -25.419 -6.580 -1.790 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -26.467 -6.390 -3.199 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -25.803 -2.982 -3.563 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -26.680 -4.382 -4.188 1.00 0.00 H new ATOM 162 N GLN A 54 -21.588 -9.006 0.009 1.00 0.00 N ATOM 163 CA GLN A 54 -21.877 -10.420 -0.368 1.00 0.00 C ATOM 164 C GLN A 54 -20.906 -11.384 0.341 1.00 0.00 C ATOM 165 O GLN A 54 -20.790 -12.538 -0.021 1.00 0.00 O ATOM 166 CB GLN A 54 -21.748 -10.440 -1.916 1.00 0.00 C ATOM 167 CG GLN A 54 -20.436 -11.087 -2.410 1.00 0.00 C ATOM 168 CD GLN A 54 -19.216 -10.384 -1.803 1.00 0.00 C ATOM 169 OE1 GLN A 54 -19.341 -9.595 -0.891 1.00 0.00 O ATOM 170 NE2 GLN A 54 -18.028 -10.647 -2.274 1.00 0.00 N ATOM 0 H GLN A 54 -20.622 -8.708 -0.128 1.00 0.00 H new ATOM 0 HA GLN A 54 -22.866 -10.758 -0.059 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -22.594 -10.983 -2.337 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -21.806 -9.418 -2.292 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -20.423 -12.143 -2.141 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -20.387 -11.034 -3.498 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -17.919 -11.310 -3.041 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -17.208 -10.189 -1.875 1.00 0.00 H new ATOM 179 N ARG A 55 -20.223 -10.923 1.354 1.00 0.00 N ATOM 180 CA ARG A 55 -19.278 -11.814 2.086 1.00 0.00 C ATOM 181 C ARG A 55 -18.310 -12.490 1.113 1.00 0.00 C ATOM 182 O ARG A 55 -18.209 -12.117 -0.038 1.00 0.00 O ATOM 183 CB ARG A 55 -20.169 -12.860 2.759 1.00 0.00 C ATOM 184 CG ARG A 55 -20.854 -12.241 3.978 1.00 0.00 C ATOM 185 CD ARG A 55 -20.865 -13.253 5.126 1.00 0.00 C ATOM 186 NE ARG A 55 -22.054 -12.882 5.949 1.00 0.00 N ATOM 187 CZ ARG A 55 -22.237 -13.403 7.141 1.00 0.00 C ATOM 188 NH1 ARG A 55 -21.383 -14.261 7.642 1.00 0.00 N ATOM 189 NH2 ARG A 55 -23.286 -13.061 7.838 1.00 0.00 N ATOM 0 H ARG A 55 -20.279 -9.967 1.706 1.00 0.00 H new ATOM 0 HA ARG A 55 -18.669 -11.263 2.803 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -20.917 -13.223 2.054 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -19.572 -13.720 3.062 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -20.329 -11.335 4.282 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -21.874 -11.949 3.726 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -20.945 -14.274 4.753 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -19.947 -13.198 5.710 1.00 0.00 H new ATOM 0 HE ARG A 55 -22.733 -12.216 5.581 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -20.560 -14.534 7.105 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -21.541 -14.656 8.569 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -23.956 -12.394 7.456 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -23.435 -13.461 8.764 1.00 0.00 H new ATOM 203 N CYS A 56 -17.597 -13.484 1.569 1.00 0.00 N ATOM 204 CA CYS A 56 -16.637 -14.185 0.671 1.00 0.00 C ATOM 205 C CYS A 56 -17.155 -15.581 0.325 1.00 0.00 C ATOM 206 O CYS A 56 -16.360 -16.507 0.340 1.00 0.00 O ATOM 207 CB CYS A 56 -15.343 -14.284 1.481 1.00 0.00 C ATOM 208 SG CYS A 56 -13.924 -14.055 0.381 1.00 0.00 S ATOM 209 OXT CYS A 56 -18.340 -15.703 0.061 1.00 0.00 O ATOM 0 H CYS A 56 -17.638 -13.840 2.524 1.00 0.00 H new ATOM 0 HA CYS A 56 -16.494 -13.657 -0.272 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -15.334 -13.528 2.266 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -15.283 -15.255 1.973 1.00 0.00 H new ATOM 0 HG CYS A 56 -12.824 -14.137 1.069 1.00 0.00 H new TER 215 CYS A 56 ATOM 216 N GLY B 715 20.451 13.552 -19.047 1.00 0.00 N ATOM 217 CA GLY B 715 19.654 12.293 -19.033 1.00 0.00 C ATOM 218 C GLY B 715 19.285 11.939 -17.591 1.00 0.00 C ATOM 219 O GLY B 715 20.037 11.293 -16.888 1.00 0.00 O ATOM 0 HA2 GLY B 715 18.751 12.415 -19.631 1.00 0.00 H new ATOM 0 HA3 GLY B 715 20.227 11.482 -19.483 1.00 0.00 H new ATOM 225 N SER B 716 18.132 12.357 -17.145 1.00 0.00 N ATOM 226 CA SER B 716 17.715 12.047 -15.749 1.00 0.00 C ATOM 227 C SER B 716 17.107 10.644 -15.672 1.00 0.00 C ATOM 228 O SER B 716 15.963 10.433 -16.020 1.00 0.00 O ATOM 229 CB SER B 716 16.659 13.103 -15.413 1.00 0.00 C ATOM 230 OG SER B 716 15.842 13.334 -16.552 1.00 0.00 O ATOM 0 H SER B 716 17.461 12.900 -17.688 1.00 0.00 H new ATOM 0 HA SER B 716 18.555 12.066 -15.054 1.00 0.00 H new ATOM 0 HB2 SER B 716 16.047 12.768 -14.575 1.00 0.00 H new ATOM 0 HB3 SER B 716 17.142 14.030 -15.104 1.00 0.00 H new ATOM 0 HG SER B 716 15.524 12.477 -16.906 1.00 0.00 H new ATOM 236 N HIS B 717 17.864 9.683 -15.216 1.00 0.00 N ATOM 237 CA HIS B 717 17.328 8.296 -15.117 1.00 0.00 C ATOM 238 C HIS B 717 16.702 8.063 -13.740 1.00 0.00 C ATOM 239 O HIS B 717 16.941 8.803 -12.806 1.00 0.00 O ATOM 240 CB HIS B 717 18.547 7.390 -15.307 1.00 0.00 C ATOM 241 CG HIS B 717 18.876 7.292 -16.772 1.00 0.00 C ATOM 242 ND1 HIS B 717 20.181 7.206 -17.232 1.00 0.00 N ATOM 243 CD2 HIS B 717 18.081 7.263 -17.890 1.00 0.00 C ATOM 244 CE1 HIS B 717 20.132 7.131 -18.575 1.00 0.00 C ATOM 245 NE2 HIS B 717 18.875 7.162 -19.028 1.00 0.00 N ATOM 0 H HIS B 717 18.830 9.799 -14.908 1.00 0.00 H new ATOM 0 HA HIS B 717 16.550 8.102 -15.855 1.00 0.00 H new ATOM 0 HB2 HIS B 717 19.400 7.790 -14.758 1.00 0.00 H new ATOM 0 HB3 HIS B 717 18.343 6.399 -14.902 1.00 0.00 H new ATOM 0 HD2 HIS B 717 17.002 7.311 -17.887 1.00 0.00 H new ATOM 0 HE1 HIS B 717 21.003 7.055 -19.209 1.00 0.00 H new ATOM 0 HE2 HIS B 717 18.565 7.121 -19.999 1.00 0.00 H new ATOM 253 N MET B 718 15.904 7.040 -13.606 1.00 0.00 N ATOM 254 CA MET B 718 15.264 6.762 -12.290 1.00 0.00 C ATOM 255 C MET B 718 15.574 5.334 -11.836 1.00 0.00 C ATOM 256 O MET B 718 14.685 4.548 -11.577 1.00 0.00 O ATOM 257 CB MET B 718 13.764 6.927 -12.541 1.00 0.00 C ATOM 258 CG MET B 718 13.162 7.827 -11.459 1.00 0.00 C ATOM 259 SD MET B 718 13.521 9.558 -11.844 1.00 0.00 S ATOM 260 CE MET B 718 12.346 10.297 -10.682 1.00 0.00 C ATOM 0 H MET B 718 15.668 6.385 -14.351 1.00 0.00 H new ATOM 0 HA MET B 718 15.627 7.428 -11.507 1.00 0.00 H new ATOM 0 HB2 MET B 718 13.595 7.362 -13.526 1.00 0.00 H new ATOM 0 HB3 MET B 718 13.274 5.953 -12.534 1.00 0.00 H new ATOM 0 HG2 MET B 718 12.085 7.672 -11.401 1.00 0.00 H new ATOM 0 HG3 MET B 718 13.575 7.567 -10.484 1.00 0.00 H new ATOM 0 HE1 MET B 718 12.399 11.383 -10.752 1.00 0.00 H new ATOM 0 HE2 MET B 718 11.336 9.967 -10.926 1.00 0.00 H new ATOM 0 HE3 MET B 718 12.594 9.986 -9.667 1.00 0.00 H new ATOM 270 N SER B 719 16.830 4.993 -11.735 1.00 0.00 N ATOM 271 CA SER B 719 17.194 3.617 -11.293 1.00 0.00 C ATOM 272 C SER B 719 16.929 3.454 -9.795 1.00 0.00 C ATOM 273 O SER B 719 16.934 4.411 -9.048 1.00 0.00 O ATOM 274 CB SER B 719 18.691 3.495 -11.585 1.00 0.00 C ATOM 275 OG SER B 719 19.430 4.104 -10.537 1.00 0.00 O ATOM 0 H SER B 719 17.619 5.607 -11.939 1.00 0.00 H new ATOM 0 HA SER B 719 16.611 2.851 -11.804 1.00 0.00 H new ATOM 0 HB2 SER B 719 18.970 2.445 -11.678 1.00 0.00 H new ATOM 0 HB3 SER B 719 18.927 3.973 -12.536 1.00 0.00 H new ATOM 0 HG SER B 719 20.389 4.024 -10.724 1.00 0.00 H new ATOM 281 N LYS B 720 16.697 2.250 -9.350 1.00 0.00 N ATOM 282 CA LYS B 720 16.432 2.033 -7.901 1.00 0.00 C ATOM 283 C LYS B 720 16.505 0.543 -7.561 1.00 0.00 C ATOM 284 O LYS B 720 15.737 0.041 -6.764 1.00 0.00 O ATOM 285 CB LYS B 720 15.014 2.561 -7.678 1.00 0.00 C ATOM 286 CG LYS B 720 14.915 3.184 -6.284 1.00 0.00 C ATOM 287 CD LYS B 720 14.152 4.506 -6.367 1.00 0.00 C ATOM 288 CE LYS B 720 12.704 4.234 -6.779 1.00 0.00 C ATOM 289 NZ LYS B 720 12.433 5.200 -7.880 1.00 0.00 N ATOM 0 H LYS B 720 16.680 1.409 -9.926 1.00 0.00 H new ATOM 0 HA LYS B 720 17.164 2.537 -7.270 1.00 0.00 H new ATOM 0 HB2 LYS B 720 14.767 3.302 -8.438 1.00 0.00 H new ATOM 0 HB3 LYS B 720 14.293 1.750 -7.778 1.00 0.00 H new ATOM 0 HG2 LYS B 720 14.406 2.501 -5.604 1.00 0.00 H new ATOM 0 HG3 LYS B 720 15.912 3.353 -5.878 1.00 0.00 H new ATOM 0 HD2 LYS B 720 14.178 5.014 -5.403 1.00 0.00 H new ATOM 0 HD3 LYS B 720 14.629 5.169 -7.089 1.00 0.00 H new ATOM 0 HE2 LYS B 720 12.575 3.205 -7.115 1.00 0.00 H new ATOM 0 HE3 LYS B 720 12.020 4.385 -5.944 1.00 0.00 H new ATOM 0 HZ1 LYS B 720 11.457 5.076 -8.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 720 12.557 6.171 -7.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 720 13.095 5.028 -8.663 1.00 0.00 H new ATOM 303 N GLU B 721 17.422 -0.169 -8.157 1.00 0.00 N ATOM 304 CA GLU B 721 17.543 -1.623 -7.860 1.00 0.00 C ATOM 305 C GLU B 721 18.127 -1.828 -6.454 1.00 0.00 C ATOM 306 O GLU B 721 19.129 -1.231 -6.117 1.00 0.00 O ATOM 307 CB GLU B 721 18.512 -2.158 -8.917 1.00 0.00 C ATOM 308 CG GLU B 721 17.726 -2.604 -10.151 1.00 0.00 C ATOM 309 CD GLU B 721 18.700 -2.916 -11.290 1.00 0.00 C ATOM 310 OE1 GLU B 721 19.347 -3.947 -11.224 1.00 0.00 O ATOM 311 OE2 GLU B 721 18.781 -2.117 -12.209 1.00 0.00 O ATOM 0 H GLU B 721 18.092 0.193 -8.836 1.00 0.00 H new ATOM 0 HA GLU B 721 16.580 -2.133 -7.886 1.00 0.00 H new ATOM 0 HB2 GLU B 721 19.231 -1.386 -9.190 1.00 0.00 H new ATOM 0 HB3 GLU B 721 19.081 -2.995 -8.513 1.00 0.00 H new ATOM 0 HG2 GLU B 721 17.129 -3.486 -9.916 1.00 0.00 H new ATOM 0 HG3 GLU B 721 17.032 -1.821 -10.456 1.00 0.00 H new ATOM 318 N PRO B 722 17.489 -2.669 -5.672 1.00 0.00 N ATOM 319 CA PRO B 722 17.972 -2.927 -4.297 1.00 0.00 C ATOM 320 C PRO B 722 19.167 -3.889 -4.310 1.00 0.00 C ATOM 321 O PRO B 722 19.860 -4.037 -3.323 1.00 0.00 O ATOM 322 CB PRO B 722 16.771 -3.570 -3.610 1.00 0.00 C ATOM 323 CG PRO B 722 15.966 -4.187 -4.710 1.00 0.00 C ATOM 324 CD PRO B 722 16.270 -3.431 -5.980 1.00 0.00 C ATOM 0 HA PRO B 722 18.318 -2.024 -3.794 1.00 0.00 H new ATOM 0 HB2 PRO B 722 17.088 -4.321 -2.887 1.00 0.00 H new ATOM 0 HB3 PRO B 722 16.187 -2.829 -3.064 1.00 0.00 H new ATOM 0 HG2 PRO B 722 16.218 -5.242 -4.823 1.00 0.00 H new ATOM 0 HG3 PRO B 722 14.902 -4.136 -4.480 1.00 0.00 H new ATOM 0 HD2 PRO B 722 16.427 -4.110 -6.818 1.00 0.00 H new ATOM 0 HD3 PRO B 722 15.448 -2.770 -6.255 1.00 0.00 H new ATOM 332 N ARG B 723 19.413 -4.542 -5.418 1.00 0.00 N ATOM 333 CA ARG B 723 20.569 -5.485 -5.502 1.00 0.00 C ATOM 334 C ARG B 723 20.494 -6.547 -4.396 1.00 0.00 C ATOM 335 O ARG B 723 19.974 -7.626 -4.600 1.00 0.00 O ATOM 336 CB ARG B 723 21.811 -4.603 -5.335 1.00 0.00 C ATOM 337 CG ARG B 723 21.913 -3.640 -6.514 1.00 0.00 C ATOM 338 CD ARG B 723 21.627 -2.215 -6.033 1.00 0.00 C ATOM 339 NE ARG B 723 22.926 -1.730 -5.481 1.00 0.00 N ATOM 340 CZ ARG B 723 23.926 -1.424 -6.276 1.00 0.00 C ATOM 341 NH1 ARG B 723 23.813 -1.537 -7.577 1.00 0.00 N ATOM 342 NH2 ARG B 723 25.049 -1.002 -5.764 1.00 0.00 N ATOM 0 H ARG B 723 18.860 -4.462 -6.271 1.00 0.00 H new ATOM 0 HA ARG B 723 20.582 -6.033 -6.444 1.00 0.00 H new ATOM 0 HB2 ARG B 723 21.751 -4.045 -4.400 1.00 0.00 H new ATOM 0 HB3 ARG B 723 22.706 -5.223 -5.280 1.00 0.00 H new ATOM 0 HG2 ARG B 723 22.908 -3.693 -6.956 1.00 0.00 H new ATOM 0 HG3 ARG B 723 21.203 -3.923 -7.291 1.00 0.00 H new ATOM 0 HD2 ARG B 723 21.285 -1.582 -6.852 1.00 0.00 H new ATOM 0 HD3 ARG B 723 20.846 -2.203 -5.273 1.00 0.00 H new ATOM 0 HE ARG B 723 23.039 -1.635 -4.472 1.00 0.00 H new ATOM 0 HH11 ARG B 723 22.939 -1.867 -7.986 1.00 0.00 H new ATOM 0 HH12 ARG B 723 24.599 -1.295 -8.180 1.00 0.00 H new ATOM 0 HH21 ARG B 723 25.146 -0.912 -4.753 1.00 0.00 H new ATOM 0 HH22 ARG B 723 25.830 -0.763 -6.375 1.00 0.00 H new ATOM 356 N ASP B 724 21.026 -6.266 -3.234 1.00 0.00 N ATOM 357 CA ASP B 724 20.989 -7.272 -2.135 1.00 0.00 C ATOM 358 C ASP B 724 19.538 -7.567 -1.725 1.00 0.00 C ATOM 359 O ASP B 724 18.832 -6.675 -1.298 1.00 0.00 O ATOM 360 CB ASP B 724 21.742 -6.612 -0.979 1.00 0.00 C ATOM 361 CG ASP B 724 23.238 -6.581 -1.296 1.00 0.00 C ATOM 362 OD1 ASP B 724 23.740 -7.579 -1.785 1.00 0.00 O ATOM 363 OD2 ASP B 724 23.856 -5.560 -1.043 1.00 0.00 O ATOM 0 H ASP B 724 21.483 -5.385 -3.001 1.00 0.00 H new ATOM 0 HA ASP B 724 21.433 -8.222 -2.431 1.00 0.00 H new ATOM 0 HB2 ASP B 724 21.372 -5.599 -0.821 1.00 0.00 H new ATOM 0 HB3 ASP B 724 21.567 -7.163 -0.055 1.00 0.00 H new ATOM 368 N PRO B 725 19.134 -8.811 -1.855 1.00 0.00 N ATOM 369 CA PRO B 725 17.750 -9.191 -1.483 1.00 0.00 C ATOM 370 C PRO B 725 17.571 -9.146 0.036 1.00 0.00 C ATOM 371 O PRO B 725 16.526 -8.782 0.538 1.00 0.00 O ATOM 372 CB PRO B 725 17.614 -10.625 -1.996 1.00 0.00 C ATOM 373 CG PRO B 725 19.013 -11.141 -2.106 1.00 0.00 C ATOM 374 CD PRO B 725 19.907 -9.957 -2.358 1.00 0.00 C ATOM 0 HA PRO B 725 17.001 -8.519 -1.902 1.00 0.00 H new ATOM 0 HB2 PRO B 725 17.024 -11.233 -1.311 1.00 0.00 H new ATOM 0 HB3 PRO B 725 17.109 -10.651 -2.961 1.00 0.00 H new ATOM 0 HG2 PRO B 725 19.306 -11.656 -1.191 1.00 0.00 H new ATOM 0 HG3 PRO B 725 19.094 -11.863 -2.918 1.00 0.00 H new ATOM 0 HD2 PRO B 725 20.858 -10.057 -1.835 1.00 0.00 H new ATOM 0 HD3 PRO B 725 20.136 -9.849 -3.418 1.00 0.00 H new ATOM 382 N ASP B 726 18.583 -9.514 0.773 1.00 0.00 N ATOM 383 CA ASP B 726 18.471 -9.491 2.259 1.00 0.00 C ATOM 384 C ASP B 726 18.436 -8.048 2.767 1.00 0.00 C ATOM 385 O ASP B 726 17.818 -7.747 3.769 1.00 0.00 O ATOM 386 CB ASP B 726 19.730 -10.201 2.758 1.00 0.00 C ATOM 387 CG ASP B 726 19.683 -11.674 2.345 1.00 0.00 C ATOM 388 OD1 ASP B 726 18.974 -11.981 1.401 1.00 0.00 O ATOM 389 OD2 ASP B 726 20.357 -12.469 2.978 1.00 0.00 O ATOM 0 H ASP B 726 19.483 -9.830 0.410 1.00 0.00 H new ATOM 0 HA ASP B 726 17.559 -9.973 2.612 1.00 0.00 H new ATOM 0 HB2 ASP B 726 20.618 -9.724 2.343 1.00 0.00 H new ATOM 0 HB3 ASP B 726 19.801 -10.118 3.843 1.00 0.00 H new ATOM 394 N GLN B 727 19.093 -7.153 2.081 1.00 0.00 N ATOM 395 CA GLN B 727 19.095 -5.730 2.522 1.00 0.00 C ATOM 396 C GLN B 727 17.672 -5.169 2.515 1.00 0.00 C ATOM 397 O GLN B 727 17.250 -4.509 3.443 1.00 0.00 O ATOM 398 CB GLN B 727 19.959 -5.004 1.491 1.00 0.00 C ATOM 399 CG GLN B 727 20.275 -3.593 1.991 1.00 0.00 C ATOM 400 CD GLN B 727 21.031 -3.680 3.319 1.00 0.00 C ATOM 401 OE1 GLN B 727 20.481 -3.393 4.364 1.00 0.00 O ATOM 402 NE2 GLN B 727 22.277 -4.067 3.323 1.00 0.00 N ATOM 0 H GLN B 727 19.628 -7.346 1.234 1.00 0.00 H new ATOM 0 HA GLN B 727 19.476 -5.612 3.536 1.00 0.00 H new ATOM 0 HB2 GLN B 727 20.883 -5.557 1.322 1.00 0.00 H new ATOM 0 HB3 GLN B 727 19.438 -4.954 0.535 1.00 0.00 H new ATOM 0 HG2 GLN B 727 20.875 -3.060 1.253 1.00 0.00 H new ATOM 0 HG3 GLN B 727 19.353 -3.027 2.122 1.00 0.00 H new ATOM 0 HE21 GLN B 727 22.739 -4.308 2.446 1.00 0.00 H new ATOM 0 HE22 GLN B 727 22.789 -4.129 4.203 1.00 0.00 H new ATOM 411 N LEU B 728 16.929 -5.430 1.475 1.00 0.00 N ATOM 412 CA LEU B 728 15.533 -4.913 1.407 1.00 0.00 C ATOM 413 C LEU B 728 14.611 -5.751 2.293 1.00 0.00 C ATOM 414 O LEU B 728 13.653 -5.254 2.847 1.00 0.00 O ATOM 415 CB LEU B 728 15.125 -5.072 -0.062 1.00 0.00 C ATOM 416 CG LEU B 728 15.296 -3.746 -0.815 1.00 0.00 C ATOM 417 CD1 LEU B 728 14.283 -2.725 -0.296 1.00 0.00 C ATOM 418 CD2 LEU B 728 16.717 -3.208 -0.617 1.00 0.00 C ATOM 0 H LEU B 728 17.228 -5.979 0.669 1.00 0.00 H new ATOM 0 HA LEU B 728 15.463 -3.881 1.751 1.00 0.00 H new ATOM 0 HB2 LEU B 728 15.733 -5.845 -0.532 1.00 0.00 H new ATOM 0 HB3 LEU B 728 14.088 -5.401 -0.124 1.00 0.00 H new ATOM 0 HG LEU B 728 15.126 -3.917 -1.878 1.00 0.00 H new ATOM 0 HD11 LEU B 728 14.407 -1.784 -0.833 1.00 0.00 H new ATOM 0 HD12 LEU B 728 13.273 -3.102 -0.454 1.00 0.00 H new ATOM 0 HD13 LEU B 728 14.446 -2.559 0.769 1.00 0.00 H new ATOM 0 HD21 LEU B 728 16.828 -2.267 -1.155 1.00 0.00 H new ATOM 0 HD22 LEU B 728 16.899 -3.042 0.445 1.00 0.00 H new ATOM 0 HD23 LEU B 728 17.437 -3.932 -0.999 1.00 0.00 H new ATOM 430 N TYR B 729 14.891 -7.024 2.420 1.00 0.00 N ATOM 431 CA TYR B 729 14.021 -7.921 3.240 1.00 0.00 C ATOM 432 C TYR B 729 13.653 -7.263 4.571 1.00 0.00 C ATOM 433 O TYR B 729 12.497 -7.023 4.858 1.00 0.00 O ATOM 434 CB TYR B 729 14.871 -9.173 3.480 1.00 0.00 C ATOM 435 CG TYR B 729 14.127 -10.130 4.384 1.00 0.00 C ATOM 436 CD1 TYR B 729 12.766 -10.383 4.170 1.00 0.00 C ATOM 437 CD2 TYR B 729 14.799 -10.761 5.438 1.00 0.00 C ATOM 438 CE1 TYR B 729 12.078 -11.267 5.009 1.00 0.00 C ATOM 439 CE2 TYR B 729 14.110 -11.645 6.277 1.00 0.00 C ATOM 440 CZ TYR B 729 12.750 -11.898 6.063 1.00 0.00 C ATOM 441 OH TYR B 729 12.071 -12.770 6.890 1.00 0.00 O ATOM 0 H TYR B 729 15.692 -7.484 1.987 1.00 0.00 H new ATOM 0 HA TYR B 729 13.080 -8.145 2.738 1.00 0.00 H new ATOM 0 HB2 TYR B 729 15.098 -9.657 2.530 1.00 0.00 H new ATOM 0 HB3 TYR B 729 15.823 -8.896 3.933 1.00 0.00 H new ATOM 0 HD1 TYR B 729 12.248 -9.896 3.357 1.00 0.00 H new ATOM 0 HD2 TYR B 729 15.848 -10.566 5.604 1.00 0.00 H new ATOM 0 HE1 TYR B 729 11.029 -11.462 4.843 1.00 0.00 H new ATOM 0 HE2 TYR B 729 14.628 -12.132 7.090 1.00 0.00 H new ATOM 0 HH TYR B 729 12.684 -13.122 7.569 1.00 0.00 H new ATOM 451 N SER B 730 14.626 -6.951 5.376 1.00 0.00 N ATOM 452 CA SER B 730 14.324 -6.297 6.673 1.00 0.00 C ATOM 453 C SER B 730 13.903 -4.847 6.447 1.00 0.00 C ATOM 454 O SER B 730 13.252 -4.246 7.279 1.00 0.00 O ATOM 455 CB SER B 730 15.627 -6.365 7.461 1.00 0.00 C ATOM 456 OG SER B 730 15.651 -5.328 8.431 1.00 0.00 O ATOM 0 H SER B 730 15.615 -7.120 5.192 1.00 0.00 H new ATOM 0 HA SER B 730 13.504 -6.783 7.202 1.00 0.00 H new ATOM 0 HB2 SER B 730 15.719 -7.335 7.949 1.00 0.00 H new ATOM 0 HB3 SER B 730 16.477 -6.266 6.786 1.00 0.00 H new ATOM 0 HG SER B 730 16.488 -5.374 8.938 1.00 0.00 H new ATOM 462 N THR B 731 14.256 -4.277 5.324 1.00 0.00 N ATOM 463 CA THR B 731 13.830 -2.878 5.055 1.00 0.00 C ATOM 464 C THR B 731 12.319 -2.841 4.871 1.00 0.00 C ATOM 465 O THR B 731 11.612 -2.167 5.593 1.00 0.00 O ATOM 466 CB THR B 731 14.522 -2.463 3.762 1.00 0.00 C ATOM 467 OG1 THR B 731 15.930 -2.524 3.931 1.00 0.00 O ATOM 468 CG2 THR B 731 14.104 -1.029 3.430 1.00 0.00 C ATOM 0 H THR B 731 14.814 -4.716 4.592 1.00 0.00 H new ATOM 0 HA THR B 731 14.092 -2.208 5.874 1.00 0.00 H new ATOM 0 HB THR B 731 14.236 -3.134 2.952 1.00 0.00 H new ATOM 0 HG1 THR B 731 16.223 -3.458 3.897 1.00 0.00 H new ATOM 0 HG21 THR B 731 14.589 -0.713 2.507 1.00 0.00 H new ATOM 0 HG22 THR B 731 13.022 -0.985 3.305 1.00 0.00 H new ATOM 0 HG23 THR B 731 14.402 -0.366 4.242 1.00 0.00 H new ATOM 476 N LEU B 732 11.810 -3.581 3.920 1.00 0.00 N ATOM 477 CA LEU B 732 10.330 -3.630 3.748 1.00 0.00 C ATOM 478 C LEU B 732 9.726 -4.108 5.062 1.00 0.00 C ATOM 479 O LEU B 732 8.665 -3.677 5.470 1.00 0.00 O ATOM 480 CB LEU B 732 10.054 -4.634 2.613 1.00 0.00 C ATOM 481 CG LEU B 732 11.015 -4.435 1.418 1.00 0.00 C ATOM 482 CD1 LEU B 732 10.359 -4.986 0.155 1.00 0.00 C ATOM 483 CD2 LEU B 732 11.348 -2.952 1.198 1.00 0.00 C ATOM 0 H LEU B 732 12.348 -4.146 3.263 1.00 0.00 H new ATOM 0 HA LEU B 732 9.897 -2.662 3.498 1.00 0.00 H new ATOM 0 HB2 LEU B 732 10.156 -5.650 2.995 1.00 0.00 H new ATOM 0 HB3 LEU B 732 9.024 -4.523 2.273 1.00 0.00 H new ATOM 0 HG LEU B 732 11.942 -4.964 1.638 1.00 0.00 H new ATOM 0 HD11 LEU B 732 11.030 -4.850 -0.693 1.00 0.00 H new ATOM 0 HD12 LEU B 732 10.152 -6.048 0.286 1.00 0.00 H new ATOM 0 HD13 LEU B 732 9.426 -4.454 -0.032 1.00 0.00 H new ATOM 0 HD21 LEU B 732 12.026 -2.853 0.350 1.00 0.00 H new ATOM 0 HD22 LEU B 732 10.431 -2.399 0.996 1.00 0.00 H new ATOM 0 HD23 LEU B 732 11.825 -2.550 2.092 1.00 0.00 H new ATOM 495 N LYS B 733 10.449 -4.935 5.769 1.00 0.00 N ATOM 496 CA LYS B 733 9.992 -5.352 7.114 1.00 0.00 C ATOM 497 C LYS B 733 9.920 -4.109 7.994 1.00 0.00 C ATOM 498 O LYS B 733 8.970 -3.895 8.715 1.00 0.00 O ATOM 499 CB LYS B 733 11.076 -6.303 7.629 1.00 0.00 C ATOM 500 CG LYS B 733 10.458 -7.286 8.624 1.00 0.00 C ATOM 501 CD LYS B 733 10.657 -8.716 8.119 1.00 0.00 C ATOM 502 CE LYS B 733 9.448 -9.566 8.515 1.00 0.00 C ATOM 503 NZ LYS B 733 9.680 -10.887 7.865 1.00 0.00 N ATOM 0 H LYS B 733 11.337 -5.337 5.467 1.00 0.00 H new ATOM 0 HA LYS B 733 9.014 -5.832 7.109 1.00 0.00 H new ATOM 0 HB2 LYS B 733 11.525 -6.845 6.797 1.00 0.00 H new ATOM 0 HB3 LYS B 733 11.874 -5.737 8.109 1.00 0.00 H new ATOM 0 HG2 LYS B 733 10.921 -7.167 9.604 1.00 0.00 H new ATOM 0 HG3 LYS B 733 9.395 -7.077 8.746 1.00 0.00 H new ATOM 0 HD2 LYS B 733 10.778 -8.718 7.036 1.00 0.00 H new ATOM 0 HD3 LYS B 733 11.568 -9.140 8.542 1.00 0.00 H new ATOM 0 HE2 LYS B 733 9.373 -9.666 9.598 1.00 0.00 H new ATOM 0 HE3 LYS B 733 8.518 -9.114 8.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 8.882 -11.109 7.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 10.559 -10.851 7.310 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 9.761 -11.624 8.595 1.00 0.00 H new ATOM 517 N SER B 734 10.912 -3.265 7.897 1.00 0.00 N ATOM 518 CA SER B 734 10.902 -2.007 8.687 1.00 0.00 C ATOM 519 C SER B 734 9.671 -1.185 8.319 1.00 0.00 C ATOM 520 O SER B 734 8.780 -1.001 9.122 1.00 0.00 O ATOM 521 CB SER B 734 12.181 -1.273 8.281 1.00 0.00 C ATOM 522 OG SER B 734 12.875 -0.850 9.445 1.00 0.00 O ATOM 0 H SER B 734 11.730 -3.396 7.302 1.00 0.00 H new ATOM 0 HA SER B 734 10.865 -2.185 9.762 1.00 0.00 H new ATOM 0 HB2 SER B 734 12.815 -1.929 7.685 1.00 0.00 H new ATOM 0 HB3 SER B 734 11.937 -0.413 7.658 1.00 0.00 H new ATOM 0 HG SER B 734 13.695 -0.381 9.185 1.00 0.00 H new ATOM 528 N ILE B 735 9.580 -0.735 7.093 1.00 0.00 N ATOM 529 CA ILE B 735 8.391 0.058 6.689 1.00 0.00 C ATOM 530 C ILE B 735 7.100 -0.680 7.070 1.00 0.00 C ATOM 531 O ILE B 735 6.444 -0.343 8.030 1.00 0.00 O ATOM 532 CB ILE B 735 8.487 0.210 5.166 1.00 0.00 C ATOM 533 CG1 ILE B 735 9.729 1.026 4.797 1.00 0.00 C ATOM 534 CG2 ILE B 735 7.239 0.938 4.655 1.00 0.00 C ATOM 535 CD1 ILE B 735 10.379 0.417 3.555 1.00 0.00 C ATOM 0 H ILE B 735 10.276 -0.884 6.362 1.00 0.00 H new ATOM 0 HA ILE B 735 8.368 1.026 7.189 1.00 0.00 H new ATOM 0 HB ILE B 735 8.559 -0.778 4.711 1.00 0.00 H new ATOM 0 HG12 ILE B 735 9.454 2.063 4.607 1.00 0.00 H new ATOM 0 HG13 ILE B 735 10.436 1.031 5.627 1.00 0.00 H new ATOM 0 HG21 ILE B 735 7.301 1.050 3.572 1.00 0.00 H new ATOM 0 HG22 ILE B 735 6.351 0.360 4.910 1.00 0.00 H new ATOM 0 HG23 ILE B 735 7.177 1.923 5.118 1.00 0.00 H new ATOM 0 HD11 ILE B 735 11.264 0.994 3.288 1.00 0.00 H new ATOM 0 HD12 ILE B 735 10.667 -0.613 3.763 1.00 0.00 H new ATOM 0 HD13 ILE B 735 9.670 0.435 2.727 1.00 0.00 H new ATOM 547 N LEU B 736 6.759 -1.704 6.334 1.00 0.00 N ATOM 548 CA LEU B 736 5.500 -2.470 6.600 1.00 0.00 C ATOM 549 C LEU B 736 5.265 -2.690 8.099 1.00 0.00 C ATOM 550 O LEU B 736 4.141 -2.721 8.557 1.00 0.00 O ATOM 551 CB LEU B 736 5.718 -3.809 5.898 1.00 0.00 C ATOM 552 CG LEU B 736 4.375 -4.493 5.610 1.00 0.00 C ATOM 553 CD1 LEU B 736 3.688 -4.854 6.927 1.00 0.00 C ATOM 554 CD2 LEU B 736 3.471 -3.555 4.806 1.00 0.00 C ATOM 0 H LEU B 736 7.307 -2.050 5.546 1.00 0.00 H new ATOM 0 HA LEU B 736 4.623 -1.933 6.240 1.00 0.00 H new ATOM 0 HB2 LEU B 736 6.260 -3.653 4.965 1.00 0.00 H new ATOM 0 HB3 LEU B 736 6.336 -4.456 6.521 1.00 0.00 H new ATOM 0 HG LEU B 736 4.557 -5.399 5.032 1.00 0.00 H new ATOM 0 HD11 LEU B 736 2.735 -5.340 6.719 1.00 0.00 H new ATOM 0 HD12 LEU B 736 4.324 -5.532 7.495 1.00 0.00 H new ATOM 0 HD13 LEU B 736 3.515 -3.948 7.507 1.00 0.00 H new ATOM 0 HD21 LEU B 736 2.520 -4.049 4.606 1.00 0.00 H new ATOM 0 HD22 LEU B 736 3.294 -2.643 5.376 1.00 0.00 H new ATOM 0 HD23 LEU B 736 3.955 -3.304 3.862 1.00 0.00 H new ATOM 566 N GLN B 737 6.305 -2.851 8.870 1.00 0.00 N ATOM 567 CA GLN B 737 6.103 -3.030 10.332 1.00 0.00 C ATOM 568 C GLN B 737 5.480 -1.757 10.909 1.00 0.00 C ATOM 569 O GLN B 737 4.347 -1.756 11.347 1.00 0.00 O ATOM 570 CB GLN B 737 7.502 -3.272 10.905 1.00 0.00 C ATOM 571 CG GLN B 737 7.441 -3.297 12.431 1.00 0.00 C ATOM 572 CD GLN B 737 6.538 -4.443 12.890 1.00 0.00 C ATOM 573 OE1 GLN B 737 5.242 -4.291 12.858 1.00 0.00 O flip ATOM 574 NE2 GLN B 737 7.016 -5.488 13.285 1.00 0.00 N flip ATOM 0 H GLN B 737 7.275 -2.866 8.554 1.00 0.00 H new ATOM 0 HA GLN B 737 5.435 -3.856 10.573 1.00 0.00 H new ATOM 0 HB2 GLN B 737 7.899 -4.216 10.533 1.00 0.00 H new ATOM 0 HB3 GLN B 737 8.182 -2.487 10.572 1.00 0.00 H new ATOM 0 HG2 GLN B 737 8.442 -3.422 12.843 1.00 0.00 H new ATOM 0 HG3 GLN B 737 7.059 -2.347 12.805 1.00 0.00 H new ATOM 0 HE21 GLN B 737 8.029 -5.608 13.311 1.00 0.00 H new ATOM 0 HE22 GLN B 737 6.405 -6.245 13.591 1.00 0.00 H new ATOM 583 N GLN B 738 6.176 -0.654 10.835 1.00 0.00 N ATOM 584 CA GLN B 738 5.599 0.611 11.388 1.00 0.00 C ATOM 585 C GLN B 738 4.292 0.993 10.668 1.00 0.00 C ATOM 586 O GLN B 738 3.442 1.637 11.251 1.00 0.00 O ATOM 587 CB GLN B 738 6.657 1.731 11.257 1.00 0.00 C ATOM 588 CG GLN B 738 7.392 1.707 9.910 1.00 0.00 C ATOM 589 CD GLN B 738 6.615 2.501 8.860 1.00 0.00 C ATOM 590 OE1 GLN B 738 5.429 2.721 8.995 1.00 0.00 O ATOM 591 NE2 GLN B 738 7.243 2.922 7.796 1.00 0.00 N ATOM 0 H GLN B 738 7.105 -0.571 10.423 1.00 0.00 H new ATOM 0 HA GLN B 738 5.347 0.466 12.439 1.00 0.00 H new ATOM 0 HB2 GLN B 738 6.171 2.699 11.382 1.00 0.00 H new ATOM 0 HB3 GLN B 738 7.384 1.633 12.063 1.00 0.00 H new ATOM 0 HG2 GLN B 738 8.391 2.128 10.027 1.00 0.00 H new ATOM 0 HG3 GLN B 738 7.517 0.677 9.576 1.00 0.00 H new ATOM 0 HE21 GLN B 738 8.240 2.736 7.685 1.00 0.00 H new ATOM 0 HE22 GLN B 738 6.737 3.437 7.076 1.00 0.00 H new ATOM 600 N VAL B 739 4.102 0.615 9.420 1.00 0.00 N ATOM 601 CA VAL B 739 2.794 0.955 8.763 1.00 0.00 C ATOM 602 C VAL B 739 1.734 -0.066 9.199 1.00 0.00 C ATOM 603 O VAL B 739 0.591 0.272 9.432 1.00 0.00 O ATOM 604 CB VAL B 739 2.995 0.953 7.218 1.00 0.00 C ATOM 605 CG1 VAL B 739 4.336 1.587 6.838 1.00 0.00 C ATOM 606 CG2 VAL B 739 2.900 -0.454 6.638 1.00 0.00 C ATOM 0 H VAL B 739 4.771 0.103 8.845 1.00 0.00 H new ATOM 0 HA VAL B 739 2.451 1.945 9.063 1.00 0.00 H new ATOM 0 HB VAL B 739 2.189 1.550 6.791 1.00 0.00 H new ATOM 0 HG11 VAL B 739 4.451 1.573 5.754 1.00 0.00 H new ATOM 0 HG12 VAL B 739 4.365 2.617 7.193 1.00 0.00 H new ATOM 0 HG13 VAL B 739 5.148 1.023 7.296 1.00 0.00 H new ATOM 0 HG21 VAL B 739 3.046 -0.413 5.559 1.00 0.00 H new ATOM 0 HG22 VAL B 739 3.669 -1.084 7.084 1.00 0.00 H new ATOM 0 HG23 VAL B 739 1.917 -0.872 6.856 1.00 0.00 H new ATOM 616 N LYS B 740 2.116 -1.309 9.331 1.00 0.00 N ATOM 617 CA LYS B 740 1.137 -2.346 9.762 1.00 0.00 C ATOM 618 C LYS B 740 0.475 -1.942 11.081 1.00 0.00 C ATOM 619 O LYS B 740 -0.718 -2.075 11.249 1.00 0.00 O ATOM 620 CB LYS B 740 1.973 -3.611 9.958 1.00 0.00 C ATOM 621 CG LYS B 740 1.090 -4.729 10.517 1.00 0.00 C ATOM 622 CD LYS B 740 1.178 -4.738 12.045 1.00 0.00 C ATOM 623 CE LYS B 740 0.717 -6.098 12.575 1.00 0.00 C ATOM 624 NZ LYS B 740 -0.146 -5.779 13.747 1.00 0.00 N ATOM 0 H LYS B 740 3.062 -1.649 9.159 1.00 0.00 H new ATOM 0 HA LYS B 740 0.337 -2.484 9.035 1.00 0.00 H new ATOM 0 HB2 LYS B 740 2.411 -3.920 9.009 1.00 0.00 H new ATOM 0 HB3 LYS B 740 2.799 -3.411 10.640 1.00 0.00 H new ATOM 0 HG2 LYS B 740 0.057 -4.581 10.203 1.00 0.00 H new ATOM 0 HG3 LYS B 740 1.410 -5.692 10.119 1.00 0.00 H new ATOM 0 HD2 LYS B 740 2.202 -4.540 12.362 1.00 0.00 H new ATOM 0 HD3 LYS B 740 0.557 -3.944 12.460 1.00 0.00 H new ATOM 0 HE2 LYS B 740 0.164 -6.651 11.816 1.00 0.00 H new ATOM 0 HE3 LYS B 740 1.566 -6.717 12.866 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 -0.502 -6.662 14.167 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 0.409 -5.258 14.455 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 -0.949 -5.194 13.438 1.00 0.00 H new ATOM 638 N SER B 741 1.242 -1.476 12.028 1.00 0.00 N ATOM 639 CA SER B 741 0.649 -1.080 13.338 1.00 0.00 C ATOM 640 C SER B 741 0.364 0.422 13.361 1.00 0.00 C ATOM 641 O SER B 741 0.272 1.032 14.408 1.00 0.00 O ATOM 642 CB SER B 741 1.718 -1.436 14.372 1.00 0.00 C ATOM 643 OG SER B 741 1.103 -2.035 15.502 1.00 0.00 O ATOM 0 H SER B 741 2.252 -1.352 11.952 1.00 0.00 H new ATOM 0 HA SER B 741 -0.298 -1.584 13.533 1.00 0.00 H new ATOM 0 HB2 SER B 741 2.447 -2.119 13.937 1.00 0.00 H new ATOM 0 HB3 SER B 741 2.261 -0.540 14.673 1.00 0.00 H new ATOM 0 HG SER B 741 1.788 -2.265 16.164 1.00 0.00 H new ATOM 649 N HIS B 742 0.234 1.025 12.212 1.00 0.00 N ATOM 650 CA HIS B 742 -0.034 2.489 12.160 1.00 0.00 C ATOM 651 C HIS B 742 -1.513 2.782 12.399 1.00 0.00 C ATOM 652 O HIS B 742 -2.369 1.966 12.129 1.00 0.00 O ATOM 653 CB HIS B 742 0.346 2.895 10.740 1.00 0.00 C ATOM 654 CG HIS B 742 0.931 4.282 10.757 1.00 0.00 C ATOM 655 ND1 HIS B 742 0.172 5.402 11.059 1.00 0.00 N ATOM 656 CD2 HIS B 742 2.200 4.743 10.514 1.00 0.00 C ATOM 657 CE1 HIS B 742 0.985 6.472 10.989 1.00 0.00 C ATOM 658 NE2 HIS B 742 2.233 6.127 10.661 1.00 0.00 N ATOM 0 H HIS B 742 0.302 0.565 11.304 1.00 0.00 H new ATOM 0 HA HIS B 742 0.523 3.031 12.924 1.00 0.00 H new ATOM 0 HB2 HIS B 742 1.067 2.189 10.329 1.00 0.00 H new ATOM 0 HB3 HIS B 742 -0.532 2.866 10.094 1.00 0.00 H new ATOM 0 HD2 HIS B 742 3.046 4.126 10.249 1.00 0.00 H new ATOM 0 HE1 HIS B 742 0.667 7.487 11.175 1.00 0.00 H new ATOM 0 HE2 HIS B 742 3.037 6.744 10.544 1.00 0.00 H new ATOM 666 N GLN B 743 -1.828 3.973 12.828 1.00 0.00 N ATOM 667 CA GLN B 743 -3.258 4.329 13.047 1.00 0.00 C ATOM 668 C GLN B 743 -3.945 4.672 11.717 1.00 0.00 C ATOM 669 O GLN B 743 -5.090 5.078 11.694 1.00 0.00 O ATOM 670 CB GLN B 743 -3.222 5.556 13.959 1.00 0.00 C ATOM 671 CG GLN B 743 -4.651 6.039 14.217 1.00 0.00 C ATOM 672 CD GLN B 743 -4.693 6.847 15.516 1.00 0.00 C ATOM 673 OE1 GLN B 743 -4.394 8.025 15.523 1.00 0.00 O ATOM 674 NE2 GLN B 743 -5.057 6.261 16.624 1.00 0.00 N ATOM 0 H GLN B 743 -1.158 4.714 13.036 1.00 0.00 H new ATOM 0 HA GLN B 743 -3.820 3.504 13.484 1.00 0.00 H new ATOM 0 HB2 GLN B 743 -2.734 5.308 14.902 1.00 0.00 H new ATOM 0 HB3 GLN B 743 -2.636 6.350 13.496 1.00 0.00 H new ATOM 0 HG2 GLN B 743 -4.994 6.653 13.384 1.00 0.00 H new ATOM 0 HG3 GLN B 743 -5.327 5.187 14.285 1.00 0.00 H new ATOM 0 HE21 GLN B 743 -5.308 5.272 16.619 1.00 0.00 H new ATOM 0 HE22 GLN B 743 -5.090 6.792 17.494 1.00 0.00 H new ATOM 683 N SER B 744 -3.264 4.517 10.608 1.00 0.00 N ATOM 684 CA SER B 744 -3.903 4.826 9.298 1.00 0.00 C ATOM 685 C SER B 744 -3.821 3.617 8.354 1.00 0.00 C ATOM 686 O SER B 744 -4.352 3.639 7.264 1.00 0.00 O ATOM 687 CB SER B 744 -3.113 6.008 8.735 1.00 0.00 C ATOM 688 OG SER B 744 -3.465 7.190 9.439 1.00 0.00 O ATOM 0 H SER B 744 -2.299 4.192 10.556 1.00 0.00 H new ATOM 0 HA SER B 744 -4.962 5.061 9.408 1.00 0.00 H new ATOM 0 HB2 SER B 744 -2.043 5.822 8.828 1.00 0.00 H new ATOM 0 HB3 SER B 744 -3.325 6.128 7.673 1.00 0.00 H new ATOM 0 HG SER B 744 -2.668 7.564 9.869 1.00 0.00 H new ATOM 694 N ALA B 745 -3.175 2.558 8.765 1.00 0.00 N ATOM 695 CA ALA B 745 -3.117 1.341 7.908 1.00 0.00 C ATOM 696 C ALA B 745 -4.439 0.569 7.993 1.00 0.00 C ATOM 697 O ALA B 745 -4.710 -0.301 7.189 1.00 0.00 O ATOM 698 CB ALA B 745 -1.983 0.502 8.496 1.00 0.00 C ATOM 0 H ALA B 745 -2.686 2.485 9.657 1.00 0.00 H new ATOM 0 HA ALA B 745 -2.953 1.584 6.858 1.00 0.00 H new ATOM 0 HB1 ALA B 745 -1.874 -0.417 7.920 1.00 0.00 H new ATOM 0 HB2 ALA B 745 -1.053 1.069 8.456 1.00 0.00 H new ATOM 0 HB3 ALA B 745 -2.213 0.255 9.532 1.00 0.00 H new ATOM 704 N TRP B 746 -5.263 0.874 8.966 1.00 0.00 N ATOM 705 CA TRP B 746 -6.564 0.154 9.102 1.00 0.00 C ATOM 706 C TRP B 746 -7.296 0.043 7.747 1.00 0.00 C ATOM 707 O TRP B 746 -7.678 -1.043 7.358 1.00 0.00 O ATOM 708 CB TRP B 746 -7.396 0.977 10.098 1.00 0.00 C ATOM 709 CG TRP B 746 -6.652 1.203 11.381 1.00 0.00 C ATOM 710 CD1 TRP B 746 -7.050 2.069 12.341 1.00 0.00 C ATOM 711 CD2 TRP B 746 -5.427 0.578 11.882 1.00 0.00 C ATOM 712 NE1 TRP B 746 -6.155 2.023 13.391 1.00 0.00 N ATOM 713 CE2 TRP B 746 -5.138 1.122 13.159 1.00 0.00 C ATOM 714 CE3 TRP B 746 -4.544 -0.390 11.367 1.00 0.00 C ATOM 715 CZ2 TRP B 746 -4.020 0.722 13.893 1.00 0.00 C ATOM 716 CZ3 TRP B 746 -3.420 -0.793 12.104 1.00 0.00 C ATOM 717 CH2 TRP B 746 -3.161 -0.244 13.366 1.00 0.00 C ATOM 0 H TRP B 746 -5.089 1.591 9.671 1.00 0.00 H new ATOM 0 HA TRP B 746 -6.408 -0.868 9.448 1.00 0.00 H new ATOM 0 HB2 TRP B 746 -7.654 1.937 9.652 1.00 0.00 H new ATOM 0 HB3 TRP B 746 -8.333 0.460 10.306 1.00 0.00 H new ATOM 0 HD1 TRP B 746 -7.928 2.696 12.294 1.00 0.00 H new ATOM 0 HE1 TRP B 746 -6.236 2.588 14.237 1.00 0.00 H new ATOM 0 HE3 TRP B 746 -4.733 -0.826 10.397 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 -3.821 1.157 14.861 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 -2.749 -1.533 11.694 1.00 0.00 H new ATOM 0 HH2 TRP B 746 -2.299 -0.567 13.930 1.00 0.00 H new ATOM 728 N PRO B 747 -7.471 1.154 7.056 1.00 0.00 N ATOM 729 CA PRO B 747 -8.195 1.122 5.758 1.00 0.00 C ATOM 730 C PRO B 747 -7.468 0.258 4.725 1.00 0.00 C ATOM 731 O PRO B 747 -8.031 -0.098 3.708 1.00 0.00 O ATOM 732 CB PRO B 747 -8.202 2.583 5.298 1.00 0.00 C ATOM 733 CG PRO B 747 -7.148 3.259 6.111 1.00 0.00 C ATOM 734 CD PRO B 747 -7.081 2.524 7.417 1.00 0.00 C ATOM 0 HA PRO B 747 -9.192 0.694 5.864 1.00 0.00 H new ATOM 0 HB2 PRO B 747 -7.986 2.661 4.232 1.00 0.00 H new ATOM 0 HB3 PRO B 747 -9.178 3.041 5.460 1.00 0.00 H new ATOM 0 HG2 PRO B 747 -6.186 3.230 5.600 1.00 0.00 H new ATOM 0 HG3 PRO B 747 -7.394 4.309 6.269 1.00 0.00 H new ATOM 0 HD2 PRO B 747 -6.079 2.557 7.846 1.00 0.00 H new ATOM 0 HD3 PRO B 747 -7.758 2.953 8.155 1.00 0.00 H new ATOM 742 N PHE B 748 -6.218 -0.056 4.942 1.00 0.00 N ATOM 743 CA PHE B 748 -5.489 -0.874 3.937 1.00 0.00 C ATOM 744 C PHE B 748 -5.458 -2.344 4.346 1.00 0.00 C ATOM 745 O PHE B 748 -5.029 -3.193 3.594 1.00 0.00 O ATOM 746 CB PHE B 748 -4.072 -0.288 3.895 1.00 0.00 C ATOM 747 CG PHE B 748 -4.120 1.209 3.637 1.00 0.00 C ATOM 748 CD1 PHE B 748 -5.205 1.790 2.957 1.00 0.00 C ATOM 749 CD2 PHE B 748 -3.058 2.013 4.062 1.00 0.00 C ATOM 750 CE1 PHE B 748 -5.231 3.170 2.728 1.00 0.00 C ATOM 751 CE2 PHE B 748 -3.083 3.393 3.826 1.00 0.00 C ATOM 752 CZ PHE B 748 -4.169 3.970 3.160 1.00 0.00 C ATOM 0 H PHE B 748 -5.678 0.216 5.763 1.00 0.00 H new ATOM 0 HA PHE B 748 -5.972 -0.841 2.961 1.00 0.00 H new ATOM 0 HB2 PHE B 748 -3.564 -0.484 4.839 1.00 0.00 H new ATOM 0 HB3 PHE B 748 -3.493 -0.779 3.113 1.00 0.00 H new ATOM 0 HD1 PHE B 748 -6.019 1.170 2.611 1.00 0.00 H new ATOM 0 HD2 PHE B 748 -2.217 1.569 4.573 1.00 0.00 H new ATOM 0 HE1 PHE B 748 -6.071 3.617 2.218 1.00 0.00 H new ATOM 0 HE2 PHE B 748 -2.263 4.012 4.159 1.00 0.00 H new ATOM 0 HZ PHE B 748 -4.187 5.035 2.979 1.00 0.00 H new ATOM 762 N MET B 749 -5.940 -2.664 5.511 1.00 0.00 N ATOM 763 CA MET B 749 -5.947 -4.085 5.935 1.00 0.00 C ATOM 764 C MET B 749 -7.320 -4.705 5.674 1.00 0.00 C ATOM 765 O MET B 749 -7.789 -5.540 6.422 1.00 0.00 O ATOM 766 CB MET B 749 -5.654 -4.043 7.427 1.00 0.00 C ATOM 767 CG MET B 749 -4.229 -3.532 7.653 1.00 0.00 C ATOM 768 SD MET B 749 -3.212 -4.854 8.361 1.00 0.00 S ATOM 769 CE MET B 749 -1.977 -3.793 9.150 1.00 0.00 C ATOM 0 H MET B 749 -6.328 -2.004 6.185 1.00 0.00 H new ATOM 0 HA MET B 749 -5.220 -4.687 5.391 1.00 0.00 H new ATOM 0 HB2 MET B 749 -6.369 -3.393 7.931 1.00 0.00 H new ATOM 0 HB3 MET B 749 -5.768 -5.037 7.859 1.00 0.00 H new ATOM 0 HG2 MET B 749 -3.799 -3.195 6.710 1.00 0.00 H new ATOM 0 HG3 MET B 749 -4.243 -2.672 8.323 1.00 0.00 H new ATOM 0 HE1 MET B 749 -0.989 -4.028 8.753 1.00 0.00 H new ATOM 0 HE2 MET B 749 -2.211 -2.748 8.946 1.00 0.00 H new ATOM 0 HE3 MET B 749 -1.986 -3.963 10.227 1.00 0.00 H new ATOM 779 N GLU B 750 -7.968 -4.302 4.617 1.00 0.00 N ATOM 780 CA GLU B 750 -9.302 -4.882 4.290 1.00 0.00 C ATOM 781 C GLU B 750 -9.360 -5.227 2.796 1.00 0.00 C ATOM 782 O GLU B 750 -8.984 -4.421 1.969 1.00 0.00 O ATOM 783 CB GLU B 750 -10.316 -3.783 4.620 1.00 0.00 C ATOM 784 CG GLU B 750 -10.103 -3.297 6.055 1.00 0.00 C ATOM 785 CD GLU B 750 -11.333 -2.512 6.515 1.00 0.00 C ATOM 786 OE1 GLU B 750 -12.361 -3.133 6.728 1.00 0.00 O ATOM 787 OE2 GLU B 750 -11.225 -1.304 6.647 1.00 0.00 O ATOM 0 H GLU B 750 -7.631 -3.595 3.964 1.00 0.00 H new ATOM 0 HA GLU B 750 -9.504 -5.796 4.848 1.00 0.00 H new ATOM 0 HB2 GLU B 750 -10.205 -2.951 3.924 1.00 0.00 H new ATOM 0 HB3 GLU B 750 -11.330 -4.164 4.502 1.00 0.00 H new ATOM 0 HG2 GLU B 750 -9.932 -4.146 6.716 1.00 0.00 H new ATOM 0 HG3 GLU B 750 -9.215 -2.667 6.109 1.00 0.00 H new ATOM 794 N PRO B 751 -9.826 -6.413 2.490 1.00 0.00 N ATOM 795 CA PRO B 751 -9.887 -6.850 1.081 1.00 0.00 C ATOM 796 C PRO B 751 -11.184 -6.384 0.412 1.00 0.00 C ATOM 797 O PRO B 751 -12.229 -6.977 0.598 1.00 0.00 O ATOM 798 CB PRO B 751 -9.878 -8.372 1.193 1.00 0.00 C ATOM 799 CG PRO B 751 -10.481 -8.675 2.526 1.00 0.00 C ATOM 800 CD PRO B 751 -10.283 -7.466 3.410 1.00 0.00 C ATOM 0 HA PRO B 751 -9.073 -6.446 0.479 1.00 0.00 H new ATOM 0 HB2 PRO B 751 -10.454 -8.829 0.388 1.00 0.00 H new ATOM 0 HB3 PRO B 751 -8.864 -8.765 1.122 1.00 0.00 H new ATOM 0 HG2 PRO B 751 -11.542 -8.902 2.422 1.00 0.00 H new ATOM 0 HG3 PRO B 751 -10.009 -9.552 2.968 1.00 0.00 H new ATOM 0 HD2 PRO B 751 -11.209 -7.183 3.910 1.00 0.00 H new ATOM 0 HD3 PRO B 751 -9.547 -7.660 4.190 1.00 0.00 H new ATOM 808 N VAL B 752 -11.130 -5.355 -0.398 1.00 0.00 N ATOM 809 CA VAL B 752 -12.376 -4.899 -1.103 1.00 0.00 C ATOM 810 C VAL B 752 -13.043 -6.090 -1.789 1.00 0.00 C ATOM 811 O VAL B 752 -12.397 -6.966 -2.329 1.00 0.00 O ATOM 812 CB VAL B 752 -11.947 -3.811 -2.127 1.00 0.00 C ATOM 813 CG1 VAL B 752 -10.638 -4.200 -2.827 1.00 0.00 C ATOM 814 CG2 VAL B 752 -13.036 -3.606 -3.189 1.00 0.00 C ATOM 0 H VAL B 752 -10.289 -4.815 -0.602 1.00 0.00 H new ATOM 0 HA VAL B 752 -13.104 -4.482 -0.408 1.00 0.00 H new ATOM 0 HB VAL B 752 -11.797 -2.884 -1.574 1.00 0.00 H new ATOM 0 HG11 VAL B 752 -10.360 -3.422 -3.538 1.00 0.00 H new ATOM 0 HG12 VAL B 752 -9.848 -4.312 -2.085 1.00 0.00 H new ATOM 0 HG13 VAL B 752 -10.775 -5.143 -3.356 1.00 0.00 H new ATOM 0 HG21 VAL B 752 -12.716 -2.840 -3.896 1.00 0.00 H new ATOM 0 HG22 VAL B 752 -13.207 -4.542 -3.721 1.00 0.00 H new ATOM 0 HG23 VAL B 752 -13.960 -3.290 -2.706 1.00 0.00 H new ATOM 824 N LYS B 753 -14.338 -6.130 -1.729 1.00 0.00 N ATOM 825 CA LYS B 753 -15.096 -7.255 -2.328 1.00 0.00 C ATOM 826 C LYS B 753 -14.610 -7.562 -3.746 1.00 0.00 C ATOM 827 O LYS B 753 -14.740 -8.669 -4.229 1.00 0.00 O ATOM 828 CB LYS B 753 -16.540 -6.748 -2.362 1.00 0.00 C ATOM 829 CG LYS B 753 -17.051 -6.446 -0.942 1.00 0.00 C ATOM 830 CD LYS B 753 -16.711 -7.598 0.012 1.00 0.00 C ATOM 831 CE LYS B 753 -15.329 -7.358 0.625 1.00 0.00 C ATOM 832 NZ LYS B 753 -15.501 -7.647 2.077 1.00 0.00 N ATOM 0 H LYS B 753 -14.915 -5.417 -1.282 1.00 0.00 H new ATOM 0 HA LYS B 753 -14.977 -8.179 -1.762 1.00 0.00 H new ATOM 0 HB2 LYS B 753 -16.599 -5.847 -2.973 1.00 0.00 H new ATOM 0 HB3 LYS B 753 -17.180 -7.494 -2.832 1.00 0.00 H new ATOM 0 HG2 LYS B 753 -16.603 -5.521 -0.578 1.00 0.00 H new ATOM 0 HG3 LYS B 753 -18.130 -6.291 -0.963 1.00 0.00 H new ATOM 0 HD2 LYS B 753 -17.463 -7.668 0.798 1.00 0.00 H new ATOM 0 HD3 LYS B 753 -16.723 -8.546 -0.526 1.00 0.00 H new ATOM 0 HE2 LYS B 753 -14.579 -8.011 0.178 1.00 0.00 H new ATOM 0 HE3 LYS B 753 -14.997 -6.333 0.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 753 -14.568 -7.772 2.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 753 -15.997 -6.854 2.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 753 -16.059 -8.517 2.194 1.00 0.00 H new ATOM 846 N ARG B 754 -14.050 -6.594 -4.420 1.00 0.00 N ATOM 847 CA ARG B 754 -13.586 -6.833 -5.817 1.00 0.00 C ATOM 848 C ARG B 754 -14.743 -7.373 -6.662 1.00 0.00 C ATOM 849 O ARG B 754 -14.541 -8.010 -7.678 1.00 0.00 O ATOM 850 CB ARG B 754 -12.473 -7.878 -5.697 1.00 0.00 C ATOM 851 CG ARG B 754 -11.729 -7.987 -7.029 1.00 0.00 C ATOM 852 CD ARG B 754 -11.789 -9.432 -7.531 1.00 0.00 C ATOM 853 NE ARG B 754 -11.634 -9.329 -9.012 1.00 0.00 N ATOM 854 CZ ARG B 754 -11.755 -10.389 -9.778 1.00 0.00 C ATOM 855 NH1 ARG B 754 -12.017 -11.566 -9.267 1.00 0.00 N ATOM 856 NH2 ARG B 754 -11.614 -10.267 -11.070 1.00 0.00 N ATOM 0 H ARG B 754 -13.894 -5.651 -4.065 1.00 0.00 H new ATOM 0 HA ARG B 754 -13.232 -5.922 -6.299 1.00 0.00 H new ATOM 0 HB2 ARG B 754 -11.780 -7.597 -4.903 1.00 0.00 H new ATOM 0 HB3 ARG B 754 -12.896 -8.845 -5.424 1.00 0.00 H new ATOM 0 HG2 ARG B 754 -12.176 -7.317 -7.763 1.00 0.00 H new ATOM 0 HG3 ARG B 754 -10.691 -7.677 -6.905 1.00 0.00 H new ATOM 0 HD2 ARG B 754 -10.996 -10.036 -7.092 1.00 0.00 H new ATOM 0 HD3 ARG B 754 -12.734 -9.904 -7.264 1.00 0.00 H new ATOM 0 HE ARG B 754 -11.431 -8.423 -9.435 1.00 0.00 H new ATOM 0 HH11 ARG B 754 -12.131 -11.670 -8.259 1.00 0.00 H new ATOM 0 HH12 ARG B 754 -12.108 -12.378 -9.877 1.00 0.00 H new ATOM 0 HH21 ARG B 754 -11.412 -9.354 -11.477 1.00 0.00 H new ATOM 0 HH22 ARG B 754 -11.706 -11.085 -11.673 1.00 0.00 H new ATOM 870 N THR B 755 -15.955 -7.128 -6.243 1.00 0.00 N ATOM 871 CA THR B 755 -17.133 -7.614 -7.016 1.00 0.00 C ATOM 872 C THR B 755 -18.405 -6.887 -6.559 1.00 0.00 C ATOM 873 O THR B 755 -19.252 -6.547 -7.361 1.00 0.00 O ATOM 874 CB THR B 755 -17.221 -9.118 -6.726 1.00 0.00 C ATOM 875 OG1 THR B 755 -18.408 -9.639 -7.305 1.00 0.00 O ATOM 876 CG2 THR B 755 -17.241 -9.370 -5.215 1.00 0.00 C ATOM 0 H THR B 755 -16.180 -6.609 -5.394 1.00 0.00 H new ATOM 0 HA THR B 755 -17.031 -7.422 -8.084 1.00 0.00 H new ATOM 0 HB THR B 755 -16.349 -9.612 -7.155 1.00 0.00 H new ATOM 0 HG1 THR B 755 -19.164 -9.476 -6.704 1.00 0.00 H new ATOM 0 HG21 THR B 755 -17.304 -10.442 -5.026 1.00 0.00 H new ATOM 0 HG22 THR B 755 -16.328 -8.975 -4.768 1.00 0.00 H new ATOM 0 HG23 THR B 755 -18.105 -8.873 -4.775 1.00 0.00 H new ATOM 884 N GLU B 756 -18.536 -6.619 -5.285 1.00 0.00 N ATOM 885 CA GLU B 756 -19.730 -5.867 -4.801 1.00 0.00 C ATOM 886 C GLU B 756 -19.381 -4.381 -4.727 1.00 0.00 C ATOM 887 O GLU B 756 -20.209 -3.521 -4.946 1.00 0.00 O ATOM 888 CB GLU B 756 -20.027 -6.404 -3.394 1.00 0.00 C ATOM 889 CG GLU B 756 -20.018 -7.933 -3.397 1.00 0.00 C ATOM 890 CD GLU B 756 -21.058 -8.449 -4.394 1.00 0.00 C ATOM 891 OE1 GLU B 756 -22.222 -8.123 -4.228 1.00 0.00 O ATOM 892 OE2 GLU B 756 -20.672 -9.160 -5.307 1.00 0.00 O ATOM 0 H GLU B 756 -17.869 -6.888 -4.562 1.00 0.00 H new ATOM 0 HA GLU B 756 -20.590 -5.989 -5.460 1.00 0.00 H new ATOM 0 HB2 GLU B 756 -19.283 -6.031 -2.690 1.00 0.00 H new ATOM 0 HB3 GLU B 756 -20.997 -6.040 -3.056 1.00 0.00 H new ATOM 0 HG2 GLU B 756 -19.028 -8.301 -3.666 1.00 0.00 H new ATOM 0 HG3 GLU B 756 -20.238 -8.310 -2.398 1.00 0.00 H new ATOM 899 N ALA B 757 -18.146 -4.087 -4.419 1.00 0.00 N ATOM 900 CA ALA B 757 -17.694 -2.669 -4.330 1.00 0.00 C ATOM 901 C ALA B 757 -17.946 -1.953 -5.666 1.00 0.00 C ATOM 902 O ALA B 757 -17.283 -2.234 -6.645 1.00 0.00 O ATOM 903 CB ALA B 757 -16.188 -2.774 -4.048 1.00 0.00 C ATOM 0 H ALA B 757 -17.422 -4.779 -4.223 1.00 0.00 H new ATOM 0 HA ALA B 757 -18.221 -2.100 -3.564 1.00 0.00 H new ATOM 0 HB1 ALA B 757 -15.763 -1.774 -3.965 1.00 0.00 H new ATOM 0 HB2 ALA B 757 -16.029 -3.314 -3.115 1.00 0.00 H new ATOM 0 HB3 ALA B 757 -15.702 -3.309 -4.864 1.00 0.00 H new ATOM 909 N PRO B 758 -18.911 -1.061 -5.676 1.00 0.00 N ATOM 910 CA PRO B 758 -19.251 -0.334 -6.922 1.00 0.00 C ATOM 911 C PRO B 758 -18.270 0.813 -7.167 1.00 0.00 C ATOM 912 O PRO B 758 -17.673 1.337 -6.249 1.00 0.00 O ATOM 913 CB PRO B 758 -20.645 0.215 -6.636 1.00 0.00 C ATOM 914 CG PRO B 758 -20.696 0.378 -5.150 1.00 0.00 C ATOM 915 CD PRO B 758 -19.777 -0.660 -4.554 1.00 0.00 C ATOM 0 HA PRO B 758 -19.207 -0.967 -7.808 1.00 0.00 H new ATOM 0 HB2 PRO B 758 -20.807 1.166 -7.144 1.00 0.00 H new ATOM 0 HB3 PRO B 758 -21.419 -0.469 -6.985 1.00 0.00 H new ATOM 0 HG2 PRO B 758 -20.381 1.381 -4.862 1.00 0.00 H new ATOM 0 HG3 PRO B 758 -21.714 0.246 -4.783 1.00 0.00 H new ATOM 0 HD2 PRO B 758 -19.195 -0.250 -3.728 1.00 0.00 H new ATOM 0 HD3 PRO B 758 -20.337 -1.508 -4.160 1.00 0.00 H new ATOM 923 N GLY B 759 -18.100 1.208 -8.401 1.00 0.00 N ATOM 924 CA GLY B 759 -17.165 2.331 -8.705 1.00 0.00 C ATOM 925 C GLY B 759 -15.714 1.830 -8.723 1.00 0.00 C ATOM 926 O GLY B 759 -14.800 2.575 -9.014 1.00 0.00 O ATOM 0 H GLY B 759 -18.568 0.802 -9.211 1.00 0.00 H new ATOM 0 HA2 GLY B 759 -17.416 2.771 -9.670 1.00 0.00 H new ATOM 0 HA3 GLY B 759 -17.276 3.117 -7.958 1.00 0.00 H new ATOM 930 N TYR B 760 -15.488 0.580 -8.413 1.00 0.00 N ATOM 931 CA TYR B 760 -14.098 0.048 -8.416 1.00 0.00 C ATOM 932 C TYR B 760 -13.632 -0.206 -9.850 1.00 0.00 C ATOM 933 O TYR B 760 -14.172 0.334 -10.794 1.00 0.00 O ATOM 934 CB TYR B 760 -14.205 -1.276 -7.655 1.00 0.00 C ATOM 935 CG TYR B 760 -13.070 -1.404 -6.669 1.00 0.00 C ATOM 936 CD1 TYR B 760 -12.933 -0.476 -5.630 1.00 0.00 C ATOM 937 CD2 TYR B 760 -12.171 -2.471 -6.777 1.00 0.00 C ATOM 938 CE1 TYR B 760 -11.887 -0.606 -4.709 1.00 0.00 C ATOM 939 CE2 TYR B 760 -11.124 -2.601 -5.858 1.00 0.00 C ATOM 940 CZ TYR B 760 -10.984 -1.671 -4.822 1.00 0.00 C ATOM 941 OH TYR B 760 -9.949 -1.797 -3.917 1.00 0.00 O ATOM 0 H TYR B 760 -16.209 -0.095 -8.158 1.00 0.00 H new ATOM 0 HA TYR B 760 -13.383 0.737 -7.967 1.00 0.00 H new ATOM 0 HB2 TYR B 760 -15.159 -1.326 -7.131 1.00 0.00 H new ATOM 0 HB3 TYR B 760 -14.183 -2.110 -8.357 1.00 0.00 H new ATOM 0 HD1 TYR B 760 -13.634 0.340 -5.539 1.00 0.00 H new ATOM 0 HD2 TYR B 760 -12.285 -3.195 -7.570 1.00 0.00 H new ATOM 0 HE1 TYR B 760 -11.776 0.114 -3.912 1.00 0.00 H new ATOM 0 HE2 TYR B 760 -10.424 -3.419 -5.948 1.00 0.00 H new ATOM 0 HH TYR B 760 -9.194 -2.251 -4.345 1.00 0.00 H new ATOM 951 N TYR B 761 -12.641 -1.038 -10.021 1.00 0.00 N ATOM 952 CA TYR B 761 -12.159 -1.353 -11.396 1.00 0.00 C ATOM 953 C TYR B 761 -11.869 -0.071 -12.179 1.00 0.00 C ATOM 954 O TYR B 761 -12.026 -0.024 -13.383 1.00 0.00 O ATOM 955 CB TYR B 761 -13.320 -2.108 -12.045 1.00 0.00 C ATOM 956 CG TYR B 761 -12.820 -2.869 -13.249 1.00 0.00 C ATOM 957 CD1 TYR B 761 -11.761 -3.776 -13.115 1.00 0.00 C ATOM 958 CD2 TYR B 761 -13.420 -2.675 -14.499 1.00 0.00 C ATOM 959 CE1 TYR B 761 -11.299 -4.484 -14.231 1.00 0.00 C ATOM 960 CE2 TYR B 761 -12.958 -3.383 -15.615 1.00 0.00 C ATOM 961 CZ TYR B 761 -11.898 -4.287 -15.481 1.00 0.00 C ATOM 962 OH TYR B 761 -11.444 -4.985 -16.581 1.00 0.00 O ATOM 0 H TYR B 761 -12.144 -1.513 -9.268 1.00 0.00 H new ATOM 0 HA TYR B 761 -11.234 -1.929 -11.382 1.00 0.00 H new ATOM 0 HB2 TYR B 761 -13.766 -2.796 -11.327 1.00 0.00 H new ATOM 0 HB3 TYR B 761 -14.101 -1.408 -12.343 1.00 0.00 H new ATOM 0 HD1 TYR B 761 -11.301 -3.929 -12.150 1.00 0.00 H new ATOM 0 HD2 TYR B 761 -14.239 -1.979 -14.602 1.00 0.00 H new ATOM 0 HE1 TYR B 761 -10.481 -5.182 -14.128 1.00 0.00 H new ATOM 0 HE2 TYR B 761 -13.420 -3.232 -16.580 1.00 0.00 H new ATOM 0 HH TYR B 761 -11.969 -4.732 -17.369 1.00 0.00 H new ATOM 972 N GLU B 762 -11.448 0.969 -11.515 1.00 0.00 N ATOM 973 CA GLU B 762 -11.158 2.239 -12.241 1.00 0.00 C ATOM 974 C GLU B 762 -10.363 3.205 -11.359 1.00 0.00 C ATOM 975 O GLU B 762 -9.495 3.915 -11.828 1.00 0.00 O ATOM 976 CB GLU B 762 -12.534 2.826 -12.563 1.00 0.00 C ATOM 977 CG GLU B 762 -12.637 3.090 -14.066 1.00 0.00 C ATOM 978 CD GLU B 762 -12.162 4.512 -14.369 1.00 0.00 C ATOM 979 OE1 GLU B 762 -12.957 5.426 -14.220 1.00 0.00 O ATOM 980 OE2 GLU B 762 -11.012 4.664 -14.746 1.00 0.00 O ATOM 0 H GLU B 762 -11.293 0.996 -10.507 1.00 0.00 H new ATOM 0 HA GLU B 762 -10.557 2.068 -13.134 1.00 0.00 H new ATOM 0 HB2 GLU B 762 -13.318 2.136 -12.250 1.00 0.00 H new ATOM 0 HB3 GLU B 762 -12.685 3.753 -12.009 1.00 0.00 H new ATOM 0 HG2 GLU B 762 -12.032 2.369 -14.615 1.00 0.00 H new ATOM 0 HG3 GLU B 762 -13.667 2.961 -14.399 1.00 0.00 H new ATOM 987 N VAL B 763 -10.659 3.252 -10.089 1.00 0.00 N ATOM 988 CA VAL B 763 -9.915 4.189 -9.190 1.00 0.00 C ATOM 989 C VAL B 763 -8.707 3.500 -8.569 1.00 0.00 C ATOM 990 O VAL B 763 -7.747 4.135 -8.181 1.00 0.00 O ATOM 991 CB VAL B 763 -10.896 4.592 -8.080 1.00 0.00 C ATOM 992 CG1 VAL B 763 -12.010 5.454 -8.671 1.00 0.00 C ATOM 993 CG2 VAL B 763 -11.513 3.352 -7.427 1.00 0.00 C ATOM 0 H VAL B 763 -11.377 2.688 -9.635 1.00 0.00 H new ATOM 0 HA VAL B 763 -9.553 5.051 -9.750 1.00 0.00 H new ATOM 0 HB VAL B 763 -10.350 5.155 -7.323 1.00 0.00 H new ATOM 0 HG11 VAL B 763 -12.706 5.740 -7.882 1.00 0.00 H new ATOM 0 HG12 VAL B 763 -11.579 6.350 -9.117 1.00 0.00 H new ATOM 0 HG13 VAL B 763 -12.541 4.888 -9.436 1.00 0.00 H new ATOM 0 HG21 VAL B 763 -12.205 3.660 -6.643 1.00 0.00 H new ATOM 0 HG22 VAL B 763 -12.050 2.774 -8.179 1.00 0.00 H new ATOM 0 HG23 VAL B 763 -10.723 2.738 -6.993 1.00 0.00 H new ATOM 1003 N ILE B 764 -8.756 2.212 -8.445 1.00 0.00 N ATOM 1004 CA ILE B 764 -7.638 1.491 -7.792 1.00 0.00 C ATOM 1005 C ILE B 764 -6.732 0.830 -8.821 1.00 0.00 C ATOM 1006 O ILE B 764 -5.558 0.631 -8.589 1.00 0.00 O ATOM 1007 CB ILE B 764 -8.312 0.428 -6.904 1.00 0.00 C ATOM 1008 CG1 ILE B 764 -9.436 1.044 -6.053 1.00 0.00 C ATOM 1009 CG2 ILE B 764 -7.277 -0.195 -5.974 1.00 0.00 C ATOM 1010 CD1 ILE B 764 -8.966 2.346 -5.392 1.00 0.00 C ATOM 0 H ILE B 764 -9.524 1.624 -8.768 1.00 0.00 H new ATOM 0 HA ILE B 764 -7.005 2.168 -7.219 1.00 0.00 H new ATOM 0 HB ILE B 764 -8.742 -0.331 -7.557 1.00 0.00 H new ATOM 0 HG12 ILE B 764 -10.306 1.242 -6.679 1.00 0.00 H new ATOM 0 HG13 ILE B 764 -9.749 0.334 -5.287 1.00 0.00 H new ATOM 0 HG21 ILE B 764 -7.757 -0.947 -5.347 1.00 0.00 H new ATOM 0 HG22 ILE B 764 -6.491 -0.664 -6.566 1.00 0.00 H new ATOM 0 HG23 ILE B 764 -6.842 0.580 -5.343 1.00 0.00 H new ATOM 0 HD11 ILE B 764 -9.777 2.764 -4.795 1.00 0.00 H new ATOM 0 HD12 ILE B 764 -8.111 2.139 -4.748 1.00 0.00 H new ATOM 0 HD13 ILE B 764 -8.676 3.061 -6.162 1.00 0.00 H new ATOM 1022 N ARG B 765 -7.275 0.509 -9.954 1.00 0.00 N ATOM 1023 CA ARG B 765 -6.480 -0.164 -11.033 1.00 0.00 C ATOM 1024 C ARG B 765 -5.954 -1.520 -10.541 1.00 0.00 C ATOM 1025 O ARG B 765 -6.435 -2.562 -10.940 1.00 0.00 O ATOM 1026 CB ARG B 765 -5.317 0.782 -11.363 1.00 0.00 C ATOM 1027 CG ARG B 765 -5.851 2.193 -11.604 1.00 0.00 C ATOM 1028 CD ARG B 765 -5.353 3.114 -10.491 1.00 0.00 C ATOM 1029 NE ARG B 765 -4.235 3.888 -11.106 1.00 0.00 N ATOM 1030 CZ ARG B 765 -4.476 4.883 -11.929 1.00 0.00 C ATOM 1031 NH1 ARG B 765 -5.704 5.226 -12.234 1.00 0.00 N ATOM 1032 NH2 ARG B 765 -3.477 5.539 -12.451 1.00 0.00 N ATOM 0 H ARG B 765 -8.252 0.683 -10.191 1.00 0.00 H new ATOM 0 HA ARG B 765 -7.090 -0.359 -11.915 1.00 0.00 H new ATOM 0 HB2 ARG B 765 -4.599 0.790 -10.543 1.00 0.00 H new ATOM 0 HB3 ARG B 765 -4.787 0.428 -12.247 1.00 0.00 H new ATOM 0 HG2 ARG B 765 -5.517 2.561 -12.574 1.00 0.00 H new ATOM 0 HG3 ARG B 765 -6.941 2.184 -11.625 1.00 0.00 H new ATOM 0 HD2 ARG B 765 -6.146 3.775 -10.141 1.00 0.00 H new ATOM 0 HD3 ARG B 765 -5.010 2.542 -9.629 1.00 0.00 H new ATOM 0 HE ARG B 765 -3.271 3.641 -10.884 1.00 0.00 H new ATOM 0 HH11 ARG B 765 -6.491 4.718 -11.830 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -5.873 6.001 -12.875 1.00 0.00 H new ATOM 0 HH21 ARG B 765 -2.519 5.278 -12.219 1.00 0.00 H new ATOM 0 HH22 ARG B 765 -3.654 6.313 -13.091 1.00 0.00 H new ATOM 1046 N PHE B 766 -4.970 -1.517 -9.681 1.00 0.00 N ATOM 1047 CA PHE B 766 -4.439 -2.797 -9.143 1.00 0.00 C ATOM 1048 C PHE B 766 -4.834 -2.944 -7.668 1.00 0.00 C ATOM 1049 O PHE B 766 -4.070 -2.602 -6.790 1.00 0.00 O ATOM 1050 CB PHE B 766 -2.921 -2.684 -9.275 1.00 0.00 C ATOM 1051 CG PHE B 766 -2.478 -3.342 -10.559 1.00 0.00 C ATOM 1052 CD1 PHE B 766 -2.946 -2.864 -11.789 1.00 0.00 C ATOM 1053 CD2 PHE B 766 -1.603 -4.434 -10.519 1.00 0.00 C ATOM 1054 CE1 PHE B 766 -2.537 -3.476 -12.979 1.00 0.00 C ATOM 1055 CE2 PHE B 766 -1.194 -5.046 -11.710 1.00 0.00 C ATOM 1056 CZ PHE B 766 -1.660 -4.568 -12.940 1.00 0.00 C ATOM 0 H PHE B 766 -4.511 -0.677 -9.328 1.00 0.00 H new ATOM 0 HA PHE B 766 -4.831 -3.665 -9.674 1.00 0.00 H new ATOM 0 HB2 PHE B 766 -2.622 -1.636 -9.269 1.00 0.00 H new ATOM 0 HB3 PHE B 766 -2.435 -3.160 -8.423 1.00 0.00 H new ATOM 0 HD1 PHE B 766 -3.623 -2.023 -11.819 1.00 0.00 H new ATOM 0 HD2 PHE B 766 -1.244 -4.804 -9.570 1.00 0.00 H new ATOM 0 HE1 PHE B 766 -2.897 -3.107 -13.928 1.00 0.00 H new ATOM 0 HE2 PHE B 766 -0.518 -5.888 -11.679 1.00 0.00 H new ATOM 0 HZ PHE B 766 -1.344 -5.040 -13.858 1.00 0.00 H new ATOM 1066 N PRO B 767 -6.029 -3.434 -7.440 1.00 0.00 N ATOM 1067 CA PRO B 767 -6.541 -3.617 -6.060 1.00 0.00 C ATOM 1068 C PRO B 767 -5.472 -4.189 -5.121 1.00 0.00 C ATOM 1069 O PRO B 767 -5.233 -5.379 -5.087 1.00 0.00 O ATOM 1070 CB PRO B 767 -7.696 -4.615 -6.225 1.00 0.00 C ATOM 1071 CG PRO B 767 -7.791 -4.915 -7.695 1.00 0.00 C ATOM 1072 CD PRO B 767 -7.022 -3.854 -8.425 1.00 0.00 C ATOM 0 HA PRO B 767 -6.846 -2.671 -5.613 1.00 0.00 H new ATOM 0 HB2 PRO B 767 -7.508 -5.524 -5.654 1.00 0.00 H new ATOM 0 HB3 PRO B 767 -8.630 -4.193 -5.854 1.00 0.00 H new ATOM 0 HG2 PRO B 767 -7.382 -5.902 -7.912 1.00 0.00 H new ATOM 0 HG3 PRO B 767 -8.832 -4.924 -8.018 1.00 0.00 H new ATOM 0 HD2 PRO B 767 -6.554 -4.244 -9.329 1.00 0.00 H new ATOM 0 HD3 PRO B 767 -7.664 -3.027 -8.729 1.00 0.00 H new ATOM 1080 N MET B 768 -4.857 -3.348 -4.331 1.00 0.00 N ATOM 1081 CA MET B 768 -3.851 -3.842 -3.346 1.00 0.00 C ATOM 1082 C MET B 768 -4.276 -3.428 -1.937 1.00 0.00 C ATOM 1083 O MET B 768 -5.199 -2.657 -1.761 1.00 0.00 O ATOM 1084 CB MET B 768 -2.532 -3.154 -3.718 1.00 0.00 C ATOM 1085 CG MET B 768 -1.898 -3.837 -4.934 1.00 0.00 C ATOM 1086 SD MET B 768 -1.545 -5.577 -4.570 1.00 0.00 S ATOM 1087 CE MET B 768 -0.658 -5.317 -3.015 1.00 0.00 C ATOM 0 H MET B 768 -5.009 -2.339 -4.326 1.00 0.00 H new ATOM 0 HA MET B 768 -3.756 -4.928 -3.366 1.00 0.00 H new ATOM 0 HB2 MET B 768 -2.713 -2.102 -3.937 1.00 0.00 H new ATOM 0 HB3 MET B 768 -1.845 -3.190 -2.873 1.00 0.00 H new ATOM 0 HG2 MET B 768 -2.570 -3.767 -5.789 1.00 0.00 H new ATOM 0 HG3 MET B 768 -0.977 -3.322 -5.209 1.00 0.00 H new ATOM 0 HE1 MET B 768 0.093 -6.097 -2.889 1.00 0.00 H new ATOM 0 HE2 MET B 768 -0.169 -4.343 -3.033 1.00 0.00 H new ATOM 0 HE3 MET B 768 -1.362 -5.354 -2.184 1.00 0.00 H new ATOM 1097 N ASP B 769 -3.613 -3.926 -0.929 1.00 0.00 N ATOM 1098 CA ASP B 769 -3.994 -3.552 0.465 1.00 0.00 C ATOM 1099 C ASP B 769 -3.055 -4.199 1.476 1.00 0.00 C ATOM 1100 O ASP B 769 -2.624 -5.322 1.307 1.00 0.00 O ATOM 1101 CB ASP B 769 -5.412 -4.101 0.655 1.00 0.00 C ATOM 1102 CG ASP B 769 -5.448 -5.587 0.287 1.00 0.00 C ATOM 1103 OD1 ASP B 769 -4.792 -6.360 0.964 1.00 0.00 O ATOM 1104 OD2 ASP B 769 -6.130 -5.924 -0.666 1.00 0.00 O ATOM 0 H ASP B 769 -2.828 -4.572 -1.008 1.00 0.00 H new ATOM 0 HA ASP B 769 -3.938 -2.474 0.618 1.00 0.00 H new ATOM 0 HB2 ASP B 769 -5.728 -3.966 1.689 1.00 0.00 H new ATOM 0 HB3 ASP B 769 -6.113 -3.546 0.032 1.00 0.00 H new ATOM 1109 N LEU B 770 -2.772 -3.517 2.556 1.00 0.00 N ATOM 1110 CA LEU B 770 -1.908 -4.113 3.615 1.00 0.00 C ATOM 1111 C LEU B 770 -2.418 -5.514 3.962 1.00 0.00 C ATOM 1112 O LEU B 770 -1.659 -6.397 4.308 1.00 0.00 O ATOM 1113 CB LEU B 770 -2.055 -3.167 4.819 1.00 0.00 C ATOM 1114 CG LEU B 770 -1.225 -1.888 4.616 1.00 0.00 C ATOM 1115 CD1 LEU B 770 -1.178 -1.112 5.935 1.00 0.00 C ATOM 1116 CD2 LEU B 770 0.205 -2.233 4.189 1.00 0.00 C ATOM 0 H LEU B 770 -3.103 -2.572 2.749 1.00 0.00 H new ATOM 0 HA LEU B 770 -0.868 -4.216 3.306 1.00 0.00 H new ATOM 0 HB2 LEU B 770 -3.105 -2.906 4.956 1.00 0.00 H new ATOM 0 HB3 LEU B 770 -1.732 -3.675 5.728 1.00 0.00 H new ATOM 0 HG LEU B 770 -1.689 -1.287 3.834 1.00 0.00 H new ATOM 0 HD11 LEU B 770 -0.592 -0.203 5.802 1.00 0.00 H new ATOM 0 HD12 LEU B 770 -2.191 -0.849 6.239 1.00 0.00 H new ATOM 0 HD13 LEU B 770 -0.718 -1.731 6.705 1.00 0.00 H new ATOM 0 HD21 LEU B 770 0.775 -1.314 4.051 1.00 0.00 H new ATOM 0 HD22 LEU B 770 0.678 -2.841 4.960 1.00 0.00 H new ATOM 0 HD23 LEU B 770 0.181 -2.789 3.252 1.00 0.00 H new ATOM 1128 N LYS B 771 -3.696 -5.737 3.792 1.00 0.00 N ATOM 1129 CA LYS B 771 -4.269 -7.086 4.043 1.00 0.00 C ATOM 1130 C LYS B 771 -3.434 -8.161 3.346 1.00 0.00 C ATOM 1131 O LYS B 771 -2.972 -9.102 3.960 1.00 0.00 O ATOM 1132 CB LYS B 771 -5.657 -7.023 3.406 1.00 0.00 C ATOM 1133 CG LYS B 771 -6.707 -7.474 4.416 1.00 0.00 C ATOM 1134 CD LYS B 771 -6.614 -8.984 4.641 1.00 0.00 C ATOM 1135 CE LYS B 771 -6.700 -9.728 3.305 1.00 0.00 C ATOM 1136 NZ LYS B 771 -7.467 -10.969 3.606 1.00 0.00 N ATOM 0 H LYS B 771 -4.369 -5.034 3.487 1.00 0.00 H new ATOM 0 HA LYS B 771 -4.293 -7.336 5.104 1.00 0.00 H new ATOM 0 HB2 LYS B 771 -5.870 -6.007 3.075 1.00 0.00 H new ATOM 0 HB3 LYS B 771 -5.691 -7.660 2.522 1.00 0.00 H new ATOM 0 HG2 LYS B 771 -6.562 -6.949 5.360 1.00 0.00 H new ATOM 0 HG3 LYS B 771 -7.703 -7.214 4.056 1.00 0.00 H new ATOM 0 HD2 LYS B 771 -5.676 -9.227 5.140 1.00 0.00 H new ATOM 0 HD3 LYS B 771 -7.419 -9.311 5.299 1.00 0.00 H new ATOM 0 HE2 LYS B 771 -7.204 -9.126 2.549 1.00 0.00 H new ATOM 0 HE3 LYS B 771 -5.708 -9.961 2.918 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 -7.568 -11.534 2.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 -6.960 -11.525 4.324 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 -8.409 -10.716 3.966 1.00 0.00 H new ATOM 1150 N THR B 772 -3.245 -8.025 2.061 1.00 0.00 N ATOM 1151 CA THR B 772 -2.457 -9.042 1.311 1.00 0.00 C ATOM 1152 C THR B 772 -1.051 -8.523 1.001 1.00 0.00 C ATOM 1153 O THR B 772 -0.136 -9.293 0.781 1.00 0.00 O ATOM 1154 CB THR B 772 -3.239 -9.268 0.014 1.00 0.00 C ATOM 1155 OG1 THR B 772 -2.537 -10.193 -0.804 1.00 0.00 O ATOM 1156 CG2 THR B 772 -3.393 -7.942 -0.736 1.00 0.00 C ATOM 0 H THR B 772 -3.603 -7.253 1.499 1.00 0.00 H new ATOM 0 HA THR B 772 -2.330 -9.960 1.884 1.00 0.00 H new ATOM 0 HB THR B 772 -4.226 -9.664 0.253 1.00 0.00 H new ATOM 0 HG1 THR B 772 -3.037 -10.340 -1.634 1.00 0.00 H new ATOM 0 HG21 THR B 772 -3.950 -8.108 -1.658 1.00 0.00 H new ATOM 0 HG22 THR B 772 -3.931 -7.230 -0.110 1.00 0.00 H new ATOM 0 HG23 THR B 772 -2.407 -7.542 -0.975 1.00 0.00 H new ATOM 1164 N MET B 773 -0.862 -7.230 0.975 1.00 0.00 N ATOM 1165 CA MET B 773 0.497 -6.695 0.676 1.00 0.00 C ATOM 1166 C MET B 773 1.487 -7.137 1.755 1.00 0.00 C ATOM 1167 O MET B 773 2.627 -7.448 1.474 1.00 0.00 O ATOM 1168 CB MET B 773 0.347 -5.173 0.687 1.00 0.00 C ATOM 1169 CG MET B 773 1.294 -4.559 -0.350 1.00 0.00 C ATOM 1170 SD MET B 773 3.006 -5.016 0.029 1.00 0.00 S ATOM 1171 CE MET B 773 3.259 -3.843 1.382 1.00 0.00 C ATOM 0 H MET B 773 -1.582 -6.528 1.146 1.00 0.00 H new ATOM 0 HA MET B 773 0.876 -7.058 -0.279 1.00 0.00 H new ATOM 0 HB2 MET B 773 -0.683 -4.897 0.463 1.00 0.00 H new ATOM 0 HB3 MET B 773 0.573 -4.782 1.679 1.00 0.00 H new ATOM 0 HG2 MET B 773 1.028 -4.907 -1.348 1.00 0.00 H new ATOM 0 HG3 MET B 773 1.190 -3.474 -0.352 1.00 0.00 H new ATOM 0 HE1 MET B 773 4.104 -3.195 1.148 1.00 0.00 H new ATOM 0 HE2 MET B 773 2.362 -3.238 1.511 1.00 0.00 H new ATOM 0 HE3 MET B 773 3.464 -4.389 2.303 1.00 0.00 H new ATOM 1181 N SER B 774 1.061 -7.161 2.988 1.00 0.00 N ATOM 1182 CA SER B 774 1.973 -7.597 4.080 1.00 0.00 C ATOM 1183 C SER B 774 2.157 -9.113 4.025 1.00 0.00 C ATOM 1184 O SER B 774 3.217 -9.632 4.310 1.00 0.00 O ATOM 1185 CB SER B 774 1.265 -7.190 5.374 1.00 0.00 C ATOM 1186 OG SER B 774 0.161 -8.053 5.602 1.00 0.00 O ATOM 0 H SER B 774 0.121 -6.898 3.285 1.00 0.00 H new ATOM 0 HA SER B 774 2.963 -7.148 4.001 1.00 0.00 H new ATOM 0 HB2 SER B 774 1.959 -7.241 6.213 1.00 0.00 H new ATOM 0 HB3 SER B 774 0.924 -6.157 5.305 1.00 0.00 H new ATOM 0 HG SER B 774 -0.645 -7.666 5.200 1.00 0.00 H new ATOM 1192 N GLU B 775 1.133 -9.825 3.642 1.00 0.00 N ATOM 1193 CA GLU B 775 1.248 -11.306 3.551 1.00 0.00 C ATOM 1194 C GLU B 775 2.386 -11.693 2.605 1.00 0.00 C ATOM 1195 O GLU B 775 2.898 -12.794 2.651 1.00 0.00 O ATOM 1196 CB GLU B 775 -0.094 -11.769 2.982 1.00 0.00 C ATOM 1197 CG GLU B 775 -1.171 -11.634 4.058 1.00 0.00 C ATOM 1198 CD GLU B 775 -2.434 -12.375 3.615 1.00 0.00 C ATOM 1199 OE1 GLU B 775 -2.302 -13.363 2.911 1.00 0.00 O ATOM 1200 OE2 GLU B 775 -3.512 -11.943 3.989 1.00 0.00 O ATOM 0 H GLU B 775 0.222 -9.444 3.388 1.00 0.00 H new ATOM 0 HA GLU B 775 1.467 -11.762 4.516 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.358 -11.171 2.110 1.00 0.00 H new ATOM 0 HB3 GLU B 775 -0.023 -12.805 2.649 1.00 0.00 H new ATOM 0 HG2 GLU B 775 -0.810 -12.042 5.002 1.00 0.00 H new ATOM 0 HG3 GLU B 775 -1.396 -10.582 4.231 1.00 0.00 H new ATOM 1207 N ARG B 776 2.786 -10.795 1.746 1.00 0.00 N ATOM 1208 CA ARG B 776 3.881 -11.116 0.789 1.00 0.00 C ATOM 1209 C ARG B 776 5.215 -11.220 1.517 1.00 0.00 C ATOM 1210 O ARG B 776 5.931 -12.182 1.364 1.00 0.00 O ATOM 1211 CB ARG B 776 3.909 -9.948 -0.190 1.00 0.00 C ATOM 1212 CG ARG B 776 2.531 -9.797 -0.832 1.00 0.00 C ATOM 1213 CD ARG B 776 2.565 -10.342 -2.260 1.00 0.00 C ATOM 1214 NE ARG B 776 2.245 -11.793 -2.123 1.00 0.00 N ATOM 1215 CZ ARG B 776 1.024 -12.191 -1.852 1.00 0.00 C ATOM 1216 NH1 ARG B 776 0.051 -11.327 -1.692 1.00 0.00 N ATOM 1217 NH2 ARG B 776 0.774 -13.467 -1.739 1.00 0.00 N ATOM 0 H ARG B 776 2.402 -9.854 1.666 1.00 0.00 H new ATOM 0 HA ARG B 776 3.715 -12.070 0.289 1.00 0.00 H new ATOM 0 HB2 ARG B 776 4.184 -9.030 0.329 1.00 0.00 H new ATOM 0 HB3 ARG B 776 4.664 -10.119 -0.957 1.00 0.00 H new ATOM 0 HG2 ARG B 776 1.785 -10.333 -0.245 1.00 0.00 H new ATOM 0 HG3 ARG B 776 2.236 -8.748 -0.840 1.00 0.00 H new ATOM 0 HD2 ARG B 776 1.838 -9.835 -2.894 1.00 0.00 H new ATOM 0 HD3 ARG B 776 3.544 -10.194 -2.716 1.00 0.00 H new ATOM 0 HE ARG B 776 2.985 -12.485 -2.242 1.00 0.00 H new ATOM 0 HH11 ARG B 776 0.237 -10.328 -1.778 1.00 0.00 H new ATOM 0 HH12 ARG B 776 -0.892 -11.654 -1.482 1.00 0.00 H new ATOM 0 HH21 ARG B 776 1.525 -14.147 -1.861 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -0.172 -13.785 -1.529 1.00 0.00 H new ATOM 1231 N LEU B 777 5.566 -10.236 2.305 1.00 0.00 N ATOM 1232 CA LEU B 777 6.866 -10.310 3.033 1.00 0.00 C ATOM 1233 C LEU B 777 6.952 -11.626 3.805 1.00 0.00 C ATOM 1234 O LEU B 777 8.002 -12.227 3.915 1.00 0.00 O ATOM 1235 CB LEU B 777 6.871 -9.118 3.990 1.00 0.00 C ATOM 1236 CG LEU B 777 8.261 -8.473 3.978 1.00 0.00 C ATOM 1237 CD1 LEU B 777 8.135 -6.994 3.609 1.00 0.00 C ATOM 1238 CD2 LEU B 777 8.900 -8.608 5.362 1.00 0.00 C ATOM 0 H LEU B 777 5.015 -9.394 2.474 1.00 0.00 H new ATOM 0 HA LEU B 777 7.720 -10.277 2.356 1.00 0.00 H new ATOM 0 HB2 LEU B 777 6.116 -8.391 3.690 1.00 0.00 H new ATOM 0 HB3 LEU B 777 6.616 -9.444 4.998 1.00 0.00 H new ATOM 0 HG LEU B 777 8.889 -8.975 3.242 1.00 0.00 H new ATOM 0 HD11 LEU B 777 9.124 -6.536 3.601 1.00 0.00 H new ATOM 0 HD12 LEU B 777 7.684 -6.903 2.621 1.00 0.00 H new ATOM 0 HD13 LEU B 777 7.507 -6.488 4.342 1.00 0.00 H new ATOM 0 HD21 LEU B 777 9.889 -8.149 5.353 1.00 0.00 H new ATOM 0 HD22 LEU B 777 8.275 -8.108 6.102 1.00 0.00 H new ATOM 0 HD23 LEU B 777 8.992 -9.663 5.619 1.00 0.00 H new ATOM 1250 N LYS B 778 5.844 -12.099 4.306 1.00 0.00 N ATOM 1251 CA LYS B 778 5.853 -13.410 5.006 1.00 0.00 C ATOM 1252 C LYS B 778 6.246 -14.498 4.008 1.00 0.00 C ATOM 1253 O LYS B 778 6.834 -15.502 4.360 1.00 0.00 O ATOM 1254 CB LYS B 778 4.416 -13.613 5.493 1.00 0.00 C ATOM 1255 CG LYS B 778 4.023 -12.458 6.418 1.00 0.00 C ATOM 1256 CD LYS B 778 2.619 -12.706 6.972 1.00 0.00 C ATOM 1257 CE LYS B 778 2.299 -11.655 8.037 1.00 0.00 C ATOM 1258 NZ LYS B 778 2.777 -12.253 9.315 1.00 0.00 N ATOM 0 H LYS B 778 4.937 -11.635 4.260 1.00 0.00 H new ATOM 0 HA LYS B 778 6.560 -13.448 5.835 1.00 0.00 H new ATOM 0 HB2 LYS B 778 3.736 -13.660 4.643 1.00 0.00 H new ATOM 0 HB3 LYS B 778 4.331 -14.562 6.022 1.00 0.00 H new ATOM 0 HG2 LYS B 778 4.739 -12.373 7.236 1.00 0.00 H new ATOM 0 HG3 LYS B 778 4.049 -11.515 5.872 1.00 0.00 H new ATOM 0 HD2 LYS B 778 1.885 -12.659 6.167 1.00 0.00 H new ATOM 0 HD3 LYS B 778 2.557 -13.706 7.402 1.00 0.00 H new ATOM 0 HE2 LYS B 778 2.805 -10.712 7.827 1.00 0.00 H new ATOM 0 HE3 LYS B 778 1.231 -11.442 8.075 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 2.594 -11.593 10.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 2.273 -13.146 9.490 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 3.798 -12.439 9.251 1.00 0.00 H new ATOM 1272 N ASN B 779 5.949 -14.283 2.753 1.00 0.00 N ATOM 1273 CA ASN B 779 6.337 -15.268 1.706 1.00 0.00 C ATOM 1274 C ASN B 779 7.398 -14.664 0.780 1.00 0.00 C ATOM 1275 O ASN B 779 7.658 -15.171 -0.293 1.00 0.00 O ATOM 1276 CB ASN B 779 5.048 -15.517 0.922 1.00 0.00 C ATOM 1277 CG ASN B 779 4.916 -17.009 0.619 1.00 0.00 C ATOM 1278 OD1 ASN B 779 4.647 -17.836 1.591 1.00 0.00 O flip ATOM 1279 ND2 ASN B 779 5.059 -17.427 -0.513 1.00 0.00 N flip ATOM 0 H ASN B 779 5.451 -13.462 2.409 1.00 0.00 H new ATOM 0 HA ASN B 779 6.757 -16.181 2.129 1.00 0.00 H new ATOM 0 HB2 ASN B 779 4.188 -15.174 1.497 1.00 0.00 H new ATOM 0 HB3 ASN B 779 5.058 -14.946 -0.006 1.00 0.00 H new ATOM 0 HD21 ASN B 779 5.269 -16.780 -1.273 1.00 0.00 H new ATOM 0 HD22 ASN B 779 4.969 -18.425 -0.703 1.00 0.00 H new ATOM 1286 N ARG B 780 7.990 -13.565 1.176 1.00 0.00 N ATOM 1287 CA ARG B 780 8.990 -12.882 0.309 1.00 0.00 C ATOM 1288 C ARG B 780 8.505 -12.787 -1.137 1.00 0.00 C ATOM 1289 O ARG B 780 9.182 -13.196 -2.059 1.00 0.00 O ATOM 1290 CB ARG B 780 10.255 -13.718 0.380 1.00 0.00 C ATOM 1291 CG ARG B 780 11.323 -13.021 -0.460 1.00 0.00 C ATOM 1292 CD ARG B 780 11.873 -13.995 -1.492 1.00 0.00 C ATOM 1293 NE ARG B 780 12.713 -14.952 -0.713 1.00 0.00 N ATOM 1294 CZ ARG B 780 13.431 -15.869 -1.320 1.00 0.00 C ATOM 1295 NH1 ARG B 780 13.434 -15.969 -2.627 1.00 0.00 N ATOM 1296 NH2 ARG B 780 14.154 -16.692 -0.611 1.00 0.00 N ATOM 0 H ARG B 780 7.819 -13.110 2.073 1.00 0.00 H new ATOM 0 HA ARG B 780 9.158 -11.861 0.651 1.00 0.00 H new ATOM 0 HB2 ARG B 780 10.588 -13.820 1.413 1.00 0.00 H new ATOM 0 HB3 ARG B 780 10.070 -14.724 0.004 1.00 0.00 H new ATOM 0 HG2 ARG B 780 10.898 -12.149 -0.957 1.00 0.00 H new ATOM 0 HG3 ARG B 780 12.128 -12.661 0.181 1.00 0.00 H new ATOM 0 HD2 ARG B 780 11.068 -14.512 -2.015 1.00 0.00 H new ATOM 0 HD3 ARG B 780 12.463 -13.477 -2.248 1.00 0.00 H new ATOM 0 HE ARG B 780 12.730 -14.893 0.305 1.00 0.00 H new ATOM 0 HH11 ARG B 780 12.873 -15.329 -3.189 1.00 0.00 H new ATOM 0 HH12 ARG B 780 13.997 -16.687 -3.082 1.00 0.00 H new ATOM 0 HH21 ARG B 780 14.159 -16.620 0.406 1.00 0.00 H new ATOM 0 HH22 ARG B 780 14.715 -17.407 -1.074 1.00 0.00 H new ATOM 1310 N TYR B 781 7.347 -12.239 -1.343 1.00 0.00 N ATOM 1311 CA TYR B 781 6.856 -12.048 -2.733 1.00 0.00 C ATOM 1312 C TYR B 781 7.110 -10.599 -3.159 1.00 0.00 C ATOM 1313 O TYR B 781 7.145 -10.279 -4.331 1.00 0.00 O ATOM 1314 CB TYR B 781 5.357 -12.345 -2.680 1.00 0.00 C ATOM 1315 CG TYR B 781 5.087 -13.678 -3.334 1.00 0.00 C ATOM 1316 CD1 TYR B 781 5.523 -14.860 -2.723 1.00 0.00 C ATOM 1317 CD2 TYR B 781 4.404 -13.733 -4.555 1.00 0.00 C ATOM 1318 CE1 TYR B 781 5.275 -16.096 -3.332 1.00 0.00 C ATOM 1319 CE2 TYR B 781 4.156 -14.969 -5.164 1.00 0.00 C ATOM 1320 CZ TYR B 781 4.590 -16.151 -4.552 1.00 0.00 C ATOM 1321 OH TYR B 781 4.346 -17.369 -5.153 1.00 0.00 O ATOM 0 H TYR B 781 6.717 -11.914 -0.610 1.00 0.00 H new ATOM 0 HA TYR B 781 7.359 -12.695 -3.451 1.00 0.00 H new ATOM 0 HB2 TYR B 781 5.014 -12.359 -1.645 1.00 0.00 H new ATOM 0 HB3 TYR B 781 4.801 -11.558 -3.190 1.00 0.00 H new ATOM 0 HD1 TYR B 781 6.051 -14.818 -1.782 1.00 0.00 H new ATOM 0 HD2 TYR B 781 4.068 -12.822 -5.027 1.00 0.00 H new ATOM 0 HE1 TYR B 781 5.612 -17.007 -2.861 1.00 0.00 H new ATOM 0 HE2 TYR B 781 3.630 -15.011 -6.106 1.00 0.00 H new ATOM 0 HH TYR B 781 3.860 -17.228 -5.992 1.00 0.00 H new ATOM 1331 N TYR B 782 7.305 -9.726 -2.205 1.00 0.00 N ATOM 1332 CA TYR B 782 7.619 -8.305 -2.531 1.00 0.00 C ATOM 1333 C TYR B 782 8.864 -7.886 -1.751 1.00 0.00 C ATOM 1334 O TYR B 782 8.830 -6.981 -0.941 1.00 0.00 O ATOM 1335 CB TYR B 782 6.407 -7.492 -2.060 1.00 0.00 C ATOM 1336 CG TYR B 782 5.268 -7.591 -3.054 1.00 0.00 C ATOM 1337 CD1 TYR B 782 5.515 -7.579 -4.436 1.00 0.00 C ATOM 1338 CD2 TYR B 782 3.950 -7.654 -2.585 1.00 0.00 C ATOM 1339 CE1 TYR B 782 4.448 -7.655 -5.339 1.00 0.00 C ATOM 1340 CE2 TYR B 782 2.884 -7.724 -3.491 1.00 0.00 C ATOM 1341 CZ TYR B 782 3.133 -7.729 -4.867 1.00 0.00 C ATOM 1342 OH TYR B 782 2.083 -7.805 -5.758 1.00 0.00 O ATOM 0 H TYR B 782 7.260 -9.939 -1.208 1.00 0.00 H new ATOM 0 HA TYR B 782 7.810 -8.153 -3.593 1.00 0.00 H new ATOM 0 HB2 TYR B 782 6.077 -7.855 -1.086 1.00 0.00 H new ATOM 0 HB3 TYR B 782 6.693 -6.448 -1.931 1.00 0.00 H new ATOM 0 HD1 TYR B 782 6.529 -7.511 -4.803 1.00 0.00 H new ATOM 0 HD2 TYR B 782 3.755 -7.649 -1.523 1.00 0.00 H new ATOM 0 HE1 TYR B 782 4.640 -7.657 -6.402 1.00 0.00 H new ATOM 0 HE2 TYR B 782 1.869 -7.774 -3.126 1.00 0.00 H new ATOM 0 HH TYR B 782 1.561 -6.977 -5.720 1.00 0.00 H new ATOM 1352 N VAL B 783 9.953 -8.571 -1.959 1.00 0.00 N ATOM 1353 CA VAL B 783 11.187 -8.269 -1.185 1.00 0.00 C ATOM 1354 C VAL B 783 12.163 -7.411 -2.007 1.00 0.00 C ATOM 1355 O VAL B 783 13.310 -7.766 -2.190 1.00 0.00 O ATOM 1356 CB VAL B 783 11.775 -9.654 -0.873 1.00 0.00 C ATOM 1357 CG1 VAL B 783 12.399 -10.273 -2.132 1.00 0.00 C ATOM 1358 CG2 VAL B 783 12.837 -9.525 0.216 1.00 0.00 C ATOM 0 H VAL B 783 10.041 -9.330 -2.635 1.00 0.00 H new ATOM 0 HA VAL B 783 10.988 -7.690 -0.283 1.00 0.00 H new ATOM 0 HB VAL B 783 10.972 -10.305 -0.527 1.00 0.00 H new ATOM 0 HG11 VAL B 783 12.810 -11.253 -1.890 1.00 0.00 H new ATOM 0 HG12 VAL B 783 11.635 -10.380 -2.902 1.00 0.00 H new ATOM 0 HG13 VAL B 783 13.196 -9.626 -2.499 1.00 0.00 H new ATOM 0 HG21 VAL B 783 13.253 -10.508 0.436 1.00 0.00 H new ATOM 0 HG22 VAL B 783 13.632 -8.863 -0.128 1.00 0.00 H new ATOM 0 HG23 VAL B 783 12.385 -9.112 1.118 1.00 0.00 H new ATOM 1368 N SER B 784 11.725 -6.278 -2.486 1.00 0.00 N ATOM 1369 CA SER B 784 12.637 -5.409 -3.285 1.00 0.00 C ATOM 1370 C SER B 784 12.180 -3.949 -3.228 1.00 0.00 C ATOM 1371 O SER B 784 11.606 -3.507 -2.254 1.00 0.00 O ATOM 1372 CB SER B 784 12.532 -5.945 -4.713 1.00 0.00 C ATOM 1373 OG SER B 784 12.613 -7.363 -4.694 1.00 0.00 O ATOM 0 H SER B 784 10.779 -5.917 -2.360 1.00 0.00 H new ATOM 0 HA SER B 784 13.659 -5.430 -2.908 1.00 0.00 H new ATOM 0 HB2 SER B 784 11.590 -5.630 -5.163 1.00 0.00 H new ATOM 0 HB3 SER B 784 13.332 -5.533 -5.327 1.00 0.00 H new ATOM 0 HG SER B 784 13.175 -7.649 -3.944 1.00 0.00 H new ATOM 1379 N LYS B 785 12.441 -3.192 -4.259 1.00 0.00 N ATOM 1380 CA LYS B 785 12.022 -1.761 -4.258 1.00 0.00 C ATOM 1381 C LYS B 785 10.846 -1.550 -5.213 1.00 0.00 C ATOM 1382 O LYS B 785 9.734 -1.295 -4.796 1.00 0.00 O ATOM 1383 CB LYS B 785 13.250 -0.990 -4.746 1.00 0.00 C ATOM 1384 CG LYS B 785 14.423 -1.242 -3.796 1.00 0.00 C ATOM 1385 CD LYS B 785 14.833 0.074 -3.131 1.00 0.00 C ATOM 1386 CE LYS B 785 16.068 0.636 -3.837 1.00 0.00 C ATOM 1387 NZ LYS B 785 17.135 0.635 -2.798 1.00 0.00 N ATOM 0 H LYS B 785 12.926 -3.502 -5.101 1.00 0.00 H new ATOM 0 HA LYS B 785 11.694 -1.429 -3.273 1.00 0.00 H new ATOM 0 HB2 LYS B 785 13.512 -1.305 -5.756 1.00 0.00 H new ATOM 0 HB3 LYS B 785 13.028 0.076 -4.792 1.00 0.00 H new ATOM 0 HG2 LYS B 785 14.140 -1.972 -3.038 1.00 0.00 H new ATOM 0 HG3 LYS B 785 15.266 -1.662 -4.345 1.00 0.00 H new ATOM 0 HD2 LYS B 785 14.014 0.791 -3.182 1.00 0.00 H new ATOM 0 HD3 LYS B 785 15.047 -0.091 -2.075 1.00 0.00 H new ATOM 0 HE2 LYS B 785 16.348 0.021 -4.692 1.00 0.00 H new ATOM 0 HE3 LYS B 785 15.884 1.642 -4.214 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 18.067 0.692 -3.257 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 17.008 1.454 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 17.077 -0.241 -2.241 1.00 0.00 H new ATOM 1401 N LYS B 786 11.079 -1.664 -6.494 1.00 0.00 N ATOM 1402 CA LYS B 786 9.974 -1.472 -7.479 1.00 0.00 C ATOM 1403 C LYS B 786 8.752 -2.306 -7.085 1.00 0.00 C ATOM 1404 O LYS B 786 7.631 -1.985 -7.425 1.00 0.00 O ATOM 1405 CB LYS B 786 10.547 -1.969 -8.807 1.00 0.00 C ATOM 1406 CG LYS B 786 9.999 -1.115 -9.952 1.00 0.00 C ATOM 1407 CD LYS B 786 8.987 -1.931 -10.759 1.00 0.00 C ATOM 1408 CE LYS B 786 7.647 -1.193 -10.790 1.00 0.00 C ATOM 1409 NZ LYS B 786 7.749 -0.266 -11.952 1.00 0.00 N ATOM 0 H LYS B 786 11.988 -1.882 -6.901 1.00 0.00 H new ATOM 0 HA LYS B 786 9.645 -0.434 -7.530 1.00 0.00 H new ATOM 0 HB2 LYS B 786 11.636 -1.915 -8.788 1.00 0.00 H new ATOM 0 HB3 LYS B 786 10.282 -3.015 -8.961 1.00 0.00 H new ATOM 0 HG2 LYS B 786 9.525 -0.217 -9.555 1.00 0.00 H new ATOM 0 HG3 LYS B 786 10.814 -0.786 -10.597 1.00 0.00 H new ATOM 0 HD2 LYS B 786 9.354 -2.084 -11.774 1.00 0.00 H new ATOM 0 HD3 LYS B 786 8.861 -2.918 -10.313 1.00 0.00 H new ATOM 0 HE2 LYS B 786 6.816 -1.888 -10.910 1.00 0.00 H new ATOM 0 HE3 LYS B 786 7.475 -0.647 -9.862 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 6.867 0.278 -12.041 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 8.545 0.387 -11.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 7.906 -0.815 -12.821 1.00 0.00 H new ATOM 1423 N LEU B 787 8.965 -3.379 -6.374 1.00 0.00 N ATOM 1424 CA LEU B 787 7.822 -4.238 -5.957 1.00 0.00 C ATOM 1425 C LEU B 787 7.119 -3.642 -4.736 1.00 0.00 C ATOM 1426 O LEU B 787 5.967 -3.261 -4.795 1.00 0.00 O ATOM 1427 CB LEU B 787 8.462 -5.581 -5.600 1.00 0.00 C ATOM 1428 CG LEU B 787 8.613 -6.425 -6.868 1.00 0.00 C ATOM 1429 CD1 LEU B 787 9.270 -7.761 -6.516 1.00 0.00 C ATOM 1430 CD2 LEU B 787 7.234 -6.681 -7.479 1.00 0.00 C ATOM 0 H LEU B 787 9.883 -3.698 -6.064 1.00 0.00 H new ATOM 0 HA LEU B 787 7.067 -4.330 -6.738 1.00 0.00 H new ATOM 0 HB2 LEU B 787 9.436 -5.421 -5.138 1.00 0.00 H new ATOM 0 HB3 LEU B 787 7.846 -6.107 -4.871 1.00 0.00 H new ATOM 0 HG LEU B 787 9.235 -5.892 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU B 787 9.378 -8.362 -7.419 1.00 0.00 H new ATOM 0 HD12 LEU B 787 10.253 -7.580 -6.081 1.00 0.00 H new ATOM 0 HD13 LEU B 787 8.648 -8.294 -5.797 1.00 0.00 H new ATOM 0 HD21 LEU B 787 7.342 -7.282 -8.382 1.00 0.00 H new ATOM 0 HD22 LEU B 787 6.611 -7.214 -6.761 1.00 0.00 H new ATOM 0 HD23 LEU B 787 6.765 -5.730 -7.730 1.00 0.00 H new ATOM 1442 N PHE B 788 7.804 -3.564 -3.629 1.00 0.00 N ATOM 1443 CA PHE B 788 7.178 -3.002 -2.399 1.00 0.00 C ATOM 1444 C PHE B 788 6.764 -1.549 -2.624 1.00 0.00 C ATOM 1445 O PHE B 788 5.623 -1.182 -2.426 1.00 0.00 O ATOM 1446 CB PHE B 788 8.276 -3.090 -1.341 1.00 0.00 C ATOM 1447 CG PHE B 788 7.783 -2.512 -0.036 1.00 0.00 C ATOM 1448 CD1 PHE B 788 7.955 -1.149 0.244 1.00 0.00 C ATOM 1449 CD2 PHE B 788 7.174 -3.348 0.907 1.00 0.00 C ATOM 1450 CE1 PHE B 788 7.505 -0.624 1.461 1.00 0.00 C ATOM 1451 CE2 PHE B 788 6.724 -2.822 2.123 1.00 0.00 C ATOM 1452 CZ PHE B 788 6.891 -1.461 2.400 1.00 0.00 C ATOM 0 H PHE B 788 8.772 -3.866 -3.523 1.00 0.00 H new ATOM 0 HA PHE B 788 6.275 -3.539 -2.108 1.00 0.00 H new ATOM 0 HB2 PHE B 788 8.573 -4.129 -1.199 1.00 0.00 H new ATOM 0 HB3 PHE B 788 9.160 -2.549 -1.677 1.00 0.00 H new ATOM 0 HD1 PHE B 788 8.434 -0.505 -0.478 1.00 0.00 H new ATOM 0 HD2 PHE B 788 7.051 -4.400 0.696 1.00 0.00 H new ATOM 0 HE1 PHE B 788 7.632 0.427 1.676 1.00 0.00 H new ATOM 0 HE2 PHE B 788 6.248 -3.466 2.847 1.00 0.00 H new ATOM 0 HZ PHE B 788 6.546 -1.056 3.340 1.00 0.00 H new ATOM 1462 N MET B 789 7.680 -0.717 -3.042 1.00 0.00 N ATOM 1463 CA MET B 789 7.332 0.712 -3.281 1.00 0.00 C ATOM 1464 C MET B 789 6.108 0.816 -4.192 1.00 0.00 C ATOM 1465 O MET B 789 5.320 1.732 -4.084 1.00 0.00 O ATOM 1466 CB MET B 789 8.559 1.305 -3.972 1.00 0.00 C ATOM 1467 CG MET B 789 9.727 1.355 -2.982 1.00 0.00 C ATOM 1468 SD MET B 789 10.190 3.078 -2.678 1.00 0.00 S ATOM 1469 CE MET B 789 8.817 3.478 -1.571 1.00 0.00 C ATOM 0 H MET B 789 8.652 -0.965 -3.228 1.00 0.00 H new ATOM 0 HA MET B 789 7.086 1.236 -2.357 1.00 0.00 H new ATOM 0 HB2 MET B 789 8.829 0.702 -4.839 1.00 0.00 H new ATOM 0 HB3 MET B 789 8.335 2.307 -4.338 1.00 0.00 H new ATOM 0 HG2 MET B 789 9.445 0.873 -2.046 1.00 0.00 H new ATOM 0 HG3 MET B 789 10.579 0.804 -3.380 1.00 0.00 H new ATOM 0 HE1 MET B 789 9.178 4.103 -0.755 1.00 0.00 H new ATOM 0 HE2 MET B 789 8.047 4.014 -2.125 1.00 0.00 H new ATOM 0 HE3 MET B 789 8.397 2.558 -1.165 1.00 0.00 H new ATOM 1479 N ALA B 790 5.938 -0.121 -5.084 1.00 0.00 N ATOM 1480 CA ALA B 790 4.757 -0.077 -5.989 1.00 0.00 C ATOM 1481 C ALA B 790 3.490 -0.446 -5.220 1.00 0.00 C ATOM 1482 O ALA B 790 2.556 0.325 -5.135 1.00 0.00 O ATOM 1483 CB ALA B 790 5.041 -1.125 -7.066 1.00 0.00 C ATOM 0 H ALA B 790 6.565 -0.913 -5.224 1.00 0.00 H new ATOM 0 HA ALA B 790 4.602 0.916 -6.412 1.00 0.00 H new ATOM 0 HB1 ALA B 790 4.213 -1.153 -7.774 1.00 0.00 H new ATOM 0 HB2 ALA B 790 5.960 -0.866 -7.592 1.00 0.00 H new ATOM 0 HB3 ALA B 790 5.153 -2.104 -6.600 1.00 0.00 H new ATOM 1489 N ASP B 791 3.453 -1.623 -4.659 1.00 0.00 N ATOM 1490 CA ASP B 791 2.248 -2.049 -3.896 1.00 0.00 C ATOM 1491 C ASP B 791 1.912 -1.022 -2.815 1.00 0.00 C ATOM 1492 O ASP B 791 0.781 -0.601 -2.677 1.00 0.00 O ATOM 1493 CB ASP B 791 2.637 -3.384 -3.260 1.00 0.00 C ATOM 1494 CG ASP B 791 2.744 -4.454 -4.349 1.00 0.00 C ATOM 1495 OD1 ASP B 791 3.790 -4.536 -4.970 1.00 0.00 O ATOM 1496 OD2 ASP B 791 1.776 -5.170 -4.545 1.00 0.00 O ATOM 0 H ASP B 791 4.207 -2.309 -4.697 1.00 0.00 H new ATOM 0 HA ASP B 791 1.368 -2.138 -4.533 1.00 0.00 H new ATOM 0 HB2 ASP B 791 3.588 -3.286 -2.736 1.00 0.00 H new ATOM 0 HB3 ASP B 791 1.893 -3.677 -2.519 1.00 0.00 H new ATOM 1501 N LEU B 792 2.884 -0.616 -2.045 1.00 0.00 N ATOM 1502 CA LEU B 792 2.611 0.385 -0.977 1.00 0.00 C ATOM 1503 C LEU B 792 2.184 1.714 -1.599 1.00 0.00 C ATOM 1504 O LEU B 792 1.137 2.244 -1.285 1.00 0.00 O ATOM 1505 CB LEU B 792 3.932 0.542 -0.224 1.00 0.00 C ATOM 1506 CG LEU B 792 3.660 0.495 1.280 1.00 0.00 C ATOM 1507 CD1 LEU B 792 3.295 -0.934 1.687 1.00 0.00 C ATOM 1508 CD2 LEU B 792 4.908 0.938 2.043 1.00 0.00 C ATOM 0 H LEU B 792 3.851 -0.933 -2.109 1.00 0.00 H new ATOM 0 HA LEU B 792 1.805 0.070 -0.314 1.00 0.00 H new ATOM 0 HB2 LEU B 792 4.622 -0.253 -0.506 1.00 0.00 H new ATOM 0 HB3 LEU B 792 4.407 1.486 -0.491 1.00 0.00 H new ATOM 0 HG LEU B 792 2.834 1.165 1.519 1.00 0.00 H new ATOM 0 HD11 LEU B 792 3.101 -0.969 2.759 1.00 0.00 H new ATOM 0 HD12 LEU B 792 2.403 -1.250 1.146 1.00 0.00 H new ATOM 0 HD13 LEU B 792 4.121 -1.603 1.446 1.00 0.00 H new ATOM 0 HD21 LEU B 792 4.711 0.903 3.114 1.00 0.00 H new ATOM 0 HD22 LEU B 792 5.736 0.271 1.805 1.00 0.00 H new ATOM 0 HD23 LEU B 792 5.168 1.956 1.755 1.00 0.00 H new ATOM 1520 N GLN B 793 2.971 2.253 -2.493 1.00 0.00 N ATOM 1521 CA GLN B 793 2.577 3.539 -3.139 1.00 0.00 C ATOM 1522 C GLN B 793 1.186 3.401 -3.754 1.00 0.00 C ATOM 1523 O GLN B 793 0.340 4.261 -3.605 1.00 0.00 O ATOM 1524 CB GLN B 793 3.619 3.781 -4.230 1.00 0.00 C ATOM 1525 CG GLN B 793 3.357 5.137 -4.888 1.00 0.00 C ATOM 1526 CD GLN B 793 2.448 4.949 -6.104 1.00 0.00 C ATOM 1527 OE1 GLN B 793 2.130 3.836 -6.473 1.00 0.00 O ATOM 1528 NE2 GLN B 793 2.012 5.998 -6.747 1.00 0.00 N ATOM 0 H GLN B 793 3.861 1.863 -2.801 1.00 0.00 H new ATOM 0 HA GLN B 793 2.540 4.364 -2.428 1.00 0.00 H new ATOM 0 HB2 GLN B 793 4.621 3.759 -3.803 1.00 0.00 H new ATOM 0 HB3 GLN B 793 3.573 2.987 -4.976 1.00 0.00 H new ATOM 0 HG2 GLN B 793 2.890 5.815 -4.174 1.00 0.00 H new ATOM 0 HG3 GLN B 793 4.299 5.593 -5.192 1.00 0.00 H new ATOM 0 HE21 GLN B 793 2.278 6.933 -6.438 1.00 0.00 H new ATOM 0 HE22 GLN B 793 1.405 5.883 -7.558 1.00 0.00 H new ATOM 1537 N ARG B 794 0.934 2.312 -4.427 1.00 0.00 N ATOM 1538 CA ARG B 794 -0.414 2.102 -5.015 1.00 0.00 C ATOM 1539 C ARG B 794 -1.466 2.153 -3.907 1.00 0.00 C ATOM 1540 O ARG B 794 -2.332 3.001 -3.905 1.00 0.00 O ATOM 1541 CB ARG B 794 -0.357 0.710 -5.648 1.00 0.00 C ATOM 1542 CG ARG B 794 0.013 0.840 -7.127 1.00 0.00 C ATOM 1543 CD ARG B 794 -1.259 1.020 -7.962 1.00 0.00 C ATOM 1544 NE ARG B 794 -0.772 1.426 -9.313 1.00 0.00 N ATOM 1545 CZ ARG B 794 -0.232 0.547 -10.127 1.00 0.00 C ATOM 1546 NH1 ARG B 794 -0.108 -0.710 -9.777 1.00 0.00 N ATOM 1547 NH2 ARG B 794 0.185 0.932 -11.302 1.00 0.00 N ATOM 0 H ARG B 794 1.604 1.561 -4.594 1.00 0.00 H new ATOM 0 HA ARG B 794 -0.680 2.864 -5.748 1.00 0.00 H new ATOM 0 HB2 ARG B 794 0.378 0.093 -5.131 1.00 0.00 H new ATOM 0 HB3 ARG B 794 -1.321 0.212 -5.545 1.00 0.00 H new ATOM 0 HG2 ARG B 794 0.679 1.691 -7.272 1.00 0.00 H new ATOM 0 HG3 ARG B 794 0.554 -0.047 -7.456 1.00 0.00 H new ATOM 0 HD2 ARG B 794 -1.835 0.096 -8.010 1.00 0.00 H new ATOM 0 HD3 ARG B 794 -1.911 1.780 -7.531 1.00 0.00 H new ATOM 0 HE ARG B 794 -0.859 2.398 -9.608 1.00 0.00 H new ATOM 0 HH11 ARG B 794 -0.433 -1.019 -8.861 1.00 0.00 H new ATOM 0 HH12 ARG B 794 0.313 -1.379 -10.421 1.00 0.00 H new ATOM 0 HH21 ARG B 794 0.091 1.908 -11.582 1.00 0.00 H new ATOM 0 HH22 ARG B 794 0.605 0.257 -11.940 1.00 0.00 H new ATOM 1561 N VAL B 795 -1.360 1.281 -2.934 1.00 0.00 N ATOM 1562 CA VAL B 795 -2.329 1.282 -1.798 1.00 0.00 C ATOM 1563 C VAL B 795 -2.504 2.703 -1.253 1.00 0.00 C ATOM 1564 O VAL B 795 -3.538 3.052 -0.725 1.00 0.00 O ATOM 1565 CB VAL B 795 -1.695 0.380 -0.733 1.00 0.00 C ATOM 1566 CG1 VAL B 795 -2.537 0.423 0.547 1.00 0.00 C ATOM 1567 CG2 VAL B 795 -1.636 -1.061 -1.249 1.00 0.00 C ATOM 0 H VAL B 795 -0.637 0.564 -2.880 1.00 0.00 H new ATOM 0 HA VAL B 795 -3.316 0.930 -2.099 1.00 0.00 H new ATOM 0 HB VAL B 795 -0.687 0.734 -0.519 1.00 0.00 H new ATOM 0 HG11 VAL B 795 -2.084 -0.219 1.302 1.00 0.00 H new ATOM 0 HG12 VAL B 795 -2.581 1.446 0.920 1.00 0.00 H new ATOM 0 HG13 VAL B 795 -3.546 0.072 0.331 1.00 0.00 H new ATOM 0 HG21 VAL B 795 -1.185 -1.701 -0.491 1.00 0.00 H new ATOM 0 HG22 VAL B 795 -2.645 -1.411 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL B 795 -1.036 -1.098 -2.158 1.00 0.00 H new ATOM 1577 N PHE B 796 -1.493 3.518 -1.366 1.00 0.00 N ATOM 1578 CA PHE B 796 -1.603 4.913 -0.856 1.00 0.00 C ATOM 1579 C PHE B 796 -2.347 5.793 -1.861 1.00 0.00 C ATOM 1580 O PHE B 796 -3.229 6.548 -1.502 1.00 0.00 O ATOM 1581 CB PHE B 796 -0.159 5.389 -0.694 1.00 0.00 C ATOM 1582 CG PHE B 796 0.434 4.773 0.551 1.00 0.00 C ATOM 1583 CD1 PHE B 796 -0.275 4.816 1.757 1.00 0.00 C ATOM 1584 CD2 PHE B 796 1.690 4.156 0.499 1.00 0.00 C ATOM 1585 CE1 PHE B 796 0.271 4.243 2.911 1.00 0.00 C ATOM 1586 CE2 PHE B 796 2.235 3.581 1.653 1.00 0.00 C ATOM 1587 CZ PHE B 796 1.527 3.625 2.859 1.00 0.00 C ATOM 0 H PHE B 796 -0.596 3.279 -1.789 1.00 0.00 H new ATOM 0 HA PHE B 796 -2.160 4.965 0.080 1.00 0.00 H new ATOM 0 HB2 PHE B 796 0.429 5.108 -1.568 1.00 0.00 H new ATOM 0 HB3 PHE B 796 -0.128 6.476 -0.626 1.00 0.00 H new ATOM 0 HD1 PHE B 796 -1.244 5.292 1.797 1.00 0.00 H new ATOM 0 HD2 PHE B 796 2.238 4.124 -0.431 1.00 0.00 H new ATOM 0 HE1 PHE B 796 -0.276 4.277 3.842 1.00 0.00 H new ATOM 0 HE2 PHE B 796 3.203 3.103 1.612 1.00 0.00 H new ATOM 0 HZ PHE B 796 1.949 3.183 3.749 1.00 0.00 H new ATOM 1597 N THR B 797 -1.994 5.715 -3.116 1.00 0.00 N ATOM 1598 CA THR B 797 -2.683 6.561 -4.129 1.00 0.00 C ATOM 1599 C THR B 797 -4.025 5.940 -4.528 1.00 0.00 C ATOM 1600 O THR B 797 -5.009 6.630 -4.692 1.00 0.00 O ATOM 1601 CB THR B 797 -1.729 6.625 -5.325 1.00 0.00 C ATOM 1602 OG1 THR B 797 -2.204 7.585 -6.257 1.00 0.00 O ATOM 1603 CG2 THR B 797 -1.654 5.259 -5.999 1.00 0.00 C ATOM 0 H THR B 797 -1.262 5.105 -3.481 1.00 0.00 H new ATOM 0 HA THR B 797 -2.907 7.556 -3.743 1.00 0.00 H new ATOM 0 HB THR B 797 -0.736 6.911 -4.978 1.00 0.00 H new ATOM 0 HG1 THR B 797 -1.593 7.628 -7.022 1.00 0.00 H new ATOM 0 HG21 THR B 797 -0.974 5.310 -6.849 1.00 0.00 H new ATOM 0 HG22 THR B 797 -1.288 4.521 -5.285 1.00 0.00 H new ATOM 0 HG23 THR B 797 -2.646 4.969 -6.345 1.00 0.00 H new ATOM 1611 N ASN B 798 -4.069 4.646 -4.706 1.00 0.00 N ATOM 1612 CA ASN B 798 -5.354 4.010 -5.103 1.00 0.00 C ATOM 1613 C ASN B 798 -6.389 4.196 -3.994 1.00 0.00 C ATOM 1614 O ASN B 798 -7.570 4.317 -4.250 1.00 0.00 O ATOM 1615 CB ASN B 798 -5.033 2.530 -5.351 1.00 0.00 C ATOM 1616 CG ASN B 798 -4.768 1.784 -4.040 1.00 0.00 C ATOM 1617 OD1 ASN B 798 -4.467 2.380 -3.032 1.00 0.00 O ATOM 1618 ND2 ASN B 798 -4.857 0.482 -4.021 1.00 0.00 N ATOM 0 H ASN B 798 -3.279 4.010 -4.595 1.00 0.00 H new ATOM 0 HA ASN B 798 -5.781 4.458 -6.000 1.00 0.00 H new ATOM 0 HB2 ASN B 798 -5.864 2.060 -5.876 1.00 0.00 H new ATOM 0 HB3 ASN B 798 -4.160 2.450 -5.999 1.00 0.00 H new ATOM 0 HD21 ASN B 798 -4.673 -0.029 -3.158 1.00 0.00 H new ATOM 0 HD22 ASN B 798 -5.111 -0.024 -4.869 1.00 0.00 H new ATOM 1625 N CYS B 799 -5.952 4.282 -2.767 1.00 0.00 N ATOM 1626 CA CYS B 799 -6.911 4.546 -1.666 1.00 0.00 C ATOM 1627 C CYS B 799 -7.267 6.020 -1.713 1.00 0.00 C ATOM 1628 O CYS B 799 -8.404 6.411 -1.552 1.00 0.00 O ATOM 1629 CB CYS B 799 -6.162 4.202 -0.380 1.00 0.00 C ATOM 1630 SG CYS B 799 -6.241 2.414 -0.101 1.00 0.00 S ATOM 0 H CYS B 799 -4.977 4.181 -2.484 1.00 0.00 H new ATOM 0 HA CYS B 799 -7.831 3.966 -1.736 1.00 0.00 H new ATOM 0 HB2 CYS B 799 -5.123 4.525 -0.453 1.00 0.00 H new ATOM 0 HB3 CYS B 799 -6.602 4.733 0.464 1.00 0.00 H new ATOM 0 HG CYS B 799 -5.862 2.147 1.114 1.00 0.00 H new ATOM 1636 N LYS B 800 -6.300 6.831 -2.028 1.00 0.00 N ATOM 1637 CA LYS B 800 -6.557 8.280 -2.173 1.00 0.00 C ATOM 1638 C LYS B 800 -7.268 8.558 -3.496 1.00 0.00 C ATOM 1639 O LYS B 800 -7.792 9.632 -3.716 1.00 0.00 O ATOM 1640 CB LYS B 800 -5.167 8.915 -2.159 1.00 0.00 C ATOM 1641 CG LYS B 800 -4.773 9.245 -0.717 1.00 0.00 C ATOM 1642 CD LYS B 800 -4.581 10.755 -0.570 1.00 0.00 C ATOM 1643 CE LYS B 800 -3.086 11.078 -0.539 1.00 0.00 C ATOM 1644 NZ LYS B 800 -3.020 12.554 -0.344 1.00 0.00 N ATOM 0 H LYS B 800 -5.335 6.546 -2.192 1.00 0.00 H new ATOM 0 HA LYS B 800 -7.198 8.677 -1.386 1.00 0.00 H new ATOM 0 HB2 LYS B 800 -4.439 8.233 -2.600 1.00 0.00 H new ATOM 0 HB3 LYS B 800 -5.163 9.821 -2.765 1.00 0.00 H new ATOM 0 HG2 LYS B 800 -5.545 8.898 -0.030 1.00 0.00 H new ATOM 0 HG3 LYS B 800 -3.853 8.724 -0.452 1.00 0.00 H new ATOM 0 HD2 LYS B 800 -5.059 11.276 -1.400 1.00 0.00 H new ATOM 0 HD3 LYS B 800 -5.059 11.106 0.345 1.00 0.00 H new ATOM 0 HE2 LYS B 800 -2.584 10.549 0.271 1.00 0.00 H new ATOM 0 HE3 LYS B 800 -2.597 10.779 -1.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 -2.330 12.961 -1.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 -3.957 12.970 -0.521 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 -2.727 12.762 0.632 1.00 0.00 H new ATOM 1658 N GLU B 801 -7.315 7.591 -4.369 1.00 0.00 N ATOM 1659 CA GLU B 801 -8.018 7.794 -5.656 1.00 0.00 C ATOM 1660 C GLU B 801 -9.523 7.936 -5.411 1.00 0.00 C ATOM 1661 O GLU B 801 -10.205 8.681 -6.087 1.00 0.00 O ATOM 1662 CB GLU B 801 -7.732 6.527 -6.461 1.00 0.00 C ATOM 1663 CG GLU B 801 -7.495 6.908 -7.924 1.00 0.00 C ATOM 1664 CD GLU B 801 -8.837 7.082 -8.639 1.00 0.00 C ATOM 1665 OE1 GLU B 801 -9.843 7.185 -7.957 1.00 0.00 O ATOM 1666 OE2 GLU B 801 -8.836 7.110 -9.859 1.00 0.00 O ATOM 0 H GLU B 801 -6.895 6.670 -4.243 1.00 0.00 H new ATOM 0 HA GLU B 801 -7.687 8.694 -6.174 1.00 0.00 H new ATOM 0 HB2 GLU B 801 -6.858 6.015 -6.059 1.00 0.00 H new ATOM 0 HB3 GLU B 801 -8.570 5.835 -6.383 1.00 0.00 H new ATOM 0 HG2 GLU B 801 -6.920 7.833 -7.980 1.00 0.00 H new ATOM 0 HG3 GLU B 801 -6.906 6.136 -8.419 1.00 0.00 H new ATOM 1673 N TYR B 802 -10.046 7.233 -4.438 1.00 0.00 N ATOM 1674 CA TYR B 802 -11.511 7.313 -4.172 1.00 0.00 C ATOM 1675 C TYR B 802 -11.799 7.708 -2.714 1.00 0.00 C ATOM 1676 O TYR B 802 -12.906 8.076 -2.375 1.00 0.00 O ATOM 1677 CB TYR B 802 -12.038 5.901 -4.482 1.00 0.00 C ATOM 1678 CG TYR B 802 -11.692 4.929 -3.370 1.00 0.00 C ATOM 1679 CD1 TYR B 802 -10.469 4.249 -3.381 1.00 0.00 C ATOM 1680 CD2 TYR B 802 -12.620 4.676 -2.352 1.00 0.00 C ATOM 1681 CE1 TYR B 802 -10.165 3.342 -2.359 1.00 0.00 C ATOM 1682 CE2 TYR B 802 -12.317 3.767 -1.337 1.00 0.00 C ATOM 1683 CZ TYR B 802 -11.090 3.098 -1.341 1.00 0.00 C ATOM 1684 OH TYR B 802 -10.789 2.203 -0.336 1.00 0.00 O ATOM 0 H TYR B 802 -9.524 6.611 -3.821 1.00 0.00 H new ATOM 0 HA TYR B 802 -11.995 8.077 -4.780 1.00 0.00 H new ATOM 0 HB2 TYR B 802 -13.119 5.935 -4.615 1.00 0.00 H new ATOM 0 HB3 TYR B 802 -11.612 5.549 -5.422 1.00 0.00 H new ATOM 0 HD1 TYR B 802 -9.760 4.424 -4.177 1.00 0.00 H new ATOM 0 HD2 TYR B 802 -13.572 5.185 -2.352 1.00 0.00 H new ATOM 0 HE1 TYR B 802 -9.214 2.830 -2.358 1.00 0.00 H new ATOM 0 HE2 TYR B 802 -13.031 3.581 -0.548 1.00 0.00 H new ATOM 0 HH TYR B 802 -11.052 2.581 0.529 1.00 0.00 H new ATOM 1694 N ASN B 803 -10.815 7.618 -1.855 1.00 0.00 N ATOM 1695 CA ASN B 803 -11.019 7.964 -0.410 1.00 0.00 C ATOM 1696 C ASN B 803 -11.864 9.239 -0.246 1.00 0.00 C ATOM 1697 O ASN B 803 -11.880 10.084 -1.119 1.00 0.00 O ATOM 1698 CB ASN B 803 -9.608 8.207 0.129 1.00 0.00 C ATOM 1699 CG ASN B 803 -9.140 6.995 0.939 1.00 0.00 C ATOM 1700 OD1 ASN B 803 -8.351 7.130 1.851 1.00 0.00 O ATOM 1701 ND2 ASN B 803 -9.575 5.804 0.629 1.00 0.00 N ATOM 0 H ASN B 803 -9.870 7.317 -2.093 1.00 0.00 H new ATOM 0 HA ASN B 803 -11.551 7.173 0.118 1.00 0.00 H new ATOM 0 HB2 ASN B 803 -8.921 8.390 -0.697 1.00 0.00 H new ATOM 0 HB3 ASN B 803 -9.598 9.099 0.755 1.00 0.00 H new ATOM 0 HD21 ASN B 803 -9.252 4.991 1.153 1.00 0.00 H new ATOM 0 HD22 ASN B 803 -10.238 5.687 -0.137 1.00 0.00 H new ATOM 1708 N PRO B 804 -12.543 9.332 0.873 1.00 0.00 N ATOM 1709 CA PRO B 804 -13.396 10.516 1.146 1.00 0.00 C ATOM 1710 C PRO B 804 -12.579 11.809 1.045 1.00 0.00 C ATOM 1711 O PRO B 804 -11.387 11.800 1.270 1.00 0.00 O ATOM 1712 CB PRO B 804 -13.876 10.302 2.583 1.00 0.00 C ATOM 1713 CG PRO B 804 -13.712 8.838 2.842 1.00 0.00 C ATOM 1714 CD PRO B 804 -12.579 8.361 1.976 1.00 0.00 C ATOM 0 HA PRO B 804 -14.216 10.613 0.434 1.00 0.00 H new ATOM 0 HB2 PRO B 804 -13.289 10.894 3.286 1.00 0.00 H new ATOM 0 HB3 PRO B 804 -14.916 10.608 2.700 1.00 0.00 H new ATOM 0 HG2 PRO B 804 -13.496 8.655 3.895 1.00 0.00 H new ATOM 0 HG3 PRO B 804 -14.630 8.300 2.606 1.00 0.00 H new ATOM 0 HD2 PRO B 804 -11.637 8.344 2.524 1.00 0.00 H new ATOM 0 HD3 PRO B 804 -12.754 7.349 1.611 1.00 0.00 H new ATOM 1722 N PRO B 805 -13.249 12.888 0.717 1.00 0.00 N ATOM 1723 CA PRO B 805 -12.559 14.197 0.604 1.00 0.00 C ATOM 1724 C PRO B 805 -11.966 14.600 1.955 1.00 0.00 C ATOM 1725 O PRO B 805 -12.518 15.417 2.666 1.00 0.00 O ATOM 1726 CB PRO B 805 -13.667 15.173 0.196 1.00 0.00 C ATOM 1727 CG PRO B 805 -14.811 14.323 -0.262 1.00 0.00 C ATOM 1728 CD PRO B 805 -14.685 12.995 0.431 1.00 0.00 C ATOM 0 HA PRO B 805 -11.735 14.178 -0.109 1.00 0.00 H new ATOM 0 HB2 PRO B 805 -13.960 15.804 1.035 1.00 0.00 H new ATOM 0 HB3 PRO B 805 -13.330 15.837 -0.600 1.00 0.00 H new ATOM 0 HG2 PRO B 805 -15.763 14.795 -0.018 1.00 0.00 H new ATOM 0 HG3 PRO B 805 -14.786 14.196 -1.344 1.00 0.00 H new ATOM 0 HD2 PRO B 805 -15.279 12.962 1.344 1.00 0.00 H new ATOM 0 HD3 PRO B 805 -15.029 12.178 -0.203 1.00 0.00 H new ATOM 1736 N GLU B 806 -10.850 14.030 2.320 1.00 0.00 N ATOM 1737 CA GLU B 806 -10.233 14.371 3.634 1.00 0.00 C ATOM 1738 C GLU B 806 -11.254 14.185 4.758 1.00 0.00 C ATOM 1739 O GLU B 806 -11.471 15.066 5.566 1.00 0.00 O ATOM 1740 CB GLU B 806 -9.835 15.844 3.513 1.00 0.00 C ATOM 1741 CG GLU B 806 -8.720 16.155 4.513 1.00 0.00 C ATOM 1742 CD GLU B 806 -7.829 17.266 3.954 1.00 0.00 C ATOM 1743 OE1 GLU B 806 -7.075 16.987 3.036 1.00 0.00 O ATOM 1744 OE2 GLU B 806 -7.917 18.377 4.451 1.00 0.00 O ATOM 0 H GLU B 806 -10.339 13.343 1.766 1.00 0.00 H new ATOM 0 HA GLU B 806 -9.380 13.735 3.868 1.00 0.00 H new ATOM 0 HB2 GLU B 806 -9.499 16.059 2.499 1.00 0.00 H new ATOM 0 HB3 GLU B 806 -10.698 16.482 3.704 1.00 0.00 H new ATOM 0 HG2 GLU B 806 -9.148 16.463 5.467 1.00 0.00 H new ATOM 0 HG3 GLU B 806 -8.128 15.260 4.703 1.00 0.00 H new ATOM 1751 N SER B 807 -11.888 13.045 4.811 1.00 0.00 N ATOM 1752 CA SER B 807 -12.901 12.805 5.877 1.00 0.00 C ATOM 1753 C SER B 807 -12.352 11.847 6.934 1.00 0.00 C ATOM 1754 O SER B 807 -12.170 12.210 8.079 1.00 0.00 O ATOM 1755 CB SER B 807 -14.091 12.173 5.152 1.00 0.00 C ATOM 1756 OG SER B 807 -15.290 12.495 5.842 1.00 0.00 O ATOM 0 H SER B 807 -11.748 12.270 4.162 1.00 0.00 H new ATOM 0 HA SER B 807 -13.174 13.723 6.397 1.00 0.00 H new ATOM 0 HB2 SER B 807 -14.140 12.537 4.126 1.00 0.00 H new ATOM 0 HB3 SER B 807 -13.967 11.091 5.101 1.00 0.00 H new ATOM 0 HG SER B 807 -16.053 12.092 5.377 1.00 0.00 H new ATOM 1762 N GLU B 808 -12.089 10.624 6.564 1.00 0.00 N ATOM 1763 CA GLU B 808 -11.559 9.648 7.558 1.00 0.00 C ATOM 1764 C GLU B 808 -10.615 8.651 6.884 1.00 0.00 C ATOM 1765 O GLU B 808 -9.588 8.292 7.426 1.00 0.00 O ATOM 1766 CB GLU B 808 -12.796 8.929 8.096 1.00 0.00 C ATOM 1767 CG GLU B 808 -12.811 9.018 9.623 1.00 0.00 C ATOM 1768 CD GLU B 808 -14.216 8.698 10.140 1.00 0.00 C ATOM 1769 OE1 GLU B 808 -15.164 9.239 9.596 1.00 0.00 O ATOM 1770 OE2 GLU B 808 -14.319 7.917 11.072 1.00 0.00 O ATOM 0 H GLU B 808 -12.217 10.259 5.620 1.00 0.00 H new ATOM 0 HA GLU B 808 -10.987 10.136 8.347 1.00 0.00 H new ATOM 0 HB2 GLU B 808 -13.700 9.380 7.686 1.00 0.00 H new ATOM 0 HB3 GLU B 808 -12.789 7.885 7.782 1.00 0.00 H new ATOM 0 HG2 GLU B 808 -12.089 8.320 10.046 1.00 0.00 H new ATOM 0 HG3 GLU B 808 -12.513 10.017 9.943 1.00 0.00 H new ATOM 1777 N TYR B 809 -10.957 8.190 5.714 1.00 0.00 N ATOM 1778 CA TYR B 809 -10.078 7.211 5.015 1.00 0.00 C ATOM 1779 C TYR B 809 -8.914 7.931 4.330 1.00 0.00 C ATOM 1780 O TYR B 809 -7.814 7.421 4.255 1.00 0.00 O ATOM 1781 CB TYR B 809 -10.983 6.547 3.973 1.00 0.00 C ATOM 1782 CG TYR B 809 -11.174 5.089 4.319 1.00 0.00 C ATOM 1783 CD1 TYR B 809 -11.465 4.714 5.636 1.00 0.00 C ATOM 1784 CD2 TYR B 809 -11.068 4.112 3.320 1.00 0.00 C ATOM 1785 CE1 TYR B 809 -11.645 3.363 5.956 1.00 0.00 C ATOM 1786 CE2 TYR B 809 -11.247 2.761 3.640 1.00 0.00 C ATOM 1787 CZ TYR B 809 -11.536 2.387 4.958 1.00 0.00 C ATOM 1788 OH TYR B 809 -11.713 1.056 5.273 1.00 0.00 O ATOM 0 H TYR B 809 -11.806 8.448 5.211 1.00 0.00 H new ATOM 0 HA TYR B 809 -9.640 6.487 5.702 1.00 0.00 H new ATOM 0 HB2 TYR B 809 -11.948 7.052 3.941 1.00 0.00 H new ATOM 0 HB3 TYR B 809 -10.541 6.640 2.981 1.00 0.00 H new ATOM 0 HD1 TYR B 809 -11.551 5.467 6.405 1.00 0.00 H new ATOM 0 HD2 TYR B 809 -10.848 4.401 2.303 1.00 0.00 H new ATOM 0 HE1 TYR B 809 -11.868 3.074 6.972 1.00 0.00 H new ATOM 0 HE2 TYR B 809 -11.162 2.008 2.871 1.00 0.00 H new ATOM 0 HH TYR B 809 -11.317 0.872 6.151 1.00 0.00 H new ATOM 1798 N TYR B 810 -9.150 9.109 3.820 1.00 0.00 N ATOM 1799 CA TYR B 810 -8.062 9.859 3.127 1.00 0.00 C ATOM 1800 C TYR B 810 -6.987 10.295 4.125 1.00 0.00 C ATOM 1801 O TYR B 810 -5.807 10.249 3.840 1.00 0.00 O ATOM 1802 CB TYR B 810 -8.760 11.080 2.526 1.00 0.00 C ATOM 1803 CG TYR B 810 -7.786 11.858 1.674 1.00 0.00 C ATOM 1804 CD1 TYR B 810 -6.786 12.628 2.279 1.00 0.00 C ATOM 1805 CD2 TYR B 810 -7.893 11.819 0.278 1.00 0.00 C ATOM 1806 CE1 TYR B 810 -5.887 13.354 1.488 1.00 0.00 C ATOM 1807 CE2 TYR B 810 -6.994 12.544 -0.513 1.00 0.00 C ATOM 1808 CZ TYR B 810 -5.992 13.313 0.092 1.00 0.00 C ATOM 1809 OH TYR B 810 -5.106 14.028 -0.688 1.00 0.00 O ATOM 0 H TYR B 810 -10.051 9.586 3.853 1.00 0.00 H new ATOM 0 HA TYR B 810 -7.559 9.254 2.373 1.00 0.00 H new ATOM 0 HB2 TYR B 810 -9.612 10.764 1.924 1.00 0.00 H new ATOM 0 HB3 TYR B 810 -9.150 11.715 3.321 1.00 0.00 H new ATOM 0 HD1 TYR B 810 -6.708 12.662 3.356 1.00 0.00 H new ATOM 0 HD2 TYR B 810 -8.669 11.230 -0.188 1.00 0.00 H new ATOM 0 HE1 TYR B 810 -5.113 13.945 1.954 1.00 0.00 H new ATOM 0 HE2 TYR B 810 -7.073 12.510 -1.590 1.00 0.00 H new ATOM 0 HH TYR B 810 -5.318 13.889 -1.635 1.00 0.00 H new ATOM 1819 N LYS B 811 -7.383 10.716 5.295 1.00 0.00 N ATOM 1820 CA LYS B 811 -6.382 11.149 6.310 1.00 0.00 C ATOM 1821 C LYS B 811 -5.420 10.002 6.639 1.00 0.00 C ATOM 1822 O LYS B 811 -4.356 10.210 7.187 1.00 0.00 O ATOM 1823 CB LYS B 811 -7.211 11.521 7.541 1.00 0.00 C ATOM 1824 CG LYS B 811 -8.161 12.667 7.188 1.00 0.00 C ATOM 1825 CD LYS B 811 -7.639 13.970 7.797 1.00 0.00 C ATOM 1826 CE LYS B 811 -7.637 13.857 9.322 1.00 0.00 C ATOM 1827 NZ LYS B 811 -8.198 15.151 9.801 1.00 0.00 N ATOM 0 H LYS B 811 -8.357 10.779 5.592 1.00 0.00 H new ATOM 0 HA LYS B 811 -5.770 11.979 5.957 1.00 0.00 H new ATOM 0 HB2 LYS B 811 -7.779 10.657 7.885 1.00 0.00 H new ATOM 0 HB3 LYS B 811 -6.554 11.817 8.359 1.00 0.00 H new ATOM 0 HG2 LYS B 811 -8.242 12.766 6.106 1.00 0.00 H new ATOM 0 HG3 LYS B 811 -9.161 12.453 7.564 1.00 0.00 H new ATOM 0 HD2 LYS B 811 -6.631 14.174 7.436 1.00 0.00 H new ATOM 0 HD3 LYS B 811 -8.265 14.806 7.485 1.00 0.00 H new ATOM 0 HE2 LYS B 811 -8.243 13.015 9.657 1.00 0.00 H new ATOM 0 HE3 LYS B 811 -6.629 13.697 9.705 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 -8.230 15.152 10.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 -7.597 15.933 9.472 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 -9.160 15.273 9.425 1.00 0.00 H new ATOM 1841 N CYS B 812 -5.792 8.791 6.320 1.00 0.00 N ATOM 1842 CA CYS B 812 -4.902 7.635 6.607 1.00 0.00 C ATOM 1843 C CYS B 812 -3.820 7.520 5.536 1.00 0.00 C ATOM 1844 O CYS B 812 -2.642 7.591 5.822 1.00 0.00 O ATOM 1845 CB CYS B 812 -5.819 6.414 6.567 1.00 0.00 C ATOM 1846 SG CYS B 812 -6.973 6.479 7.960 1.00 0.00 S ATOM 0 H CYS B 812 -6.677 8.555 5.872 1.00 0.00 H new ATOM 0 HA CYS B 812 -4.392 7.736 7.565 1.00 0.00 H new ATOM 0 HB2 CYS B 812 -6.369 6.390 5.626 1.00 0.00 H new ATOM 0 HB3 CYS B 812 -5.227 5.500 6.614 1.00 0.00 H new ATOM 0 HG CYS B 812 -7.986 7.232 7.649 1.00 0.00 H new ATOM 1852 N ALA B 813 -4.210 7.348 4.297 1.00 0.00 N ATOM 1853 CA ALA B 813 -3.198 7.239 3.204 1.00 0.00 C ATOM 1854 C ALA B 813 -2.181 8.375 3.311 1.00 0.00 C ATOM 1855 O ALA B 813 -1.006 8.198 3.062 1.00 0.00 O ATOM 1856 CB ALA B 813 -4.001 7.369 1.908 1.00 0.00 C ATOM 0 H ALA B 813 -5.182 7.279 3.997 1.00 0.00 H new ATOM 0 HA ALA B 813 -2.641 6.304 3.251 1.00 0.00 H new ATOM 0 HB1 ALA B 813 -3.327 7.299 1.054 1.00 0.00 H new ATOM 0 HB2 ALA B 813 -4.738 6.568 1.855 1.00 0.00 H new ATOM 0 HB3 ALA B 813 -4.510 8.333 1.890 1.00 0.00 H new ATOM 1862 N ASN B 814 -2.625 9.534 3.710 1.00 0.00 N ATOM 1863 CA ASN B 814 -1.689 10.679 3.850 1.00 0.00 C ATOM 1864 C ASN B 814 -0.713 10.431 5.001 1.00 0.00 C ATOM 1865 O ASN B 814 0.488 10.453 4.825 1.00 0.00 O ATOM 1866 CB ASN B 814 -2.584 11.880 4.162 1.00 0.00 C ATOM 1867 CG ASN B 814 -1.811 13.173 3.895 1.00 0.00 C ATOM 1868 OD1 ASN B 814 -1.878 13.727 2.715 1.00 0.00 O flip ATOM 1869 ND2 ASN B 814 -1.136 13.682 4.767 1.00 0.00 N flip ATOM 0 H ASN B 814 -3.597 9.736 3.945 1.00 0.00 H new ATOM 0 HA ASN B 814 -1.089 10.833 2.953 1.00 0.00 H new ATOM 0 HB2 ASN B 814 -3.483 11.847 3.547 1.00 0.00 H new ATOM 0 HB3 ASN B 814 -2.908 11.845 5.202 1.00 0.00 H new ATOM 0 HD21 ASN B 814 -1.083 13.249 5.689 1.00 0.00 H new ATOM 0 HD22 ASN B 814 -0.622 14.542 4.577 1.00 0.00 H new ATOM 1876 N ILE B 815 -1.220 10.186 6.177 1.00 0.00 N ATOM 1877 CA ILE B 815 -0.324 9.949 7.344 1.00 0.00 C ATOM 1878 C ILE B 815 0.489 8.665 7.156 1.00 0.00 C ATOM 1879 O ILE B 815 1.704 8.686 7.172 1.00 0.00 O ATOM 1880 CB ILE B 815 -1.271 9.807 8.539 1.00 0.00 C ATOM 1881 CG1 ILE B 815 -2.015 11.124 8.763 1.00 0.00 C ATOM 1882 CG2 ILE B 815 -0.466 9.458 9.793 1.00 0.00 C ATOM 1883 CD1 ILE B 815 -3.021 10.953 9.903 1.00 0.00 C ATOM 0 H ILE B 815 -2.218 10.140 6.381 1.00 0.00 H new ATOM 0 HA ILE B 815 0.396 10.757 7.475 1.00 0.00 H new ATOM 0 HB ILE B 815 -1.990 9.013 8.336 1.00 0.00 H new ATOM 0 HG12 ILE B 815 -1.308 11.917 9.004 1.00 0.00 H new ATOM 0 HG13 ILE B 815 -2.531 11.423 7.850 1.00 0.00 H new ATOM 0 HG21 ILE B 815 -1.141 9.357 10.643 1.00 0.00 H new ATOM 0 HG22 ILE B 815 0.062 8.518 9.636 1.00 0.00 H new ATOM 0 HG23 ILE B 815 0.255 10.250 9.995 1.00 0.00 H new ATOM 0 HD11 ILE B 815 -3.552 11.891 10.064 1.00 0.00 H new ATOM 0 HD12 ILE B 815 -3.735 10.172 9.644 1.00 0.00 H new ATOM 0 HD13 ILE B 815 -2.493 10.674 10.815 1.00 0.00 H new ATOM 1895 N LEU B 816 -0.163 7.541 6.999 1.00 0.00 N ATOM 1896 CA LEU B 816 0.595 6.264 6.841 1.00 0.00 C ATOM 1897 C LEU B 816 1.648 6.403 5.739 1.00 0.00 C ATOM 1898 O LEU B 816 2.752 5.911 5.861 1.00 0.00 O ATOM 1899 CB LEU B 816 -0.455 5.205 6.473 1.00 0.00 C ATOM 1900 CG LEU B 816 0.210 3.825 6.320 1.00 0.00 C ATOM 1901 CD1 LEU B 816 1.095 3.514 7.530 1.00 0.00 C ATOM 1902 CD2 LEU B 816 -0.867 2.748 6.208 1.00 0.00 C ATOM 0 H LEU B 816 -1.179 7.453 6.974 1.00 0.00 H new ATOM 0 HA LEU B 816 1.131 5.991 7.750 1.00 0.00 H new ATOM 0 HB2 LEU B 816 -1.224 5.162 7.244 1.00 0.00 H new ATOM 0 HB3 LEU B 816 -0.951 5.483 5.543 1.00 0.00 H new ATOM 0 HG LEU B 816 0.826 3.838 5.421 1.00 0.00 H new ATOM 0 HD11 LEU B 816 1.555 2.534 7.402 1.00 0.00 H new ATOM 0 HD12 LEU B 816 1.873 4.272 7.616 1.00 0.00 H new ATOM 0 HD13 LEU B 816 0.487 3.514 8.435 1.00 0.00 H new ATOM 0 HD21 LEU B 816 -0.395 1.771 6.100 1.00 0.00 H new ATOM 0 HD22 LEU B 816 -1.484 2.755 7.107 1.00 0.00 H new ATOM 0 HD23 LEU B 816 -1.492 2.948 5.337 1.00 0.00 H new ATOM 1914 N GLU B 817 1.334 7.098 4.680 1.00 0.00 N ATOM 1915 CA GLU B 817 2.347 7.300 3.607 1.00 0.00 C ATOM 1916 C GLU B 817 3.478 8.182 4.140 1.00 0.00 C ATOM 1917 O GLU B 817 4.643 7.931 3.904 1.00 0.00 O ATOM 1918 CB GLU B 817 1.592 8.011 2.477 1.00 0.00 C ATOM 1919 CG GLU B 817 2.581 8.483 1.406 1.00 0.00 C ATOM 1920 CD GLU B 817 1.827 9.249 0.317 1.00 0.00 C ATOM 1921 OE1 GLU B 817 1.670 10.450 0.466 1.00 0.00 O ATOM 1922 OE2 GLU B 817 1.421 8.623 -0.647 1.00 0.00 O ATOM 0 H GLU B 817 0.426 7.532 4.512 1.00 0.00 H new ATOM 0 HA GLU B 817 2.794 6.367 3.264 1.00 0.00 H new ATOM 0 HB2 GLU B 817 0.860 7.335 2.036 1.00 0.00 H new ATOM 0 HB3 GLU B 817 1.040 8.862 2.876 1.00 0.00 H new ATOM 0 HG2 GLU B 817 3.342 9.122 1.855 1.00 0.00 H new ATOM 0 HG3 GLU B 817 3.099 7.628 0.972 1.00 0.00 H new ATOM 1929 N LYS B 818 3.137 9.212 4.864 1.00 0.00 N ATOM 1930 CA LYS B 818 4.181 10.114 5.423 1.00 0.00 C ATOM 1931 C LYS B 818 5.207 9.306 6.220 1.00 0.00 C ATOM 1932 O LYS B 818 6.382 9.300 5.911 1.00 0.00 O ATOM 1933 CB LYS B 818 3.418 11.067 6.344 1.00 0.00 C ATOM 1934 CG LYS B 818 3.628 12.504 5.884 1.00 0.00 C ATOM 1935 CD LYS B 818 2.773 12.735 4.655 1.00 0.00 C ATOM 1936 CE LYS B 818 2.018 14.052 4.799 1.00 0.00 C ATOM 1937 NZ LYS B 818 2.919 15.079 4.204 1.00 0.00 N ATOM 0 H LYS B 818 2.177 9.468 5.093 1.00 0.00 H new ATOM 0 HA LYS B 818 4.731 10.645 4.646 1.00 0.00 H new ATOM 0 HB2 LYS B 818 2.356 10.824 6.335 1.00 0.00 H new ATOM 0 HB3 LYS B 818 3.763 10.950 7.371 1.00 0.00 H new ATOM 0 HG2 LYS B 818 3.353 13.201 6.676 1.00 0.00 H new ATOM 0 HG3 LYS B 818 4.679 12.681 5.655 1.00 0.00 H new ATOM 0 HD2 LYS B 818 3.399 12.758 3.763 1.00 0.00 H new ATOM 0 HD3 LYS B 818 2.069 11.912 4.529 1.00 0.00 H new ATOM 0 HE2 LYS B 818 1.061 14.017 4.279 1.00 0.00 H new ATOM 0 HE3 LYS B 818 1.804 14.272 5.845 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 2.468 16.014 4.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 3.820 15.094 4.724 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 3.099 14.847 3.206 1.00 0.00 H new ATOM 1951 N PHE B 819 4.773 8.618 7.241 1.00 0.00 N ATOM 1952 CA PHE B 819 5.723 7.803 8.050 1.00 0.00 C ATOM 1953 C PHE B 819 6.507 6.854 7.142 1.00 0.00 C ATOM 1954 O PHE B 819 7.625 6.480 7.434 1.00 0.00 O ATOM 1955 CB PHE B 819 4.836 7.008 9.011 1.00 0.00 C ATOM 1956 CG PHE B 819 5.024 7.527 10.416 1.00 0.00 C ATOM 1957 CD1 PHE B 819 6.122 7.107 11.176 1.00 0.00 C ATOM 1958 CD2 PHE B 819 4.101 8.429 10.960 1.00 0.00 C ATOM 1959 CE1 PHE B 819 6.298 7.588 12.478 1.00 0.00 C ATOM 1960 CE2 PHE B 819 4.276 8.909 12.263 1.00 0.00 C ATOM 1961 CZ PHE B 819 5.375 8.489 13.022 1.00 0.00 C ATOM 0 H PHE B 819 3.801 8.585 7.550 1.00 0.00 H new ATOM 0 HA PHE B 819 6.453 8.418 8.577 1.00 0.00 H new ATOM 0 HB2 PHE B 819 3.791 7.097 8.716 1.00 0.00 H new ATOM 0 HB3 PHE B 819 5.091 5.949 8.966 1.00 0.00 H new ATOM 0 HD1 PHE B 819 6.834 6.411 10.757 1.00 0.00 H new ATOM 0 HD2 PHE B 819 3.254 8.754 10.374 1.00 0.00 H new ATOM 0 HE1 PHE B 819 7.146 7.264 13.063 1.00 0.00 H new ATOM 0 HE2 PHE B 819 3.563 9.603 12.683 1.00 0.00 H new ATOM 0 HZ PHE B 819 5.511 8.860 14.027 1.00 0.00 H new ATOM 1971 N PHE B 820 5.928 6.464 6.041 1.00 0.00 N ATOM 1972 CA PHE B 820 6.634 5.541 5.108 1.00 0.00 C ATOM 1973 C PHE B 820 7.591 6.345 4.209 1.00 0.00 C ATOM 1974 O PHE B 820 8.659 5.884 3.860 1.00 0.00 O ATOM 1975 CB PHE B 820 5.486 4.851 4.328 1.00 0.00 C ATOM 1976 CG PHE B 820 5.807 4.667 2.856 1.00 0.00 C ATOM 1977 CD1 PHE B 820 6.496 3.528 2.424 1.00 0.00 C ATOM 1978 CD2 PHE B 820 5.393 5.628 1.927 1.00 0.00 C ATOM 1979 CE1 PHE B 820 6.778 3.355 1.064 1.00 0.00 C ATOM 1980 CE2 PHE B 820 5.678 5.457 0.568 1.00 0.00 C ATOM 1981 CZ PHE B 820 6.371 4.320 0.137 1.00 0.00 C ATOM 0 H PHE B 820 4.993 6.745 5.746 1.00 0.00 H new ATOM 0 HA PHE B 820 7.265 4.800 5.599 1.00 0.00 H new ATOM 0 HB2 PHE B 820 5.281 3.878 4.776 1.00 0.00 H new ATOM 0 HB3 PHE B 820 4.577 5.445 4.426 1.00 0.00 H new ATOM 0 HD1 PHE B 820 6.810 2.783 3.140 1.00 0.00 H new ATOM 0 HD2 PHE B 820 4.853 6.502 2.259 1.00 0.00 H new ATOM 0 HE1 PHE B 820 7.310 2.476 0.730 1.00 0.00 H new ATOM 0 HE2 PHE B 820 5.363 6.202 -0.148 1.00 0.00 H new ATOM 0 HZ PHE B 820 6.592 4.188 -0.912 1.00 0.00 H new ATOM 1991 N PHE B 821 7.226 7.546 3.852 1.00 0.00 N ATOM 1992 CA PHE B 821 8.122 8.369 2.989 1.00 0.00 C ATOM 1993 C PHE B 821 9.451 8.631 3.701 1.00 0.00 C ATOM 1994 O PHE B 821 10.503 8.618 3.094 1.00 0.00 O ATOM 1995 CB PHE B 821 7.364 9.681 2.779 1.00 0.00 C ATOM 1996 CG PHE B 821 7.377 10.045 1.314 1.00 0.00 C ATOM 1997 CD1 PHE B 821 6.916 9.129 0.360 1.00 0.00 C ATOM 1998 CD2 PHE B 821 7.845 11.300 0.910 1.00 0.00 C ATOM 1999 CE1 PHE B 821 6.926 9.469 -0.998 1.00 0.00 C ATOM 2000 CE2 PHE B 821 7.855 11.640 -0.448 1.00 0.00 C ATOM 2001 CZ PHE B 821 7.395 10.725 -1.402 1.00 0.00 C ATOM 0 H PHE B 821 6.349 7.993 4.119 1.00 0.00 H new ATOM 0 HA PHE B 821 8.359 7.873 2.047 1.00 0.00 H new ATOM 0 HB2 PHE B 821 6.337 9.579 3.130 1.00 0.00 H new ATOM 0 HB3 PHE B 821 7.824 10.476 3.366 1.00 0.00 H new ATOM 0 HD1 PHE B 821 6.553 8.161 0.672 1.00 0.00 H new ATOM 0 HD2 PHE B 821 8.199 12.007 1.646 1.00 0.00 H new ATOM 0 HE1 PHE B 821 6.572 8.762 -1.734 1.00 0.00 H new ATOM 0 HE2 PHE B 821 8.218 12.608 -0.760 1.00 0.00 H new ATOM 0 HZ PHE B 821 7.402 10.988 -2.450 1.00 0.00 H new ATOM 2011 N SER B 822 9.411 8.872 4.982 1.00 0.00 N ATOM 2012 CA SER B 822 10.674 9.118 5.733 1.00 0.00 C ATOM 2013 C SER B 822 11.448 7.812 5.898 1.00 0.00 C ATOM 2014 O SER B 822 12.658 7.798 5.931 1.00 0.00 O ATOM 2015 CB SER B 822 10.222 9.648 7.095 1.00 0.00 C ATOM 2016 OG SER B 822 9.654 10.940 6.936 1.00 0.00 O ATOM 0 H SER B 822 8.559 8.909 5.541 1.00 0.00 H new ATOM 0 HA SER B 822 11.334 9.817 5.220 1.00 0.00 H new ATOM 0 HB2 SER B 822 9.492 8.970 7.537 1.00 0.00 H new ATOM 0 HB3 SER B 822 11.070 9.693 7.779 1.00 0.00 H new ATOM 0 HG SER B 822 9.363 11.279 7.808 1.00 0.00 H new ATOM 2022 N LYS B 823 10.759 6.712 5.988 1.00 0.00 N ATOM 2023 CA LYS B 823 11.456 5.409 6.145 1.00 0.00 C ATOM 2024 C LYS B 823 12.011 4.945 4.802 1.00 0.00 C ATOM 2025 O LYS B 823 13.091 4.397 4.728 1.00 0.00 O ATOM 2026 CB LYS B 823 10.380 4.448 6.648 1.00 0.00 C ATOM 2027 CG LYS B 823 9.877 4.934 8.010 1.00 0.00 C ATOM 2028 CD LYS B 823 10.938 4.652 9.076 1.00 0.00 C ATOM 2029 CE LYS B 823 10.932 3.161 9.420 1.00 0.00 C ATOM 2030 NZ LYS B 823 10.753 3.109 10.898 1.00 0.00 N ATOM 0 H LYS B 823 9.741 6.659 5.960 1.00 0.00 H new ATOM 0 HA LYS B 823 12.301 5.468 6.831 1.00 0.00 H new ATOM 0 HB2 LYS B 823 9.555 4.400 5.937 1.00 0.00 H new ATOM 0 HB3 LYS B 823 10.786 3.440 6.734 1.00 0.00 H new ATOM 0 HG2 LYS B 823 9.661 6.002 7.970 1.00 0.00 H new ATOM 0 HG3 LYS B 823 8.945 4.430 8.267 1.00 0.00 H new ATOM 0 HD2 LYS B 823 11.922 4.948 8.712 1.00 0.00 H new ATOM 0 HD3 LYS B 823 10.737 5.243 9.970 1.00 0.00 H new ATOM 0 HE2 LYS B 823 10.124 2.640 8.906 1.00 0.00 H new ATOM 0 HE3 LYS B 823 11.863 2.682 9.118 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 10.739 2.117 11.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 11.540 3.607 11.361 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 9.855 3.566 11.155 1.00 0.00 H new ATOM 2044 N ILE B 824 11.296 5.174 3.732 1.00 0.00 N ATOM 2045 CA ILE B 824 11.820 4.756 2.403 1.00 0.00 C ATOM 2046 C ILE B 824 13.000 5.649 2.006 1.00 0.00 C ATOM 2047 O ILE B 824 14.044 5.170 1.608 1.00 0.00 O ATOM 2048 CB ILE B 824 10.648 4.887 1.424 1.00 0.00 C ATOM 2049 CG1 ILE B 824 10.203 6.339 1.278 1.00 0.00 C ATOM 2050 CG2 ILE B 824 9.478 4.046 1.933 1.00 0.00 C ATOM 2051 CD1 ILE B 824 9.055 6.397 0.269 1.00 0.00 C ATOM 0 H ILE B 824 10.382 5.627 3.722 1.00 0.00 H new ATOM 0 HA ILE B 824 12.194 3.732 2.408 1.00 0.00 H new ATOM 0 HB ILE B 824 10.975 4.534 0.446 1.00 0.00 H new ATOM 0 HG12 ILE B 824 9.881 6.735 2.241 1.00 0.00 H new ATOM 0 HG13 ILE B 824 11.035 6.958 0.941 1.00 0.00 H new ATOM 0 HG21 ILE B 824 8.639 4.133 1.242 1.00 0.00 H new ATOM 0 HG22 ILE B 824 9.783 3.002 2.003 1.00 0.00 H new ATOM 0 HG23 ILE B 824 9.175 4.402 2.918 1.00 0.00 H new ATOM 0 HD11 ILE B 824 8.725 7.429 0.153 1.00 0.00 H new ATOM 0 HD12 ILE B 824 9.396 6.015 -0.693 1.00 0.00 H new ATOM 0 HD13 ILE B 824 8.225 5.788 0.627 1.00 0.00 H new ATOM 2063 N LYS B 825 12.879 6.934 2.179 1.00 0.00 N ATOM 2064 CA LYS B 825 14.024 7.824 1.856 1.00 0.00 C ATOM 2065 C LYS B 825 15.218 7.429 2.708 1.00 0.00 C ATOM 2066 O LYS B 825 16.350 7.430 2.265 1.00 0.00 O ATOM 2067 CB LYS B 825 13.562 9.226 2.227 1.00 0.00 C ATOM 2068 CG LYS B 825 13.676 10.114 1.003 1.00 0.00 C ATOM 2069 CD LYS B 825 14.182 11.483 1.424 1.00 0.00 C ATOM 2070 CE LYS B 825 13.846 12.494 0.331 1.00 0.00 C ATOM 2071 NZ LYS B 825 15.165 12.914 -0.221 1.00 0.00 N ATOM 0 H LYS B 825 12.043 7.403 2.528 1.00 0.00 H new ATOM 0 HA LYS B 825 14.319 7.760 0.809 1.00 0.00 H new ATOM 0 HB2 LYS B 825 12.532 9.203 2.583 1.00 0.00 H new ATOM 0 HB3 LYS B 825 14.171 9.622 3.040 1.00 0.00 H new ATOM 0 HG2 LYS B 825 14.357 9.669 0.278 1.00 0.00 H new ATOM 0 HG3 LYS B 825 12.706 10.206 0.514 1.00 0.00 H new ATOM 0 HD2 LYS B 825 13.723 11.781 2.367 1.00 0.00 H new ATOM 0 HD3 LYS B 825 15.259 11.452 1.590 1.00 0.00 H new ATOM 0 HE2 LYS B 825 13.219 12.048 -0.441 1.00 0.00 H new ATOM 0 HE3 LYS B 825 13.298 13.345 0.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 15.016 13.571 -1.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 15.718 13.387 0.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 15.683 12.077 -0.558 1.00 0.00 H new ATOM 2085 N GLU B 826 14.964 7.100 3.938 1.00 0.00 N ATOM 2086 CA GLU B 826 16.067 6.665 4.832 1.00 0.00 C ATOM 2087 C GLU B 826 16.401 5.197 4.557 1.00 0.00 C ATOM 2088 O GLU B 826 17.486 4.732 4.845 1.00 0.00 O ATOM 2089 CB GLU B 826 15.523 6.859 6.247 1.00 0.00 C ATOM 2090 CG GLU B 826 15.201 8.342 6.460 1.00 0.00 C ATOM 2091 CD GLU B 826 16.413 9.044 7.075 1.00 0.00 C ATOM 2092 OE1 GLU B 826 17.299 9.421 6.326 1.00 0.00 O ATOM 2093 OE2 GLU B 826 16.435 9.192 8.286 1.00 0.00 O ATOM 0 H GLU B 826 14.038 7.113 4.365 1.00 0.00 H new ATOM 0 HA GLU B 826 16.988 7.229 4.681 1.00 0.00 H new ATOM 0 HB2 GLU B 826 14.627 6.255 6.392 1.00 0.00 H new ATOM 0 HB3 GLU B 826 16.256 6.524 6.981 1.00 0.00 H new ATOM 0 HG2 GLU B 826 14.940 8.809 5.510 1.00 0.00 H new ATOM 0 HG3 GLU B 826 14.336 8.447 7.115 1.00 0.00 H new ATOM 2100 N ALA B 827 15.488 4.473 3.961 1.00 0.00 N ATOM 2101 CA ALA B 827 15.771 3.050 3.618 1.00 0.00 C ATOM 2102 C ALA B 827 16.429 2.958 2.244 1.00 0.00 C ATOM 2103 O ALA B 827 16.539 1.891 1.673 1.00 0.00 O ATOM 2104 CB ALA B 827 14.399 2.376 3.558 1.00 0.00 C ATOM 0 H ALA B 827 14.561 4.807 3.698 1.00 0.00 H new ATOM 0 HA ALA B 827 16.441 2.587 4.343 1.00 0.00 H new ATOM 0 HB1 ALA B 827 14.522 1.322 3.310 1.00 0.00 H new ATOM 0 HB2 ALA B 827 13.907 2.466 4.526 1.00 0.00 H new ATOM 0 HB3 ALA B 827 13.789 2.860 2.795 1.00 0.00 H new ATOM 2110 N GLY B 828 16.822 4.068 1.675 1.00 0.00 N ATOM 2111 CA GLY B 828 17.393 4.022 0.305 1.00 0.00 C ATOM 2112 C GLY B 828 16.331 3.440 -0.629 1.00 0.00 C ATOM 2113 O GLY B 828 16.637 2.821 -1.628 1.00 0.00 O ATOM 0 H GLY B 828 16.771 4.994 2.099 1.00 0.00 H new ATOM 0 HA2 GLY B 828 17.682 5.021 -0.021 1.00 0.00 H new ATOM 0 HA3 GLY B 828 18.294 3.408 0.288 1.00 0.00 H new ATOM 2117 N LEU B 829 15.078 3.596 -0.278 1.00 0.00 N ATOM 2118 CA LEU B 829 13.989 3.052 -1.132 1.00 0.00 C ATOM 2119 C LEU B 829 13.741 3.986 -2.312 1.00 0.00 C ATOM 2120 O LEU B 829 13.770 3.584 -3.458 1.00 0.00 O ATOM 2121 CB LEU B 829 12.760 3.024 -0.228 1.00 0.00 C ATOM 2122 CG LEU B 829 12.432 1.594 0.207 1.00 0.00 C ATOM 2123 CD1 LEU B 829 11.087 1.592 0.909 1.00 0.00 C ATOM 2124 CD2 LEU B 829 12.336 0.681 -1.010 1.00 0.00 C ATOM 0 H LEU B 829 14.767 4.078 0.565 1.00 0.00 H new ATOM 0 HA LEU B 829 14.231 2.068 -1.535 1.00 0.00 H new ATOM 0 HB2 LEU B 829 12.936 3.644 0.651 1.00 0.00 H new ATOM 0 HB3 LEU B 829 11.907 3.453 -0.754 1.00 0.00 H new ATOM 0 HG LEU B 829 13.219 1.236 0.871 1.00 0.00 H new ATOM 0 HD11 LEU B 829 10.842 0.578 1.224 1.00 0.00 H new ATOM 0 HD12 LEU B 829 11.132 2.242 1.783 1.00 0.00 H new ATOM 0 HD13 LEU B 829 10.319 1.955 0.226 1.00 0.00 H new ATOM 0 HD21 LEU B 829 12.102 -0.333 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU B 829 11.549 1.041 -1.673 1.00 0.00 H new ATOM 0 HD23 LEU B 829 13.288 0.682 -1.542 1.00 0.00 H new ATOM 2136 N ILE B 830 13.493 5.236 -2.032 1.00 0.00 N ATOM 2137 CA ILE B 830 13.240 6.209 -3.129 1.00 0.00 C ATOM 2138 C ILE B 830 14.568 6.751 -3.665 1.00 0.00 C ATOM 2139 O ILE B 830 14.666 7.177 -4.799 1.00 0.00 O ATOM 2140 CB ILE B 830 12.421 7.320 -2.470 1.00 0.00 C ATOM 2141 CG1 ILE B 830 11.154 6.719 -1.846 1.00 0.00 C ATOM 2142 CG2 ILE B 830 12.040 8.368 -3.520 1.00 0.00 C ATOM 2143 CD1 ILE B 830 10.200 6.240 -2.947 1.00 0.00 C ATOM 0 H ILE B 830 13.455 5.625 -1.090 1.00 0.00 H new ATOM 0 HA ILE B 830 12.719 5.766 -3.978 1.00 0.00 H new ATOM 0 HB ILE B 830 13.014 7.797 -1.689 1.00 0.00 H new ATOM 0 HG12 ILE B 830 11.420 5.885 -1.196 1.00 0.00 H new ATOM 0 HG13 ILE B 830 10.658 7.463 -1.223 1.00 0.00 H new ATOM 0 HG21 ILE B 830 11.456 9.159 -3.049 1.00 0.00 H new ATOM 0 HG22 ILE B 830 12.945 8.794 -3.954 1.00 0.00 H new ATOM 0 HG23 ILE B 830 11.447 7.898 -4.305 1.00 0.00 H new ATOM 0 HD11 ILE B 830 9.305 5.815 -2.493 1.00 0.00 H new ATOM 0 HD12 ILE B 830 9.922 7.083 -3.579 1.00 0.00 H new ATOM 0 HD13 ILE B 830 10.695 5.481 -3.552 1.00 0.00 H new ATOM 2155 N ASP B 831 15.595 6.721 -2.858 1.00 0.00 N ATOM 2156 CA ASP B 831 16.935 7.198 -3.314 1.00 0.00 C ATOM 2157 C ASP B 831 16.833 8.546 -4.035 1.00 0.00 C ATOM 2158 O ASP B 831 17.522 8.790 -5.005 1.00 0.00 O ATOM 2159 CB ASP B 831 17.419 6.119 -4.285 1.00 0.00 C ATOM 2160 CG ASP B 831 18.898 5.825 -4.024 1.00 0.00 C ATOM 2161 OD1 ASP B 831 19.680 6.761 -4.043 1.00 0.00 O ATOM 2162 OD2 ASP B 831 19.222 4.669 -3.808 1.00 0.00 O ATOM 0 H ASP B 831 15.564 6.384 -1.896 1.00 0.00 H new ATOM 0 HA ASP B 831 17.614 7.350 -2.475 1.00 0.00 H new ATOM 0 HB2 ASP B 831 16.829 5.211 -4.160 1.00 0.00 H new ATOM 0 HB3 ASP B 831 17.279 6.451 -5.314 1.00 0.00 H new ATOM 2167 N LYS B 832 15.997 9.430 -3.565 1.00 0.00 N ATOM 2168 CA LYS B 832 15.879 10.759 -4.233 1.00 0.00 C ATOM 2169 C LYS B 832 16.646 11.824 -3.444 1.00 0.00 C ATOM 2170 O LYS B 832 17.307 11.460 -2.485 1.00 0.00 O ATOM 2171 CB LYS B 832 14.378 11.069 -4.244 1.00 0.00 C ATOM 2172 CG LYS B 832 13.872 11.257 -2.811 1.00 0.00 C ATOM 2173 CD LYS B 832 12.433 11.777 -2.846 1.00 0.00 C ATOM 2174 CE LYS B 832 12.440 13.279 -3.137 1.00 0.00 C ATOM 2175 NZ LYS B 832 11.305 13.827 -2.342 1.00 0.00 N ATOM 2176 OXT LYS B 832 16.559 12.983 -3.813 1.00 0.00 O ATOM 0 H LYS B 832 15.394 9.293 -2.754 1.00 0.00 H new ATOM 0 HA LYS B 832 16.299 10.752 -5.239 1.00 0.00 H new ATOM 0 HB2 LYS B 832 14.189 11.971 -4.827 1.00 0.00 H new ATOM 0 HB3 LYS B 832 13.834 10.257 -4.727 1.00 0.00 H new ATOM 0 HG2 LYS B 832 13.916 10.311 -2.271 1.00 0.00 H new ATOM 0 HG3 LYS B 832 14.512 11.959 -2.277 1.00 0.00 H new ATOM 0 HD2 LYS B 832 11.863 11.250 -3.611 1.00 0.00 H new ATOM 0 HD3 LYS B 832 11.942 11.583 -1.893 1.00 0.00 H new ATOM 0 HE2 LYS B 832 13.385 13.734 -2.842 1.00 0.00 H new ATOM 0 HE3 LYS B 832 12.309 13.476 -4.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 832 11.243 14.855 -2.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 832 10.418 13.379 -2.649 1.00 0.00 H new ATOM 0 HZ3 LYS B 832 11.461 13.630 -1.333 1.00 0.00 H new TER 2190 LYS B 832