USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1100 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: B 36 ALY H2 : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD NoAdj-H: B 36 ALY H : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD Set 1.1: A 799 CYS SG : rot 149:sc= -12! USER MOD Set 1.2: A 803 ASN : amide:sc= -3.26! C(o=-15!,f=-15!) USER MOD Set 2.1: A 789 MET CE :methyl -133:sc= -14.3! (180deg=-14.3!) USER MOD Set 2.2: A 793 GLN : amide:sc= -4.47! K(o=-19!,f=-15) USER MOD Set 3.1: A 773 MET CE :methyl -113:sc= -10.9! (180deg=-12.4!) USER MOD Set 3.2: A 782 TYR OH : rot -25:sc= -5.16! USER MOD Set 4.1: A 744 SER OG : rot -32:sc= 0.292 USER MOD Set 4.2: A 812 CYS SG : rot 95:sc= -1.12! USER MOD Set 5.1: A 730 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 733 LYS NZ :NH3+ 163:sc= -0.431 (180deg=-1.02) USER MOD Single : A 716 SER OG : rot 180:sc= 0 USER MOD Single : A 717 HIS : no HD1:sc= -0.0174 X(o=-0.017,f=0) USER MOD Single : A 718 MET CE :methyl 160:sc= -0.791 (180deg=-1.9!) USER MOD Single : A 719 SER OG : rot 180:sc= 0 USER MOD Single : A 720 LYS NZ :NH3+ -162:sc= -0.0622 (180deg=-0.331) USER MOD Single : A 727 GLN : amide:sc= -1.23 K(o=-1.2,f=-8.2!) USER MOD Single : A 729 TYR OH : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 65:sc= 1.25 USER MOD Single : A 734 SER OG : rot 69:sc= 0.132 USER MOD Single : A 737 GLN : amide:sc= 0.0618 X(o=0.062,f=0) USER MOD Single : A 738 GLN : amide:sc= -9.65! C(o=-9.7!,f=-4.1!) USER MOD Single : A 740 LYS NZ :NH3+ -152:sc= -0.319 (180deg=-1.93!) USER MOD Single : A 741 SER OG : rot -16:sc= 0.105 USER MOD Single : A 742 HIS : no HD1:sc= -7.63! C(o=-7.6!,f=-18!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 749 MET CE :methyl 153:sc= -3.63! (180deg=-5.11!) USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 THR OG1 : rot 180:sc= 0 USER MOD Single : A 760 TYR OH : rot 180:sc= -1.63! USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -137:sc= -3.75 (180deg=-10.2!) USER MOD Single : A 771 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0192) USER MOD Single : A 772 THR OG1 : rot 180:sc= 0 USER MOD Single : A 774 SER OG : rot -20:sc= -0.636 USER MOD Single : A 778 LYS NZ :NH3+ -176:sc= -4.13! (180deg=-4.4!) USER MOD Single : A 779 ASN : amide:sc= -8.06! C(o=-8.1!,f=-3.8!) USER MOD Single : A 781 TYR OH : rot 180:sc= -0.969! USER MOD Single : A 784 SER OG : rot 45:sc= 0.478 USER MOD Single : A 785 LYS NZ :NH3+ -118:sc= -0.0554 (180deg=-0.417) USER MOD Single : A 786 LYS NZ :NH3+ -168:sc= -0.0567 (180deg=-0.26) USER MOD Single : A 797 THR OG1 : rot -64:sc= 1.07 USER MOD Single : A 798 ASN : amide:sc= -5.7! C(o=-5.7!,f=-8.5!) USER MOD Single : A 800 LYS NZ :NH3+ -172:sc= -8.61! (180deg=-8.75!) USER MOD Single : A 802 TYR OH : rot 30:sc= -1.77 USER MOD Single : A 807 SER OG : rot 180:sc= -0.261 USER MOD Single : A 809 TYR OH : rot -15:sc= -2.44 USER MOD Single : A 810 TYR OH : rot 129:sc= 0.144 USER MOD Single : A 811 LYS NZ :NH3+ -109:sc= -1.51! (180deg=-3.75!) USER MOD Single : A 814 ASN : amide:sc= -0.125 K(o=-0.13,f=-0.83!) USER MOD Single : A 818 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0222) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 LYS NZ :NH3+ -165:sc= -0.0684 (180deg=-0.474) USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 32 THR OG1 : rot 180:sc= -0.247 USER MOD Single : B 37 LYS NZ :NH3+ -134:sc= -0.0626 (180deg=-0.361) USER MOD Single : B 39 HIS : no HD1:sc= -3.39 K(o=-3.4,f=-5.1!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 170:sc= -0.0304 (180deg=-0.176) USER MOD Single : B 43 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -21.511 0.745 15.623 1.00 0.00 N ATOM 2 CA GLY A 715 -22.503 1.750 15.151 1.00 0.00 C ATOM 3 C GLY A 715 -21.962 2.622 14.036 1.00 0.00 C ATOM 4 O GLY A 715 -21.228 2.147 13.171 1.00 0.00 O ATOM 0 HA2 GLY A 715 -23.399 1.236 14.803 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -22.802 2.381 15.988 1.00 0.00 H new ATOM 10 N SER A 716 -22.326 3.902 14.060 1.00 0.00 N ATOM 11 CA SER A 716 -21.877 4.852 13.046 1.00 0.00 C ATOM 12 C SER A 716 -22.260 4.382 11.645 1.00 0.00 C ATOM 13 O SER A 716 -21.488 3.692 10.978 1.00 0.00 O ATOM 14 CB SER A 716 -20.361 5.048 13.135 1.00 0.00 C ATOM 15 OG SER A 716 -19.985 5.539 14.410 1.00 0.00 O ATOM 0 H SER A 716 -22.933 4.306 14.773 1.00 0.00 H new ATOM 0 HA SER A 716 -22.372 5.804 13.235 1.00 0.00 H new ATOM 0 HB2 SER A 716 -19.857 4.101 12.943 1.00 0.00 H new ATOM 0 HB3 SER A 716 -20.035 5.745 12.363 1.00 0.00 H new ATOM 0 HG SER A 716 -19.012 5.654 14.442 1.00 0.00 H new ATOM 21 N HIS A 717 -23.457 4.761 11.205 1.00 0.00 N ATOM 22 CA HIS A 717 -23.943 4.378 9.884 1.00 0.00 C ATOM 23 C HIS A 717 -23.091 5.009 8.787 1.00 0.00 C ATOM 24 O HIS A 717 -22.736 6.185 8.863 1.00 0.00 O ATOM 25 CB HIS A 717 -25.406 4.792 9.713 1.00 0.00 C ATOM 26 CG HIS A 717 -26.319 4.204 10.744 1.00 0.00 C ATOM 27 ND1 HIS A 717 -27.000 3.020 10.558 1.00 0.00 N ATOM 28 CD2 HIS A 717 -26.661 4.643 11.978 1.00 0.00 C ATOM 29 CE1 HIS A 717 -27.724 2.757 11.632 1.00 0.00 C ATOM 30 NE2 HIS A 717 -27.534 3.726 12.508 1.00 0.00 N ATOM 0 H HIS A 717 -24.107 5.333 11.744 1.00 0.00 H new ATOM 0 HA HIS A 717 -23.869 3.294 9.798 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -25.475 5.879 9.756 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -25.747 4.490 8.723 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -26.312 5.546 12.456 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -28.362 1.896 11.769 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -27.966 3.784 13.430 1.00 0.00 H new ATOM 39 N MET A 718 -22.767 4.219 7.768 1.00 0.00 N ATOM 40 CA MET A 718 -21.957 4.697 6.653 1.00 0.00 C ATOM 41 C MET A 718 -22.678 4.486 5.325 1.00 0.00 C ATOM 42 O MET A 718 -23.425 3.523 5.161 1.00 0.00 O ATOM 43 CB MET A 718 -20.604 3.979 6.632 1.00 0.00 C ATOM 44 CG MET A 718 -19.748 4.244 7.862 1.00 0.00 C ATOM 45 SD MET A 718 -18.544 5.565 7.610 1.00 0.00 S ATOM 46 CE MET A 718 -19.614 6.995 7.465 1.00 0.00 C ATOM 0 H MET A 718 -23.054 3.243 7.692 1.00 0.00 H new ATOM 0 HA MET A 718 -21.792 5.766 6.790 1.00 0.00 H new ATOM 0 HB2 MET A 718 -20.774 2.906 6.544 1.00 0.00 H new ATOM 0 HB3 MET A 718 -20.053 4.288 5.744 1.00 0.00 H new ATOM 0 HG2 MET A 718 -20.395 4.504 8.699 1.00 0.00 H new ATOM 0 HG3 MET A 718 -19.223 3.329 8.137 1.00 0.00 H new ATOM 0 HE1 MET A 718 -19.040 7.900 7.661 1.00 0.00 H new ATOM 0 HE2 MET A 718 -20.028 7.039 6.458 1.00 0.00 H new ATOM 0 HE3 MET A 718 -20.426 6.917 8.188 1.00 0.00 H new ATOM 56 N SER A 719 -22.448 5.395 4.382 1.00 0.00 N ATOM 57 CA SER A 719 -23.075 5.313 3.067 1.00 0.00 C ATOM 58 C SER A 719 -22.040 5.003 1.990 1.00 0.00 C ATOM 59 O SER A 719 -22.321 4.278 1.037 1.00 0.00 O ATOM 60 CB SER A 719 -23.796 6.621 2.740 1.00 0.00 C ATOM 61 OG SER A 719 -24.825 6.886 3.678 1.00 0.00 O ATOM 0 H SER A 719 -21.831 6.198 4.504 1.00 0.00 H new ATOM 0 HA SER A 719 -23.803 4.502 3.088 1.00 0.00 H new ATOM 0 HB2 SER A 719 -23.081 7.443 2.739 1.00 0.00 H new ATOM 0 HB3 SER A 719 -24.220 6.565 1.737 1.00 0.00 H new ATOM 0 HG SER A 719 -25.269 7.729 3.447 1.00 0.00 H new ATOM 67 N LYS A 720 -20.843 5.562 2.149 1.00 0.00 N ATOM 68 CA LYS A 720 -19.764 5.342 1.193 1.00 0.00 C ATOM 69 C LYS A 720 -18.886 4.178 1.628 1.00 0.00 C ATOM 70 O LYS A 720 -17.807 4.375 2.189 1.00 0.00 O ATOM 71 CB LYS A 720 -18.925 6.603 1.040 1.00 0.00 C ATOM 72 CG LYS A 720 -19.716 7.818 0.580 1.00 0.00 C ATOM 73 CD LYS A 720 -20.168 7.684 -0.867 1.00 0.00 C ATOM 74 CE LYS A 720 -18.993 7.746 -1.829 1.00 0.00 C ATOM 75 NZ LYS A 720 -18.278 9.050 -1.750 1.00 0.00 N ATOM 0 H LYS A 720 -20.597 6.170 2.930 1.00 0.00 H new ATOM 0 HA LYS A 720 -20.209 5.096 0.229 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -18.451 6.830 1.995 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -18.125 6.411 0.325 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -20.587 7.949 1.222 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -19.103 8.713 0.688 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -20.696 6.740 -0.998 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -20.875 8.480 -1.103 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -18.298 6.937 -1.605 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -19.349 7.588 -2.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -17.696 9.179 -2.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -18.971 9.823 -1.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -17.667 9.060 -0.909 1.00 0.00 H new ATOM 89 N GLU A 721 -19.359 2.965 1.369 1.00 0.00 N ATOM 90 CA GLU A 721 -18.617 1.767 1.731 1.00 0.00 C ATOM 91 C GLU A 721 -19.161 0.545 0.995 1.00 0.00 C ATOM 92 O GLU A 721 -20.240 0.039 1.307 1.00 0.00 O ATOM 93 CB GLU A 721 -18.669 1.545 3.242 1.00 0.00 C ATOM 94 CG GLU A 721 -17.691 0.492 3.730 1.00 0.00 C ATOM 95 CD GLU A 721 -17.587 0.451 5.241 1.00 0.00 C ATOM 96 OE1 GLU A 721 -18.625 0.240 5.901 1.00 0.00 O ATOM 97 OE2 GLU A 721 -16.468 0.637 5.764 1.00 0.00 O ATOM 0 H GLU A 721 -20.252 2.787 0.910 1.00 0.00 H new ATOM 0 HA GLU A 721 -17.578 1.908 1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -18.459 2.487 3.748 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -19.680 1.250 3.524 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -18.003 -0.486 3.364 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -16.707 0.691 3.307 1.00 0.00 H new ATOM 104 N PRO A 722 -18.400 0.069 -0.003 1.00 0.00 N ATOM 105 CA PRO A 722 -18.754 -1.099 -0.822 1.00 0.00 C ATOM 106 C PRO A 722 -19.146 -2.306 0.030 1.00 0.00 C ATOM 107 O PRO A 722 -20.113 -3.005 -0.269 1.00 0.00 O ATOM 108 CB PRO A 722 -17.462 -1.365 -1.582 1.00 0.00 C ATOM 109 CG PRO A 722 -16.861 -0.026 -1.710 1.00 0.00 C ATOM 110 CD PRO A 722 -17.110 0.638 -0.413 1.00 0.00 C ATOM 0 HA PRO A 722 -19.619 -0.923 -1.461 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -16.809 -2.048 -1.039 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -17.654 -1.814 -2.556 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.793 -0.092 -1.920 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -17.313 0.531 -2.531 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.324 0.422 0.310 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -17.160 1.722 -0.516 1.00 0.00 H new ATOM 118 N ARG A 723 -18.371 -2.534 1.090 1.00 0.00 N ATOM 119 CA ARG A 723 -18.608 -3.627 2.035 1.00 0.00 C ATOM 120 C ARG A 723 -18.441 -5.015 1.422 1.00 0.00 C ATOM 121 O ARG A 723 -17.455 -5.696 1.701 1.00 0.00 O ATOM 122 CB ARG A 723 -19.983 -3.512 2.677 1.00 0.00 C ATOM 123 CG ARG A 723 -20.136 -4.471 3.836 1.00 0.00 C ATOM 124 CD ARG A 723 -19.256 -4.068 5.008 1.00 0.00 C ATOM 125 NE ARG A 723 -19.752 -2.873 5.684 1.00 0.00 N ATOM 126 CZ ARG A 723 -19.378 -2.509 6.907 1.00 0.00 C ATOM 127 NH1 ARG A 723 -18.484 -3.228 7.573 1.00 0.00 N ATOM 128 NH2 ARG A 723 -19.896 -1.424 7.466 1.00 0.00 N ATOM 0 H ARG A 723 -17.557 -1.964 1.319 1.00 0.00 H new ATOM 0 HA ARG A 723 -17.837 -3.521 2.798 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -20.139 -2.491 3.025 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -20.752 -3.715 1.932 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -21.178 -4.497 4.154 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -19.876 -5.479 3.513 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -19.203 -4.891 5.721 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -18.241 -3.888 4.653 1.00 0.00 H new ATOM 0 HE ARG A 723 -20.423 -2.284 5.191 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -18.081 -4.063 7.147 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -18.199 -2.946 8.511 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -20.583 -0.867 6.958 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -19.608 -1.147 8.404 1.00 0.00 H new ATOM 142 N ASP A 724 -19.409 -5.447 0.615 1.00 0.00 N ATOM 143 CA ASP A 724 -19.350 -6.773 0.003 1.00 0.00 C ATOM 144 C ASP A 724 -17.971 -7.051 -0.592 1.00 0.00 C ATOM 145 O ASP A 724 -17.241 -6.129 -0.954 1.00 0.00 O ATOM 146 CB ASP A 724 -20.427 -6.927 -1.066 1.00 0.00 C ATOM 147 CG ASP A 724 -21.828 -6.859 -0.489 1.00 0.00 C ATOM 148 OD1 ASP A 724 -22.170 -5.824 0.122 1.00 0.00 O ATOM 149 OD2 ASP A 724 -22.584 -7.841 -0.647 1.00 0.00 O ATOM 0 H ASP A 724 -20.237 -4.903 0.371 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.533 -7.504 0.790 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -20.307 -6.144 -1.814 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.294 -7.880 -1.578 1.00 0.00 H new ATOM 154 N PRO A 725 -17.608 -8.340 -0.710 1.00 0.00 N ATOM 155 CA PRO A 725 -16.314 -8.761 -1.224 1.00 0.00 C ATOM 156 C PRO A 725 -16.240 -8.682 -2.741 1.00 0.00 C ATOM 157 O PRO A 725 -15.156 -8.707 -3.318 1.00 0.00 O ATOM 158 CB PRO A 725 -16.178 -10.216 -0.744 1.00 0.00 C ATOM 159 CG PRO A 725 -17.435 -10.534 -0.001 1.00 0.00 C ATOM 160 CD PRO A 725 -18.444 -9.491 -0.384 1.00 0.00 C ATOM 0 HA PRO A 725 -15.510 -8.115 -0.869 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -16.044 -10.893 -1.588 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.306 -10.333 -0.100 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -17.794 -11.531 -0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.260 -10.525 1.075 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -19.049 -9.806 -1.234 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -19.132 -9.273 0.433 1.00 0.00 H new ATOM 168 N ASP A 726 -17.401 -8.592 -3.378 1.00 0.00 N ATOM 169 CA ASP A 726 -17.474 -8.499 -4.831 1.00 0.00 C ATOM 170 C ASP A 726 -17.505 -7.044 -5.262 1.00 0.00 C ATOM 171 O ASP A 726 -16.767 -6.650 -6.165 1.00 0.00 O ATOM 172 CB ASP A 726 -18.704 -9.240 -5.358 1.00 0.00 C ATOM 173 CG ASP A 726 -18.610 -10.737 -5.144 1.00 0.00 C ATOM 174 OD1 ASP A 726 -18.961 -11.203 -4.038 1.00 0.00 O ATOM 175 OD2 ASP A 726 -18.186 -11.446 -6.082 1.00 0.00 O ATOM 0 H ASP A 726 -18.307 -8.581 -2.910 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.586 -8.970 -5.253 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -19.596 -8.859 -4.860 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -18.821 -9.034 -6.422 1.00 0.00 H new ATOM 180 N GLN A 727 -18.365 -6.239 -4.629 1.00 0.00 N ATOM 181 CA GLN A 727 -18.421 -4.828 -4.967 1.00 0.00 C ATOM 182 C GLN A 727 -17.036 -4.250 -4.798 1.00 0.00 C ATOM 183 O GLN A 727 -16.553 -3.518 -5.650 1.00 0.00 O ATOM 184 CB GLN A 727 -19.417 -4.061 -4.117 1.00 0.00 C ATOM 185 CG GLN A 727 -20.777 -4.704 -4.067 1.00 0.00 C ATOM 186 CD GLN A 727 -21.730 -4.000 -3.121 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.787 -4.310 -1.933 1.00 0.00 O ATOM 188 NE2 GLN A 727 -22.489 -3.046 -3.648 1.00 0.00 N ATOM 0 H GLN A 727 -19.013 -6.537 -3.900 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.762 -4.733 -5.998 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.027 -3.973 -3.103 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.516 -3.049 -4.509 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.207 -4.711 -5.069 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.670 -5.744 -3.759 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -22.409 -2.820 -4.640 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.151 -2.539 -3.061 1.00 0.00 H new ATOM 197 N LEU A 728 -16.393 -4.636 -3.699 1.00 0.00 N ATOM 198 CA LEU A 728 -15.043 -4.194 -3.395 1.00 0.00 C ATOM 199 C LEU A 728 -14.079 -4.783 -4.389 1.00 0.00 C ATOM 200 O LEU A 728 -13.374 -4.064 -5.074 1.00 0.00 O ATOM 201 CB LEU A 728 -14.651 -4.625 -1.990 1.00 0.00 C ATOM 202 CG LEU A 728 -15.163 -3.727 -0.893 1.00 0.00 C ATOM 203 CD1 LEU A 728 -15.038 -4.403 0.459 1.00 0.00 C ATOM 204 CD2 LEU A 728 -14.385 -2.433 -0.928 1.00 0.00 C ATOM 0 H LEU A 728 -16.794 -5.261 -3.000 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.009 -3.106 -3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -15.022 -5.635 -1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.564 -4.669 -1.928 1.00 0.00 H new ATOM 0 HG LEU A 728 -16.221 -3.519 -1.052 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.414 -3.736 1.235 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.619 -5.325 0.460 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -13.991 -4.634 0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -14.744 -1.771 -0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -13.326 -2.641 -0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -14.523 -1.952 -1.896 1.00 0.00 H new ATOM 216 N TYR A 729 -14.077 -6.097 -4.490 1.00 0.00 N ATOM 217 CA TYR A 729 -13.193 -6.769 -5.412 1.00 0.00 C ATOM 218 C TYR A 729 -13.022 -5.954 -6.669 1.00 0.00 C ATOM 219 O TYR A 729 -11.928 -5.481 -6.949 1.00 0.00 O ATOM 220 CB TYR A 729 -13.779 -8.133 -5.761 1.00 0.00 C ATOM 221 CG TYR A 729 -13.496 -8.601 -7.163 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.206 -8.804 -7.538 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.502 -8.852 -8.086 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.870 -9.243 -8.792 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.193 -9.296 -9.361 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.870 -9.491 -9.711 1.00 0.00 C ATOM 227 OH TYR A 729 -12.549 -9.934 -10.973 1.00 0.00 O ATOM 0 H TYR A 729 -14.677 -6.716 -3.945 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.217 -6.892 -4.944 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.388 -8.871 -5.061 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.859 -8.097 -5.616 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.419 -8.613 -6.824 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.534 -8.700 -7.808 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.834 -9.393 -9.058 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -14.979 -9.488 -10.076 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.369 -10.060 -11.494 1.00 0.00 H new ATOM 237 N SER A 730 -14.093 -5.724 -7.394 1.00 0.00 N ATOM 238 CA SER A 730 -13.952 -4.974 -8.612 1.00 0.00 C ATOM 239 C SER A 730 -13.988 -3.469 -8.401 1.00 0.00 C ATOM 240 O SER A 730 -13.571 -2.715 -9.282 1.00 0.00 O ATOM 241 CB SER A 730 -14.861 -5.459 -9.711 1.00 0.00 C ATOM 242 OG SER A 730 -15.410 -4.380 -10.450 1.00 0.00 O ATOM 0 H SER A 730 -15.038 -6.034 -7.170 1.00 0.00 H new ATOM 0 HA SER A 730 -12.943 -5.178 -8.969 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.305 -6.114 -10.382 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.667 -6.054 -9.281 1.00 0.00 H new ATOM 0 HG SER A 730 -15.993 -4.730 -11.156 1.00 0.00 H new ATOM 248 N THR A 731 -14.488 -3.014 -7.254 1.00 0.00 N ATOM 249 CA THR A 731 -14.470 -1.582 -6.984 1.00 0.00 C ATOM 250 C THR A 731 -13.026 -1.220 -6.947 1.00 0.00 C ATOM 251 O THR A 731 -12.515 -0.444 -7.751 1.00 0.00 O ATOM 252 CB THR A 731 -15.106 -1.218 -5.627 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.519 -1.037 -5.783 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.496 0.051 -5.041 1.00 0.00 C ATOM 0 H THR A 731 -14.897 -3.594 -6.521 1.00 0.00 H new ATOM 0 HA THR A 731 -15.045 -1.051 -7.743 1.00 0.00 H new ATOM 0 HB THR A 731 -14.908 -2.040 -4.939 1.00 0.00 H new ATOM 0 HG1 THR A 731 -16.932 -1.889 -6.037 1.00 0.00 H new ATOM 0 HG21 THR A 731 -14.970 0.275 -4.085 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.426 -0.095 -4.890 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.655 0.882 -5.728 1.00 0.00 H new ATOM 262 N LEU A 732 -12.395 -1.867 -6.005 1.00 0.00 N ATOM 263 CA LEU A 732 -10.994 -1.770 -5.772 1.00 0.00 C ATOM 264 C LEU A 732 -10.240 -2.160 -7.033 1.00 0.00 C ATOM 265 O LEU A 732 -9.168 -1.636 -7.310 1.00 0.00 O ATOM 266 CB LEU A 732 -10.633 -2.719 -4.652 1.00 0.00 C ATOM 267 CG LEU A 732 -11.573 -2.767 -3.451 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.446 -4.098 -2.776 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.248 -1.673 -2.474 1.00 0.00 C ATOM 0 H LEU A 732 -12.868 -2.498 -5.358 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.727 -0.749 -5.501 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.565 -3.724 -5.069 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.638 -2.455 -4.293 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.595 -2.623 -3.801 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.116 -4.136 -1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.711 -4.889 -3.478 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.419 -4.239 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.931 -1.727 -1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.223 -1.792 -2.122 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.354 -0.705 -2.964 1.00 0.00 H new ATOM 281 N LYS A 733 -10.810 -3.093 -7.799 1.00 0.00 N ATOM 282 CA LYS A 733 -10.183 -3.531 -9.042 1.00 0.00 C ATOM 283 C LYS A 733 -9.940 -2.317 -9.904 1.00 0.00 C ATOM 284 O LYS A 733 -9.011 -2.278 -10.697 1.00 0.00 O ATOM 285 CB LYS A 733 -11.069 -4.544 -9.773 1.00 0.00 C ATOM 286 CG LYS A 733 -10.503 -5.059 -11.084 1.00 0.00 C ATOM 287 CD LYS A 733 -10.869 -6.517 -11.313 1.00 0.00 C ATOM 288 CE LYS A 733 -12.293 -6.679 -11.799 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.715 -5.569 -12.697 1.00 0.00 N ATOM 0 H LYS A 733 -11.694 -3.553 -7.582 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.237 -4.026 -8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.247 -5.393 -9.112 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.038 -4.084 -9.968 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.881 -4.454 -11.908 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.418 -4.951 -11.081 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.186 -6.951 -12.043 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.738 -7.073 -10.385 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -12.388 -7.627 -12.328 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -12.964 -6.724 -10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.564 -5.854 -13.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -12.929 -4.725 -12.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -11.948 -5.352 -13.365 1.00 0.00 H new ATOM 303 N SER A 734 -10.771 -1.307 -9.689 1.00 0.00 N ATOM 304 CA SER A 734 -10.674 -0.059 -10.431 1.00 0.00 C ATOM 305 C SER A 734 -9.703 0.867 -9.731 1.00 0.00 C ATOM 306 O SER A 734 -8.804 1.410 -10.372 1.00 0.00 O ATOM 307 CB SER A 734 -12.045 0.607 -10.568 1.00 0.00 C ATOM 308 OG SER A 734 -12.971 -0.256 -11.206 1.00 0.00 O ATOM 0 H SER A 734 -11.525 -1.329 -9.002 1.00 0.00 H new ATOM 0 HA SER A 734 -10.309 -0.274 -11.435 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.419 0.882 -9.582 1.00 0.00 H new ATOM 0 HB3 SER A 734 -11.949 1.529 -11.141 1.00 0.00 H new ATOM 0 HG SER A 734 -13.175 -1.011 -10.616 1.00 0.00 H new ATOM 314 N ILE A 735 -9.884 1.068 -8.417 1.00 0.00 N ATOM 315 CA ILE A 735 -8.956 1.902 -7.685 1.00 0.00 C ATOM 316 C ILE A 735 -7.566 1.398 -7.992 1.00 0.00 C ATOM 317 O ILE A 735 -6.791 2.081 -8.636 1.00 0.00 O ATOM 318 CB ILE A 735 -9.210 1.908 -6.166 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.585 2.496 -5.907 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.154 2.755 -5.452 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.690 1.497 -5.945 1.00 0.00 C ATOM 0 H ILE A 735 -10.645 0.672 -7.865 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.086 2.937 -8.001 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.154 0.888 -5.786 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.583 2.983 -4.932 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.783 3.270 -6.649 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.347 2.749 -4.379 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.164 2.341 -5.645 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.197 3.779 -5.823 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.639 1.997 -5.751 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.722 1.027 -6.928 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.518 0.735 -5.184 1.00 0.00 H new ATOM 333 N LEU A 736 -7.295 0.159 -7.594 1.00 0.00 N ATOM 334 CA LEU A 736 -6.014 -0.477 -7.867 1.00 0.00 C ATOM 335 C LEU A 736 -5.577 -0.171 -9.283 1.00 0.00 C ATOM 336 O LEU A 736 -4.529 0.425 -9.512 1.00 0.00 O ATOM 337 CB LEU A 736 -6.135 -1.992 -7.709 1.00 0.00 C ATOM 338 CG LEU A 736 -5.108 -2.622 -6.799 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.368 -4.091 -6.747 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.705 -2.300 -7.242 1.00 0.00 C ATOM 0 H LEU A 736 -7.951 -0.427 -7.078 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.280 -0.091 -7.160 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.129 -2.224 -7.326 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.057 -2.452 -8.694 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.198 -2.210 -5.794 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.636 -4.567 -6.094 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.371 -4.269 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.287 -4.511 -7.750 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -2.993 -2.770 -6.564 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.547 -2.677 -8.253 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.559 -1.220 -7.231 1.00 0.00 H new ATOM 352 N GLN A 737 -6.411 -0.592 -10.219 1.00 0.00 N ATOM 353 CA GLN A 737 -6.166 -0.376 -11.638 1.00 0.00 C ATOM 354 C GLN A 737 -5.688 1.046 -11.898 1.00 0.00 C ATOM 355 O GLN A 737 -4.813 1.285 -12.726 1.00 0.00 O ATOM 356 CB GLN A 737 -7.454 -0.652 -12.421 1.00 0.00 C ATOM 357 CG GLN A 737 -7.519 -2.037 -13.030 1.00 0.00 C ATOM 358 CD GLN A 737 -8.686 -2.206 -13.983 1.00 0.00 C ATOM 359 OE1 GLN A 737 -8.568 -1.940 -15.178 1.00 0.00 O ATOM 360 NE2 GLN A 737 -9.821 -2.650 -13.457 1.00 0.00 N ATOM 0 H GLN A 737 -7.277 -1.093 -10.019 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.383 -1.059 -11.968 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.307 -0.518 -11.756 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.550 0.088 -13.215 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.589 -2.239 -13.562 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.597 -2.776 -12.233 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -9.874 -2.858 -12.460 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -10.640 -2.783 -14.050 1.00 0.00 H new ATOM 369 N GLN A 738 -6.250 1.974 -11.147 1.00 0.00 N ATOM 370 CA GLN A 738 -5.934 3.386 -11.282 1.00 0.00 C ATOM 371 C GLN A 738 -4.646 3.783 -10.548 1.00 0.00 C ATOM 372 O GLN A 738 -3.728 4.333 -11.153 1.00 0.00 O ATOM 373 CB GLN A 738 -7.120 4.186 -10.768 1.00 0.00 C ATOM 374 CG GLN A 738 -8.248 4.238 -11.781 1.00 0.00 C ATOM 375 CD GLN A 738 -9.604 4.484 -11.154 1.00 0.00 C ATOM 376 OE1 GLN A 738 -10.445 5.187 -11.714 1.00 0.00 O ATOM 377 NE2 GLN A 738 -9.830 3.881 -9.996 1.00 0.00 N ATOM 0 H GLN A 738 -6.940 1.771 -10.424 1.00 0.00 H new ATOM 0 HA GLN A 738 -5.751 3.602 -12.335 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.484 3.741 -9.842 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -6.798 5.200 -10.530 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.041 5.027 -12.505 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.275 3.298 -12.333 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -9.102 3.308 -9.569 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -10.732 3.990 -9.532 1.00 0.00 H new ATOM 386 N VAL A 739 -4.590 3.506 -9.249 1.00 0.00 N ATOM 387 CA VAL A 739 -3.442 3.830 -8.432 1.00 0.00 C ATOM 388 C VAL A 739 -2.178 3.237 -9.021 1.00 0.00 C ATOM 389 O VAL A 739 -1.113 3.824 -8.922 1.00 0.00 O ATOM 390 CB VAL A 739 -3.617 3.302 -6.987 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.056 3.004 -6.654 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.743 2.099 -6.761 1.00 0.00 C ATOM 0 H VAL A 739 -5.346 3.049 -8.739 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.359 4.917 -8.409 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.302 4.095 -6.308 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.124 2.637 -5.630 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.648 3.914 -6.753 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.438 2.246 -7.337 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.877 1.739 -5.741 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.019 1.312 -7.463 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.699 2.373 -6.915 1.00 0.00 H new ATOM 402 N LYS A 740 -2.295 2.054 -9.608 1.00 0.00 N ATOM 403 CA LYS A 740 -1.139 1.412 -10.197 1.00 0.00 C ATOM 404 C LYS A 740 -0.913 1.943 -11.591 1.00 0.00 C ATOM 405 O LYS A 740 0.207 1.974 -12.066 1.00 0.00 O ATOM 406 CB LYS A 740 -1.278 -0.090 -10.215 1.00 0.00 C ATOM 407 CG LYS A 740 -2.202 -0.549 -11.273 1.00 0.00 C ATOM 408 CD LYS A 740 -3.051 -1.728 -10.822 1.00 0.00 C ATOM 409 CE LYS A 740 -2.736 -2.986 -11.613 1.00 0.00 C ATOM 410 NZ LYS A 740 -3.821 -3.998 -11.500 1.00 0.00 N ATOM 0 H LYS A 740 -3.166 1.530 -9.686 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.273 1.646 -9.578 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -0.298 -0.543 -10.368 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -1.639 -0.432 -9.245 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -2.853 0.274 -11.567 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -1.629 -0.833 -12.156 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -2.881 -1.914 -9.761 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -4.106 -1.481 -10.937 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.588 -2.728 -12.662 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -1.800 -3.415 -11.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -3.421 -4.951 -11.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -4.270 -3.923 -10.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -4.532 -3.829 -12.240 1.00 0.00 H new ATOM 424 N SER A 741 -1.986 2.331 -12.270 1.00 0.00 N ATOM 425 CA SER A 741 -1.831 2.908 -13.588 1.00 0.00 C ATOM 426 C SER A 741 -1.252 4.298 -13.422 1.00 0.00 C ATOM 427 O SER A 741 -0.869 4.962 -14.386 1.00 0.00 O ATOM 428 CB SER A 741 -3.160 2.977 -14.333 1.00 0.00 C ATOM 429 OG SER A 741 -4.040 3.909 -13.729 1.00 0.00 O ATOM 0 H SER A 741 -2.947 2.257 -11.936 1.00 0.00 H new ATOM 0 HA SER A 741 -1.166 2.279 -14.181 1.00 0.00 H new ATOM 0 HB2 SER A 741 -2.984 3.260 -15.371 1.00 0.00 H new ATOM 0 HB3 SER A 741 -3.624 1.991 -14.346 1.00 0.00 H new ATOM 0 HG SER A 741 -3.717 4.129 -12.830 1.00 0.00 H new ATOM 435 N HIS A 742 -1.201 4.719 -12.162 1.00 0.00 N ATOM 436 CA HIS A 742 -0.675 6.016 -11.793 1.00 0.00 C ATOM 437 C HIS A 742 0.798 6.126 -12.180 1.00 0.00 C ATOM 438 O HIS A 742 1.557 5.163 -12.097 1.00 0.00 O ATOM 439 CB HIS A 742 -0.860 6.236 -10.283 1.00 0.00 C ATOM 440 CG HIS A 742 -0.531 7.620 -9.823 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.461 8.392 -10.383 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.076 8.373 -8.847 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.516 9.554 -9.772 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.409 9.573 -8.834 1.00 0.00 N ATOM 0 H HIS A 742 -1.526 4.164 -11.370 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.222 6.790 -12.332 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -1.893 6.013 -10.018 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.232 5.527 -9.744 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.888 8.085 -8.195 1.00 0.00 H new ATOM 0 HE1 HIS A 742 1.202 10.356 -10.000 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.598 10.351 -8.202 1.00 0.00 H new ATOM 453 N GLN A 743 1.176 7.311 -12.628 1.00 0.00 N ATOM 454 CA GLN A 743 2.538 7.610 -13.034 1.00 0.00 C ATOM 455 C GLN A 743 3.523 7.448 -11.883 1.00 0.00 C ATOM 456 O GLN A 743 4.732 7.392 -12.087 1.00 0.00 O ATOM 457 CB GLN A 743 2.564 9.033 -13.529 1.00 0.00 C ATOM 458 CG GLN A 743 3.799 9.361 -14.327 1.00 0.00 C ATOM 459 CD GLN A 743 3.904 10.832 -14.678 1.00 0.00 C ATOM 460 OE1 GLN A 743 2.895 11.518 -14.843 1.00 0.00 O ATOM 461 NE2 GLN A 743 5.131 11.326 -14.792 1.00 0.00 N ATOM 0 H GLN A 743 0.538 8.101 -12.721 1.00 0.00 H new ATOM 0 HA GLN A 743 2.841 6.912 -13.814 1.00 0.00 H new ATOM 0 HB2 GLN A 743 1.683 9.213 -14.145 1.00 0.00 H new ATOM 0 HB3 GLN A 743 2.500 9.709 -12.676 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.681 9.065 -13.759 1.00 0.00 H new ATOM 0 HG3 GLN A 743 3.799 8.773 -15.245 1.00 0.00 H new ATOM 0 HE21 GLN A 743 5.940 10.722 -14.647 1.00 0.00 H new ATOM 0 HE22 GLN A 743 5.265 12.310 -15.025 1.00 0.00 H new ATOM 470 N SER A 744 2.988 7.407 -10.680 1.00 0.00 N ATOM 471 CA SER A 744 3.792 7.243 -9.470 1.00 0.00 C ATOM 472 C SER A 744 3.704 5.823 -8.966 1.00 0.00 C ATOM 473 O SER A 744 4.123 5.507 -7.854 1.00 0.00 O ATOM 474 CB SER A 744 3.307 8.201 -8.378 1.00 0.00 C ATOM 475 OG SER A 744 3.907 9.478 -8.512 1.00 0.00 O ATOM 0 H SER A 744 1.986 7.486 -10.506 1.00 0.00 H new ATOM 0 HA SER A 744 4.829 7.471 -9.716 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.223 8.298 -8.432 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.542 7.787 -7.397 1.00 0.00 H new ATOM 0 HG SER A 744 4.811 9.378 -8.876 1.00 0.00 H new ATOM 481 N ALA A 745 3.144 4.974 -9.793 1.00 0.00 N ATOM 482 CA ALA A 745 2.949 3.592 -9.430 1.00 0.00 C ATOM 483 C ALA A 745 3.953 2.628 -10.046 1.00 0.00 C ATOM 484 O ALA A 745 3.865 1.435 -9.790 1.00 0.00 O ATOM 485 CB ALA A 745 1.548 3.197 -9.833 1.00 0.00 C ATOM 0 H ALA A 745 2.814 5.218 -10.727 1.00 0.00 H new ATOM 0 HA ALA A 745 3.104 3.518 -8.354 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.374 2.154 -9.569 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.828 3.828 -9.312 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.430 3.324 -10.909 1.00 0.00 H new ATOM 491 N TRP A 746 4.901 3.101 -10.839 1.00 0.00 N ATOM 492 CA TRP A 746 5.843 2.172 -11.459 1.00 0.00 C ATOM 493 C TRP A 746 6.727 1.429 -10.446 1.00 0.00 C ATOM 494 O TRP A 746 7.064 0.268 -10.685 1.00 0.00 O ATOM 495 CB TRP A 746 6.681 2.835 -12.551 1.00 0.00 C ATOM 496 CG TRP A 746 7.291 4.145 -12.178 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.717 5.374 -12.292 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.602 4.356 -11.655 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.601 6.347 -11.887 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.766 5.745 -11.486 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.654 3.505 -11.313 1.00 0.00 C ATOM 502 CZ2 TRP A 746 9.948 6.297 -10.994 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.817 4.057 -10.820 1.00 0.00 C ATOM 504 CH2 TRP A 746 10.950 5.440 -10.668 1.00 0.00 C ATOM 0 H TRP A 746 5.041 4.086 -11.066 1.00 0.00 H new ATOM 0 HA TRP A 746 5.223 1.414 -11.937 1.00 0.00 H new ATOM 0 HB2 TRP A 746 7.478 2.151 -12.840 1.00 0.00 H new ATOM 0 HB3 TRP A 746 6.053 2.982 -13.430 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.714 5.558 -12.648 1.00 0.00 H new ATOM 0 HE1 TRP A 746 7.420 7.351 -11.885 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.559 2.436 -11.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 10.062 7.364 -10.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.638 3.411 -10.547 1.00 0.00 H new ATOM 0 HH2 TRP A 746 11.876 5.839 -10.280 1.00 0.00 H new ATOM 515 N PRO A 747 7.132 2.041 -9.308 1.00 0.00 N ATOM 516 CA PRO A 747 7.940 1.331 -8.323 1.00 0.00 C ATOM 517 C PRO A 747 7.108 0.295 -7.597 1.00 0.00 C ATOM 518 O PRO A 747 7.634 -0.536 -6.854 1.00 0.00 O ATOM 519 CB PRO A 747 8.395 2.403 -7.332 1.00 0.00 C ATOM 520 CG PRO A 747 7.819 3.698 -7.784 1.00 0.00 C ATOM 521 CD PRO A 747 6.839 3.421 -8.889 1.00 0.00 C ATOM 0 HA PRO A 747 8.775 0.809 -8.791 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.056 2.163 -6.324 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.483 2.458 -7.298 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.323 4.203 -6.955 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.609 4.362 -8.135 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.811 3.520 -8.541 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.965 4.121 -9.715 1.00 0.00 H new ATOM 529 N PHE A 748 5.797 0.364 -7.816 1.00 0.00 N ATOM 530 CA PHE A 748 4.863 -0.541 -7.169 1.00 0.00 C ATOM 531 C PHE A 748 4.077 -1.366 -8.190 1.00 0.00 C ATOM 532 O PHE A 748 3.455 -2.363 -7.843 1.00 0.00 O ATOM 533 CB PHE A 748 3.905 0.249 -6.267 1.00 0.00 C ATOM 534 CG PHE A 748 4.481 1.500 -5.676 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.772 1.531 -5.227 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.727 2.652 -5.583 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.308 2.678 -4.698 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.272 3.807 -5.047 1.00 0.00 C ATOM 539 CZ PHE A 748 5.557 3.811 -4.609 1.00 0.00 C ATOM 0 H PHE A 748 5.360 1.042 -8.440 1.00 0.00 H new ATOM 0 HA PHE A 748 5.438 -1.237 -6.559 1.00 0.00 H new ATOM 0 HB2 PHE A 748 3.019 0.512 -6.845 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.575 -0.400 -5.456 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.379 0.640 -5.290 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.704 2.653 -5.931 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.331 2.683 -4.350 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.675 4.704 -4.978 1.00 0.00 H new ATOM 0 HZ PHE A 748 5.983 4.711 -4.191 1.00 0.00 H new ATOM 549 N MET A 749 4.136 -0.958 -9.456 1.00 0.00 N ATOM 550 CA MET A 749 3.395 -1.623 -10.531 1.00 0.00 C ATOM 551 C MET A 749 3.522 -3.131 -10.489 1.00 0.00 C ATOM 552 O MET A 749 2.588 -3.855 -10.832 1.00 0.00 O ATOM 553 CB MET A 749 3.846 -1.101 -11.881 1.00 0.00 C ATOM 554 CG MET A 749 2.952 0.007 -12.335 1.00 0.00 C ATOM 555 SD MET A 749 3.618 0.998 -13.667 1.00 0.00 S ATOM 556 CE MET A 749 2.638 2.446 -13.344 1.00 0.00 C ATOM 0 H MET A 749 4.694 -0.163 -9.766 1.00 0.00 H new ATOM 0 HA MET A 749 2.342 -1.388 -10.378 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.874 -0.744 -11.815 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.835 -1.909 -12.613 1.00 0.00 H new ATOM 0 HG2 MET A 749 2.001 -0.418 -12.656 1.00 0.00 H new ATOM 0 HG3 MET A 749 2.740 0.657 -11.486 1.00 0.00 H new ATOM 0 HE1 MET A 749 3.168 3.330 -13.697 1.00 0.00 H new ATOM 0 HE2 MET A 749 1.684 2.363 -13.865 1.00 0.00 H new ATOM 0 HE3 MET A 749 2.460 2.533 -12.272 1.00 0.00 H new ATOM 566 N GLU A 750 4.677 -3.597 -10.066 1.00 0.00 N ATOM 567 CA GLU A 750 4.927 -5.022 -9.984 1.00 0.00 C ATOM 568 C GLU A 750 5.978 -5.340 -8.930 1.00 0.00 C ATOM 569 O GLU A 750 6.944 -4.598 -8.755 1.00 0.00 O ATOM 570 CB GLU A 750 5.346 -5.562 -11.348 1.00 0.00 C ATOM 571 CG GLU A 750 6.286 -6.751 -11.278 1.00 0.00 C ATOM 572 CD GLU A 750 6.539 -7.380 -12.634 1.00 0.00 C ATOM 573 OE1 GLU A 750 5.769 -8.284 -13.021 1.00 0.00 O ATOM 574 OE2 GLU A 750 7.505 -6.967 -13.309 1.00 0.00 O ATOM 0 H GLU A 750 5.459 -3.011 -9.773 1.00 0.00 H new ATOM 0 HA GLU A 750 4.002 -5.513 -9.683 1.00 0.00 H new ATOM 0 HB2 GLU A 750 4.453 -5.850 -11.903 1.00 0.00 H new ATOM 0 HB3 GLU A 750 5.828 -4.763 -11.911 1.00 0.00 H new ATOM 0 HG2 GLU A 750 7.235 -6.433 -10.847 1.00 0.00 H new ATOM 0 HG3 GLU A 750 5.867 -7.501 -10.607 1.00 0.00 H new ATOM 581 N PRO A 751 5.783 -6.458 -8.212 1.00 0.00 N ATOM 582 CA PRO A 751 6.693 -6.909 -7.171 1.00 0.00 C ATOM 583 C PRO A 751 8.141 -6.871 -7.615 1.00 0.00 C ATOM 584 O PRO A 751 8.509 -7.403 -8.662 1.00 0.00 O ATOM 585 CB PRO A 751 6.259 -8.344 -6.885 1.00 0.00 C ATOM 586 CG PRO A 751 5.267 -8.667 -7.936 1.00 0.00 C ATOM 587 CD PRO A 751 4.661 -7.374 -8.355 1.00 0.00 C ATOM 0 HA PRO A 751 6.644 -6.263 -6.294 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.108 -9.027 -6.922 1.00 0.00 H new ATOM 0 HB3 PRO A 751 5.822 -8.432 -5.890 1.00 0.00 H new ATOM 0 HG2 PRO A 751 5.744 -9.164 -8.781 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.505 -9.347 -7.555 1.00 0.00 H new ATOM 0 HD2 PRO A 751 4.290 -7.409 -9.379 1.00 0.00 H new ATOM 0 HD3 PRO A 751 3.820 -7.092 -7.721 1.00 0.00 H new ATOM 595 N VAL A 752 8.942 -6.231 -6.794 1.00 0.00 N ATOM 596 CA VAL A 752 10.357 -6.073 -7.019 1.00 0.00 C ATOM 597 C VAL A 752 11.040 -7.394 -7.338 1.00 0.00 C ATOM 598 O VAL A 752 10.480 -8.469 -7.125 1.00 0.00 O ATOM 599 CB VAL A 752 10.935 -5.498 -5.735 1.00 0.00 C ATOM 600 CG1 VAL A 752 12.391 -5.134 -5.830 1.00 0.00 C ATOM 601 CG2 VAL A 752 10.137 -4.300 -5.316 1.00 0.00 C ATOM 0 H VAL A 752 8.617 -5.796 -5.930 1.00 0.00 H new ATOM 0 HA VAL A 752 10.523 -5.422 -7.877 1.00 0.00 H new ATOM 0 HB VAL A 752 10.868 -6.288 -4.987 1.00 0.00 H new ATOM 0 HG11 VAL A 752 12.728 -4.731 -4.875 1.00 0.00 H new ATOM 0 HG12 VAL A 752 12.973 -6.022 -6.075 1.00 0.00 H new ATOM 0 HG13 VAL A 752 12.528 -4.384 -6.609 1.00 0.00 H new ATOM 0 HG21 VAL A 752 10.553 -3.890 -4.396 1.00 0.00 H new ATOM 0 HG22 VAL A 752 10.176 -3.544 -6.101 1.00 0.00 H new ATOM 0 HG23 VAL A 752 9.101 -4.594 -5.147 1.00 0.00 H new ATOM 611 N LYS A 753 12.262 -7.297 -7.843 1.00 0.00 N ATOM 612 CA LYS A 753 13.053 -8.477 -8.167 1.00 0.00 C ATOM 613 C LYS A 753 13.585 -9.060 -6.884 1.00 0.00 C ATOM 614 O LYS A 753 14.365 -10.013 -6.889 1.00 0.00 O ATOM 615 CB LYS A 753 14.240 -8.109 -9.057 1.00 0.00 C ATOM 616 CG LYS A 753 13.845 -7.472 -10.373 1.00 0.00 C ATOM 617 CD LYS A 753 13.655 -8.508 -11.464 1.00 0.00 C ATOM 618 CE LYS A 753 13.189 -7.860 -12.752 1.00 0.00 C ATOM 619 NZ LYS A 753 12.645 -8.859 -13.712 1.00 0.00 N ATOM 0 H LYS A 753 12.729 -6.411 -8.038 1.00 0.00 H new ATOM 0 HA LYS A 753 12.422 -9.191 -8.696 1.00 0.00 H new ATOM 0 HB2 LYS A 753 14.891 -7.424 -8.514 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.822 -9.008 -9.260 1.00 0.00 H new ATOM 0 HG2 LYS A 753 12.921 -6.909 -10.242 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.612 -6.760 -10.677 1.00 0.00 H new ATOM 0 HD2 LYS A 753 14.593 -9.036 -11.637 1.00 0.00 H new ATOM 0 HD3 LYS A 753 12.926 -9.251 -11.142 1.00 0.00 H new ATOM 0 HE2 LYS A 753 12.423 -7.117 -12.528 1.00 0.00 H new ATOM 0 HE3 LYS A 753 14.022 -7.330 -13.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 12.337 -8.375 -14.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 13.383 -9.553 -13.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 11.834 -9.348 -13.282 1.00 0.00 H new ATOM 633 N ARG A 754 13.157 -8.454 -5.780 1.00 0.00 N ATOM 634 CA ARG A 754 13.616 -8.839 -4.465 1.00 0.00 C ATOM 635 C ARG A 754 15.067 -8.435 -4.345 1.00 0.00 C ATOM 636 O ARG A 754 15.690 -8.604 -3.295 1.00 0.00 O ATOM 637 CB ARG A 754 13.466 -10.345 -4.237 1.00 0.00 C ATOM 638 CG ARG A 754 13.592 -10.756 -2.780 1.00 0.00 C ATOM 639 CD ARG A 754 13.157 -12.197 -2.566 1.00 0.00 C ATOM 640 NE ARG A 754 13.858 -13.120 -3.455 1.00 0.00 N ATOM 641 CZ ARG A 754 13.600 -14.423 -3.516 1.00 0.00 C ATOM 642 NH1 ARG A 754 12.670 -14.955 -2.733 1.00 0.00 N ATOM 643 NH2 ARG A 754 14.273 -15.194 -4.358 1.00 0.00 N ATOM 0 H ARG A 754 12.485 -7.686 -5.780 1.00 0.00 H new ATOM 0 HA ARG A 754 13.011 -8.339 -3.708 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.495 -10.666 -4.613 1.00 0.00 H new ATOM 0 HB3 ARG A 754 14.223 -10.869 -4.820 1.00 0.00 H new ATOM 0 HG2 ARG A 754 14.625 -10.635 -2.455 1.00 0.00 H new ATOM 0 HG3 ARG A 754 12.984 -10.096 -2.161 1.00 0.00 H new ATOM 0 HD2 ARG A 754 13.342 -12.481 -1.530 1.00 0.00 H new ATOM 0 HD3 ARG A 754 12.083 -12.280 -2.732 1.00 0.00 H new ATOM 0 HE ARG A 754 14.586 -12.744 -4.063 1.00 0.00 H new ATOM 0 HH11 ARG A 754 12.152 -14.364 -2.083 1.00 0.00 H new ATOM 0 HH12 ARG A 754 12.474 -15.955 -2.781 1.00 0.00 H new ATOM 0 HH21 ARG A 754 14.989 -14.788 -4.960 1.00 0.00 H new ATOM 0 HH22 ARG A 754 14.075 -16.193 -4.404 1.00 0.00 H new ATOM 657 N THR A 755 15.608 -7.887 -5.440 1.00 0.00 N ATOM 658 CA THR A 755 16.995 -7.483 -5.456 1.00 0.00 C ATOM 659 C THR A 755 17.243 -6.153 -6.173 1.00 0.00 C ATOM 660 O THR A 755 18.299 -5.556 -5.958 1.00 0.00 O ATOM 661 CB THR A 755 17.898 -8.565 -6.055 1.00 0.00 C ATOM 662 OG1 THR A 755 17.708 -8.638 -7.473 1.00 0.00 O ATOM 663 CG2 THR A 755 17.606 -9.918 -5.427 1.00 0.00 C ATOM 0 H THR A 755 15.103 -7.720 -6.310 1.00 0.00 H new ATOM 0 HA THR A 755 17.253 -7.338 -4.407 1.00 0.00 H new ATOM 0 HB THR A 755 18.934 -8.299 -5.845 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.291 -9.332 -7.846 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.259 -10.672 -5.867 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.784 -9.867 -4.353 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.566 -10.187 -5.610 1.00 0.00 H new ATOM 671 N GLU A 756 16.320 -5.670 -7.041 1.00 0.00 N ATOM 672 CA GLU A 756 16.546 -4.340 -7.631 1.00 0.00 C ATOM 673 C GLU A 756 16.692 -3.504 -6.410 1.00 0.00 C ATOM 674 O GLU A 756 17.402 -2.505 -6.322 1.00 0.00 O ATOM 675 CB GLU A 756 15.363 -3.804 -8.437 1.00 0.00 C ATOM 676 CG GLU A 756 14.236 -4.775 -8.568 1.00 0.00 C ATOM 677 CD GLU A 756 12.999 -4.165 -9.198 1.00 0.00 C ATOM 678 OE1 GLU A 756 12.316 -3.370 -8.518 1.00 0.00 O ATOM 679 OE2 GLU A 756 12.716 -4.477 -10.373 1.00 0.00 O ATOM 0 H GLU A 756 15.467 -6.149 -7.330 1.00 0.00 H new ATOM 0 HA GLU A 756 17.382 -4.350 -8.331 1.00 0.00 H new ATOM 0 HB2 GLU A 756 14.994 -2.895 -7.963 1.00 0.00 H new ATOM 0 HB3 GLU A 756 15.709 -3.526 -9.433 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.563 -5.623 -9.169 1.00 0.00 H new ATOM 0 HG3 GLU A 756 13.981 -5.163 -7.582 1.00 0.00 H new ATOM 686 N ALA A 757 15.982 -4.051 -5.456 1.00 0.00 N ATOM 687 CA ALA A 757 15.876 -3.620 -4.137 1.00 0.00 C ATOM 688 C ALA A 757 16.693 -4.611 -3.346 1.00 0.00 C ATOM 689 O ALA A 757 16.233 -5.680 -2.955 1.00 0.00 O ATOM 690 CB ALA A 757 14.447 -3.688 -3.811 1.00 0.00 C ATOM 0 H ALA A 757 15.422 -4.886 -5.628 1.00 0.00 H new ATOM 0 HA ALA A 757 16.231 -2.609 -3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.292 -3.361 -2.783 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.889 -3.039 -4.486 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.097 -4.714 -3.922 1.00 0.00 H new ATOM 696 N PRO A 758 17.938 -4.254 -3.176 1.00 0.00 N ATOM 697 CA PRO A 758 18.943 -5.080 -2.520 1.00 0.00 C ATOM 698 C PRO A 758 18.471 -5.626 -1.187 1.00 0.00 C ATOM 699 O PRO A 758 17.851 -6.688 -1.136 1.00 0.00 O ATOM 700 CB PRO A 758 20.138 -4.132 -2.378 1.00 0.00 C ATOM 701 CG PRO A 758 19.597 -2.764 -2.662 1.00 0.00 C ATOM 702 CD PRO A 758 18.439 -2.952 -3.570 1.00 0.00 C ATOM 0 HA PRO A 758 19.184 -5.979 -3.088 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.565 -4.185 -1.377 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.932 -4.393 -3.077 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.292 -2.268 -1.741 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.356 -2.135 -3.126 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.689 -2.172 -3.438 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.738 -2.933 -4.618 1.00 0.00 H new ATOM 710 N GLY A 759 18.760 -4.925 -0.110 1.00 0.00 N ATOM 711 CA GLY A 759 18.308 -5.385 1.179 1.00 0.00 C ATOM 712 C GLY A 759 16.853 -5.038 1.386 1.00 0.00 C ATOM 713 O GLY A 759 16.410 -4.857 2.514 1.00 0.00 O ATOM 0 H GLY A 759 19.293 -4.055 -0.103 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.445 -6.464 1.255 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.911 -4.931 1.965 1.00 0.00 H new ATOM 717 N TYR A 760 16.103 -4.959 0.283 1.00 0.00 N ATOM 718 CA TYR A 760 14.696 -4.599 0.324 1.00 0.00 C ATOM 719 C TYR A 760 13.869 -5.472 1.254 1.00 0.00 C ATOM 720 O TYR A 760 13.314 -4.981 2.227 1.00 0.00 O ATOM 721 CB TYR A 760 14.259 -4.663 -1.108 1.00 0.00 C ATOM 722 CG TYR A 760 12.812 -4.835 -1.460 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.865 -3.900 -1.133 1.00 0.00 C ATOM 724 CD2 TYR A 760 12.431 -5.903 -2.242 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.565 -4.024 -1.567 1.00 0.00 C ATOM 726 CE2 TYR A 760 11.138 -6.043 -2.663 1.00 0.00 C ATOM 727 CZ TYR A 760 10.209 -5.103 -2.329 1.00 0.00 C ATOM 728 OH TYR A 760 8.915 -5.229 -2.781 1.00 0.00 O ATOM 0 H TYR A 760 16.458 -5.143 -0.655 1.00 0.00 H new ATOM 0 HA TYR A 760 14.544 -3.608 0.751 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.599 -3.745 -1.588 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.802 -5.486 -1.573 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.143 -3.052 -0.525 1.00 0.00 H new ATOM 0 HD2 TYR A 760 13.166 -6.642 -2.527 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.831 -3.275 -1.308 1.00 0.00 H new ATOM 0 HE2 TYR A 760 10.853 -6.897 -3.259 1.00 0.00 H new ATOM 0 HH TYR A 760 8.831 -6.051 -3.308 1.00 0.00 H new ATOM 738 N TYR A 761 13.775 -6.751 0.958 1.00 0.00 N ATOM 739 CA TYR A 761 13.010 -7.670 1.804 1.00 0.00 C ATOM 740 C TYR A 761 13.417 -7.583 3.276 1.00 0.00 C ATOM 741 O TYR A 761 12.689 -8.045 4.156 1.00 0.00 O ATOM 742 CB TYR A 761 13.132 -9.107 1.297 1.00 0.00 C ATOM 743 CG TYR A 761 12.008 -9.466 0.363 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.625 -8.565 -0.600 1.00 0.00 C ATOM 745 CD2 TYR A 761 11.316 -10.666 0.461 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.584 -8.825 -1.459 1.00 0.00 C ATOM 747 CE2 TYR A 761 10.269 -10.949 -0.401 1.00 0.00 C ATOM 748 CZ TYR A 761 9.904 -10.022 -1.360 1.00 0.00 C ATOM 749 OH TYR A 761 8.859 -10.293 -2.214 1.00 0.00 O ATOM 0 H TYR A 761 14.212 -7.185 0.145 1.00 0.00 H new ATOM 0 HA TYR A 761 11.966 -7.363 1.740 1.00 0.00 H new ATOM 0 HB2 TYR A 761 14.085 -9.232 0.784 1.00 0.00 H new ATOM 0 HB3 TYR A 761 13.134 -9.793 2.144 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.155 -7.628 -0.685 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.597 -11.385 1.216 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.300 -8.098 -2.206 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.741 -11.888 -0.324 1.00 0.00 H new ATOM 0 HH TYR A 761 8.491 -11.178 -2.010 1.00 0.00 H new ATOM 759 N GLU A 762 14.573 -6.990 3.537 1.00 0.00 N ATOM 760 CA GLU A 762 15.078 -6.849 4.901 1.00 0.00 C ATOM 761 C GLU A 762 14.396 -5.681 5.606 1.00 0.00 C ATOM 762 O GLU A 762 13.980 -5.777 6.761 1.00 0.00 O ATOM 763 CB GLU A 762 16.592 -6.621 4.868 1.00 0.00 C ATOM 764 CG GLU A 762 17.018 -5.260 5.398 1.00 0.00 C ATOM 765 CD GLU A 762 18.508 -5.175 5.664 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.293 -5.499 4.747 1.00 0.00 O ATOM 767 OE2 GLU A 762 18.891 -4.786 6.787 1.00 0.00 O ATOM 0 H GLU A 762 15.183 -6.596 2.821 1.00 0.00 H new ATOM 0 HA GLU A 762 14.859 -7.764 5.452 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.080 -7.399 5.455 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.944 -6.728 3.842 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.737 -4.491 4.679 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.476 -5.048 6.320 1.00 0.00 H new ATOM 774 N VAL A 763 14.296 -4.584 4.878 1.00 0.00 N ATOM 775 CA VAL A 763 13.698 -3.357 5.364 1.00 0.00 C ATOM 776 C VAL A 763 12.210 -3.458 5.272 1.00 0.00 C ATOM 777 O VAL A 763 11.469 -3.067 6.176 1.00 0.00 O ATOM 778 CB VAL A 763 14.168 -2.144 4.512 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.750 -2.569 3.186 1.00 0.00 C ATOM 780 CG2 VAL A 763 13.040 -1.223 4.191 1.00 0.00 C ATOM 0 H VAL A 763 14.634 -4.521 3.918 1.00 0.00 H new ATOM 0 HA VAL A 763 14.006 -3.210 6.399 1.00 0.00 H new ATOM 0 HB VAL A 763 14.921 -1.647 5.123 1.00 0.00 H new ATOM 0 HG11 VAL A 763 15.064 -1.687 2.627 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.611 -3.216 3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 763 13.996 -3.111 2.615 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.410 -0.389 3.595 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.279 -1.763 3.627 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.606 -0.844 5.116 1.00 0.00 H new ATOM 790 N ILE A 764 11.797 -3.994 4.164 1.00 0.00 N ATOM 791 CA ILE A 764 10.418 -4.124 3.864 1.00 0.00 C ATOM 792 C ILE A 764 9.814 -5.417 4.370 1.00 0.00 C ATOM 793 O ILE A 764 9.825 -6.432 3.675 1.00 0.00 O ATOM 794 CB ILE A 764 10.207 -4.030 2.384 1.00 0.00 C ATOM 795 CG1 ILE A 764 10.943 -2.810 1.845 1.00 0.00 C ATOM 796 CG2 ILE A 764 8.736 -3.920 2.132 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.188 -1.518 2.029 1.00 0.00 C ATOM 0 H ILE A 764 12.420 -4.354 3.441 1.00 0.00 H new ATOM 0 HA ILE A 764 9.912 -3.308 4.380 1.00 0.00 H new ATOM 0 HB ILE A 764 10.597 -4.913 1.877 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.909 -2.730 2.343 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.142 -2.956 0.783 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.555 -3.850 1.059 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.232 -4.801 2.528 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.348 -3.028 2.624 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.773 -0.693 1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.233 -1.577 1.508 1.00 0.00 H new ATOM 0 HD13 ILE A 764 10.012 -1.348 3.091 1.00 0.00 H new ATOM 809 N ARG A 765 9.314 -5.382 5.587 1.00 0.00 N ATOM 810 CA ARG A 765 8.665 -6.548 6.162 1.00 0.00 C ATOM 811 C ARG A 765 7.503 -7.012 5.280 1.00 0.00 C ATOM 812 O ARG A 765 7.264 -8.212 5.143 1.00 0.00 O ATOM 813 CB ARG A 765 8.167 -6.247 7.569 1.00 0.00 C ATOM 814 CG ARG A 765 9.275 -6.179 8.589 1.00 0.00 C ATOM 815 CD ARG A 765 8.724 -5.949 9.974 1.00 0.00 C ATOM 816 NE ARG A 765 9.750 -6.071 11.006 1.00 0.00 N ATOM 817 CZ ARG A 765 9.486 -6.096 12.309 1.00 0.00 C ATOM 818 NH1 ARG A 765 8.233 -6.020 12.737 1.00 0.00 N ATOM 819 NH2 ARG A 765 10.477 -6.202 13.185 1.00 0.00 N ATOM 0 H ARG A 765 9.342 -4.565 6.197 1.00 0.00 H new ATOM 0 HA ARG A 765 9.401 -7.350 6.217 1.00 0.00 H new ATOM 0 HB2 ARG A 765 7.629 -5.299 7.562 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.454 -7.016 7.867 1.00 0.00 H new ATOM 0 HG2 ARG A 765 9.847 -7.106 8.571 1.00 0.00 H new ATOM 0 HG3 ARG A 765 9.963 -5.375 8.330 1.00 0.00 H new ATOM 0 HD2 ARG A 765 8.277 -4.956 10.025 1.00 0.00 H new ATOM 0 HD3 ARG A 765 7.928 -6.667 10.170 1.00 0.00 H new ATOM 0 HE ARG A 765 10.724 -6.141 10.711 1.00 0.00 H new ATOM 0 HH11 ARG A 765 7.469 -5.942 12.066 1.00 0.00 H new ATOM 0 HH12 ARG A 765 8.034 -6.039 13.737 1.00 0.00 H new ATOM 0 HH21 ARG A 765 11.441 -6.264 12.859 1.00 0.00 H new ATOM 0 HH22 ARG A 765 10.274 -6.221 14.184 1.00 0.00 H new ATOM 833 N PHE A 766 6.778 -6.055 4.680 1.00 0.00 N ATOM 834 CA PHE A 766 5.638 -6.392 3.822 1.00 0.00 C ATOM 835 C PHE A 766 5.725 -5.718 2.452 1.00 0.00 C ATOM 836 O PHE A 766 4.985 -4.773 2.177 1.00 0.00 O ATOM 837 CB PHE A 766 4.313 -5.991 4.473 1.00 0.00 C ATOM 838 CG PHE A 766 3.993 -6.729 5.731 1.00 0.00 C ATOM 839 CD1 PHE A 766 4.846 -6.646 6.797 1.00 0.00 C ATOM 840 CD2 PHE A 766 2.834 -7.477 5.853 1.00 0.00 C ATOM 841 CE1 PHE A 766 4.570 -7.291 7.982 1.00 0.00 C ATOM 842 CE2 PHE A 766 2.546 -8.133 7.033 1.00 0.00 C ATOM 843 CZ PHE A 766 3.416 -8.037 8.100 1.00 0.00 C ATOM 0 H PHE A 766 6.959 -5.056 4.773 1.00 0.00 H new ATOM 0 HA PHE A 766 5.675 -7.473 3.689 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.338 -4.923 4.689 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.507 -6.153 3.757 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.752 -6.065 6.708 1.00 0.00 H new ATOM 0 HD2 PHE A 766 2.151 -7.548 5.019 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.254 -7.213 8.815 1.00 0.00 H new ATOM 0 HE2 PHE A 766 1.643 -8.719 7.121 1.00 0.00 H new ATOM 0 HZ PHE A 766 3.193 -8.546 9.026 1.00 0.00 H new ATOM 853 N PRO A 767 6.626 -6.183 1.573 1.00 0.00 N ATOM 854 CA PRO A 767 6.775 -5.612 0.241 1.00 0.00 C ATOM 855 C PRO A 767 5.552 -5.812 -0.637 1.00 0.00 C ATOM 856 O PRO A 767 5.465 -6.772 -1.404 1.00 0.00 O ATOM 857 CB PRO A 767 8.002 -6.314 -0.335 1.00 0.00 C ATOM 858 CG PRO A 767 8.665 -6.965 0.807 1.00 0.00 C ATOM 859 CD PRO A 767 7.603 -7.243 1.827 1.00 0.00 C ATOM 0 HA PRO A 767 6.889 -4.529 0.286 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.715 -7.046 -1.090 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.669 -5.601 -0.820 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.152 -7.889 0.495 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.440 -6.321 1.222 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.168 -8.234 1.698 1.00 0.00 H new ATOM 0 HD3 PRO A 767 7.995 -7.197 2.843 1.00 0.00 H new ATOM 867 N MET A 768 4.607 -4.889 -0.513 1.00 0.00 N ATOM 868 CA MET A 768 3.385 -4.926 -1.293 1.00 0.00 C ATOM 869 C MET A 768 3.561 -4.132 -2.558 1.00 0.00 C ATOM 870 O MET A 768 4.339 -3.178 -2.615 1.00 0.00 O ATOM 871 CB MET A 768 2.221 -4.340 -0.503 1.00 0.00 C ATOM 872 CG MET A 768 0.852 -4.411 -1.193 1.00 0.00 C ATOM 873 SD MET A 768 0.571 -5.870 -2.191 1.00 0.00 S ATOM 874 CE MET A 768 0.086 -6.976 -0.904 1.00 0.00 C ATOM 0 H MET A 768 4.669 -4.099 0.129 1.00 0.00 H new ATOM 0 HA MET A 768 3.168 -5.967 -1.532 1.00 0.00 H new ATOM 0 HB2 MET A 768 2.154 -4.861 0.452 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.443 -3.296 -0.282 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.076 -4.359 -0.429 1.00 0.00 H new ATOM 0 HG3 MET A 768 0.737 -3.531 -1.826 1.00 0.00 H new ATOM 0 HE1 MET A 768 0.566 -7.943 -1.055 1.00 0.00 H new ATOM 0 HE2 MET A 768 0.388 -6.567 0.060 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.997 -7.102 -0.921 1.00 0.00 H new ATOM 884 N ASP A 769 2.837 -4.534 -3.566 1.00 0.00 N ATOM 885 CA ASP A 769 2.870 -3.870 -4.833 1.00 0.00 C ATOM 886 C ASP A 769 1.474 -3.808 -5.402 1.00 0.00 C ATOM 887 O ASP A 769 0.547 -4.384 -4.847 1.00 0.00 O ATOM 888 CB ASP A 769 3.792 -4.601 -5.795 1.00 0.00 C ATOM 889 CG ASP A 769 5.257 -4.359 -5.492 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.793 -5.029 -4.584 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.869 -3.500 -6.161 1.00 0.00 O ATOM 0 H ASP A 769 2.206 -5.335 -3.528 1.00 0.00 H new ATOM 0 HA ASP A 769 3.252 -2.859 -4.694 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.587 -5.670 -5.748 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.577 -4.279 -6.814 1.00 0.00 H new ATOM 896 N LEU A 770 1.324 -3.077 -6.480 1.00 0.00 N ATOM 897 CA LEU A 770 0.044 -2.957 -7.137 1.00 0.00 C ATOM 898 C LEU A 770 -0.315 -4.234 -7.859 1.00 0.00 C ATOM 899 O LEU A 770 -1.489 -4.515 -8.073 1.00 0.00 O ATOM 900 CB LEU A 770 0.068 -1.790 -8.084 1.00 0.00 C ATOM 901 CG LEU A 770 0.759 -0.581 -7.513 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.493 0.131 -8.596 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.247 0.338 -6.879 1.00 0.00 C ATOM 0 H LEU A 770 2.078 -2.553 -6.924 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.723 -2.781 -6.383 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.570 -2.087 -9.005 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -0.955 -1.525 -8.350 1.00 0.00 H new ATOM 0 HG LEU A 770 1.468 -0.900 -6.749 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.993 1.006 -8.182 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.235 -0.538 -9.033 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.789 0.446 -9.366 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.264 1.209 -6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -0.969 0.660 -7.629 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.766 -0.188 -6.078 1.00 0.00 H new ATOM 915 N LYS A 771 0.692 -4.987 -8.284 1.00 0.00 N ATOM 916 CA LYS A 771 0.419 -6.261 -8.915 1.00 0.00 C ATOM 917 C LYS A 771 0.089 -7.260 -7.832 1.00 0.00 C ATOM 918 O LYS A 771 -0.770 -8.106 -8.011 1.00 0.00 O ATOM 919 CB LYS A 771 1.574 -6.772 -9.751 1.00 0.00 C ATOM 920 CG LYS A 771 1.097 -7.594 -10.930 1.00 0.00 C ATOM 921 CD LYS A 771 1.219 -6.806 -12.216 1.00 0.00 C ATOM 922 CE LYS A 771 0.441 -7.462 -13.340 1.00 0.00 C ATOM 923 NZ LYS A 771 0.966 -8.818 -13.664 1.00 0.00 N ATOM 0 H LYS A 771 1.679 -4.742 -8.204 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.417 -6.125 -9.601 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.163 -5.928 -10.111 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.233 -7.378 -9.129 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.683 -8.510 -11.002 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.059 -7.891 -10.777 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.851 -5.792 -12.060 1.00 0.00 H new ATOM 0 HD3 LYS A 771 2.269 -6.725 -12.497 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -0.609 -7.538 -13.058 1.00 0.00 H new ATOM 0 HE3 LYS A 771 0.488 -6.833 -14.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 0.474 -9.190 -14.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 1.986 -8.758 -13.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 0.805 -9.455 -12.857 1.00 0.00 H new ATOM 937 N THR A 772 0.817 -7.181 -6.720 1.00 0.00 N ATOM 938 CA THR A 772 0.527 -8.036 -5.578 1.00 0.00 C ATOM 939 C THR A 772 -0.864 -7.668 -5.087 1.00 0.00 C ATOM 940 O THR A 772 -1.668 -8.530 -4.731 1.00 0.00 O ATOM 941 CB THR A 772 1.553 -7.887 -4.448 1.00 0.00 C ATOM 942 OG1 THR A 772 2.865 -8.196 -4.934 1.00 0.00 O ATOM 943 CG2 THR A 772 1.197 -8.815 -3.298 1.00 0.00 C ATOM 0 H THR A 772 1.601 -6.542 -6.589 1.00 0.00 H new ATOM 0 HA THR A 772 0.580 -9.080 -5.888 1.00 0.00 H new ATOM 0 HB THR A 772 1.539 -6.857 -4.092 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.515 -8.097 -4.207 1.00 0.00 H new ATOM 0 HG21 THR A 772 1.931 -8.703 -2.500 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.207 -8.562 -2.919 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.198 -9.847 -3.649 1.00 0.00 H new ATOM 951 N MET A 773 -1.128 -6.361 -5.065 1.00 0.00 N ATOM 952 CA MET A 773 -2.447 -5.843 -4.729 1.00 0.00 C ATOM 953 C MET A 773 -3.430 -6.507 -5.685 1.00 0.00 C ATOM 954 O MET A 773 -4.315 -7.246 -5.279 1.00 0.00 O ATOM 955 CB MET A 773 -2.480 -4.324 -4.922 1.00 0.00 C ATOM 956 CG MET A 773 -2.172 -3.534 -3.669 1.00 0.00 C ATOM 957 SD MET A 773 -3.348 -3.861 -2.367 1.00 0.00 S ATOM 958 CE MET A 773 -4.797 -3.097 -3.063 1.00 0.00 C ATOM 0 H MET A 773 -0.438 -5.641 -5.278 1.00 0.00 H new ATOM 0 HA MET A 773 -2.699 -6.054 -3.690 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.762 -4.051 -5.696 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.466 -4.036 -5.286 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.169 -3.781 -3.322 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.175 -2.469 -3.902 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.073 -2.228 -2.466 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.587 -2.783 -4.085 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.620 -3.812 -3.065 1.00 0.00 H new ATOM 968 N SER A 774 -3.212 -6.270 -6.976 1.00 0.00 N ATOM 969 CA SER A 774 -4.048 -6.840 -8.031 1.00 0.00 C ATOM 970 C SER A 774 -4.088 -8.358 -7.963 1.00 0.00 C ATOM 971 O SER A 774 -5.043 -8.967 -8.407 1.00 0.00 O ATOM 972 CB SER A 774 -3.558 -6.399 -9.392 1.00 0.00 C ATOM 973 OG SER A 774 -2.403 -7.117 -9.788 1.00 0.00 O ATOM 0 H SER A 774 -2.454 -5.680 -7.320 1.00 0.00 H new ATOM 0 HA SER A 774 -5.062 -6.470 -7.875 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.348 -6.545 -10.129 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.335 -5.332 -9.371 1.00 0.00 H new ATOM 0 HG SER A 774 -1.972 -7.505 -8.998 1.00 0.00 H new ATOM 979 N GLU A 775 -3.032 -8.966 -7.452 1.00 0.00 N ATOM 980 CA GLU A 775 -2.971 -10.394 -7.287 1.00 0.00 C ATOM 981 C GLU A 775 -4.092 -10.835 -6.383 1.00 0.00 C ATOM 982 O GLU A 775 -4.873 -11.742 -6.695 1.00 0.00 O ATOM 983 CB GLU A 775 -1.644 -10.705 -6.693 1.00 0.00 C ATOM 984 CG GLU A 775 -0.842 -11.573 -7.592 1.00 0.00 C ATOM 985 CD GLU A 775 -0.774 -11.089 -9.029 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.079 -10.086 -9.288 1.00 0.00 O ATOM 987 OE2 GLU A 775 -1.401 -11.729 -9.897 1.00 0.00 O ATOM 0 H GLU A 775 -2.194 -8.475 -7.141 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.084 -10.919 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.103 -9.779 -6.500 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.780 -11.200 -5.732 1.00 0.00 H new ATOM 0 HG2 GLU A 775 0.171 -11.647 -7.197 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -1.264 -12.578 -7.579 1.00 0.00 H new ATOM 994 N ARG A 776 -4.168 -10.147 -5.267 1.00 0.00 N ATOM 995 CA ARG A 776 -5.189 -10.379 -4.289 1.00 0.00 C ATOM 996 C ARG A 776 -6.532 -10.059 -4.911 1.00 0.00 C ATOM 997 O ARG A 776 -7.469 -10.848 -4.878 1.00 0.00 O ATOM 998 CB ARG A 776 -4.899 -9.495 -3.097 1.00 0.00 C ATOM 999 CG ARG A 776 -3.754 -10.024 -2.253 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.785 -8.930 -1.839 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.598 -9.484 -1.191 1.00 0.00 N ATOM 1002 CZ ARG A 776 -1.469 -9.618 0.126 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -2.446 -9.231 0.935 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.359 -10.137 0.634 1.00 0.00 N ATOM 0 H ARG A 776 -3.514 -9.405 -5.017 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.208 -11.417 -3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.658 -8.490 -3.443 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.795 -9.414 -2.481 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.156 -10.506 -1.362 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.216 -10.789 -2.814 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.487 -8.355 -2.716 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.283 -8.239 -1.159 1.00 0.00 H new ATOM 0 HE ARG A 776 -0.824 -9.785 -1.783 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -3.300 -8.829 0.548 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -2.344 -9.335 1.944 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.395 -10.433 0.015 1.00 0.00 H new ATOM 0 HH22 ARG A 776 -0.260 -10.240 1.644 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.572 -8.895 -5.514 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.744 -8.382 -6.200 1.00 0.00 C ATOM 1020 C LEU A 777 -8.299 -9.402 -7.154 1.00 0.00 C ATOM 1021 O LEU A 777 -9.476 -9.746 -7.104 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.329 -7.130 -6.969 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.431 -6.236 -7.521 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.698 -6.979 -7.836 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.715 -5.137 -6.532 1.00 0.00 C ATOM 0 H LEU A 777 -5.774 -8.260 -5.545 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.521 -8.150 -5.471 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.705 -6.525 -6.311 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.702 -7.443 -7.804 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.072 -5.826 -8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.441 -6.283 -8.225 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.494 -7.746 -8.583 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.080 -7.448 -6.929 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.503 -4.493 -6.921 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.036 -5.573 -5.586 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.811 -4.549 -6.372 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.440 -9.885 -8.011 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.843 -10.827 -9.005 1.00 0.00 C ATOM 1039 C LYS A 778 -8.564 -11.997 -8.371 1.00 0.00 C ATOM 1040 O LYS A 778 -9.648 -12.383 -8.805 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.649 -11.337 -9.780 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.558 -10.750 -11.161 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.841 -9.406 -11.166 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.321 -9.558 -11.224 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.832 -10.637 -10.327 1.00 0.00 N ATOM 0 H LYS A 778 -6.451 -9.636 -8.036 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.520 -10.315 -9.690 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.738 -11.103 -9.230 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.707 -12.423 -9.855 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.031 -11.444 -11.815 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.561 -10.627 -11.569 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -6.178 -8.820 -12.021 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.114 -8.848 -10.270 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -4.018 -9.774 -12.248 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -3.852 -8.615 -10.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.792 -10.660 -10.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -4.156 -10.455 -9.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.205 -11.553 -10.650 1.00 0.00 H new ATOM 1059 N ASN A 779 -7.950 -12.561 -7.335 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.543 -13.698 -6.645 1.00 0.00 C ATOM 1061 C ASN A 779 -9.710 -13.262 -5.754 1.00 0.00 C ATOM 1062 O ASN A 779 -10.334 -14.088 -5.088 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.492 -14.446 -5.821 1.00 0.00 C ATOM 1064 CG ASN A 779 -7.362 -13.930 -4.403 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -8.182 -14.237 -3.536 1.00 0.00 O ATOM 1066 ND2 ASN A 779 -6.313 -13.163 -4.153 1.00 0.00 N ATOM 0 H ASN A 779 -7.053 -12.253 -6.960 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.933 -14.376 -7.404 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.749 -15.505 -5.793 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -6.526 -14.366 -6.319 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -6.159 -12.801 -3.212 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -5.659 -12.934 -4.901 1.00 0.00 H new ATOM 1073 N ARG A 780 -9.975 -11.953 -5.746 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.070 -11.353 -4.968 1.00 0.00 C ATOM 1075 C ARG A 780 -10.723 -11.300 -3.489 1.00 0.00 C ATOM 1076 O ARG A 780 -11.605 -11.229 -2.632 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.377 -12.123 -5.136 1.00 0.00 C ATOM 1078 CG ARG A 780 -13.081 -11.887 -6.447 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.403 -12.631 -7.577 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.205 -13.754 -8.055 1.00 0.00 N ATOM 1081 CZ ARG A 780 -12.754 -14.678 -8.899 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -11.509 -14.619 -9.350 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -13.550 -15.664 -9.289 1.00 0.00 N ATOM 0 H ARG A 780 -9.435 -11.273 -6.281 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.204 -10.342 -5.353 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.171 -13.189 -5.036 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.050 -11.851 -4.323 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -14.119 -12.209 -6.368 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.095 -10.820 -6.668 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.215 -11.943 -8.402 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.433 -12.997 -7.239 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.166 -13.834 -7.723 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -10.893 -13.863 -9.050 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -11.167 -15.329 -9.997 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.508 -15.714 -8.942 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -13.205 -16.373 -9.936 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.437 -11.337 -3.206 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.940 -11.309 -1.845 1.00 0.00 C ATOM 1099 C TYR A 781 -9.523 -10.147 -1.056 1.00 0.00 C ATOM 1100 O TYR A 781 -9.873 -10.304 0.110 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.420 -11.206 -1.890 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.739 -10.850 -0.597 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.616 -9.528 -0.214 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.173 -11.826 0.210 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.951 -9.178 0.933 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.510 -11.489 1.373 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.398 -10.162 1.729 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.722 -9.819 2.879 1.00 0.00 O ATOM 0 H TYR A 781 -8.705 -11.387 -3.915 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.245 -12.224 -1.338 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -7.022 -12.160 -2.235 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.149 -10.459 -2.636 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -7.052 -8.755 -0.830 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.252 -12.865 -0.076 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.860 -8.139 1.212 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -5.083 -12.259 1.999 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.397 -10.631 3.322 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.627 -8.984 -1.699 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.137 -7.793 -1.038 1.00 0.00 C ATOM 1120 C TYR A 782 -11.598 -7.916 -0.687 1.00 0.00 C ATOM 1121 O TYR A 782 -12.471 -7.359 -1.353 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.876 -6.560 -1.891 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.445 -6.462 -2.225 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.564 -6.056 -1.277 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -7.967 -6.831 -3.451 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.234 -6.015 -1.525 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.623 -6.773 -3.716 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.764 -6.368 -2.741 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.425 -6.343 -2.970 1.00 0.00 O ATOM 0 H TYR A 782 -9.364 -8.846 -2.675 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.599 -7.684 -0.096 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.467 -6.611 -2.805 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.193 -5.665 -1.355 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.931 -5.760 -0.305 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.651 -7.170 -4.215 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.549 -5.700 -0.751 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.249 -7.047 -4.691 1.00 0.00 H new ATOM 0 HH TYR A 782 -4.001 -5.701 -2.363 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.847 -8.660 0.375 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.182 -8.839 0.875 1.00 0.00 C ATOM 1141 C VAL A 783 -13.482 -7.691 1.802 1.00 0.00 C ATOM 1142 O VAL A 783 -14.455 -7.691 2.556 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.328 -10.166 1.620 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -13.153 -11.307 0.653 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.322 -10.241 2.740 1.00 0.00 C ATOM 0 H VAL A 783 -11.129 -9.151 0.907 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.883 -8.860 0.041 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.324 -10.235 2.058 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.257 -12.253 1.184 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -13.912 -11.243 -0.127 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.163 -11.252 0.201 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.433 -11.189 3.266 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.315 -10.169 2.330 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.490 -9.419 3.436 1.00 0.00 H new ATOM 1155 N SER A 784 -12.601 -6.709 1.720 1.00 0.00 N ATOM 1156 CA SER A 784 -12.670 -5.527 2.536 1.00 0.00 C ATOM 1157 C SER A 784 -11.745 -4.454 1.969 1.00 0.00 C ATOM 1158 O SER A 784 -10.556 -4.706 1.773 1.00 0.00 O ATOM 1159 CB SER A 784 -12.254 -5.895 3.944 1.00 0.00 C ATOM 1160 OG SER A 784 -13.379 -6.163 4.764 1.00 0.00 O ATOM 0 H SER A 784 -11.811 -6.718 1.075 1.00 0.00 H new ATOM 0 HA SER A 784 -13.686 -5.131 2.546 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.606 -6.771 3.916 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.672 -5.081 4.377 1.00 0.00 H new ATOM 0 HG SER A 784 -14.010 -6.733 4.277 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.287 -3.264 1.688 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.471 -2.177 1.147 1.00 0.00 C ATOM 1168 C LYS A 785 -10.246 -1.963 2.006 1.00 0.00 C ATOM 1169 O LYS A 785 -9.300 -1.324 1.576 1.00 0.00 O ATOM 1170 CB LYS A 785 -12.249 -0.863 1.067 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.868 -0.427 2.386 1.00 0.00 C ATOM 1172 CD LYS A 785 -14.327 -0.032 2.219 1.00 0.00 C ATOM 1173 CE LYS A 785 -15.217 -1.254 2.114 1.00 0.00 C ATOM 1174 NZ LYS A 785 -15.261 -2.023 3.388 1.00 0.00 N ATOM 0 H LYS A 785 -13.271 -3.033 1.824 1.00 0.00 H new ATOM 0 HA LYS A 785 -11.179 -2.471 0.139 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.580 -0.078 0.715 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -13.039 -0.966 0.323 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -12.791 -1.238 3.110 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.307 0.415 2.791 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.641 0.578 3.066 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.440 0.582 1.325 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -16.226 -0.945 1.842 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -14.854 -1.899 1.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -14.880 -2.978 3.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -14.689 -1.536 4.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -16.245 -2.093 3.717 1.00 0.00 H new ATOM 1188 N LYS A 786 -10.276 -2.491 3.227 1.00 0.00 N ATOM 1189 CA LYS A 786 -9.150 -2.347 4.132 1.00 0.00 C ATOM 1190 C LYS A 786 -8.002 -3.231 3.680 1.00 0.00 C ATOM 1191 O LYS A 786 -6.852 -2.837 3.750 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.557 -2.673 5.572 1.00 0.00 C ATOM 1193 CG LYS A 786 -8.790 -1.889 6.631 1.00 0.00 C ATOM 1194 CD LYS A 786 -7.331 -2.317 6.721 1.00 0.00 C ATOM 1195 CE LYS A 786 -7.193 -3.777 7.126 1.00 0.00 C ATOM 1196 NZ LYS A 786 -7.853 -4.055 8.433 1.00 0.00 N ATOM 0 H LYS A 786 -11.063 -3.018 3.606 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.819 -1.309 4.110 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.622 -2.475 5.690 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -9.409 -3.739 5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -8.841 -0.825 6.400 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -9.268 -2.028 7.601 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -6.846 -2.160 5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -6.812 -1.689 7.445 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -7.632 -4.411 6.355 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -6.137 -4.038 7.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -7.569 -4.996 8.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -7.566 -3.336 9.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -8.886 -4.028 8.313 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.308 -4.438 3.248 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.283 -5.317 2.724 1.00 0.00 C ATOM 1212 C LEU A 787 -6.570 -4.569 1.655 1.00 0.00 C ATOM 1213 O LEU A 787 -5.346 -4.504 1.569 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.935 -6.521 2.081 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.326 -7.594 3.040 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -9.044 -8.697 2.299 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -7.091 -8.071 3.769 1.00 0.00 C ATOM 0 H LEU A 787 -9.250 -4.830 3.249 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.612 -5.637 3.521 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.822 -6.193 1.540 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.250 -6.940 1.345 1.00 0.00 H new ATOM 0 HG LEU A 787 -9.022 -7.218 3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.329 -9.481 3.001 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.937 -8.294 1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.384 -9.114 1.538 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.365 -8.856 4.474 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.373 -8.464 3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.644 -7.238 4.311 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.419 -4.012 0.850 1.00 0.00 N ATOM 1230 CA PHE A 788 -7.059 -3.222 -0.266 1.00 0.00 C ATOM 1231 C PHE A 788 -6.347 -1.971 0.150 1.00 0.00 C ATOM 1232 O PHE A 788 -5.374 -1.550 -0.475 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.318 -2.908 -0.987 1.00 0.00 C ATOM 1234 CG PHE A 788 -7.977 -2.505 -2.331 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.655 -1.230 -2.493 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.927 -3.367 -3.393 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.285 -0.745 -3.686 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.554 -2.894 -4.624 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.234 -1.574 -4.767 1.00 0.00 C ATOM 0 H PHE A 788 -8.428 -4.105 0.966 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.364 -3.762 -0.909 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -8.973 -3.779 -1.006 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.860 -2.112 -0.477 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.692 -0.565 -1.643 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.179 -4.409 -3.262 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.028 0.299 -3.791 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.513 -3.559 -5.474 1.00 0.00 H new ATOM 0 HZ PHE A 788 -6.942 -1.188 -5.733 1.00 0.00 H new ATOM 1249 N MET A 789 -6.827 -1.385 1.209 1.00 0.00 N ATOM 1250 CA MET A 789 -6.235 -0.191 1.713 1.00 0.00 C ATOM 1251 C MET A 789 -4.863 -0.512 2.244 1.00 0.00 C ATOM 1252 O MET A 789 -3.869 -0.101 1.688 1.00 0.00 O ATOM 1253 CB MET A 789 -7.104 0.374 2.797 1.00 0.00 C ATOM 1254 CG MET A 789 -8.225 1.213 2.243 1.00 0.00 C ATOM 1255 SD MET A 789 -8.406 2.736 3.144 1.00 0.00 S ATOM 1256 CE MET A 789 -7.767 3.836 1.906 1.00 0.00 C ATOM 0 H MET A 789 -7.631 -1.721 1.739 1.00 0.00 H new ATOM 0 HA MET A 789 -6.143 0.551 0.919 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.520 -0.441 3.390 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.497 0.979 3.470 1.00 0.00 H new ATOM 0 HG2 MET A 789 -8.033 1.431 1.193 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.158 0.650 2.286 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.052 4.521 2.362 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.269 3.258 1.127 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.586 4.405 1.467 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.844 -1.318 3.286 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.620 -1.752 3.938 1.00 0.00 C ATOM 1268 C ALA A 790 -2.541 -2.175 2.957 1.00 0.00 C ATOM 1269 O ALA A 790 -1.411 -1.722 3.055 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.925 -2.931 4.837 1.00 0.00 C ATOM 0 H ALA A 790 -5.690 -1.697 3.712 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.245 -0.898 4.502 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -3.009 -3.260 5.328 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.655 -2.635 5.590 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.331 -3.748 4.240 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.898 -3.057 2.028 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.941 -3.579 1.060 1.00 0.00 C ATOM 1278 C ASP A 791 -1.482 -2.501 0.075 1.00 0.00 C ATOM 1279 O ASP A 791 -0.292 -2.276 -0.084 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.517 -4.792 0.339 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.599 -6.013 1.235 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -1.545 -6.440 1.752 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.714 -6.544 1.417 1.00 0.00 O ATOM 0 H ASP A 791 -3.844 -3.425 1.926 1.00 0.00 H new ATOM 0 HA ASP A 791 -1.054 -3.901 1.606 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.513 -4.551 -0.034 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.899 -5.023 -0.529 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.391 -1.840 -0.615 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.952 -0.778 -1.510 1.00 0.00 C ATOM 1290 C LEU A 792 -1.169 0.215 -0.687 1.00 0.00 C ATOM 1291 O LEU A 792 -0.181 0.794 -1.136 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.130 -0.059 -2.163 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.168 -0.089 -3.667 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.238 0.855 -4.149 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.817 0.272 -4.231 1.00 0.00 C ATOM 0 H LEU A 792 -3.397 -2.006 -0.581 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.349 -1.213 -2.307 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -4.053 -0.500 -1.787 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.119 0.982 -1.840 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.407 -1.094 -4.014 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.273 0.840 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.204 0.544 -3.751 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.013 1.865 -3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.859 0.246 -5.320 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.541 1.274 -3.902 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.073 -0.443 -3.879 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.622 0.367 0.545 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.995 1.261 1.487 1.00 0.00 C ATOM 1309 C GLN A 793 0.303 0.636 1.932 1.00 0.00 C ATOM 1310 O GLN A 793 1.210 1.296 2.428 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.916 1.514 2.675 1.00 0.00 C ATOM 1312 CG GLN A 793 -3.061 2.448 2.341 1.00 0.00 C ATOM 1313 CD GLN A 793 -4.052 2.599 3.482 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -3.684 2.480 4.651 1.00 0.00 O ATOM 1315 NE2 GLN A 793 -5.318 2.865 3.158 1.00 0.00 N ATOM 0 H GLN A 793 -2.434 -0.128 0.915 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.797 2.225 1.019 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.319 0.564 3.026 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.336 1.937 3.495 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.660 3.428 2.082 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.583 2.074 1.460 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -5.585 2.957 2.178 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -6.019 2.977 3.890 1.00 0.00 H new ATOM 1324 N ARG A 794 0.350 -0.667 1.736 1.00 0.00 N ATOM 1325 CA ARG A 794 1.501 -1.479 2.058 1.00 0.00 C ATOM 1326 C ARG A 794 2.586 -1.241 1.003 1.00 0.00 C ATOM 1327 O ARG A 794 3.771 -1.426 1.271 1.00 0.00 O ATOM 1328 CB ARG A 794 1.068 -2.955 2.128 1.00 0.00 C ATOM 1329 CG ARG A 794 2.081 -3.874 2.751 1.00 0.00 C ATOM 1330 CD ARG A 794 2.049 -3.727 4.249 1.00 0.00 C ATOM 1331 NE ARG A 794 1.499 -4.904 4.914 1.00 0.00 N ATOM 1332 CZ ARG A 794 0.765 -4.846 6.023 1.00 0.00 C ATOM 1333 NH1 ARG A 794 0.523 -3.676 6.602 1.00 0.00 N ATOM 1334 NH2 ARG A 794 0.277 -5.956 6.560 1.00 0.00 N ATOM 0 H ARG A 794 -0.426 -1.198 1.341 1.00 0.00 H new ATOM 0 HA ARG A 794 1.915 -1.208 3.029 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.139 -3.021 2.695 1.00 0.00 H new ATOM 0 HB3 ARG A 794 0.851 -3.305 1.119 1.00 0.00 H new ATOM 0 HG2 ARG A 794 1.869 -4.906 2.473 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.077 -3.641 2.375 1.00 0.00 H new ATOM 0 HD2 ARG A 794 3.060 -3.546 4.615 1.00 0.00 H new ATOM 0 HD3 ARG A 794 1.453 -2.853 4.513 1.00 0.00 H new ATOM 0 HE ARG A 794 1.687 -5.820 4.507 1.00 0.00 H new ATOM 0 HH11 ARG A 794 0.900 -2.819 6.197 1.00 0.00 H new ATOM 0 HH12 ARG A 794 -0.040 -3.634 7.452 1.00 0.00 H new ATOM 0 HH21 ARG A 794 0.464 -6.859 6.123 1.00 0.00 H new ATOM 0 HH22 ARG A 794 -0.285 -5.907 7.410 1.00 0.00 H new ATOM 1348 N VAL A 795 2.170 -0.804 -0.202 1.00 0.00 N ATOM 1349 CA VAL A 795 3.122 -0.503 -1.278 1.00 0.00 C ATOM 1350 C VAL A 795 3.670 0.907 -1.091 1.00 0.00 C ATOM 1351 O VAL A 795 4.867 1.149 -1.239 1.00 0.00 O ATOM 1352 CB VAL A 795 2.517 -0.651 -2.703 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.299 -1.533 -2.671 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.184 0.689 -3.341 1.00 0.00 C ATOM 0 H VAL A 795 1.192 -0.654 -0.449 1.00 0.00 H new ATOM 0 HA VAL A 795 3.922 -1.240 -1.207 1.00 0.00 H new ATOM 0 HB VAL A 795 3.283 -1.117 -3.323 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.890 -1.625 -3.677 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.574 -2.520 -2.300 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.549 -1.094 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.765 0.525 -4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.457 1.216 -2.723 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.091 1.288 -3.424 1.00 0.00 H new ATOM 1364 N PHE A 796 2.776 1.841 -0.770 1.00 0.00 N ATOM 1365 CA PHE A 796 3.184 3.221 -0.528 1.00 0.00 C ATOM 1366 C PHE A 796 4.068 3.251 0.707 1.00 0.00 C ATOM 1367 O PHE A 796 5.188 3.748 0.668 1.00 0.00 O ATOM 1368 CB PHE A 796 1.984 4.140 -0.304 1.00 0.00 C ATOM 1369 CG PHE A 796 0.769 3.785 -1.109 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.856 3.493 -2.453 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.457 3.719 -0.512 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.256 3.142 -3.179 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.570 3.369 -1.234 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.462 3.081 -2.573 1.00 0.00 C ATOM 0 H PHE A 796 1.775 1.669 -0.673 1.00 0.00 H new ATOM 0 HA PHE A 796 3.719 3.580 -1.407 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.721 4.122 0.754 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.276 5.163 -0.543 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.816 3.541 -2.945 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.552 3.945 0.540 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.167 2.915 -4.231 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.533 3.320 -0.748 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.339 2.806 -3.140 1.00 0.00 H new ATOM 1384 N THR A 797 3.549 2.685 1.801 1.00 0.00 N ATOM 1385 CA THR A 797 4.272 2.636 3.067 1.00 0.00 C ATOM 1386 C THR A 797 5.640 1.986 2.888 1.00 0.00 C ATOM 1387 O THR A 797 6.634 2.492 3.402 1.00 0.00 O ATOM 1388 CB THR A 797 3.483 1.876 4.165 1.00 0.00 C ATOM 1389 OG1 THR A 797 3.852 2.365 5.459 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.744 0.379 4.104 1.00 0.00 C ATOM 0 H THR A 797 2.625 2.253 1.831 1.00 0.00 H new ATOM 0 HA THR A 797 4.398 3.669 3.392 1.00 0.00 H new ATOM 0 HB THR A 797 2.421 2.049 3.989 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.799 2.174 5.623 1.00 0.00 H new ATOM 0 HG21 THR A 797 3.175 -0.122 4.887 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.437 -0.005 3.131 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.807 0.189 4.250 1.00 0.00 H new ATOM 1398 N ASN A 798 5.693 0.859 2.170 1.00 0.00 N ATOM 1399 CA ASN A 798 6.961 0.186 1.943 1.00 0.00 C ATOM 1400 C ASN A 798 7.834 1.075 1.089 1.00 0.00 C ATOM 1401 O ASN A 798 9.061 1.009 1.154 1.00 0.00 O ATOM 1402 CB ASN A 798 6.776 -1.180 1.280 1.00 0.00 C ATOM 1403 CG ASN A 798 6.937 -1.141 -0.230 1.00 0.00 C ATOM 1404 OD1 ASN A 798 5.962 -1.070 -0.968 1.00 0.00 O ATOM 1405 ND2 ASN A 798 8.180 -1.189 -0.697 1.00 0.00 N ATOM 0 H ASN A 798 4.884 0.406 1.746 1.00 0.00 H new ATOM 0 HA ASN A 798 7.436 0.005 2.907 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.500 -1.880 1.698 1.00 0.00 H new ATOM 0 HB3 ASN A 798 5.785 -1.563 1.523 1.00 0.00 H new ATOM 0 HD21 ASN A 798 8.348 -1.167 -1.703 1.00 0.00 H new ATOM 0 HD22 ASN A 798 8.966 -1.248 -0.050 1.00 0.00 H new ATOM 1412 N CYS A 799 7.194 1.925 0.292 1.00 0.00 N ATOM 1413 CA CYS A 799 7.937 2.827 -0.543 1.00 0.00 C ATOM 1414 C CYS A 799 8.455 3.983 0.298 1.00 0.00 C ATOM 1415 O CYS A 799 9.504 4.558 0.037 1.00 0.00 O ATOM 1416 CB CYS A 799 7.118 3.316 -1.709 1.00 0.00 C ATOM 1417 SG CYS A 799 7.997 4.525 -2.710 1.00 0.00 S ATOM 0 H CYS A 799 6.180 1.999 0.215 1.00 0.00 H new ATOM 0 HA CYS A 799 8.785 2.289 -0.967 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.838 2.467 -2.333 1.00 0.00 H new ATOM 0 HB3 CYS A 799 6.193 3.759 -1.339 1.00 0.00 H new ATOM 0 HG CYS A 799 7.613 4.425 -3.948 1.00 0.00 H new ATOM 1423 N LYS A 800 7.679 4.301 1.311 1.00 0.00 N ATOM 1424 CA LYS A 800 7.982 5.343 2.265 1.00 0.00 C ATOM 1425 C LYS A 800 8.931 4.815 3.340 1.00 0.00 C ATOM 1426 O LYS A 800 9.604 5.568 4.042 1.00 0.00 O ATOM 1427 CB LYS A 800 6.678 5.747 2.889 1.00 0.00 C ATOM 1428 CG LYS A 800 5.942 6.800 2.106 1.00 0.00 C ATOM 1429 CD LYS A 800 4.589 6.303 1.659 1.00 0.00 C ATOM 1430 CE LYS A 800 3.526 7.354 1.856 1.00 0.00 C ATOM 1431 NZ LYS A 800 2.476 7.283 0.806 1.00 0.00 N ATOM 0 H LYS A 800 6.795 3.828 1.498 1.00 0.00 H new ATOM 0 HA LYS A 800 8.467 6.189 1.778 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.042 4.867 2.987 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.865 6.118 3.896 1.00 0.00 H new ATOM 0 HG2 LYS A 800 5.820 7.693 2.719 1.00 0.00 H new ATOM 0 HG3 LYS A 800 6.532 7.088 1.236 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.633 6.020 0.607 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.325 5.406 2.220 1.00 0.00 H new ATOM 0 HE2 LYS A 800 3.068 7.228 2.837 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.986 8.342 1.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.840 8.101 0.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 2.923 7.293 -0.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 1.930 6.406 0.920 1.00 0.00 H new ATOM 1445 N GLU A 801 8.948 3.493 3.446 1.00 0.00 N ATOM 1446 CA GLU A 801 9.739 2.770 4.436 1.00 0.00 C ATOM 1447 C GLU A 801 11.213 2.705 4.089 1.00 0.00 C ATOM 1448 O GLU A 801 12.078 3.181 4.822 1.00 0.00 O ATOM 1449 CB GLU A 801 9.237 1.330 4.462 1.00 0.00 C ATOM 1450 CG GLU A 801 8.664 0.869 5.792 1.00 0.00 C ATOM 1451 CD GLU A 801 7.742 1.896 6.423 1.00 0.00 C ATOM 1452 OE1 GLU A 801 6.530 1.869 6.121 1.00 0.00 O ATOM 1453 OE2 GLU A 801 8.231 2.726 7.217 1.00 0.00 O ATOM 0 H GLU A 801 8.404 2.882 2.837 1.00 0.00 H new ATOM 0 HA GLU A 801 9.631 3.294 5.386 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.471 1.215 3.695 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.061 0.670 4.191 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.116 -0.062 5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.482 0.651 6.479 1.00 0.00 H new ATOM 1460 N TYR A 802 11.462 2.099 2.950 1.00 0.00 N ATOM 1461 CA TYR A 802 12.796 1.857 2.451 1.00 0.00 C ATOM 1462 C TYR A 802 13.326 3.018 1.643 1.00 0.00 C ATOM 1463 O TYR A 802 14.350 3.610 1.975 1.00 0.00 O ATOM 1464 CB TYR A 802 12.699 0.597 1.602 1.00 0.00 C ATOM 1465 CG TYR A 802 13.860 0.251 0.721 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.098 0.886 0.771 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.671 -0.741 -0.194 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.113 0.513 -0.089 1.00 0.00 C ATOM 1469 CE2 TYR A 802 14.658 -1.118 -1.051 1.00 0.00 C ATOM 1470 CZ TYR A 802 15.887 -0.493 -1.002 1.00 0.00 C ATOM 1471 OH TYR A 802 16.885 -0.873 -1.867 1.00 0.00 O ATOM 0 H TYR A 802 10.727 1.754 2.332 1.00 0.00 H new ATOM 0 HA TYR A 802 13.498 1.737 3.276 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.526 -0.245 2.273 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.816 0.688 0.970 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.266 1.676 1.488 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.714 -1.240 -0.240 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.073 1.005 -0.046 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.480 -1.905 -1.769 1.00 0.00 H new ATOM 0 HH TYR A 802 17.757 -0.727 -1.444 1.00 0.00 H new ATOM 1481 N ASN A 803 12.612 3.344 0.596 1.00 0.00 N ATOM 1482 CA ASN A 803 13.023 4.421 -0.292 1.00 0.00 C ATOM 1483 C ASN A 803 13.102 5.742 0.453 1.00 0.00 C ATOM 1484 O ASN A 803 12.565 5.877 1.549 1.00 0.00 O ATOM 1485 CB ASN A 803 12.057 4.531 -1.473 1.00 0.00 C ATOM 1486 CG ASN A 803 12.060 3.278 -2.325 1.00 0.00 C ATOM 1487 OD1 ASN A 803 13.015 3.014 -3.055 1.00 0.00 O ATOM 1488 ND2 ASN A 803 10.989 2.496 -2.235 1.00 0.00 N ATOM 0 H ASN A 803 11.741 2.884 0.331 1.00 0.00 H new ATOM 0 HA ASN A 803 14.018 4.188 -0.672 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.049 4.715 -1.101 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.331 5.388 -2.088 1.00 0.00 H new ATOM 0 HD21 ASN A 803 10.936 1.638 -2.784 1.00 0.00 H new ATOM 0 HD22 ASN A 803 10.220 2.754 -1.617 1.00 0.00 H new ATOM 1495 N PRO A 804 13.877 6.689 -0.101 1.00 0.00 N ATOM 1496 CA PRO A 804 14.024 8.044 0.433 1.00 0.00 C ATOM 1497 C PRO A 804 13.098 9.032 -0.288 1.00 0.00 C ATOM 1498 O PRO A 804 12.929 8.937 -1.502 1.00 0.00 O ATOM 1499 CB PRO A 804 15.475 8.344 0.087 1.00 0.00 C ATOM 1500 CG PRO A 804 15.673 7.676 -1.237 1.00 0.00 C ATOM 1501 CD PRO A 804 14.764 6.476 -1.259 1.00 0.00 C ATOM 0 HA PRO A 804 13.775 8.128 1.491 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.658 9.417 0.025 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.156 7.948 0.840 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.434 8.357 -2.053 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.713 7.376 -1.367 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.200 6.418 -2.190 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.326 5.546 -1.168 1.00 0.00 H new ATOM 1509 N PRO A 805 12.474 9.991 0.438 1.00 0.00 N ATOM 1510 CA PRO A 805 11.572 10.979 -0.173 1.00 0.00 C ATOM 1511 C PRO A 805 12.232 11.713 -1.328 1.00 0.00 C ATOM 1512 O PRO A 805 11.568 12.399 -2.103 1.00 0.00 O ATOM 1513 CB PRO A 805 11.269 11.946 0.966 1.00 0.00 C ATOM 1514 CG PRO A 805 11.457 11.136 2.194 1.00 0.00 C ATOM 1515 CD PRO A 805 12.588 10.196 1.891 1.00 0.00 C ATOM 0 HA PRO A 805 10.682 10.512 -0.595 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.941 12.804 0.949 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.253 12.335 0.898 1.00 0.00 H new ATOM 0 HG2 PRO A 805 11.693 11.770 3.049 1.00 0.00 H new ATOM 0 HG3 PRO A 805 10.549 10.588 2.445 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.552 10.625 2.163 1.00 0.00 H new ATOM 0 HD3 PRO A 805 12.491 9.259 2.439 1.00 0.00 H new ATOM 1523 N GLU A 806 13.550 11.571 -1.429 1.00 0.00 N ATOM 1524 CA GLU A 806 14.301 12.214 -2.491 1.00 0.00 C ATOM 1525 C GLU A 806 14.205 11.400 -3.777 1.00 0.00 C ATOM 1526 O GLU A 806 14.227 11.950 -4.878 1.00 0.00 O ATOM 1527 CB GLU A 806 15.766 12.386 -2.082 1.00 0.00 C ATOM 1528 CG GLU A 806 15.946 13.137 -0.773 1.00 0.00 C ATOM 1529 CD GLU A 806 17.398 13.223 -0.344 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.893 12.258 0.275 1.00 0.00 O ATOM 1531 OE2 GLU A 806 18.040 14.256 -0.627 1.00 0.00 O ATOM 0 H GLU A 806 14.116 11.016 -0.787 1.00 0.00 H new ATOM 0 HA GLU A 806 13.872 13.200 -2.669 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.228 11.403 -1.994 1.00 0.00 H new ATOM 0 HB3 GLU A 806 16.296 12.918 -2.873 1.00 0.00 H new ATOM 0 HG2 GLU A 806 15.542 14.144 -0.878 1.00 0.00 H new ATOM 0 HG3 GLU A 806 15.369 12.642 0.008 1.00 0.00 H new ATOM 1538 N SER A 807 14.098 10.081 -3.624 1.00 0.00 N ATOM 1539 CA SER A 807 13.982 9.177 -4.762 1.00 0.00 C ATOM 1540 C SER A 807 12.722 9.481 -5.557 1.00 0.00 C ATOM 1541 O SER A 807 11.944 10.367 -5.199 1.00 0.00 O ATOM 1542 CB SER A 807 13.952 7.729 -4.292 1.00 0.00 C ATOM 1543 OG SER A 807 13.868 6.833 -5.387 1.00 0.00 O ATOM 0 H SER A 807 14.089 9.615 -2.717 1.00 0.00 H new ATOM 0 HA SER A 807 14.851 9.325 -5.402 1.00 0.00 H new ATOM 0 HB2 SER A 807 14.849 7.514 -3.712 1.00 0.00 H new ATOM 0 HB3 SER A 807 13.100 7.577 -3.629 1.00 0.00 H new ATOM 0 HG SER A 807 13.852 5.911 -5.055 1.00 0.00 H new ATOM 1549 N GLU A 808 12.526 8.742 -6.633 1.00 0.00 N ATOM 1550 CA GLU A 808 11.357 8.919 -7.479 1.00 0.00 C ATOM 1551 C GLU A 808 10.158 8.248 -6.858 1.00 0.00 C ATOM 1552 O GLU A 808 9.052 8.784 -6.826 1.00 0.00 O ATOM 1553 CB GLU A 808 11.558 8.247 -8.836 1.00 0.00 C ATOM 1554 CG GLU A 808 12.994 7.948 -9.210 1.00 0.00 C ATOM 1555 CD GLU A 808 13.938 9.111 -8.962 1.00 0.00 C ATOM 1556 OE1 GLU A 808 13.851 10.114 -9.703 1.00 0.00 O ATOM 1557 OE2 GLU A 808 14.764 9.019 -8.031 1.00 0.00 O ATOM 0 H GLU A 808 13.164 8.009 -6.944 1.00 0.00 H new ATOM 0 HA GLU A 808 11.207 9.993 -7.591 1.00 0.00 H new ATOM 0 HB2 GLU A 808 10.997 7.313 -8.846 1.00 0.00 H new ATOM 0 HB3 GLU A 808 11.126 8.886 -9.606 1.00 0.00 H new ATOM 0 HG2 GLU A 808 13.337 7.084 -8.641 1.00 0.00 H new ATOM 0 HG3 GLU A 808 13.037 7.673 -10.264 1.00 0.00 H new ATOM 1564 N TYR A 809 10.421 7.063 -6.350 1.00 0.00 N ATOM 1565 CA TYR A 809 9.395 6.205 -5.800 1.00 0.00 C ATOM 1566 C TYR A 809 8.755 6.746 -4.531 1.00 0.00 C ATOM 1567 O TYR A 809 7.536 6.854 -4.452 1.00 0.00 O ATOM 1568 CB TYR A 809 9.953 4.830 -5.521 1.00 0.00 C ATOM 1569 CG TYR A 809 11.183 4.459 -6.314 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.487 4.964 -7.570 1.00 0.00 C ATOM 1571 CD2 TYR A 809 12.046 3.589 -5.761 1.00 0.00 C ATOM 1572 CE1 TYR A 809 12.646 4.579 -8.220 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.184 3.196 -6.377 1.00 0.00 C ATOM 1574 CZ TYR A 809 13.493 3.691 -7.617 1.00 0.00 C ATOM 1575 OH TYR A 809 14.643 3.299 -8.259 1.00 0.00 O ATOM 0 H TYR A 809 11.359 6.666 -6.307 1.00 0.00 H new ATOM 0 HA TYR A 809 8.614 6.159 -6.559 1.00 0.00 H new ATOM 0 HB2 TYR A 809 10.191 4.761 -4.460 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.176 4.093 -5.722 1.00 0.00 H new ATOM 0 HD1 TYR A 809 10.814 5.663 -8.044 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.821 3.187 -4.784 1.00 0.00 H new ATOM 0 HE1 TYR A 809 12.880 4.977 -9.196 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.847 2.494 -5.893 1.00 0.00 H new ATOM 0 HH TYR A 809 14.589 3.545 -9.206 1.00 0.00 H new ATOM 1585 N TYR A 810 9.570 7.049 -3.525 1.00 0.00 N ATOM 1586 CA TYR A 810 9.047 7.534 -2.249 1.00 0.00 C ATOM 1587 C TYR A 810 7.940 8.559 -2.446 1.00 0.00 C ATOM 1588 O TYR A 810 6.818 8.368 -1.984 1.00 0.00 O ATOM 1589 CB TYR A 810 10.159 8.131 -1.398 1.00 0.00 C ATOM 1590 CG TYR A 810 9.805 8.223 0.069 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.622 8.791 0.475 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.657 7.744 1.037 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.297 8.880 1.811 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.348 7.825 2.378 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.163 8.396 2.762 1.00 0.00 C ATOM 1596 OH TYR A 810 8.840 8.484 4.097 1.00 0.00 O ATOM 0 H TYR A 810 10.586 6.969 -3.566 1.00 0.00 H new ATOM 0 HA TYR A 810 8.624 6.674 -1.730 1.00 0.00 H new ATOM 0 HB2 TYR A 810 11.058 7.525 -1.510 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.397 9.127 -1.770 1.00 0.00 H new ATOM 0 HD1 TYR A 810 7.935 9.174 -0.265 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.592 7.293 0.739 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.362 9.330 2.111 1.00 0.00 H new ATOM 0 HE2 TYR A 810 11.034 7.442 3.119 1.00 0.00 H new ATOM 0 HH TYR A 810 8.937 7.603 4.516 1.00 0.00 H new ATOM 1606 N LYS A 811 8.253 9.655 -3.111 1.00 0.00 N ATOM 1607 CA LYS A 811 7.246 10.676 -3.351 1.00 0.00 C ATOM 1608 C LYS A 811 6.118 10.071 -4.146 1.00 0.00 C ATOM 1609 O LYS A 811 4.961 10.382 -3.923 1.00 0.00 O ATOM 1610 CB LYS A 811 7.817 11.862 -4.113 1.00 0.00 C ATOM 1611 CG LYS A 811 9.325 11.864 -4.159 1.00 0.00 C ATOM 1612 CD LYS A 811 9.867 12.659 -5.340 1.00 0.00 C ATOM 1613 CE LYS A 811 9.518 12.009 -6.671 1.00 0.00 C ATOM 1614 NZ LYS A 811 8.203 12.475 -7.193 1.00 0.00 N ATOM 0 H LYS A 811 9.178 9.861 -3.489 1.00 0.00 H new ATOM 0 HA LYS A 811 6.889 11.038 -2.387 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.428 11.854 -5.131 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.472 12.785 -3.648 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.714 12.285 -3.232 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.686 10.837 -4.219 1.00 0.00 H new ATOM 0 HD2 LYS A 811 9.462 13.671 -5.313 1.00 0.00 H new ATOM 0 HD3 LYS A 811 10.950 12.747 -5.252 1.00 0.00 H new ATOM 0 HE2 LYS A 811 10.297 12.234 -7.399 1.00 0.00 H new ATOM 0 HE3 LYS A 811 9.497 10.926 -6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 7.508 11.704 -7.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 7.876 13.289 -6.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 8.305 12.758 -8.189 1.00 0.00 H new ATOM 1628 N CYS A 812 6.477 9.210 -5.090 1.00 0.00 N ATOM 1629 CA CYS A 812 5.496 8.528 -5.912 1.00 0.00 C ATOM 1630 C CYS A 812 4.562 7.720 -5.030 1.00 0.00 C ATOM 1631 O CYS A 812 3.430 7.442 -5.397 1.00 0.00 O ATOM 1632 CB CYS A 812 6.190 7.603 -6.911 1.00 0.00 C ATOM 1633 SG CYS A 812 6.708 8.413 -8.444 1.00 0.00 S ATOM 0 H CYS A 812 7.445 8.969 -5.303 1.00 0.00 H new ATOM 0 HA CYS A 812 4.921 9.272 -6.463 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.065 7.163 -6.433 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.516 6.783 -7.158 1.00 0.00 H new ATOM 0 HG CYS A 812 7.951 8.780 -8.342 1.00 0.00 H new ATOM 1639 N ALA A 813 5.051 7.347 -3.859 1.00 0.00 N ATOM 1640 CA ALA A 813 4.261 6.583 -2.914 1.00 0.00 C ATOM 1641 C ALA A 813 3.225 7.482 -2.277 1.00 0.00 C ATOM 1642 O ALA A 813 2.057 7.140 -2.208 1.00 0.00 O ATOM 1643 CB ALA A 813 5.163 5.961 -1.867 1.00 0.00 C ATOM 0 H ALA A 813 5.996 7.563 -3.541 1.00 0.00 H new ATOM 0 HA ALA A 813 3.745 5.777 -3.436 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.561 5.389 -1.161 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.880 5.299 -2.352 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.698 6.747 -1.334 1.00 0.00 H new ATOM 1649 N ASN A 814 3.680 8.637 -1.825 1.00 0.00 N ATOM 1650 CA ASN A 814 2.832 9.634 -1.210 1.00 0.00 C ATOM 1651 C ASN A 814 1.863 10.205 -2.243 1.00 0.00 C ATOM 1652 O ASN A 814 0.686 10.440 -1.967 1.00 0.00 O ATOM 1653 CB ASN A 814 3.725 10.742 -0.693 1.00 0.00 C ATOM 1654 CG ASN A 814 3.029 11.655 0.300 1.00 0.00 C ATOM 1655 OD1 ASN A 814 1.815 11.846 0.238 1.00 0.00 O ATOM 1656 ND2 ASN A 814 3.799 12.225 1.219 1.00 0.00 N ATOM 0 H ASN A 814 4.662 8.909 -1.877 1.00 0.00 H new ATOM 0 HA ASN A 814 2.254 9.190 -0.399 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.602 10.302 -0.219 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.081 11.336 -1.535 1.00 0.00 H new ATOM 0 HD21 ASN A 814 3.388 12.851 1.912 1.00 0.00 H new ATOM 0 HD22 ASN A 814 4.802 12.037 1.232 1.00 0.00 H new ATOM 1663 N ILE A 815 2.398 10.404 -3.439 1.00 0.00 N ATOM 1664 CA ILE A 815 1.660 10.941 -4.568 1.00 0.00 C ATOM 1665 C ILE A 815 0.558 9.985 -4.945 1.00 0.00 C ATOM 1666 O ILE A 815 -0.617 10.341 -4.984 1.00 0.00 O ATOM 1667 CB ILE A 815 2.590 11.154 -5.771 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.333 12.470 -5.621 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.816 11.116 -7.074 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.736 12.416 -6.140 1.00 0.00 C ATOM 0 H ILE A 815 3.373 10.193 -3.653 1.00 0.00 H new ATOM 0 HA ILE A 815 1.235 11.903 -4.283 1.00 0.00 H new ATOM 0 HB ILE A 815 3.315 10.341 -5.797 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.786 13.251 -6.150 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.352 12.751 -4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.500 11.270 -7.908 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.328 10.147 -7.179 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.063 11.904 -7.073 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.212 13.387 -6.004 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.297 11.657 -5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.722 12.165 -7.201 1.00 0.00 H new ATOM 1682 N LEU A 816 0.966 8.770 -5.247 1.00 0.00 N ATOM 1683 CA LEU A 816 0.037 7.722 -5.575 1.00 0.00 C ATOM 1684 C LEU A 816 -0.955 7.604 -4.444 1.00 0.00 C ATOM 1685 O LEU A 816 -2.155 7.710 -4.639 1.00 0.00 O ATOM 1686 CB LEU A 816 0.785 6.411 -5.739 1.00 0.00 C ATOM 1687 CG LEU A 816 0.143 5.406 -6.661 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.943 4.142 -6.662 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.265 5.163 -6.239 1.00 0.00 C ATOM 0 H LEU A 816 1.946 8.487 -5.271 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.479 7.951 -6.508 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.787 6.629 -6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.901 5.954 -4.756 1.00 0.00 H new ATOM 0 HG LEU A 816 0.125 5.795 -7.679 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.477 3.417 -7.329 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.956 4.353 -7.006 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.980 3.734 -5.652 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.725 4.436 -6.908 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.278 4.777 -5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.824 6.098 -6.280 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.421 7.413 -3.252 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.228 7.287 -2.056 1.00 0.00 C ATOM 1703 C GLU A 817 -2.278 8.403 -1.990 1.00 0.00 C ATOM 1704 O GLU A 817 -3.329 8.254 -1.383 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.330 7.348 -0.823 1.00 0.00 C ATOM 1706 CG GLU A 817 -1.039 6.898 0.442 1.00 0.00 C ATOM 1707 CD GLU A 817 -0.125 6.828 1.649 1.00 0.00 C ATOM 1708 OE1 GLU A 817 0.128 7.885 2.263 1.00 0.00 O ATOM 1709 OE2 GLU A 817 0.336 5.715 1.980 1.00 0.00 O ATOM 0 H GLU A 817 0.583 7.341 -3.087 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.745 6.328 -2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.547 6.721 -0.986 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.029 8.369 -0.690 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.858 7.585 0.655 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -1.482 5.916 0.273 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.968 9.528 -2.607 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.849 10.663 -2.655 1.00 0.00 C ATOM 1718 C LYS A 818 -3.918 10.474 -3.737 1.00 0.00 C ATOM 1719 O LYS A 818 -5.115 10.577 -3.457 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.955 11.840 -2.881 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.412 12.748 -3.955 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.234 13.458 -4.590 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.284 13.350 -6.101 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.488 14.016 -6.670 1.00 0.00 N ATOM 0 H LYS A 818 -1.083 9.674 -3.093 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.421 10.803 -1.738 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.874 12.405 -1.952 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.955 11.482 -3.124 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.953 12.181 -4.712 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.109 13.481 -3.547 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.237 14.508 -4.297 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.303 13.026 -4.222 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.387 13.799 -6.526 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.281 12.299 -6.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.448 13.977 -7.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.344 13.528 -6.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.514 15.009 -6.361 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.489 10.196 -4.970 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.427 9.941 -6.060 1.00 0.00 C ATOM 1740 C PHE A 819 -5.313 8.794 -5.627 1.00 0.00 C ATOM 1741 O PHE A 819 -6.540 8.896 -5.596 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.657 9.574 -7.333 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.463 8.845 -8.385 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.840 7.519 -8.202 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.816 9.474 -9.567 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.547 6.841 -9.154 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.535 8.798 -10.535 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.900 7.480 -10.331 1.00 0.00 C ATOM 0 H PHE A 819 -2.506 10.142 -5.235 1.00 0.00 H new ATOM 0 HA PHE A 819 -5.027 10.825 -6.277 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.257 10.488 -7.773 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.804 8.954 -7.057 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.568 7.014 -7.287 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.527 10.501 -9.734 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.829 5.812 -8.990 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.812 9.299 -11.451 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.459 6.950 -11.088 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.647 7.688 -5.326 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.287 6.497 -4.824 1.00 0.00 C ATOM 1760 C PHE A 820 -6.297 6.897 -3.779 1.00 0.00 C ATOM 1761 O PHE A 820 -7.432 6.460 -3.843 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.209 5.551 -4.301 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.465 4.887 -2.998 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.068 5.426 -1.799 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.035 3.674 -3.003 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.272 4.730 -0.622 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.230 2.969 -1.865 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.858 3.487 -0.663 1.00 0.00 C ATOM 0 H PHE A 820 -3.636 7.599 -5.427 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.831 5.963 -5.603 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.048 4.775 -5.050 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.278 6.112 -4.217 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.595 6.397 -1.775 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.348 3.246 -3.944 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -3.973 5.160 0.323 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.683 1.990 -1.911 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.021 2.929 0.247 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.904 7.796 -2.870 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.815 8.254 -1.829 1.00 0.00 C ATOM 1780 C PHE A 821 -8.102 8.819 -2.399 1.00 0.00 C ATOM 1781 O PHE A 821 -9.172 8.593 -1.846 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.141 9.234 -0.880 1.00 0.00 C ATOM 1783 CG PHE A 821 -5.965 8.610 0.463 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.214 7.473 0.549 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.597 9.087 1.598 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.066 6.793 1.733 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.449 8.426 2.808 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.682 7.271 2.875 1.00 0.00 C ATOM 0 H PHE A 821 -4.974 8.213 -2.838 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.090 7.375 -1.245 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.172 9.532 -1.281 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.742 10.139 -0.793 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.723 7.099 -0.337 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.207 9.976 1.541 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.473 5.891 1.772 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -6.929 8.809 3.696 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.567 6.749 3.813 1.00 0.00 H new ATOM 1798 N SER A 822 -8.010 9.533 -3.505 1.00 0.00 N ATOM 1799 CA SER A 822 -9.201 10.089 -4.127 1.00 0.00 C ATOM 1800 C SER A 822 -10.015 8.983 -4.796 1.00 0.00 C ATOM 1801 O SER A 822 -11.218 9.114 -4.987 1.00 0.00 O ATOM 1802 CB SER A 822 -8.822 11.158 -5.153 1.00 0.00 C ATOM 1803 OG SER A 822 -9.974 11.707 -5.769 1.00 0.00 O ATOM 0 H SER A 822 -7.136 9.741 -3.988 1.00 0.00 H new ATOM 0 HA SER A 822 -9.809 10.553 -3.351 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.255 11.950 -4.664 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.172 10.723 -5.913 1.00 0.00 H new ATOM 0 HG SER A 822 -9.704 12.389 -6.419 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.335 7.887 -5.125 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.945 6.730 -5.791 1.00 0.00 C ATOM 1811 C LYS A 823 -10.668 5.811 -4.819 1.00 0.00 C ATOM 1812 O LYS A 823 -11.731 5.269 -5.123 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.837 5.961 -6.503 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.899 5.973 -8.019 1.00 0.00 C ATOM 1815 CD LYS A 823 -9.757 7.103 -8.543 1.00 0.00 C ATOM 1816 CE LYS A 823 -9.232 7.655 -9.844 1.00 0.00 C ATOM 1817 NZ LYS A 823 -10.254 8.470 -10.558 1.00 0.00 N ATOM 0 H LYS A 823 -8.339 7.772 -4.937 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.695 7.090 -6.495 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -7.877 6.373 -6.193 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -8.863 4.925 -6.165 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.891 6.067 -8.422 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -9.297 5.022 -8.373 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -10.777 6.747 -8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.798 7.901 -7.801 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -8.352 8.268 -9.649 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -8.913 6.833 -10.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -9.852 8.830 -11.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -11.084 7.880 -10.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -10.541 9.270 -9.959 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.092 5.652 -3.654 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.668 4.806 -2.630 1.00 0.00 C ATOM 1833 C ILE A 824 -11.847 5.539 -2.046 1.00 0.00 C ATOM 1834 O ILE A 824 -12.944 5.009 -1.918 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.662 4.529 -1.529 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.635 5.601 -1.528 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.010 3.188 -1.723 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.442 5.297 -0.703 1.00 0.00 C ATOM 0 H ILE A 824 -9.216 6.101 -3.386 1.00 0.00 H new ATOM 0 HA ILE A 824 -10.967 3.853 -3.066 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.181 4.515 -0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.316 5.785 -2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.089 6.523 -1.165 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.293 3.013 -0.921 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.771 2.408 -1.707 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.493 3.170 -2.682 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.741 6.130 -0.756 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.745 5.144 0.333 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -6.961 4.394 -1.078 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.591 6.798 -1.739 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.590 7.678 -1.181 1.00 0.00 C ATOM 1852 C LYS A 825 -13.813 7.652 -2.065 1.00 0.00 C ATOM 1853 O LYS A 825 -14.945 7.466 -1.616 1.00 0.00 O ATOM 1854 CB LYS A 825 -12.074 9.104 -1.133 1.00 0.00 C ATOM 1855 CG LYS A 825 -12.014 9.664 0.268 1.00 0.00 C ATOM 1856 CD LYS A 825 -11.390 11.036 0.294 1.00 0.00 C ATOM 1857 CE LYS A 825 -9.889 10.938 0.127 1.00 0.00 C ATOM 1858 NZ LYS A 825 -9.313 12.155 -0.508 1.00 0.00 N ATOM 0 H LYS A 825 -10.680 7.236 -1.872 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.828 7.342 -0.172 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.078 9.139 -1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.717 9.738 -1.744 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -13.021 9.714 0.683 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -11.440 8.991 0.905 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -11.811 11.649 -0.503 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -11.626 11.532 1.236 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.426 10.785 1.102 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -9.649 10.065 -0.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -8.283 12.043 -0.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -9.734 12.288 -1.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -9.518 12.985 0.083 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.538 7.854 -3.344 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.557 7.871 -4.375 1.00 0.00 C ATOM 1874 C GLU A 826 -15.327 6.567 -4.378 1.00 0.00 C ATOM 1875 O GLU A 826 -16.536 6.541 -4.614 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.895 8.095 -5.746 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.747 6.834 -6.582 1.00 0.00 C ATOM 1878 CD GLU A 826 -15.003 6.488 -7.360 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -15.360 7.253 -8.281 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -15.629 5.452 -7.050 1.00 0.00 O ATOM 0 H GLU A 826 -12.594 8.012 -3.696 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.255 8.683 -4.172 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.483 8.822 -6.306 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.909 8.533 -5.593 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -12.918 6.962 -7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -13.489 6.000 -5.929 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.613 5.486 -4.113 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.215 4.170 -4.126 1.00 0.00 C ATOM 1889 C ALA A 827 -15.696 3.701 -2.752 1.00 0.00 C ATOM 1890 O ALA A 827 -15.927 2.512 -2.557 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.229 3.183 -4.708 1.00 0.00 C ATOM 0 H ALA A 827 -13.618 5.497 -3.887 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.110 4.230 -4.746 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.675 2.188 -4.721 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.974 3.480 -5.725 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.326 3.168 -4.097 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.869 4.621 -1.809 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.335 4.235 -0.481 1.00 0.00 C ATOM 1899 C GLY A 828 -15.345 3.345 0.244 1.00 0.00 C ATOM 1900 O GLY A 828 -15.690 2.664 1.207 1.00 0.00 O ATOM 0 H GLY A 828 -15.698 5.619 -1.934 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.515 5.131 0.112 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.289 3.715 -0.571 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.109 3.377 -0.212 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.045 2.559 0.345 1.00 0.00 C ATOM 1906 C LEU A 829 -12.623 3.055 1.719 1.00 0.00 C ATOM 1907 O LEU A 829 -13.209 2.659 2.726 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.900 2.567 -0.649 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.296 2.034 -2.033 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.159 1.352 -2.725 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.472 1.073 -1.959 1.00 0.00 C ATOM 0 H LEU A 829 -13.811 3.974 -0.984 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.389 1.536 0.500 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.525 3.585 -0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.082 1.964 -0.255 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.586 2.912 -2.611 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.489 0.993 -3.700 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.338 2.057 -2.857 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.820 0.509 -2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.718 0.721 -2.961 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.208 0.223 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.334 1.586 -1.533 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.598 3.903 1.753 1.00 0.00 N ATOM 1924 CA ILE A 830 -11.103 4.493 2.985 1.00 0.00 C ATOM 1925 C ILE A 830 -12.131 4.482 4.105 1.00 0.00 C ATOM 1926 O ILE A 830 -13.259 4.948 3.938 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.668 5.926 2.725 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.617 6.143 1.232 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.302 6.175 3.311 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.788 7.315 0.823 1.00 0.00 C ATOM 0 H ILE A 830 -11.088 4.199 0.921 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.261 3.883 3.310 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.376 6.612 3.190 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.221 5.246 0.757 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.632 6.279 0.859 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.005 7.205 3.116 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.331 6.003 4.387 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.581 5.497 2.854 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.799 7.407 -0.263 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.196 8.222 1.268 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.763 7.172 1.165 1.00 0.00 H new ATOM 1942 N ASP A 831 -11.727 3.957 5.251 1.00 0.00 N ATOM 1943 CA ASP A 831 -12.615 3.874 6.402 1.00 0.00 C ATOM 1944 C ASP A 831 -11.834 3.662 7.700 1.00 0.00 C ATOM 1945 O ASP A 831 -12.250 4.125 8.762 1.00 0.00 O ATOM 1946 CB ASP A 831 -13.623 2.737 6.212 1.00 0.00 C ATOM 1947 CG ASP A 831 -14.568 2.596 7.389 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -14.218 1.879 8.349 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -15.659 3.203 7.350 1.00 0.00 O ATOM 0 H ASP A 831 -10.792 3.582 5.410 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.147 4.822 6.478 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -14.201 2.916 5.305 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -13.086 1.800 6.067 1.00 0.00 H new ATOM 1954 N LYS A 832 -10.710 2.952 7.605 1.00 0.00 N ATOM 1955 CA LYS A 832 -9.870 2.678 8.769 1.00 0.00 C ATOM 1956 C LYS A 832 -9.616 3.946 9.585 1.00 0.00 C ATOM 1957 O LYS A 832 -8.800 4.783 9.146 1.00 0.00 O ATOM 1958 CB LYS A 832 -8.539 2.057 8.329 1.00 0.00 C ATOM 1959 CG LYS A 832 -7.857 2.809 7.196 1.00 0.00 C ATOM 1960 CD LYS A 832 -6.504 2.202 6.854 1.00 0.00 C ATOM 1961 CE LYS A 832 -5.503 2.389 7.983 1.00 0.00 C ATOM 1962 NZ LYS A 832 -5.305 3.827 8.319 1.00 0.00 N ATOM 1963 OXT LYS A 832 -10.237 4.089 10.659 1.00 0.00 O ATOM 0 H LYS A 832 -10.360 2.556 6.732 1.00 0.00 H new ATOM 0 HA LYS A 832 -10.402 1.970 9.405 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -7.865 2.019 9.185 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -8.715 1.028 8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -8.496 2.795 6.313 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -7.727 3.854 7.479 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -6.624 1.139 6.646 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -6.118 2.663 5.945 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -5.849 1.854 8.867 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -4.548 1.948 7.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -4.449 3.933 8.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -5.199 4.377 7.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -6.129 4.176 8.849 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 10.152 2.201 -21.214 1.00 0.00 N ATOM 1979 CA SER B 31 11.107 3.205 -20.675 1.00 0.00 C ATOM 1980 C SER B 31 10.866 3.443 -19.189 1.00 0.00 C ATOM 1981 O SER B 31 9.980 4.210 -18.809 1.00 0.00 O ATOM 1982 CB SER B 31 10.972 4.523 -21.440 1.00 0.00 C ATOM 1983 OG SER B 31 11.886 5.491 -20.955 1.00 0.00 O ATOM 0 HA SER B 31 12.117 2.816 -20.803 1.00 0.00 H new ATOM 0 HB2 SER B 31 11.150 4.351 -22.502 1.00 0.00 H new ATOM 0 HB3 SER B 31 9.954 4.900 -21.344 1.00 0.00 H new ATOM 0 HG SER B 31 11.780 6.323 -21.461 1.00 0.00 H new ATOM 1991 N THR B 32 11.657 2.779 -18.352 1.00 0.00 N ATOM 1992 CA THR B 32 11.528 2.919 -16.906 1.00 0.00 C ATOM 1993 C THR B 32 12.812 2.503 -16.195 1.00 0.00 C ATOM 1994 O THR B 32 13.658 1.820 -16.771 1.00 0.00 O ATOM 1995 CB THR B 32 10.357 2.079 -16.361 1.00 0.00 C ATOM 1996 OG1 THR B 32 10.279 2.210 -14.936 1.00 0.00 O ATOM 1997 CG2 THR B 32 10.522 0.612 -16.732 1.00 0.00 C ATOM 0 H THR B 32 12.393 2.139 -18.650 1.00 0.00 H new ATOM 0 HA THR B 32 11.332 3.973 -16.708 1.00 0.00 H new ATOM 0 HB THR B 32 9.436 2.449 -16.810 1.00 0.00 H new ATOM 0 HG1 THR B 32 9.531 1.674 -14.599 1.00 0.00 H new ATOM 0 HG21 THR B 32 9.683 0.040 -16.336 1.00 0.00 H new ATOM 0 HG22 THR B 32 10.549 0.512 -17.817 1.00 0.00 H new ATOM 0 HG23 THR B 32 11.452 0.232 -16.309 1.00 0.00 H new ATOM 2005 N GLY B 33 12.950 2.921 -14.940 1.00 0.00 N ATOM 2006 CA GLY B 33 14.133 2.583 -14.170 1.00 0.00 C ATOM 2007 C GLY B 33 14.325 1.085 -14.024 1.00 0.00 C ATOM 2008 O GLY B 33 15.099 0.478 -14.765 1.00 0.00 O ATOM 0 H GLY B 33 12.263 3.488 -14.443 1.00 0.00 H new ATOM 0 HA2 GLY B 33 15.011 3.013 -14.652 1.00 0.00 H new ATOM 0 HA3 GLY B 33 14.059 3.034 -13.181 1.00 0.00 H new ATOM 2012 N GLY B 34 13.618 0.490 -13.067 1.00 0.00 N ATOM 2013 CA GLY B 34 13.727 -0.939 -12.843 1.00 0.00 C ATOM 2014 C GLY B 34 15.007 -1.316 -12.122 1.00 0.00 C ATOM 2015 O GLY B 34 15.614 -2.345 -12.418 1.00 0.00 O ATOM 0 H GLY B 34 12.972 0.973 -12.443 1.00 0.00 H new ATOM 0 HA2 GLY B 34 12.871 -1.279 -12.260 1.00 0.00 H new ATOM 0 HA3 GLY B 34 13.686 -1.458 -13.801 1.00 0.00 H new ATOM 2019 N VAL B 35 15.414 -0.482 -11.170 1.00 0.00 N ATOM 2020 CA VAL B 35 16.631 -0.728 -10.404 1.00 0.00 C ATOM 2021 C VAL B 35 16.388 -0.545 -8.912 1.00 0.00 C ATOM 2022 O VAL B 35 17.218 -0.916 -8.091 1.00 0.00 O ATOM 2023 CB VAL B 35 17.764 0.217 -10.831 1.00 0.00 C ATOM 2024 CG1 VAL B 35 18.041 0.083 -12.321 1.00 0.00 C ATOM 2025 CG2 VAL B 35 17.422 1.661 -10.468 1.00 0.00 C ATOM 0 H VAL B 35 14.918 0.371 -10.910 1.00 0.00 H new ATOM 0 HA VAL B 35 16.923 -1.759 -10.606 1.00 0.00 H new ATOM 0 HB VAL B 35 18.669 -0.064 -10.293 1.00 0.00 H new ATOM 0 HG11 VAL B 35 18.847 0.761 -12.604 1.00 0.00 H new ATOM 0 HG12 VAL B 35 18.334 -0.943 -12.546 1.00 0.00 H new ATOM 0 HG13 VAL B 35 17.141 0.335 -12.882 1.00 0.00 H new ATOM 0 HG21 VAL B 35 18.236 2.317 -10.778 1.00 0.00 H new ATOM 0 HG22 VAL B 35 16.504 1.956 -10.977 1.00 0.00 H new ATOM 0 HG23 VAL B 35 17.281 1.742 -9.390 1.00 0.00 H new HETATM 2035 OH ALY B 36 8.951 -1.463 -3.656 1.00 0.00 O HETATM 2036 CH ALY B 36 9.546 -0.473 -4.081 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.773 0.832 -4.275 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.861 -0.471 -4.277 1.00 0.00 N HETATM 2039 CE ALY B 36 11.667 -1.685 -4.287 1.00 0.00 C HETATM 2040 CD ALY B 36 12.603 -1.738 -5.477 1.00 0.00 C HETATM 2041 CG ALY B 36 13.765 -0.850 -5.261 1.00 0.00 C HETATM 2042 CB ALY B 36 14.717 -0.997 -6.401 1.00 0.00 C HETATM 2043 CA ALY B 36 14.858 0.301 -7.202 1.00 0.00 C HETATM 2044 N ALY B 36 15.249 0.046 -8.585 1.00 0.00 N HETATM 2045 C ALY B 36 15.812 1.251 -6.493 1.00 0.00 C HETATM 2046 O ALY B 36 15.800 1.329 -5.265 1.00 0.00 O HETATM 0 HH33 ALY B 36 7.964 0.673 -4.988 1.00 0.00 H new HETATM 0 HH32 ALY B 36 8.357 1.154 -3.320 1.00 0.00 H new HETATM 0 HH31 ALY B 36 9.446 1.601 -4.655 1.00 0.00 H new HETATM 0 HZ ALY B 36 11.328 0.423 -4.428 1.00 0.00 H new HETATM 0 HG3 ALY B 36 14.261 -1.102 -4.324 1.00 0.00 H new HETATM 0 HG2 ALY B 36 13.435 0.186 -5.179 1.00 0.00 H new HETATM 0 HE3 ALY B 36 11.011 -2.555 -4.303 1.00 0.00 H new HETATM 0 HE2 ALY B 36 12.248 -1.741 -3.367 1.00 0.00 H new HETATM 0 HD3 ALY B 36 12.071 -1.437 -6.380 1.00 0.00 H new HETATM 0 HD2 ALY B 36 12.944 -2.761 -5.634 1.00 0.00 H new HETATM 0 HCA ALY B 36 13.882 0.784 -7.252 1.00 0.00 H new HETATM 0 HB3 ALY B 36 14.373 -1.794 -7.060 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.694 -1.297 -6.021 1.00 0.00 H new ATOM 2061 N LYS B 37 16.612 1.986 -7.272 1.00 0.00 N ATOM 2062 CA LYS B 37 17.570 2.948 -6.721 1.00 0.00 C ATOM 2063 C LYS B 37 17.925 2.602 -5.277 1.00 0.00 C ATOM 2064 O LYS B 37 17.575 3.340 -4.356 1.00 0.00 O ATOM 2065 CB LYS B 37 17.002 4.371 -6.798 1.00 0.00 C ATOM 2066 CG LYS B 37 17.109 4.992 -8.181 1.00 0.00 C ATOM 2067 CD LYS B 37 16.406 6.339 -8.246 1.00 0.00 C ATOM 2068 CE LYS B 37 16.576 6.989 -9.609 1.00 0.00 C ATOM 2069 NZ LYS B 37 18.010 7.206 -9.946 1.00 0.00 N ATOM 0 H LYS B 37 16.614 1.932 -8.291 1.00 0.00 H new ATOM 0 HA LYS B 37 18.480 2.897 -7.318 1.00 0.00 H new ATOM 0 HB2 LYS B 37 15.955 4.352 -6.497 1.00 0.00 H new ATOM 0 HB3 LYS B 37 17.528 5.003 -6.083 1.00 0.00 H new ATOM 0 HG2 LYS B 37 18.159 5.116 -8.444 1.00 0.00 H new ATOM 0 HG3 LYS B 37 16.673 4.318 -8.918 1.00 0.00 H new ATOM 0 HD2 LYS B 37 15.345 6.208 -8.034 1.00 0.00 H new ATOM 0 HD3 LYS B 37 16.806 6.997 -7.475 1.00 0.00 H new ATOM 0 HE2 LYS B 37 16.115 6.360 -10.371 1.00 0.00 H new ATOM 0 HE3 LYS B 37 16.051 7.944 -9.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 18.137 8.168 -10.320 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 18.589 7.088 -9.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 18.307 6.514 -10.663 1.00 0.00 H new ATOM 2083 N PRO B 38 18.615 1.462 -5.069 1.00 0.00 N ATOM 2084 CA PRO B 38 19.006 0.994 -3.744 1.00 0.00 C ATOM 2085 C PRO B 38 19.320 2.139 -2.781 1.00 0.00 C ATOM 2086 O PRO B 38 20.046 3.069 -3.134 1.00 0.00 O ATOM 2087 CB PRO B 38 20.275 0.214 -4.054 1.00 0.00 C ATOM 2088 CG PRO B 38 20.010 -0.406 -5.384 1.00 0.00 C ATOM 2089 CD PRO B 38 19.091 0.539 -6.120 1.00 0.00 C ATOM 0 HA PRO B 38 18.218 0.425 -3.251 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.146 0.868 -4.086 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.473 -0.543 -3.295 1.00 0.00 H new ATOM 0 HG2 PRO B 38 20.938 -0.553 -5.936 1.00 0.00 H new ATOM 0 HG3 PRO B 38 19.548 -1.387 -5.270 1.00 0.00 H new ATOM 0 HD2 PRO B 38 19.617 1.072 -6.912 1.00 0.00 H new ATOM 0 HD3 PRO B 38 18.263 0.007 -6.589 1.00 0.00 H new ATOM 2097 N HIS B 39 18.775 2.073 -1.570 1.00 0.00 N ATOM 2098 CA HIS B 39 19.015 3.115 -0.575 1.00 0.00 C ATOM 2099 C HIS B 39 19.544 2.515 0.729 1.00 0.00 C ATOM 2100 O HIS B 39 19.458 1.306 0.938 1.00 0.00 O ATOM 2101 CB HIS B 39 17.735 3.922 -0.324 1.00 0.00 C ATOM 2102 CG HIS B 39 17.917 5.041 0.657 1.00 0.00 C ATOM 2103 ND1 HIS B 39 17.755 4.885 2.018 1.00 0.00 N ATOM 2104 CD2 HIS B 39 18.262 6.337 0.469 1.00 0.00 C ATOM 2105 CE1 HIS B 39 17.988 6.037 2.623 1.00 0.00 C ATOM 2106 NE2 HIS B 39 18.298 6.934 1.705 1.00 0.00 N ATOM 0 H HIS B 39 18.169 1.316 -1.255 1.00 0.00 H new ATOM 0 HA HIS B 39 19.776 3.790 -0.965 1.00 0.00 H new ATOM 0 HB2 HIS B 39 17.382 4.332 -1.270 1.00 0.00 H new ATOM 0 HB3 HIS B 39 16.958 3.251 0.042 1.00 0.00 H new ATOM 0 HD2 HIS B 39 18.470 6.813 -0.478 1.00 0.00 H new ATOM 0 HE1 HIS B 39 17.934 6.214 3.687 1.00 0.00 H new ATOM 0 HE2 HIS B 39 18.527 7.912 1.885 1.00 0.00 H new ATOM 2115 N ARG B 40 20.095 3.377 1.589 1.00 0.00 N ATOM 2116 CA ARG B 40 20.659 2.965 2.879 1.00 0.00 C ATOM 2117 C ARG B 40 19.921 1.770 3.476 1.00 0.00 C ATOM 2118 O ARG B 40 20.549 0.798 3.896 1.00 0.00 O ATOM 2119 CB ARG B 40 20.627 4.134 3.866 1.00 0.00 C ATOM 2120 CG ARG B 40 21.459 5.330 3.428 1.00 0.00 C ATOM 2121 CD ARG B 40 22.928 5.153 3.780 1.00 0.00 C ATOM 2122 NE ARG B 40 23.541 4.044 3.054 1.00 0.00 N ATOM 2123 CZ ARG B 40 24.726 3.526 3.360 1.00 0.00 C ATOM 2124 NH1 ARG B 40 25.426 4.015 4.376 1.00 0.00 N ATOM 2125 NH2 ARG B 40 25.214 2.516 2.653 1.00 0.00 N ATOM 0 H ARG B 40 20.163 4.379 1.411 1.00 0.00 H new ATOM 0 HA ARG B 40 21.690 2.661 2.697 1.00 0.00 H new ATOM 0 HB2 ARG B 40 19.594 4.453 4.004 1.00 0.00 H new ATOM 0 HB3 ARG B 40 20.986 3.789 4.836 1.00 0.00 H new ATOM 0 HG2 ARG B 40 21.357 5.470 2.352 1.00 0.00 H new ATOM 0 HG3 ARG B 40 21.077 6.233 3.904 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.467 6.074 3.556 1.00 0.00 H new ATOM 0 HD3 ARG B 40 23.024 4.980 4.852 1.00 0.00 H new ATOM 0 HE ARG B 40 23.030 3.644 2.267 1.00 0.00 H new ATOM 0 HH11 ARG B 40 25.055 4.791 4.925 1.00 0.00 H new ATOM 0 HH12 ARG B 40 26.335 3.615 4.608 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.680 2.135 1.872 1.00 0.00 H new ATOM 0 HH22 ARG B 40 26.124 2.120 2.890 1.00 0.00 H new ATOM 2139 N TYR B 41 18.593 1.848 3.522 1.00 0.00 N ATOM 2140 CA TYR B 41 17.785 0.760 4.067 1.00 0.00 C ATOM 2141 C TYR B 41 17.996 -0.517 3.266 1.00 0.00 C ATOM 2142 O TYR B 41 17.251 -0.807 2.330 1.00 0.00 O ATOM 2143 CB TYR B 41 16.301 1.147 4.076 1.00 0.00 C ATOM 2144 CG TYR B 41 15.905 2.004 5.265 1.00 0.00 C ATOM 2145 CD1 TYR B 41 16.743 3.010 5.734 1.00 0.00 C ATOM 2146 CD2 TYR B 41 14.695 1.803 5.921 1.00 0.00 C ATOM 2147 CE1 TYR B 41 16.387 3.789 6.820 1.00 0.00 C ATOM 2148 CE2 TYR B 41 14.334 2.578 7.007 1.00 0.00 C ATOM 2149 CZ TYR B 41 15.183 3.569 7.452 1.00 0.00 C ATOM 2150 OH TYR B 41 14.825 4.342 8.533 1.00 0.00 O ATOM 0 H TYR B 41 18.056 2.649 3.190 1.00 0.00 H new ATOM 0 HA TYR B 41 18.102 0.578 5.094 1.00 0.00 H new ATOM 0 HB2 TYR B 41 16.069 1.685 3.157 1.00 0.00 H new ATOM 0 HB3 TYR B 41 15.697 0.240 4.075 1.00 0.00 H new ATOM 0 HD1 TYR B 41 17.688 3.186 5.242 1.00 0.00 H new ATOM 0 HD2 TYR B 41 14.026 1.028 5.576 1.00 0.00 H new ATOM 0 HE1 TYR B 41 17.050 4.566 7.171 1.00 0.00 H new ATOM 0 HE2 TYR B 41 13.391 2.408 7.505 1.00 0.00 H new ATOM 0 HH TYR B 41 13.946 4.058 8.861 1.00 0.00 H new ATOM 2160 N LYS B 42 19.021 -1.277 3.642 1.00 0.00 N ATOM 2161 CA LYS B 42 19.350 -2.523 2.960 1.00 0.00 C ATOM 2162 C LYS B 42 20.536 -3.209 3.631 1.00 0.00 C ATOM 2163 O LYS B 42 20.942 -2.834 4.731 1.00 0.00 O ATOM 2164 CB LYS B 42 19.676 -2.250 1.490 1.00 0.00 C ATOM 2165 CG LYS B 42 20.861 -1.319 1.298 1.00 0.00 C ATOM 2166 CD LYS B 42 21.137 -1.059 -0.174 1.00 0.00 C ATOM 2167 CE LYS B 42 22.263 -0.056 -0.361 1.00 0.00 C ATOM 2168 NZ LYS B 42 23.536 -0.525 0.254 1.00 0.00 N ATOM 0 H LYS B 42 19.640 -1.049 4.420 1.00 0.00 H new ATOM 0 HA LYS B 42 18.485 -3.183 3.020 1.00 0.00 H new ATOM 0 HB2 LYS B 42 19.882 -3.196 0.989 1.00 0.00 H new ATOM 0 HB3 LYS B 42 18.801 -1.817 1.006 1.00 0.00 H new ATOM 0 HG2 LYS B 42 20.667 -0.374 1.805 1.00 0.00 H new ATOM 0 HG3 LYS B 42 21.745 -1.755 1.763 1.00 0.00 H new ATOM 0 HD2 LYS B 42 21.397 -1.996 -0.667 1.00 0.00 H new ATOM 0 HD3 LYS B 42 20.233 -0.686 -0.654 1.00 0.00 H new ATOM 0 HE2 LYS B 42 22.418 0.121 -1.425 1.00 0.00 H new ATOM 0 HE3 LYS B 42 21.976 0.898 0.082 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 24.314 0.100 -0.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 23.448 -0.507 1.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 23.736 -1.496 -0.060 1.00 0.00 H new ATOM 2182 N CYS B 43 21.087 -4.215 2.959 1.00 0.00 N ATOM 2183 CA CYS B 43 22.229 -4.953 3.486 1.00 0.00 C ATOM 2184 C CYS B 43 23.502 -4.119 3.400 1.00 0.00 C ATOM 2185 O CYS B 43 24.161 -4.153 2.339 1.00 0.00 O ATOM 2186 CB CYS B 43 22.410 -6.266 2.722 1.00 0.00 C ATOM 2187 SG CYS B 43 23.781 -7.283 3.316 1.00 0.00 S ATOM 2188 OXT CYS B 43 23.831 -3.436 4.394 1.00 0.00 O ATOM 0 H CYS B 43 20.761 -4.538 2.048 1.00 0.00 H new ATOM 0 HA CYS B 43 22.034 -5.176 4.535 1.00 0.00 H new ATOM 0 HB2 CYS B 43 21.488 -6.843 2.790 1.00 0.00 H new ATOM 0 HB3 CYS B 43 22.569 -6.041 1.667 1.00 0.00 H new ATOM 0 HG CYS B 43 23.852 -8.372 2.609 1.00 0.00 H new TER 2194 CYS B 43