USER MOD reduce.3.24.130724 H: found=0, std=0, add=1408, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1410 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 THR OG1 : rot 87:sc= 1.26 USER MOD Set 1.2: B 74 MET CE :methyl -154:sc= -0.24 (180deg=-1.17) USER MOD Set 2.1: A 74 MET CE :methyl -156:sc= -0.226 (180deg=-1.15!) USER MOD Set 2.2: B 81 THR OG1 : rot 91:sc= 1.17 USER MOD Single : A 1 SER N :NH3+ 139:sc= -0.153 (180deg=-1.41!) USER MOD Single : A 1 SER OG : rot -156:sc= 0.998 USER MOD Single : A 5 LYS NZ :NH3+ 161:sc= -0.0502 (180deg=-0.504) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= -1.96 X(o=-2,f=-1.5!) USER MOD Single : A 17 TYR OH : rot 175:sc= 0.504 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.864 K(o=-0.86,f=-1.5) USER MOD Single : A 26 LYS NZ :NH3+ -176:sc=-0.00465 (180deg=-0.0144) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.094) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0927 USER MOD Single : A 33 LYS NZ :NH3+ -132:sc= -1.82 (180deg=-4.59!) USER MOD Single : A 37 ASN : amide:sc= -1.74! C(o=-1.7!,f=-4.9!) USER MOD Single : A 38 ASN : amide:sc= -0.0227 K(o=-0.023,f=-1.8!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc=-0.00976 X(o=-0.0098,f=-0.039) USER MOD Single : A 48 LYS NZ :NH3+ -158:sc= -0.0896 (180deg=-0.633) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -173:sc= -0.447 (180deg=-0.646) USER MOD Single : A 59 THR OG1 : rot 81:sc= 0.503 USER MOD Single : A 68 CYS SG : rot 175:sc= -3.13 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 78 SER OG : rot 180:sc= -0.371 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot -37:sc= -0.0749 USER MOD Single : A 84 CYS SG : rot 81:sc= 1.01 USER MOD Single : A 85 HIS : no HD1:sc= 0.00918 X(o=0.0092,f=-0.35) USER MOD Single : A 90 HIS : no HD1:sc= -0.0205 X(o=-0.02,f=-0.37) USER MOD Single : B 1 SER N :NH3+ 138:sc= -0.255 (180deg=-1.54!) USER MOD Single : B 1 SER OG : rot -170:sc= 1.08 USER MOD Single : B 5 LYS NZ :NH3+ 160:sc= -0.064 (180deg=-0.535) USER MOD Single : B 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN : amide:sc= -1.92 X(o=-1.9,f=-1.4!) USER MOD Single : B 17 TYR OH : rot -14:sc= 0.525 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -0.882 K(o=-0.88,f=-1.5) USER MOD Single : B 26 LYS NZ :NH3+ -176:sc=-0.00464 (180deg=-0.019) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0591) USER MOD Single : B 30 SER OG : rot 180:sc= -0.0875 USER MOD Single : B 33 LYS NZ :NH3+ -130:sc= -1.69 (180deg=-4.51!) USER MOD Single : B 37 ASN : amide:sc= -1.7! C(o=-1.7!,f=-4.9!) USER MOD Single : B 38 ASN : amide:sc= -0.0175 K(o=-0.017,f=-1.8!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc=-0.00736 X(o=-0.0074,f=-0.022) USER MOD Single : B 48 LYS NZ :NH3+ -156:sc= -0.126 (180deg=-0.742) USER MOD Single : B 50 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl -174:sc= -0.487 (180deg=-0.674) USER MOD Single : B 59 THR OG1 : rot 82:sc= 0.491 USER MOD Single : B 68 CYS SG : rot 170:sc= -3.05 USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 78 SER OG : rot 90:sc= -0.309 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 THR OG1 : rot -30:sc= -0.0588 USER MOD Single : B 84 CYS SG : rot 76:sc= 1.02 USER MOD Single : B 85 HIS : no HD1:sc= 0.00787 X(o=0.0079,f=-0.35) USER MOD Single : B 90 HIS : no HD1:sc= -0.0576 X(o=-0.058,f=-0.53) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 67.154 13.059 -9.498 1.00 0.00 N ATOM 2 CA SER A 1 67.837 12.130 -10.442 1.00 0.00 C ATOM 3 C SER A 1 67.309 10.710 -10.234 1.00 0.00 C ATOM 4 O SER A 1 66.629 10.428 -9.268 1.00 0.00 O ATOM 5 CB SER A 1 69.343 12.156 -10.174 1.00 0.00 C ATOM 6 OG SER A 1 69.636 11.325 -9.059 1.00 0.00 O ATOM 0 H1 SER A 1 67.846 13.734 -9.114 1.00 0.00 H new ATOM 0 H2 SER A 1 66.407 13.578 -10.002 1.00 0.00 H new ATOM 0 H3 SER A 1 66.732 12.514 -8.719 1.00 0.00 H new ATOM 0 HA SER A 1 67.641 12.443 -11.468 1.00 0.00 H new ATOM 0 HB2 SER A 1 69.886 11.810 -11.053 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.672 13.177 -9.978 1.00 0.00 H new ATOM 0 HG SER A 1 70.481 11.609 -8.653 1.00 0.00 H new ATOM 14 N GLU A 2 67.602 9.816 -11.139 1.00 0.00 N ATOM 15 CA GLU A 2 67.106 8.419 -11.001 1.00 0.00 C ATOM 16 C GLU A 2 67.633 7.797 -9.707 1.00 0.00 C ATOM 17 O GLU A 2 66.948 7.026 -9.062 1.00 0.00 O ATOM 18 CB GLU A 2 67.585 7.593 -12.198 1.00 0.00 C ATOM 19 CG GLU A 2 66.848 8.046 -13.461 1.00 0.00 C ATOM 20 CD GLU A 2 67.328 7.221 -14.655 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.304 6.503 -14.500 1.00 0.00 O ATOM 22 OE2 GLU A 2 66.715 7.320 -15.706 1.00 0.00 O ATOM 0 H GLU A 2 68.165 9.995 -11.970 1.00 0.00 H new ATOM 0 HA GLU A 2 66.016 8.428 -10.970 1.00 0.00 H new ATOM 0 HB2 GLU A 2 68.660 7.713 -12.329 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.402 6.534 -12.018 1.00 0.00 H new ATOM 0 HG2 GLU A 2 65.773 7.925 -13.331 1.00 0.00 H new ATOM 0 HG3 GLU A 2 67.030 9.106 -13.641 1.00 0.00 H new ATOM 29 N LEU A 3 68.833 8.118 -9.309 1.00 0.00 N ATOM 30 CA LEU A 3 69.377 7.539 -8.048 1.00 0.00 C ATOM 31 C LEU A 3 68.580 8.062 -6.851 1.00 0.00 C ATOM 32 O LEU A 3 68.409 7.378 -5.862 1.00 0.00 O ATOM 33 CB LEU A 3 70.837 7.966 -7.868 1.00 0.00 C ATOM 34 CG LEU A 3 71.738 7.293 -8.909 1.00 0.00 C ATOM 35 CD1 LEU A 3 73.143 7.894 -8.798 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.803 5.771 -8.667 1.00 0.00 C ATOM 0 H LEU A 3 69.460 8.755 -9.801 1.00 0.00 H new ATOM 0 HA LEU A 3 69.305 6.453 -8.106 1.00 0.00 H new ATOM 0 HB2 LEU A 3 70.917 9.049 -7.959 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.175 7.704 -6.865 1.00 0.00 H new ATOM 0 HG LEU A 3 71.331 7.463 -9.906 1.00 0.00 H new ATOM 0 HD11 LEU A 3 73.798 7.426 -9.533 1.00 0.00 H new ATOM 0 HD12 LEU A 3 73.096 8.967 -8.985 1.00 0.00 H new ATOM 0 HD13 LEU A 3 73.536 7.718 -7.797 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.447 5.311 -9.416 1.00 0.00 H new ATOM 0 HD22 LEU A 3 72.206 5.578 -7.673 1.00 0.00 H new ATOM 0 HD23 LEU A 3 70.801 5.348 -8.741 1.00 0.00 H new ATOM 48 N GLU A 4 68.107 9.279 -6.922 1.00 0.00 N ATOM 49 CA GLU A 4 67.341 9.846 -5.777 1.00 0.00 C ATOM 50 C GLU A 4 66.064 9.038 -5.555 1.00 0.00 C ATOM 51 O GLU A 4 65.685 8.749 -4.437 1.00 0.00 O ATOM 52 CB GLU A 4 66.976 11.298 -6.094 1.00 0.00 C ATOM 53 CG GLU A 4 68.247 12.150 -6.096 1.00 0.00 C ATOM 54 CD GLU A 4 67.895 13.591 -6.467 1.00 0.00 C ATOM 55 OE1 GLU A 4 66.731 13.845 -6.734 1.00 0.00 O ATOM 56 OE2 GLU A 4 68.795 14.414 -6.482 1.00 0.00 O ATOM 0 H GLU A 4 68.219 9.902 -7.722 1.00 0.00 H new ATOM 0 HA GLU A 4 67.950 9.803 -4.874 1.00 0.00 H new ATOM 0 HB2 GLU A 4 66.483 11.358 -7.064 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.271 11.678 -5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 4 68.718 12.121 -5.114 1.00 0.00 H new ATOM 0 HG3 GLU A 4 68.967 11.746 -6.807 1.00 0.00 H new ATOM 63 N LYS A 5 65.394 8.676 -6.611 1.00 0.00 N ATOM 64 CA LYS A 5 64.135 7.891 -6.478 1.00 0.00 C ATOM 65 C LYS A 5 64.417 6.567 -5.770 1.00 0.00 C ATOM 66 O LYS A 5 63.642 6.110 -4.953 1.00 0.00 O ATOM 67 CB LYS A 5 63.570 7.629 -7.876 1.00 0.00 C ATOM 68 CG LYS A 5 62.222 6.914 -7.772 1.00 0.00 C ATOM 69 CD LYS A 5 61.680 6.664 -9.180 1.00 0.00 C ATOM 70 CE LYS A 5 60.323 5.963 -9.094 1.00 0.00 C ATOM 71 NZ LYS A 5 59.342 6.858 -8.415 1.00 0.00 N ATOM 0 H LYS A 5 65.666 8.892 -7.570 1.00 0.00 H new ATOM 0 HA LYS A 5 63.411 8.451 -5.887 1.00 0.00 H new ATOM 0 HB2 LYS A 5 63.450 8.571 -8.411 1.00 0.00 H new ATOM 0 HB3 LYS A 5 64.269 7.022 -8.451 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.337 5.970 -7.240 1.00 0.00 H new ATOM 0 HG3 LYS A 5 61.518 7.519 -7.200 1.00 0.00 H new ATOM 0 HD2 LYS A 5 61.579 7.609 -9.714 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.381 6.051 -9.746 1.00 0.00 H new ATOM 0 HE2 LYS A 5 59.969 5.710 -10.093 1.00 0.00 H new ATOM 0 HE3 LYS A 5 60.419 5.027 -8.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 58.375 6.543 -8.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 59.494 6.823 -7.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 59.472 7.834 -8.751 1.00 0.00 H new ATOM 85 N ALA A 6 65.515 5.943 -6.081 1.00 0.00 N ATOM 86 CA ALA A 6 65.838 4.645 -5.431 1.00 0.00 C ATOM 87 C ALA A 6 65.939 4.842 -3.915 1.00 0.00 C ATOM 88 O ALA A 6 65.374 4.091 -3.148 1.00 0.00 O ATOM 89 CB ALA A 6 67.173 4.126 -5.966 1.00 0.00 C ATOM 0 H ALA A 6 66.203 6.275 -6.757 1.00 0.00 H new ATOM 0 HA ALA A 6 65.051 3.924 -5.652 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.411 3.175 -5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.103 3.985 -7.044 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.959 4.848 -5.745 1.00 0.00 H new ATOM 95 N MET A 7 66.648 5.845 -3.475 1.00 0.00 N ATOM 96 CA MET A 7 66.771 6.079 -2.007 1.00 0.00 C ATOM 97 C MET A 7 65.380 6.312 -1.414 1.00 0.00 C ATOM 98 O MET A 7 65.026 5.770 -0.386 1.00 0.00 O ATOM 99 CB MET A 7 67.626 7.325 -1.769 1.00 0.00 C ATOM 100 CG MET A 7 69.080 7.043 -2.146 1.00 0.00 C ATOM 101 SD MET A 7 70.060 8.545 -1.899 1.00 0.00 S ATOM 102 CE MET A 7 71.617 7.915 -2.569 1.00 0.00 C ATOM 0 H MET A 7 67.146 6.511 -4.066 1.00 0.00 H new ATOM 0 HA MET A 7 67.234 5.212 -1.535 1.00 0.00 H new ATOM 0 HB2 MET A 7 67.243 8.157 -2.361 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.565 7.623 -0.722 1.00 0.00 H new ATOM 0 HG2 MET A 7 69.476 6.231 -1.535 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.143 6.720 -3.185 1.00 0.00 H new ATOM 0 HE1 MET A 7 72.378 8.693 -2.514 1.00 0.00 H new ATOM 0 HE2 MET A 7 71.939 7.050 -1.989 1.00 0.00 H new ATOM 0 HE3 MET A 7 71.473 7.621 -3.609 1.00 0.00 H new ATOM 112 N VAL A 8 64.609 7.154 -2.043 1.00 0.00 N ATOM 113 CA VAL A 8 63.253 7.485 -1.518 1.00 0.00 C ATOM 114 C VAL A 8 62.376 6.228 -1.430 1.00 0.00 C ATOM 115 O VAL A 8 61.619 6.066 -0.493 1.00 0.00 O ATOM 116 CB VAL A 8 62.597 8.499 -2.466 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.127 8.708 -2.087 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.341 9.833 -2.372 1.00 0.00 C ATOM 0 H VAL A 8 64.862 7.632 -2.907 1.00 0.00 H new ATOM 0 HA VAL A 8 63.351 7.903 -0.516 1.00 0.00 H new ATOM 0 HB VAL A 8 62.647 8.116 -3.485 1.00 0.00 H new ATOM 0 HG11 VAL A 8 60.675 9.429 -2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 8 60.595 7.759 -2.158 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.064 9.084 -1.066 1.00 0.00 H new ATOM 0 HG21 VAL A 8 62.878 10.556 -3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.292 10.206 -1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.383 9.689 -2.656 1.00 0.00 H new ATOM 128 N ALA A 9 62.441 5.349 -2.392 1.00 0.00 N ATOM 129 CA ALA A 9 61.575 4.135 -2.336 1.00 0.00 C ATOM 130 C ALA A 9 61.879 3.317 -1.078 1.00 0.00 C ATOM 131 O ALA A 9 60.983 2.869 -0.390 1.00 0.00 O ATOM 132 CB ALA A 9 61.821 3.276 -3.577 1.00 0.00 C ATOM 0 H ALA A 9 63.050 5.416 -3.208 1.00 0.00 H new ATOM 0 HA ALA A 9 60.532 4.449 -2.306 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.189 2.389 -3.537 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.582 3.852 -4.471 1.00 0.00 H new ATOM 0 HB3 ALA A 9 62.868 2.974 -3.609 1.00 0.00 H new ATOM 138 N LEU A 10 63.126 3.108 -0.770 1.00 0.00 N ATOM 139 CA LEU A 10 63.462 2.306 0.444 1.00 0.00 C ATOM 140 C LEU A 10 62.878 2.988 1.687 1.00 0.00 C ATOM 141 O LEU A 10 62.236 2.357 2.502 1.00 0.00 O ATOM 142 CB LEU A 10 64.993 2.189 0.584 1.00 0.00 C ATOM 143 CG LEU A 10 65.544 1.030 -0.274 1.00 0.00 C ATOM 144 CD1 LEU A 10 65.225 -0.328 0.373 1.00 0.00 C ATOM 145 CD2 LEU A 10 64.942 1.081 -1.684 1.00 0.00 C ATOM 0 H LEU A 10 63.926 3.454 -1.301 1.00 0.00 H new ATOM 0 HA LEU A 10 63.035 1.308 0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.461 3.125 0.280 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.254 2.027 1.630 1.00 0.00 H new ATOM 0 HG LEU A 10 66.626 1.142 -0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 10 65.623 -1.130 -0.249 1.00 0.00 H new ATOM 0 HD12 LEU A 10 65.681 -0.376 1.362 1.00 0.00 H new ATOM 0 HD13 LEU A 10 64.145 -0.442 0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.339 0.258 -2.279 1.00 0.00 H new ATOM 0 HD22 LEU A 10 63.857 0.993 -1.620 1.00 0.00 H new ATOM 0 HD23 LEU A 10 65.201 2.028 -2.156 1.00 0.00 H new ATOM 157 N ILE A 11 63.100 4.263 1.850 1.00 0.00 N ATOM 158 CA ILE A 11 62.559 4.957 3.053 1.00 0.00 C ATOM 159 C ILE A 11 61.032 4.840 3.074 1.00 0.00 C ATOM 160 O ILE A 11 60.441 4.448 4.061 1.00 0.00 O ATOM 161 CB ILE A 11 62.947 6.436 2.991 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.471 6.571 3.061 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.317 7.183 4.166 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.871 8.005 2.704 1.00 0.00 C ATOM 0 H ILE A 11 63.629 4.852 1.207 1.00 0.00 H new ATOM 0 HA ILE A 11 62.970 4.499 3.953 1.00 0.00 H new ATOM 0 HB ILE A 11 62.587 6.862 2.055 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.824 6.322 4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.941 5.868 2.373 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.595 8.236 4.119 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.232 7.092 4.116 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.674 6.755 5.103 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.955 8.103 2.753 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.531 8.237 1.695 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.412 8.697 3.410 1.00 0.00 H new ATOM 176 N ASP A 12 60.389 5.197 1.997 1.00 0.00 N ATOM 177 CA ASP A 12 58.900 5.128 1.958 1.00 0.00 C ATOM 178 C ASP A 12 58.440 3.687 2.195 1.00 0.00 C ATOM 179 O ASP A 12 57.503 3.436 2.925 1.00 0.00 O ATOM 180 CB ASP A 12 58.406 5.599 0.588 1.00 0.00 C ATOM 181 CG ASP A 12 56.877 5.599 0.568 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.291 5.070 1.497 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.317 6.132 -0.376 1.00 0.00 O ATOM 0 H ASP A 12 60.830 5.534 1.141 1.00 0.00 H new ATOM 0 HA ASP A 12 58.490 5.769 2.738 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.783 6.600 0.378 1.00 0.00 H new ATOM 0 HB3 ASP A 12 58.790 4.944 -0.194 1.00 0.00 H new ATOM 188 N VAL A 13 59.093 2.739 1.586 1.00 0.00 N ATOM 189 CA VAL A 13 58.688 1.319 1.782 1.00 0.00 C ATOM 190 C VAL A 13 58.985 0.894 3.226 1.00 0.00 C ATOM 191 O VAL A 13 58.194 0.224 3.859 1.00 0.00 O ATOM 192 CB VAL A 13 59.460 0.429 0.802 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.242 -1.044 1.157 1.00 0.00 C ATOM 194 CG2 VAL A 13 58.954 0.684 -0.622 1.00 0.00 C ATOM 0 H VAL A 13 59.887 2.884 0.963 1.00 0.00 H new ATOM 0 HA VAL A 13 57.619 1.214 1.594 1.00 0.00 H new ATOM 0 HB VAL A 13 60.523 0.663 0.865 1.00 0.00 H new ATOM 0 HG11 VAL A 13 59.793 -1.672 0.457 1.00 0.00 H new ATOM 0 HG12 VAL A 13 59.598 -1.231 2.170 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.179 -1.279 1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.502 0.052 -1.321 1.00 0.00 H new ATOM 0 HG22 VAL A 13 57.891 0.450 -0.678 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.109 1.731 -0.881 1.00 0.00 H new ATOM 204 N PHE A 14 60.117 1.279 3.752 1.00 0.00 N ATOM 205 CA PHE A 14 60.458 0.891 5.153 1.00 0.00 C ATOM 206 C PHE A 14 59.405 1.443 6.122 1.00 0.00 C ATOM 207 O PHE A 14 58.871 0.726 6.944 1.00 0.00 O ATOM 208 CB PHE A 14 61.825 1.483 5.507 1.00 0.00 C ATOM 209 CG PHE A 14 62.176 1.177 6.947 1.00 0.00 C ATOM 210 CD1 PHE A 14 61.795 2.066 7.960 1.00 0.00 C ATOM 211 CD2 PHE A 14 62.896 0.019 7.267 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.133 1.797 9.293 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.232 -0.250 8.602 1.00 0.00 C ATOM 214 CZ PHE A 14 62.850 0.639 9.613 1.00 0.00 C ATOM 0 H PHE A 14 60.819 1.844 3.274 1.00 0.00 H new ATOM 0 HA PHE A 14 60.482 -0.196 5.234 1.00 0.00 H new ATOM 0 HB2 PHE A 14 62.588 1.073 4.845 1.00 0.00 H new ATOM 0 HB3 PHE A 14 61.813 2.562 5.350 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.240 2.959 7.714 1.00 0.00 H new ATOM 0 HD2 PHE A 14 63.192 -0.666 6.487 1.00 0.00 H new ATOM 0 HE1 PHE A 14 61.840 2.484 10.073 1.00 0.00 H new ATOM 0 HE2 PHE A 14 63.786 -1.144 8.850 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.109 0.431 10.641 1.00 0.00 H new ATOM 224 N HIS A 15 59.151 2.723 6.071 1.00 0.00 N ATOM 225 CA HIS A 15 58.192 3.345 7.027 1.00 0.00 C ATOM 226 C HIS A 15 56.794 2.739 6.914 1.00 0.00 C ATOM 227 O HIS A 15 56.161 2.468 7.915 1.00 0.00 O ATOM 228 CB HIS A 15 58.114 4.843 6.725 1.00 0.00 C ATOM 229 CG HIS A 15 57.135 5.500 7.655 1.00 0.00 C ATOM 230 ND1 HIS A 15 57.395 5.676 9.006 1.00 0.00 N ATOM 231 CD2 HIS A 15 55.885 6.030 7.441 1.00 0.00 C ATOM 232 CE1 HIS A 15 56.325 6.288 9.548 1.00 0.00 C ATOM 233 NE2 HIS A 15 55.381 6.524 8.636 1.00 0.00 N ATOM 0 H HIS A 15 59.571 3.369 5.402 1.00 0.00 H new ATOM 0 HA HIS A 15 58.550 3.162 8.040 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.098 5.298 6.838 1.00 0.00 H new ATOM 0 HB3 HIS A 15 57.808 4.999 5.691 1.00 0.00 H new ATOM 0 HD2 HIS A 15 55.374 6.058 6.490 1.00 0.00 H new ATOM 0 HE1 HIS A 15 56.242 6.555 10.591 1.00 0.00 H new ATOM 0 HE2 HIS A 15 54.478 6.973 8.785 1.00 0.00 H new ATOM 242 N GLN A 16 56.285 2.520 5.735 1.00 0.00 N ATOM 243 CA GLN A 16 54.917 1.931 5.646 1.00 0.00 C ATOM 244 C GLN A 16 54.956 0.476 6.114 1.00 0.00 C ATOM 245 O GLN A 16 54.073 0.010 6.805 1.00 0.00 O ATOM 246 CB GLN A 16 54.419 1.998 4.201 1.00 0.00 C ATOM 247 CG GLN A 16 54.136 3.455 3.827 1.00 0.00 C ATOM 248 CD GLN A 16 53.658 3.528 2.375 1.00 0.00 C ATOM 249 OE1 GLN A 16 53.881 4.513 1.699 1.00 0.00 O ATOM 250 NE2 GLN A 16 53.006 2.520 1.865 1.00 0.00 N ATOM 0 H GLN A 16 56.743 2.717 4.845 1.00 0.00 H new ATOM 0 HA GLN A 16 54.237 2.496 6.284 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.166 1.577 3.528 1.00 0.00 H new ATOM 0 HB3 GLN A 16 53.515 1.400 4.088 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.379 3.871 4.491 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.037 4.055 3.955 1.00 0.00 H new ATOM 0 HE21 GLN A 16 52.819 1.694 2.433 1.00 0.00 H new ATOM 0 HE22 GLN A 16 52.683 2.558 0.898 1.00 0.00 H new ATOM 259 N TYR A 17 55.984 -0.236 5.751 1.00 0.00 N ATOM 260 CA TYR A 17 56.099 -1.658 6.181 1.00 0.00 C ATOM 261 C TYR A 17 56.351 -1.708 7.690 1.00 0.00 C ATOM 262 O TYR A 17 55.736 -2.466 8.414 1.00 0.00 O ATOM 263 CB TYR A 17 57.263 -2.316 5.436 1.00 0.00 C ATOM 264 CG TYR A 17 57.395 -3.760 5.861 1.00 0.00 C ATOM 265 CD1 TYR A 17 56.697 -4.757 5.169 1.00 0.00 C ATOM 266 CD2 TYR A 17 58.215 -4.102 6.943 1.00 0.00 C ATOM 267 CE1 TYR A 17 56.818 -6.095 5.559 1.00 0.00 C ATOM 268 CE2 TYR A 17 58.337 -5.442 7.332 1.00 0.00 C ATOM 269 CZ TYR A 17 57.639 -6.439 6.640 1.00 0.00 C ATOM 270 OH TYR A 17 57.759 -7.760 7.022 1.00 0.00 O ATOM 0 H TYR A 17 56.752 0.105 5.173 1.00 0.00 H new ATOM 0 HA TYR A 17 55.177 -2.193 5.952 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.097 -2.258 4.360 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.189 -1.780 5.645 1.00 0.00 H new ATOM 0 HD1 TYR A 17 56.065 -4.493 4.334 1.00 0.00 H new ATOM 0 HD2 TYR A 17 58.753 -3.333 7.477 1.00 0.00 H new ATOM 0 HE1 TYR A 17 56.278 -6.863 5.026 1.00 0.00 H new ATOM 0 HE2 TYR A 17 58.970 -5.706 8.166 1.00 0.00 H new ATOM 0 HH TYR A 17 58.427 -7.835 7.735 1.00 0.00 H new ATOM 280 N SER A 18 57.256 -0.898 8.162 1.00 0.00 N ATOM 281 CA SER A 18 57.573 -0.873 9.619 1.00 0.00 C ATOM 282 C SER A 18 56.475 -0.134 10.385 1.00 0.00 C ATOM 283 O SER A 18 56.360 -0.254 11.590 1.00 0.00 O ATOM 284 CB SER A 18 58.905 -0.154 9.835 1.00 0.00 C ATOM 285 OG SER A 18 59.188 -0.099 11.228 1.00 0.00 O ATOM 0 H SER A 18 57.796 -0.244 7.595 1.00 0.00 H new ATOM 0 HA SER A 18 57.638 -1.898 9.985 1.00 0.00 H new ATOM 0 HB2 SER A 18 59.704 -0.678 9.310 1.00 0.00 H new ATOM 0 HB3 SER A 18 58.859 0.853 9.421 1.00 0.00 H new ATOM 291 N GLY A 19 55.675 0.645 9.703 1.00 0.00 N ATOM 292 CA GLY A 19 54.593 1.408 10.395 1.00 0.00 C ATOM 293 C GLY A 19 53.313 0.572 10.477 1.00 0.00 C ATOM 294 O GLY A 19 52.258 1.080 10.801 1.00 0.00 O ATOM 0 H GLY A 19 55.725 0.786 8.694 1.00 0.00 H new ATOM 0 HA2 GLY A 19 54.919 1.683 11.398 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.394 2.336 9.858 1.00 0.00 H new ATOM 298 N ARG A 20 53.390 -0.704 10.219 1.00 0.00 N ATOM 299 CA ARG A 20 52.165 -1.548 10.327 1.00 0.00 C ATOM 300 C ARG A 20 51.820 -1.716 11.809 1.00 0.00 C ATOM 301 O ARG A 20 50.671 -1.688 12.203 1.00 0.00 O ATOM 302 CB ARG A 20 52.411 -2.921 9.701 1.00 0.00 C ATOM 303 CG ARG A 20 52.526 -2.784 8.182 1.00 0.00 C ATOM 304 CD ARG A 20 52.771 -4.166 7.571 1.00 0.00 C ATOM 305 NE ARG A 20 54.024 -4.742 8.133 1.00 0.00 N ATOM 306 CZ ARG A 20 54.419 -5.928 7.759 1.00 0.00 C ATOM 307 NH1 ARG A 20 53.737 -6.588 6.864 1.00 0.00 N ATOM 308 NH2 ARG A 20 55.496 -6.452 8.277 1.00 0.00 N ATOM 0 H ARG A 20 54.239 -1.196 9.941 1.00 0.00 H new ATOM 0 HA ARG A 20 51.342 -1.067 9.798 1.00 0.00 H new ATOM 0 HB2 ARG A 20 53.324 -3.357 10.106 1.00 0.00 H new ATOM 0 HB3 ARG A 20 51.595 -3.598 9.954 1.00 0.00 H new ATOM 0 HG2 ARG A 20 51.614 -2.349 7.774 1.00 0.00 H new ATOM 0 HG3 ARG A 20 53.343 -2.110 7.926 1.00 0.00 H new ATOM 0 HD2 ARG A 20 51.928 -4.824 7.783 1.00 0.00 H new ATOM 0 HD3 ARG A 20 52.849 -4.087 6.487 1.00 0.00 H new ATOM 0 HE ARG A 20 54.572 -4.210 8.809 1.00 0.00 H new ATOM 0 HH11 ARG A 20 52.897 -6.177 6.458 1.00 0.00 H new ATOM 0 HH12 ARG A 20 54.044 -7.515 6.570 1.00 0.00 H new ATOM 0 HH21 ARG A 20 56.030 -5.934 8.975 1.00 0.00 H new ATOM 0 HH22 ARG A 20 55.804 -7.379 7.984 1.00 0.00 H new ATOM 322 N GLU A 21 52.830 -1.889 12.627 1.00 0.00 N ATOM 323 CA GLU A 21 52.622 -2.061 14.098 1.00 0.00 C ATOM 324 C GLU A 21 53.109 -0.804 14.821 1.00 0.00 C ATOM 325 O GLU A 21 53.858 -0.017 14.279 1.00 0.00 O ATOM 326 CB GLU A 21 53.421 -3.269 14.598 1.00 0.00 C ATOM 327 CG GLU A 21 52.798 -4.562 14.070 1.00 0.00 C ATOM 328 CD GLU A 21 53.068 -4.679 12.570 1.00 0.00 C ATOM 329 OE1 GLU A 21 54.088 -4.174 12.133 1.00 0.00 O ATOM 330 OE2 GLU A 21 52.251 -5.273 11.885 1.00 0.00 O ATOM 0 H GLU A 21 53.806 -1.919 12.331 1.00 0.00 H new ATOM 0 HA GLU A 21 51.563 -2.222 14.298 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.457 -3.193 14.267 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.435 -3.281 15.688 1.00 0.00 H new ATOM 0 HG2 GLU A 21 53.217 -5.421 14.594 1.00 0.00 H new ATOM 0 HG3 GLU A 21 51.725 -4.565 14.259 1.00 0.00 H new ATOM 337 N GLY A 22 52.685 -0.606 16.039 1.00 0.00 N ATOM 338 CA GLY A 22 53.120 0.603 16.800 1.00 0.00 C ATOM 339 C GLY A 22 54.631 0.549 17.067 1.00 0.00 C ATOM 340 O GLY A 22 55.095 0.955 18.115 1.00 0.00 O ATOM 0 H GLY A 22 52.055 -1.230 16.542 1.00 0.00 H new ATOM 0 HA2 GLY A 22 52.875 1.503 16.236 1.00 0.00 H new ATOM 0 HA3 GLY A 22 52.579 0.661 17.744 1.00 0.00 H new ATOM 344 N ASP A 23 55.400 0.054 16.126 1.00 0.00 N ATOM 345 CA ASP A 23 56.885 -0.030 16.302 1.00 0.00 C ATOM 346 C ASP A 23 57.565 0.671 15.119 1.00 0.00 C ATOM 347 O ASP A 23 57.801 0.080 14.085 1.00 0.00 O ATOM 348 CB ASP A 23 57.292 -1.505 16.333 1.00 0.00 C ATOM 349 CG ASP A 23 56.881 -2.175 15.020 1.00 0.00 C ATOM 350 OD1 ASP A 23 56.122 -1.569 14.282 1.00 0.00 O ATOM 351 OD2 ASP A 23 57.334 -3.280 14.774 1.00 0.00 O ATOM 0 H ASP A 23 55.057 -0.300 15.233 1.00 0.00 H new ATOM 0 HA ASP A 23 57.187 0.452 17.232 1.00 0.00 H new ATOM 0 HB2 ASP A 23 58.369 -1.593 16.477 1.00 0.00 H new ATOM 0 HB3 ASP A 23 56.815 -2.007 17.175 1.00 0.00 H new ATOM 356 N LYS A 24 57.862 1.939 15.258 1.00 0.00 N ATOM 357 CA LYS A 24 58.501 2.699 14.136 1.00 0.00 C ATOM 358 C LYS A 24 60.014 2.836 14.348 1.00 0.00 C ATOM 359 O LYS A 24 60.456 3.357 15.349 1.00 0.00 O ATOM 360 CB LYS A 24 57.882 4.095 14.074 1.00 0.00 C ATOM 361 CG LYS A 24 56.423 3.984 13.628 1.00 0.00 C ATOM 362 CD LYS A 24 55.798 5.380 13.564 1.00 0.00 C ATOM 363 CE LYS A 24 54.339 5.267 13.118 1.00 0.00 C ATOM 364 NZ LYS A 24 53.703 6.614 13.151 1.00 0.00 N ATOM 0 H LYS A 24 57.689 2.484 16.103 1.00 0.00 H new ATOM 0 HA LYS A 24 58.331 2.155 13.207 1.00 0.00 H new ATOM 0 HB2 LYS A 24 57.940 4.574 15.051 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.440 4.722 13.378 1.00 0.00 H new ATOM 0 HG2 LYS A 24 56.366 3.504 12.651 1.00 0.00 H new ATOM 0 HG3 LYS A 24 55.866 3.357 14.324 1.00 0.00 H new ATOM 0 HD2 LYS A 24 55.854 5.860 14.541 1.00 0.00 H new ATOM 0 HD3 LYS A 24 56.354 6.007 12.868 1.00 0.00 H new ATOM 0 HE2 LYS A 24 54.287 4.853 12.111 1.00 0.00 H new ATOM 0 HE3 LYS A 24 53.800 4.582 13.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 52.711 6.537 12.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 53.741 6.992 14.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 54.213 7.254 12.509 1.00 0.00 H new ATOM 378 N HIS A 25 60.793 2.367 13.394 1.00 0.00 N ATOM 379 CA HIS A 25 62.290 2.441 13.461 1.00 0.00 C ATOM 380 C HIS A 25 62.866 1.219 14.184 1.00 0.00 C ATOM 381 O HIS A 25 63.928 1.279 14.770 1.00 0.00 O ATOM 382 CB HIS A 25 62.726 3.727 14.171 1.00 0.00 C ATOM 383 CG HIS A 25 64.118 4.112 13.739 1.00 0.00 C ATOM 384 ND1 HIS A 25 65.191 4.116 14.620 1.00 0.00 N ATOM 385 CD2 HIS A 25 64.630 4.496 12.523 1.00 0.00 C ATOM 386 CE1 HIS A 25 66.283 4.492 13.928 1.00 0.00 C ATOM 387 NE2 HIS A 25 65.993 4.734 12.648 1.00 0.00 N ATOM 0 H HIS A 25 60.438 1.923 12.547 1.00 0.00 H new ATOM 0 HA HIS A 25 62.676 2.450 12.442 1.00 0.00 H new ATOM 0 HB2 HIS A 25 62.029 4.533 13.940 1.00 0.00 H new ATOM 0 HB3 HIS A 25 62.699 3.582 15.251 1.00 0.00 H new ATOM 0 HD2 HIS A 25 64.061 4.597 11.611 1.00 0.00 H new ATOM 0 HE1 HIS A 25 67.270 4.586 14.355 1.00 0.00 H new ATOM 0 HE2 HIS A 25 66.637 5.031 11.915 1.00 0.00 H new ATOM 396 N LYS A 26 62.195 0.105 14.117 1.00 0.00 N ATOM 397 CA LYS A 26 62.728 -1.125 14.768 1.00 0.00 C ATOM 398 C LYS A 26 61.873 -2.325 14.348 1.00 0.00 C ATOM 399 O LYS A 26 60.667 -2.328 14.506 1.00 0.00 O ATOM 400 CB LYS A 26 62.719 -0.953 16.290 1.00 0.00 C ATOM 401 CG LYS A 26 61.323 -0.558 16.767 1.00 0.00 C ATOM 402 CD LYS A 26 61.395 -0.137 18.237 1.00 0.00 C ATOM 403 CE LYS A 26 59.985 0.123 18.769 1.00 0.00 C ATOM 404 NZ LYS A 26 59.489 1.429 18.247 1.00 0.00 N ATOM 0 H LYS A 26 61.301 -0.008 13.640 1.00 0.00 H new ATOM 0 HA LYS A 26 63.757 -1.297 14.452 1.00 0.00 H new ATOM 0 HB2 LYS A 26 63.026 -1.882 16.770 1.00 0.00 H new ATOM 0 HB3 LYS A 26 63.441 -0.190 16.581 1.00 0.00 H new ATOM 0 HG2 LYS A 26 60.936 0.261 16.160 1.00 0.00 H new ATOM 0 HG3 LYS A 26 60.635 -1.395 16.649 1.00 0.00 H new ATOM 0 HD2 LYS A 26 61.878 -0.917 18.825 1.00 0.00 H new ATOM 0 HD3 LYS A 26 62.004 0.761 18.338 1.00 0.00 H new ATOM 0 HE2 LYS A 26 59.315 -0.681 18.463 1.00 0.00 H new ATOM 0 HE3 LYS A 26 59.992 0.134 19.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 58.559 1.638 18.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 60.159 2.182 18.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 59.403 1.379 17.212 1.00 0.00 H new ATOM 418 N LEU A 27 62.495 -3.333 13.781 1.00 0.00 N ATOM 419 CA LEU A 27 61.738 -4.536 13.306 1.00 0.00 C ATOM 420 C LEU A 27 62.039 -5.751 14.188 1.00 0.00 C ATOM 421 O LEU A 27 63.150 -5.960 14.632 1.00 0.00 O ATOM 422 CB LEU A 27 62.150 -4.847 11.867 1.00 0.00 C ATOM 423 CG LEU A 27 61.829 -3.648 10.963 1.00 0.00 C ATOM 424 CD1 LEU A 27 62.413 -3.904 9.572 1.00 0.00 C ATOM 425 CD2 LEU A 27 60.303 -3.452 10.857 1.00 0.00 C ATOM 0 H LEU A 27 63.502 -3.374 13.626 1.00 0.00 H new ATOM 0 HA LEU A 27 60.670 -4.323 13.359 1.00 0.00 H new ATOM 0 HB2 LEU A 27 63.216 -5.071 11.825 1.00 0.00 H new ATOM 0 HB3 LEU A 27 61.624 -5.733 11.512 1.00 0.00 H new ATOM 0 HG LEU A 27 62.267 -2.746 11.390 1.00 0.00 H new ATOM 0 HD11 LEU A 27 62.190 -3.058 8.922 1.00 0.00 H new ATOM 0 HD12 LEU A 27 63.493 -4.028 9.648 1.00 0.00 H new ATOM 0 HD13 LEU A 27 61.972 -4.809 9.153 1.00 0.00 H new ATOM 0 HD21 LEU A 27 60.090 -2.599 10.213 1.00 0.00 H new ATOM 0 HD22 LEU A 27 59.850 -4.348 10.434 1.00 0.00 H new ATOM 0 HD23 LEU A 27 59.890 -3.270 11.849 1.00 0.00 H new ATOM 437 N LYS A 28 61.037 -6.555 14.424 1.00 0.00 N ATOM 438 CA LYS A 28 61.203 -7.785 15.259 1.00 0.00 C ATOM 439 C LYS A 28 61.409 -8.991 14.331 1.00 0.00 C ATOM 440 O LYS A 28 61.209 -8.898 13.136 1.00 0.00 O ATOM 441 CB LYS A 28 59.938 -7.978 16.100 1.00 0.00 C ATOM 442 CG LYS A 28 60.152 -9.100 17.120 1.00 0.00 C ATOM 443 CD LYS A 28 59.012 -9.101 18.148 1.00 0.00 C ATOM 444 CE LYS A 28 57.701 -9.535 17.484 1.00 0.00 C ATOM 445 NZ LYS A 28 56.664 -9.753 18.531 1.00 0.00 N ATOM 0 H LYS A 28 60.092 -6.410 14.068 1.00 0.00 H new ATOM 0 HA LYS A 28 62.066 -7.689 15.918 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.689 -7.050 16.615 1.00 0.00 H new ATOM 0 HB3 LYS A 28 59.095 -8.220 15.453 1.00 0.00 H new ATOM 0 HG2 LYS A 28 60.194 -10.063 16.610 1.00 0.00 H new ATOM 0 HG3 LYS A 28 61.108 -8.965 17.626 1.00 0.00 H new ATOM 0 HD2 LYS A 28 59.253 -9.776 18.969 1.00 0.00 H new ATOM 0 HD3 LYS A 28 58.899 -8.105 18.577 1.00 0.00 H new ATOM 0 HE2 LYS A 28 57.368 -8.773 16.780 1.00 0.00 H new ATOM 0 HE3 LYS A 28 57.855 -10.451 16.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 55.774 -10.048 18.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 56.983 -10.495 19.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 56.510 -8.869 19.057 1.00 0.00 H new ATOM 459 N LYS A 29 61.816 -10.118 14.856 1.00 0.00 N ATOM 460 CA LYS A 29 62.038 -11.304 13.973 1.00 0.00 C ATOM 461 C LYS A 29 60.740 -11.639 13.229 1.00 0.00 C ATOM 462 O LYS A 29 60.756 -11.975 12.062 1.00 0.00 O ATOM 463 CB LYS A 29 62.496 -12.507 14.816 1.00 0.00 C ATOM 464 CG LYS A 29 61.353 -13.004 15.709 1.00 0.00 C ATOM 465 CD LYS A 29 61.876 -14.106 16.634 1.00 0.00 C ATOM 466 CE LYS A 29 60.731 -14.629 17.504 1.00 0.00 C ATOM 467 NZ LYS A 29 60.401 -13.621 18.551 1.00 0.00 N ATOM 0 H LYS A 29 62.003 -10.269 15.847 1.00 0.00 H new ATOM 0 HA LYS A 29 62.816 -11.073 13.245 1.00 0.00 H new ATOM 0 HB2 LYS A 29 62.830 -13.312 14.161 1.00 0.00 H new ATOM 0 HB3 LYS A 29 63.349 -12.223 15.432 1.00 0.00 H new ATOM 0 HG2 LYS A 29 60.951 -12.179 16.298 1.00 0.00 H new ATOM 0 HG3 LYS A 29 60.536 -13.385 15.096 1.00 0.00 H new ATOM 0 HD2 LYS A 29 62.300 -14.919 16.045 1.00 0.00 H new ATOM 0 HD3 LYS A 29 62.677 -13.718 17.263 1.00 0.00 H new ATOM 0 HE2 LYS A 29 59.854 -14.829 16.888 1.00 0.00 H new ATOM 0 HE3 LYS A 29 61.016 -15.573 17.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 59.773 -14.050 19.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 61.276 -13.300 19.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 59.923 -12.808 18.112 1.00 0.00 H new ATOM 481 N SER A 30 59.616 -11.540 13.885 1.00 0.00 N ATOM 482 CA SER A 30 58.325 -11.841 13.197 1.00 0.00 C ATOM 483 C SER A 30 58.163 -10.886 12.012 1.00 0.00 C ATOM 484 O SER A 30 57.697 -11.256 10.953 1.00 0.00 O ATOM 485 CB SER A 30 57.166 -11.636 14.173 1.00 0.00 C ATOM 486 OG SER A 30 57.003 -10.245 14.420 1.00 0.00 O ATOM 0 H SER A 30 59.534 -11.265 14.864 1.00 0.00 H new ATOM 0 HA SER A 30 58.324 -12.873 12.848 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.248 -12.054 13.759 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.364 -12.163 15.107 1.00 0.00 H new ATOM 0 HG SER A 30 56.260 -10.108 15.044 1.00 0.00 H new ATOM 492 N GLU A 31 58.566 -9.660 12.192 1.00 0.00 N ATOM 493 CA GLU A 31 58.470 -8.660 11.092 1.00 0.00 C ATOM 494 C GLU A 31 59.488 -9.024 10.012 1.00 0.00 C ATOM 495 O GLU A 31 59.266 -8.834 8.832 1.00 0.00 O ATOM 496 CB GLU A 31 58.792 -7.268 11.636 1.00 0.00 C ATOM 497 CG GLU A 31 57.673 -6.806 12.569 1.00 0.00 C ATOM 498 CD GLU A 31 58.012 -5.421 13.124 1.00 0.00 C ATOM 499 OE1 GLU A 31 57.649 -4.445 12.488 1.00 0.00 O ATOM 500 OE2 GLU A 31 58.634 -5.360 14.171 1.00 0.00 O ATOM 0 H GLU A 31 58.962 -9.304 13.062 1.00 0.00 H new ATOM 0 HA GLU A 31 57.462 -8.661 10.677 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.741 -7.288 12.172 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.906 -6.563 10.813 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.726 -6.772 12.030 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.549 -7.517 13.386 1.00 0.00 H new ATOM 507 N LEU A 32 60.610 -9.545 10.423 1.00 0.00 N ATOM 508 CA LEU A 32 61.665 -9.926 9.445 1.00 0.00 C ATOM 509 C LEU A 32 61.189 -11.129 8.626 1.00 0.00 C ATOM 510 O LEU A 32 61.374 -11.190 7.428 1.00 0.00 O ATOM 511 CB LEU A 32 62.944 -10.286 10.212 1.00 0.00 C ATOM 512 CG LEU A 32 64.070 -10.657 9.238 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.394 -9.460 8.321 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.315 -11.045 10.046 1.00 0.00 C ATOM 0 H LEU A 32 60.842 -9.724 11.400 1.00 0.00 H new ATOM 0 HA LEU A 32 61.867 -9.095 8.769 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.253 -9.443 10.830 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.748 -11.121 10.885 1.00 0.00 H new ATOM 0 HG LEU A 32 63.755 -11.495 8.617 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.194 -9.734 7.634 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.505 -9.186 7.752 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.712 -8.612 8.928 1.00 0.00 H new ATOM 0 HD21 LEU A 32 66.123 -11.311 9.364 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.625 -10.202 10.664 1.00 0.00 H new ATOM 0 HD23 LEU A 32 65.083 -11.898 10.684 1.00 0.00 H new ATOM 526 N LYS A 33 60.580 -12.089 9.269 1.00 0.00 N ATOM 527 CA LYS A 33 60.096 -13.292 8.528 1.00 0.00 C ATOM 528 C LYS A 33 58.961 -12.906 7.576 1.00 0.00 C ATOM 529 O LYS A 33 58.882 -13.393 6.465 1.00 0.00 O ATOM 530 CB LYS A 33 59.590 -14.342 9.521 1.00 0.00 C ATOM 531 CG LYS A 33 59.096 -15.571 8.750 1.00 0.00 C ATOM 532 CD LYS A 33 58.871 -16.740 9.717 1.00 0.00 C ATOM 533 CE LYS A 33 57.676 -16.451 10.633 1.00 0.00 C ATOM 534 NZ LYS A 33 58.100 -15.541 11.734 1.00 0.00 N ATOM 0 H LYS A 33 60.397 -12.093 10.272 1.00 0.00 H new ATOM 0 HA LYS A 33 60.923 -13.703 7.950 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.388 -14.625 10.207 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.782 -13.929 10.125 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.168 -15.335 8.229 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.826 -15.852 7.990 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.693 -17.657 9.155 1.00 0.00 H new ATOM 0 HD3 LYS A 33 59.767 -16.902 10.317 1.00 0.00 H new ATOM 0 HE2 LYS A 33 56.868 -15.995 10.061 1.00 0.00 H new ATOM 0 HE3 LYS A 33 57.288 -17.382 11.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 57.764 -15.917 12.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 59.138 -15.474 11.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 57.694 -14.596 11.579 1.00 0.00 H new ATOM 548 N GLU A 34 58.078 -12.044 7.997 1.00 0.00 N ATOM 549 CA GLU A 34 56.951 -11.645 7.106 1.00 0.00 C ATOM 550 C GLU A 34 57.507 -11.015 5.829 1.00 0.00 C ATOM 551 O GLU A 34 57.027 -11.264 4.741 1.00 0.00 O ATOM 552 CB GLU A 34 56.051 -10.641 7.830 1.00 0.00 C ATOM 553 CG GLU A 34 54.891 -10.244 6.915 1.00 0.00 C ATOM 554 CD GLU A 34 53.915 -9.349 7.681 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.124 -9.159 8.868 1.00 0.00 O ATOM 556 OE2 GLU A 34 52.975 -8.871 7.069 1.00 0.00 O ATOM 0 H GLU A 34 58.087 -11.600 8.915 1.00 0.00 H new ATOM 0 HA GLU A 34 56.365 -12.527 6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 34 55.668 -11.079 8.752 1.00 0.00 H new ATOM 0 HB3 GLU A 34 56.625 -9.758 8.111 1.00 0.00 H new ATOM 0 HG2 GLU A 34 55.270 -9.719 6.038 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.377 -11.135 6.555 1.00 0.00 H new ATOM 563 N LEU A 35 58.494 -10.175 5.956 1.00 0.00 N ATOM 564 CA LEU A 35 59.061 -9.497 4.755 1.00 0.00 C ATOM 565 C LEU A 35 59.575 -10.547 3.768 1.00 0.00 C ATOM 566 O LEU A 35 59.353 -10.452 2.577 1.00 0.00 O ATOM 567 CB LEU A 35 60.218 -8.595 5.210 1.00 0.00 C ATOM 568 CG LEU A 35 60.847 -7.864 4.015 1.00 0.00 C ATOM 569 CD1 LEU A 35 59.805 -6.962 3.333 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.018 -7.009 4.517 1.00 0.00 C ATOM 0 H LEU A 35 58.935 -9.927 6.842 1.00 0.00 H new ATOM 0 HA LEU A 35 58.295 -8.899 4.262 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.853 -7.868 5.935 1.00 0.00 H new ATOM 0 HB3 LEU A 35 60.976 -9.195 5.714 1.00 0.00 H new ATOM 0 HG LEU A 35 61.202 -8.596 3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 35 60.265 -6.450 2.488 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.973 -7.571 2.980 1.00 0.00 H new ATOM 0 HD13 LEU A 35 59.438 -6.225 4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.473 -6.485 3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 35 61.653 -6.282 5.243 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.761 -7.651 4.989 1.00 0.00 H new ATOM 582 N ILE A 36 60.246 -11.554 4.249 1.00 0.00 N ATOM 583 CA ILE A 36 60.758 -12.617 3.335 1.00 0.00 C ATOM 584 C ILE A 36 59.574 -13.307 2.644 1.00 0.00 C ATOM 585 O ILE A 36 59.606 -13.586 1.464 1.00 0.00 O ATOM 586 CB ILE A 36 61.542 -13.643 4.161 1.00 0.00 C ATOM 587 CG1 ILE A 36 62.843 -13.009 4.655 1.00 0.00 C ATOM 588 CG2 ILE A 36 61.867 -14.869 3.303 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.486 -13.916 5.708 1.00 0.00 C ATOM 0 H ILE A 36 60.464 -11.689 5.236 1.00 0.00 H new ATOM 0 HA ILE A 36 61.409 -12.178 2.579 1.00 0.00 H new ATOM 0 HB ILE A 36 60.937 -13.954 5.013 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.528 -12.861 3.820 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.642 -12.026 5.080 1.00 0.00 H new ATOM 0 HG21 ILE A 36 62.424 -15.592 3.898 1.00 0.00 H new ATOM 0 HG22 ILE A 36 60.940 -15.324 2.953 1.00 0.00 H new ATOM 0 HG23 ILE A 36 62.468 -14.565 2.446 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.413 -13.464 6.060 1.00 0.00 H new ATOM 0 HD12 ILE A 36 62.802 -14.041 6.547 1.00 0.00 H new ATOM 0 HD13 ILE A 36 63.701 -14.889 5.267 1.00 0.00 H new ATOM 601 N ASN A 37 58.531 -13.593 3.369 1.00 0.00 N ATOM 602 CA ASN A 37 57.362 -14.266 2.741 1.00 0.00 C ATOM 603 C ASN A 37 56.805 -13.385 1.618 1.00 0.00 C ATOM 604 O ASN A 37 56.506 -13.851 0.537 1.00 0.00 O ATOM 605 CB ASN A 37 56.278 -14.487 3.799 1.00 0.00 C ATOM 606 CG ASN A 37 55.073 -15.177 3.162 1.00 0.00 C ATOM 607 OD1 ASN A 37 54.919 -15.171 1.957 1.00 0.00 O ATOM 608 ND2 ASN A 37 54.200 -15.772 3.927 1.00 0.00 N ATOM 0 H ASN A 37 58.437 -13.391 4.364 1.00 0.00 H new ATOM 0 HA ASN A 37 57.673 -15.226 2.328 1.00 0.00 H new ATOM 0 HB2 ASN A 37 56.670 -15.096 4.614 1.00 0.00 H new ATOM 0 HB3 ASN A 37 55.977 -13.532 4.231 1.00 0.00 H new ATOM 0 HD21 ASN A 37 53.389 -16.232 3.513 1.00 0.00 H new ATOM 0 HD22 ASN A 37 54.328 -15.778 4.939 1.00 0.00 H new ATOM 615 N ASN A 38 56.661 -12.115 1.877 1.00 0.00 N ATOM 616 CA ASN A 38 56.120 -11.185 0.842 1.00 0.00 C ATOM 617 C ASN A 38 57.216 -10.778 -0.151 1.00 0.00 C ATOM 618 O ASN A 38 56.987 -10.708 -1.343 1.00 0.00 O ATOM 619 CB ASN A 38 55.572 -9.935 1.536 1.00 0.00 C ATOM 620 CG ASN A 38 54.813 -9.074 0.525 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.450 -9.539 -0.538 1.00 0.00 O ATOM 622 ND2 ASN A 38 54.556 -7.827 0.812 1.00 0.00 N ATOM 0 H ASN A 38 56.896 -11.677 2.768 1.00 0.00 H new ATOM 0 HA ASN A 38 55.327 -11.691 0.291 1.00 0.00 H new ATOM 0 HB2 ASN A 38 54.910 -10.222 2.353 1.00 0.00 H new ATOM 0 HB3 ASN A 38 56.390 -9.363 1.974 1.00 0.00 H new ATOM 0 HD21 ASN A 38 54.051 -7.244 0.145 1.00 0.00 H new ATOM 0 HD22 ASN A 38 54.860 -7.436 1.704 1.00 0.00 H new ATOM 629 N GLU A 39 58.398 -10.479 0.337 1.00 0.00 N ATOM 630 CA GLU A 39 59.519 -10.037 -0.560 1.00 0.00 C ATOM 631 C GLU A 39 60.641 -11.085 -0.566 1.00 0.00 C ATOM 632 O GLU A 39 60.708 -11.946 0.283 1.00 0.00 O ATOM 633 CB GLU A 39 60.061 -8.699 -0.029 1.00 0.00 C ATOM 634 CG GLU A 39 60.871 -7.972 -1.112 1.00 0.00 C ATOM 635 CD GLU A 39 59.941 -7.522 -2.241 1.00 0.00 C ATOM 636 OE1 GLU A 39 58.839 -7.094 -1.939 1.00 0.00 O ATOM 637 OE2 GLU A 39 60.349 -7.608 -3.388 1.00 0.00 O ATOM 0 H GLU A 39 58.637 -10.522 1.328 1.00 0.00 H new ATOM 0 HA GLU A 39 59.153 -9.921 -1.580 1.00 0.00 H new ATOM 0 HB2 GLU A 39 59.233 -8.069 0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 39 60.689 -8.876 0.844 1.00 0.00 H new ATOM 0 HG2 GLU A 39 61.379 -7.109 -0.681 1.00 0.00 H new ATOM 0 HG3 GLU A 39 61.643 -8.632 -1.506 1.00 0.00 H new ATOM 644 N LEU A 40 61.534 -10.996 -1.517 1.00 0.00 N ATOM 645 CA LEU A 40 62.679 -11.951 -1.605 1.00 0.00 C ATOM 646 C LEU A 40 62.165 -13.386 -1.796 1.00 0.00 C ATOM 647 O LEU A 40 62.866 -14.341 -1.527 1.00 0.00 O ATOM 648 CB LEU A 40 63.535 -11.836 -0.319 1.00 0.00 C ATOM 649 CG LEU A 40 64.822 -11.041 -0.590 1.00 0.00 C ATOM 650 CD1 LEU A 40 64.469 -9.597 -0.964 1.00 0.00 C ATOM 651 CD2 LEU A 40 65.693 -11.040 0.671 1.00 0.00 C ATOM 0 H LEU A 40 61.517 -10.288 -2.251 1.00 0.00 H new ATOM 0 HA LEU A 40 63.298 -11.702 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 40 62.958 -11.346 0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 40 63.787 -12.832 0.046 1.00 0.00 H new ATOM 0 HG LEU A 40 65.366 -11.505 -1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 40 65.384 -9.037 -1.155 1.00 0.00 H new ATOM 0 HD12 LEU A 40 63.848 -9.595 -1.860 1.00 0.00 H new ATOM 0 HD13 LEU A 40 63.923 -9.132 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 40 66.607 -10.477 0.482 1.00 0.00 H new ATOM 0 HD22 LEU A 40 65.145 -10.577 1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 40 65.948 -12.066 0.938 1.00 0.00 H new ATOM 663 N SER A 41 60.961 -13.551 -2.270 1.00 0.00 N ATOM 664 CA SER A 41 60.442 -14.932 -2.484 1.00 0.00 C ATOM 665 C SER A 41 61.287 -15.634 -3.555 1.00 0.00 C ATOM 666 O SER A 41 61.681 -16.773 -3.402 1.00 0.00 O ATOM 667 CB SER A 41 58.987 -14.863 -2.951 1.00 0.00 C ATOM 668 OG SER A 41 58.176 -14.368 -1.893 1.00 0.00 O ATOM 0 H SER A 41 60.319 -12.798 -2.517 1.00 0.00 H new ATOM 0 HA SER A 41 60.499 -15.490 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 41 58.903 -14.214 -3.823 1.00 0.00 H new ATOM 0 HB3 SER A 41 58.644 -15.852 -3.256 1.00 0.00 H new ATOM 0 HG SER A 41 57.243 -14.321 -2.190 1.00 0.00 H new ATOM 674 N HIS A 42 61.564 -14.961 -4.642 1.00 0.00 N ATOM 675 CA HIS A 42 62.378 -15.582 -5.730 1.00 0.00 C ATOM 676 C HIS A 42 63.871 -15.488 -5.391 1.00 0.00 C ATOM 677 O HIS A 42 64.676 -16.256 -5.880 1.00 0.00 O ATOM 678 CB HIS A 42 62.105 -14.850 -7.048 1.00 0.00 C ATOM 679 CG HIS A 42 62.883 -15.498 -8.160 1.00 0.00 C ATOM 680 ND1 HIS A 42 62.660 -16.811 -8.551 1.00 0.00 N ATOM 681 CD2 HIS A 42 63.881 -15.025 -8.978 1.00 0.00 C ATOM 682 CE1 HIS A 42 63.505 -17.081 -9.566 1.00 0.00 C ATOM 683 NE2 HIS A 42 64.268 -16.026 -9.862 1.00 0.00 N ATOM 0 H HIS A 42 61.260 -14.004 -4.824 1.00 0.00 H new ATOM 0 HA HIS A 42 62.103 -16.632 -5.828 1.00 0.00 H new ATOM 0 HB2 HIS A 42 61.039 -14.875 -7.275 1.00 0.00 H new ATOM 0 HB3 HIS A 42 62.387 -13.801 -6.957 1.00 0.00 H new ATOM 0 HD2 HIS A 42 64.300 -14.030 -8.940 1.00 0.00 H new ATOM 0 HE1 HIS A 42 63.558 -18.032 -10.076 1.00 0.00 H new ATOM 0 HE2 HIS A 42 64.985 -15.967 -10.585 1.00 0.00 H new ATOM 692 N PHE A 43 64.247 -14.539 -4.571 1.00 0.00 N ATOM 693 CA PHE A 43 65.693 -14.375 -4.213 1.00 0.00 C ATOM 694 C PHE A 43 65.977 -15.034 -2.863 1.00 0.00 C ATOM 695 O PHE A 43 67.097 -15.039 -2.392 1.00 0.00 O ATOM 696 CB PHE A 43 66.039 -12.882 -4.137 1.00 0.00 C ATOM 697 CG PHE A 43 66.151 -12.314 -5.533 1.00 0.00 C ATOM 698 CD1 PHE A 43 65.027 -11.776 -6.170 1.00 0.00 C ATOM 699 CD2 PHE A 43 67.388 -12.327 -6.189 1.00 0.00 C ATOM 700 CE1 PHE A 43 65.140 -11.252 -7.464 1.00 0.00 C ATOM 701 CE2 PHE A 43 67.501 -11.803 -7.482 1.00 0.00 C ATOM 702 CZ PHE A 43 66.376 -11.266 -8.120 1.00 0.00 C ATOM 0 H PHE A 43 63.615 -13.869 -4.132 1.00 0.00 H new ATOM 0 HA PHE A 43 66.304 -14.853 -4.979 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.271 -12.349 -3.577 1.00 0.00 H new ATOM 0 HB3 PHE A 43 66.978 -12.743 -3.601 1.00 0.00 H new ATOM 0 HD1 PHE A 43 64.073 -11.765 -5.664 1.00 0.00 H new ATOM 0 HD2 PHE A 43 68.255 -12.742 -5.697 1.00 0.00 H new ATOM 0 HE1 PHE A 43 64.273 -10.837 -7.956 1.00 0.00 H new ATOM 0 HE2 PHE A 43 68.455 -11.813 -7.987 1.00 0.00 H new ATOM 0 HZ PHE A 43 66.462 -10.863 -9.118 1.00 0.00 H new ATOM 712 N LEU A 44 64.986 -15.613 -2.246 1.00 0.00 N ATOM 713 CA LEU A 44 65.223 -16.292 -0.941 1.00 0.00 C ATOM 714 C LEU A 44 64.089 -17.288 -0.687 1.00 0.00 C ATOM 715 O LEU A 44 62.926 -16.981 -0.859 1.00 0.00 O ATOM 716 CB LEU A 44 65.280 -15.251 0.192 1.00 0.00 C ATOM 717 CG LEU A 44 66.137 -15.775 1.366 1.00 0.00 C ATOM 718 CD1 LEU A 44 67.625 -15.492 1.103 1.00 0.00 C ATOM 719 CD2 LEU A 44 65.715 -15.075 2.667 1.00 0.00 C ATOM 0 H LEU A 44 64.025 -15.646 -2.587 1.00 0.00 H new ATOM 0 HA LEU A 44 66.175 -16.823 -0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 44 65.700 -14.318 -0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 44 64.272 -15.029 0.541 1.00 0.00 H new ATOM 0 HG LEU A 44 65.985 -16.850 1.458 1.00 0.00 H new ATOM 0 HD11 LEU A 44 68.219 -15.866 1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 44 67.934 -15.992 0.185 1.00 0.00 H new ATOM 0 HD13 LEU A 44 67.778 -14.418 1.001 1.00 0.00 H new ATOM 0 HD21 LEU A 44 66.321 -15.447 3.493 1.00 0.00 H new ATOM 0 HD22 LEU A 44 65.860 -14.000 2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 44 64.664 -15.282 2.867 1.00 0.00 H new ATOM 731 N GLU A 45 64.421 -18.477 -0.277 1.00 0.00 N ATOM 732 CA GLU A 45 63.366 -19.495 -0.009 1.00 0.00 C ATOM 733 C GLU A 45 62.619 -19.127 1.272 1.00 0.00 C ATOM 734 O GLU A 45 63.205 -18.677 2.236 1.00 0.00 O ATOM 735 CB GLU A 45 64.001 -20.880 0.147 1.00 0.00 C ATOM 736 CG GLU A 45 64.524 -21.366 -1.209 1.00 0.00 C ATOM 737 CD GLU A 45 65.740 -20.535 -1.623 1.00 0.00 C ATOM 738 OE1 GLU A 45 66.315 -19.891 -0.763 1.00 0.00 O ATOM 739 OE2 GLU A 45 66.074 -20.557 -2.797 1.00 0.00 O ATOM 0 H GLU A 45 65.378 -18.791 -0.115 1.00 0.00 H new ATOM 0 HA GLU A 45 62.668 -19.517 -0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 45 64.817 -20.837 0.868 1.00 0.00 H new ATOM 0 HB3 GLU A 45 63.267 -21.585 0.538 1.00 0.00 H new ATOM 0 HG2 GLU A 45 64.796 -22.420 -1.148 1.00 0.00 H new ATOM 0 HG3 GLU A 45 63.741 -21.282 -1.963 1.00 0.00 H new ATOM 746 N GLU A 46 61.327 -19.316 1.294 1.00 0.00 N ATOM 747 CA GLU A 46 60.555 -18.974 2.519 1.00 0.00 C ATOM 748 C GLU A 46 61.042 -19.854 3.667 1.00 0.00 C ATOM 749 O GLU A 46 61.260 -21.038 3.499 1.00 0.00 O ATOM 750 CB GLU A 46 59.068 -19.233 2.275 1.00 0.00 C ATOM 751 CG GLU A 46 58.563 -18.307 1.168 1.00 0.00 C ATOM 752 CD GLU A 46 57.076 -18.566 0.924 1.00 0.00 C ATOM 753 OE1 GLU A 46 56.569 -19.538 1.458 1.00 0.00 O ATOM 754 OE2 GLU A 46 56.467 -17.783 0.213 1.00 0.00 O ATOM 0 H GLU A 46 60.777 -19.690 0.521 1.00 0.00 H new ATOM 0 HA GLU A 46 60.700 -17.923 2.768 1.00 0.00 H new ATOM 0 HB2 GLU A 46 58.911 -20.274 1.992 1.00 0.00 H new ATOM 0 HB3 GLU A 46 58.503 -19.063 3.192 1.00 0.00 H new ATOM 0 HG2 GLU A 46 58.720 -17.266 1.451 1.00 0.00 H new ATOM 0 HG3 GLU A 46 59.128 -18.477 0.251 1.00 0.00 H new ATOM 761 N ILE A 47 61.220 -19.286 4.833 1.00 0.00 N ATOM 762 CA ILE A 47 61.703 -20.086 6.003 1.00 0.00 C ATOM 763 C ILE A 47 60.547 -20.300 6.980 1.00 0.00 C ATOM 764 O ILE A 47 59.973 -19.361 7.495 1.00 0.00 O ATOM 765 CB ILE A 47 62.831 -19.315 6.691 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.970 -19.103 5.689 1.00 0.00 C ATOM 767 CG2 ILE A 47 63.350 -20.123 7.882 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.995 -18.126 6.270 1.00 0.00 C ATOM 0 H ILE A 47 61.051 -18.299 5.027 1.00 0.00 H new ATOM 0 HA ILE A 47 62.072 -21.056 5.671 1.00 0.00 H new ATOM 0 HB ILE A 47 62.459 -18.352 7.042 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.449 -20.055 5.462 1.00 0.00 H new ATOM 0 HG13 ILE A 47 63.574 -18.714 4.751 1.00 0.00 H new ATOM 0 HG21 ILE A 47 64.154 -19.573 8.372 1.00 0.00 H new ATOM 0 HG22 ILE A 47 62.539 -20.288 8.591 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.728 -21.084 7.533 1.00 0.00 H new ATOM 0 HD11 ILE A 47 65.803 -17.978 5.554 1.00 0.00 H new ATOM 0 HD12 ILE A 47 64.512 -17.170 6.474 1.00 0.00 H new ATOM 0 HD13 ILE A 47 65.401 -18.533 7.196 1.00 0.00 H new ATOM 780 N LYS A 48 60.197 -21.533 7.236 1.00 0.00 N ATOM 781 CA LYS A 48 59.074 -21.826 8.177 1.00 0.00 C ATOM 782 C LYS A 48 59.642 -22.117 9.569 1.00 0.00 C ATOM 783 O LYS A 48 58.925 -22.151 10.550 1.00 0.00 O ATOM 784 CB LYS A 48 58.296 -23.043 7.663 1.00 0.00 C ATOM 785 CG LYS A 48 57.062 -23.285 8.536 1.00 0.00 C ATOM 786 CD LYS A 48 56.238 -24.431 7.947 1.00 0.00 C ATOM 787 CE LYS A 48 55.042 -24.720 8.857 1.00 0.00 C ATOM 788 NZ LYS A 48 55.532 -25.179 10.187 1.00 0.00 N ATOM 0 H LYS A 48 60.644 -22.356 6.831 1.00 0.00 H new ATOM 0 HA LYS A 48 58.404 -20.968 8.238 1.00 0.00 H new ATOM 0 HB2 LYS A 48 57.993 -22.881 6.629 1.00 0.00 H new ATOM 0 HB3 LYS A 48 58.937 -23.925 7.673 1.00 0.00 H new ATOM 0 HG2 LYS A 48 57.366 -23.527 9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 48 56.458 -22.379 8.590 1.00 0.00 H new ATOM 0 HD2 LYS A 48 55.893 -24.168 6.947 1.00 0.00 H new ATOM 0 HD3 LYS A 48 56.856 -25.323 7.847 1.00 0.00 H new ATOM 0 HE2 LYS A 48 54.433 -23.823 8.971 1.00 0.00 H new ATOM 0 HE3 LYS A 48 54.406 -25.483 8.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 54.782 -25.717 10.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 56.366 -25.786 10.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 55.790 -24.354 10.766 1.00 0.00 H new ATOM 802 N GLU A 49 60.930 -22.326 9.666 1.00 0.00 N ATOM 803 CA GLU A 49 61.552 -22.616 10.996 1.00 0.00 C ATOM 804 C GLU A 49 62.192 -21.343 11.555 1.00 0.00 C ATOM 805 O GLU A 49 63.098 -20.783 10.971 1.00 0.00 O ATOM 806 CB GLU A 49 62.635 -23.684 10.819 1.00 0.00 C ATOM 807 CG GLU A 49 61.993 -24.999 10.365 1.00 0.00 C ATOM 808 CD GLU A 49 61.621 -24.911 8.881 1.00 0.00 C ATOM 809 OE1 GLU A 49 62.028 -23.956 8.242 1.00 0.00 O ATOM 810 OE2 GLU A 49 60.934 -25.802 8.410 1.00 0.00 O ATOM 0 H GLU A 49 61.580 -22.309 8.880 1.00 0.00 H new ATOM 0 HA GLU A 49 60.786 -22.970 11.686 1.00 0.00 H new ATOM 0 HB2 GLU A 49 63.369 -23.353 10.084 1.00 0.00 H new ATOM 0 HB3 GLU A 49 63.169 -23.834 11.757 1.00 0.00 H new ATOM 0 HG2 GLU A 49 62.684 -25.826 10.528 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.104 -25.205 10.961 1.00 0.00 H new ATOM 817 N GLN A 50 61.731 -20.889 12.689 1.00 0.00 N ATOM 818 CA GLN A 50 62.315 -19.659 13.298 1.00 0.00 C ATOM 819 C GLN A 50 63.785 -19.908 13.640 1.00 0.00 C ATOM 820 O GLN A 50 64.626 -19.045 13.488 1.00 0.00 O ATOM 821 CB GLN A 50 61.544 -19.290 14.568 1.00 0.00 C ATOM 822 CG GLN A 50 60.146 -18.794 14.188 1.00 0.00 C ATOM 823 CD GLN A 50 59.374 -18.425 15.455 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.926 -17.852 16.374 1.00 0.00 O ATOM 825 NE2 GLN A 50 58.111 -18.738 15.549 1.00 0.00 N ATOM 0 H GLN A 50 60.974 -21.318 13.221 1.00 0.00 H new ATOM 0 HA GLN A 50 62.242 -18.836 12.587 1.00 0.00 H new ATOM 0 HB2 GLN A 50 61.468 -20.156 15.225 1.00 0.00 H new ATOM 0 HB3 GLN A 50 62.079 -18.517 15.120 1.00 0.00 H new ATOM 0 HG2 GLN A 50 60.222 -17.928 13.531 1.00 0.00 H new ATOM 0 HG3 GLN A 50 59.612 -19.567 13.636 1.00 0.00 H new ATOM 0 HE21 GLN A 50 57.646 -19.219 14.779 1.00 0.00 H new ATOM 0 HE22 GLN A 50 57.588 -18.502 16.393 1.00 0.00 H new ATOM 834 N GLU A 51 64.091 -21.080 14.121 1.00 0.00 N ATOM 835 CA GLU A 51 65.499 -21.392 14.502 1.00 0.00 C ATOM 836 C GLU A 51 66.425 -21.106 13.321 1.00 0.00 C ATOM 837 O GLU A 51 67.533 -20.637 13.493 1.00 0.00 O ATOM 838 CB GLU A 51 65.606 -22.873 14.891 1.00 0.00 C ATOM 839 CG GLU A 51 67.026 -23.187 15.379 1.00 0.00 C ATOM 840 CD GLU A 51 67.316 -22.405 16.662 1.00 0.00 C ATOM 841 OE1 GLU A 51 66.368 -21.966 17.293 1.00 0.00 O ATOM 842 OE2 GLU A 51 68.481 -22.260 16.994 1.00 0.00 O ATOM 0 H GLU A 51 63.425 -21.839 14.268 1.00 0.00 H new ATOM 0 HA GLU A 51 65.792 -20.771 15.349 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.884 -23.105 15.674 1.00 0.00 H new ATOM 0 HB3 GLU A 51 65.360 -23.501 14.035 1.00 0.00 H new ATOM 0 HG2 GLU A 51 67.130 -24.256 15.562 1.00 0.00 H new ATOM 0 HG3 GLU A 51 67.752 -22.924 14.609 1.00 0.00 H new ATOM 849 N VAL A 52 65.980 -21.345 12.121 1.00 0.00 N ATOM 850 CA VAL A 52 66.832 -21.041 10.940 1.00 0.00 C ATOM 851 C VAL A 52 66.937 -19.518 10.801 1.00 0.00 C ATOM 852 O VAL A 52 67.963 -18.978 10.438 1.00 0.00 O ATOM 853 CB VAL A 52 66.203 -21.645 9.680 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.935 -21.129 8.438 1.00 0.00 C ATOM 855 CG2 VAL A 52 66.318 -23.170 9.740 1.00 0.00 C ATOM 0 H VAL A 52 65.063 -21.738 11.907 1.00 0.00 H new ATOM 0 HA VAL A 52 67.826 -21.470 11.069 1.00 0.00 H new ATOM 0 HB VAL A 52 65.153 -21.356 9.625 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.484 -21.561 7.544 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.857 -20.043 8.395 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.985 -21.416 8.489 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.872 -23.604 8.845 1.00 0.00 H new ATOM 0 HG22 VAL A 52 67.369 -23.454 9.795 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.795 -23.540 10.622 1.00 0.00 H new ATOM 865 N VAL A 53 65.869 -18.830 11.102 1.00 0.00 N ATOM 866 CA VAL A 53 65.876 -17.342 11.006 1.00 0.00 C ATOM 867 C VAL A 53 66.766 -16.769 12.113 1.00 0.00 C ATOM 868 O VAL A 53 67.488 -15.812 11.913 1.00 0.00 O ATOM 869 CB VAL A 53 64.446 -16.813 11.178 1.00 0.00 C ATOM 870 CG1 VAL A 53 64.465 -15.287 11.321 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.606 -17.197 9.960 1.00 0.00 C ATOM 0 H VAL A 53 64.987 -19.237 11.412 1.00 0.00 H new ATOM 0 HA VAL A 53 66.261 -17.040 10.032 1.00 0.00 H new ATOM 0 HB VAL A 53 64.011 -17.253 12.076 1.00 0.00 H new ATOM 0 HG11 VAL A 53 63.446 -14.920 11.443 1.00 0.00 H new ATOM 0 HG12 VAL A 53 65.057 -15.011 12.194 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.906 -14.843 10.428 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.591 -16.820 10.085 1.00 0.00 H new ATOM 0 HG22 VAL A 53 64.047 -16.763 9.063 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.581 -18.282 9.863 1.00 0.00 H new ATOM 881 N ASP A 54 66.700 -17.335 13.286 1.00 0.00 N ATOM 882 CA ASP A 54 67.520 -16.812 14.417 1.00 0.00 C ATOM 883 C ASP A 54 69.006 -16.887 14.067 1.00 0.00 C ATOM 884 O ASP A 54 69.766 -15.986 14.364 1.00 0.00 O ATOM 885 CB ASP A 54 67.248 -17.649 15.670 1.00 0.00 C ATOM 886 CG ASP A 54 68.058 -17.104 16.851 1.00 0.00 C ATOM 887 OD1 ASP A 54 69.012 -16.382 16.614 1.00 0.00 O ATOM 888 OD2 ASP A 54 67.704 -17.415 17.977 1.00 0.00 O ATOM 0 H ASP A 54 66.113 -18.138 13.512 1.00 0.00 H new ATOM 0 HA ASP A 54 67.251 -15.772 14.603 1.00 0.00 H new ATOM 0 HB2 ASP A 54 66.184 -17.628 15.907 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.513 -18.690 15.486 1.00 0.00 H new ATOM 893 N LYS A 55 69.432 -17.944 13.439 1.00 0.00 N ATOM 894 CA LYS A 55 70.874 -18.045 13.082 1.00 0.00 C ATOM 895 C LYS A 55 71.236 -16.902 12.135 1.00 0.00 C ATOM 896 O LYS A 55 72.249 -16.250 12.292 1.00 0.00 O ATOM 897 CB LYS A 55 71.155 -19.393 12.414 1.00 0.00 C ATOM 898 CG LYS A 55 71.032 -20.507 13.460 1.00 0.00 C ATOM 899 CD LYS A 55 71.419 -21.859 12.843 1.00 0.00 C ATOM 900 CE LYS A 55 70.263 -22.411 12.003 1.00 0.00 C ATOM 901 NZ LYS A 55 70.576 -23.809 11.590 1.00 0.00 N ATOM 0 H LYS A 55 68.853 -18.735 13.159 1.00 0.00 H new ATOM 0 HA LYS A 55 71.480 -17.973 13.985 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.451 -19.563 11.599 1.00 0.00 H new ATOM 0 HB3 LYS A 55 72.154 -19.395 11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 55 71.677 -20.289 14.311 1.00 0.00 H new ATOM 0 HG3 LYS A 55 70.010 -20.550 13.837 1.00 0.00 H new ATOM 0 HD2 LYS A 55 72.306 -21.742 12.221 1.00 0.00 H new ATOM 0 HD3 LYS A 55 71.674 -22.567 13.632 1.00 0.00 H new ATOM 0 HE2 LYS A 55 69.337 -22.388 12.578 1.00 0.00 H new ATOM 0 HE3 LYS A 55 70.107 -21.786 11.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 69.793 -24.186 11.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 71.450 -23.817 11.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 70.704 -24.400 12.436 1.00 0.00 H new ATOM 915 N VAL A 56 70.409 -16.644 11.163 1.00 0.00 N ATOM 916 CA VAL A 56 70.694 -15.532 10.214 1.00 0.00 C ATOM 917 C VAL A 56 70.534 -14.189 10.935 1.00 0.00 C ATOM 918 O VAL A 56 71.314 -13.276 10.751 1.00 0.00 O ATOM 919 CB VAL A 56 69.713 -15.619 9.037 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.809 -14.357 8.173 1.00 0.00 C ATOM 921 CG2 VAL A 56 70.060 -16.838 8.181 1.00 0.00 C ATOM 0 H VAL A 56 69.545 -17.156 10.983 1.00 0.00 H new ATOM 0 HA VAL A 56 71.715 -15.612 9.842 1.00 0.00 H new ATOM 0 HB VAL A 56 68.699 -15.710 9.426 1.00 0.00 H new ATOM 0 HG11 VAL A 56 69.108 -14.431 7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.564 -13.483 8.777 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.823 -14.258 7.785 1.00 0.00 H new ATOM 0 HG21 VAL A 56 69.366 -16.904 7.343 1.00 0.00 H new ATOM 0 HG22 VAL A 56 71.077 -16.739 7.802 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.985 -17.741 8.787 1.00 0.00 H new ATOM 931 N MET A 57 69.518 -14.061 11.742 1.00 0.00 N ATOM 932 CA MET A 57 69.287 -12.777 12.467 1.00 0.00 C ATOM 933 C MET A 57 70.478 -12.434 13.368 1.00 0.00 C ATOM 934 O MET A 57 70.957 -11.318 13.371 1.00 0.00 O ATOM 935 CB MET A 57 68.018 -12.894 13.314 1.00 0.00 C ATOM 936 CG MET A 57 67.725 -11.550 13.982 1.00 0.00 C ATOM 937 SD MET A 57 66.130 -11.632 14.831 1.00 0.00 S ATOM 938 CE MET A 57 65.775 -9.859 14.817 1.00 0.00 C ATOM 0 H MET A 57 68.834 -14.793 11.932 1.00 0.00 H new ATOM 0 HA MET A 57 69.172 -11.979 11.733 1.00 0.00 H new ATOM 0 HB2 MET A 57 67.177 -13.192 12.688 1.00 0.00 H new ATOM 0 HB3 MET A 57 68.143 -13.669 14.071 1.00 0.00 H new ATOM 0 HG2 MET A 57 68.515 -11.305 14.692 1.00 0.00 H new ATOM 0 HG3 MET A 57 67.711 -10.756 13.235 1.00 0.00 H new ATOM 0 HE1 MET A 57 64.880 -9.662 15.408 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.618 -9.316 15.243 1.00 0.00 H new ATOM 0 HE3 MET A 57 65.612 -9.529 13.791 1.00 0.00 H new ATOM 948 N GLU A 58 70.953 -13.369 14.141 1.00 0.00 N ATOM 949 CA GLU A 58 72.102 -13.064 15.045 1.00 0.00 C ATOM 950 C GLU A 58 73.298 -12.623 14.202 1.00 0.00 C ATOM 951 O GLU A 58 74.004 -11.694 14.541 1.00 0.00 O ATOM 952 CB GLU A 58 72.470 -14.315 15.853 1.00 0.00 C ATOM 953 CG GLU A 58 73.600 -13.992 16.840 1.00 0.00 C ATOM 954 CD GLU A 58 73.115 -12.965 17.866 1.00 0.00 C ATOM 955 OE1 GLU A 58 71.913 -12.812 18.001 1.00 0.00 O ATOM 956 OE2 GLU A 58 73.955 -12.349 18.501 1.00 0.00 O ATOM 0 H GLU A 58 70.601 -14.325 14.188 1.00 0.00 H new ATOM 0 HA GLU A 58 71.826 -12.265 15.733 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.596 -14.678 16.395 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.782 -15.114 15.180 1.00 0.00 H new ATOM 0 HG2 GLU A 58 73.923 -14.901 17.347 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.464 -13.602 16.302 1.00 0.00 H new ATOM 963 N THR A 59 73.521 -13.274 13.099 1.00 0.00 N ATOM 964 CA THR A 59 74.658 -12.891 12.218 1.00 0.00 C ATOM 965 C THR A 59 74.453 -11.463 11.708 1.00 0.00 C ATOM 966 O THR A 59 75.377 -10.680 11.626 1.00 0.00 O ATOM 967 CB THR A 59 74.733 -13.851 11.027 1.00 0.00 C ATOM 968 OG1 THR A 59 74.926 -15.176 11.499 1.00 0.00 O ATOM 969 CG2 THR A 59 75.899 -13.451 10.121 1.00 0.00 C ATOM 0 H THR A 59 72.962 -14.060 12.766 1.00 0.00 H new ATOM 0 HA THR A 59 75.587 -12.945 12.786 1.00 0.00 H new ATOM 0 HB THR A 59 73.803 -13.802 10.460 1.00 0.00 H new ATOM 0 HG1 THR A 59 74.066 -15.550 11.784 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.952 -14.134 9.273 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.746 -12.434 9.759 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.831 -13.499 10.685 1.00 0.00 H new ATOM 977 N LEU A 60 73.241 -11.123 11.372 1.00 0.00 N ATOM 978 CA LEU A 60 72.965 -9.746 10.871 1.00 0.00 C ATOM 979 C LEU A 60 73.046 -8.729 12.010 1.00 0.00 C ATOM 980 O LEU A 60 73.534 -7.631 11.834 1.00 0.00 O ATOM 981 CB LEU A 60 71.570 -9.684 10.233 1.00 0.00 C ATOM 982 CG LEU A 60 71.566 -10.406 8.872 1.00 0.00 C ATOM 983 CD1 LEU A 60 70.127 -10.783 8.496 1.00 0.00 C ATOM 984 CD2 LEU A 60 72.124 -9.481 7.776 1.00 0.00 C ATOM 0 H LEU A 60 72.429 -11.738 11.422 1.00 0.00 H new ATOM 0 HA LEU A 60 73.719 -9.501 10.123 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.839 -10.144 10.898 1.00 0.00 H new ATOM 0 HB3 LEU A 60 71.270 -8.644 10.101 1.00 0.00 H new ATOM 0 HG LEU A 60 72.186 -11.299 8.952 1.00 0.00 H new ATOM 0 HD11 LEU A 60 70.124 -11.294 7.533 1.00 0.00 H new ATOM 0 HD12 LEU A 60 69.713 -11.443 9.258 1.00 0.00 H new ATOM 0 HD13 LEU A 60 69.520 -9.880 8.429 1.00 0.00 H new ATOM 0 HD21 LEU A 60 72.115 -10.004 6.820 1.00 0.00 H new ATOM 0 HD22 LEU A 60 71.506 -8.586 7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 60 73.146 -9.197 8.025 1.00 0.00 H new ATOM 996 N ASP A 61 72.550 -9.066 13.167 1.00 0.00 N ATOM 997 CA ASP A 61 72.577 -8.089 14.293 1.00 0.00 C ATOM 998 C ASP A 61 74.006 -7.891 14.801 1.00 0.00 C ATOM 999 O ASP A 61 74.484 -8.617 15.649 1.00 0.00 O ATOM 1000 CB ASP A 61 71.699 -8.605 15.435 1.00 0.00 C ATOM 1001 CG ASP A 61 70.230 -8.535 15.018 1.00 0.00 C ATOM 1002 OD1 ASP A 61 69.928 -7.791 14.100 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.429 -9.229 15.624 1.00 0.00 O ATOM 0 H ASP A 61 72.129 -9.970 13.382 1.00 0.00 H new ATOM 0 HA ASP A 61 72.197 -7.132 13.935 1.00 0.00 H new ATOM 0 HB2 ASP A 61 71.970 -9.632 15.681 1.00 0.00 H new ATOM 0 HB3 ASP A 61 71.863 -8.008 16.332 1.00 0.00 H new ATOM 1008 N GLU A 62 74.681 -6.899 14.295 1.00 0.00 N ATOM 1009 CA GLU A 62 76.070 -6.637 14.759 1.00 0.00 C ATOM 1010 C GLU A 62 76.052 -6.354 16.263 1.00 0.00 C ATOM 1011 O GLU A 62 76.919 -6.788 16.995 1.00 0.00 O ATOM 1012 CB GLU A 62 76.659 -5.436 14.011 1.00 0.00 C ATOM 1013 CG GLU A 62 76.913 -5.811 12.548 1.00 0.00 C ATOM 1014 CD GLU A 62 75.580 -5.969 11.814 1.00 0.00 C ATOM 1015 OE1 GLU A 62 74.580 -5.505 12.337 1.00 0.00 O ATOM 1016 OE2 GLU A 62 75.583 -6.552 10.742 1.00 0.00 O ATOM 0 H GLU A 62 74.332 -6.259 13.581 1.00 0.00 H new ATOM 0 HA GLU A 62 76.689 -7.511 14.557 1.00 0.00 H new ATOM 0 HB2 GLU A 62 75.974 -4.590 14.066 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.590 -5.123 14.483 1.00 0.00 H new ATOM 0 HG2 GLU A 62 77.515 -5.041 12.065 1.00 0.00 H new ATOM 0 HG3 GLU A 62 77.480 -6.740 12.495 1.00 0.00 H new ATOM 1023 N ASP A 63 75.075 -5.625 16.730 1.00 0.00 N ATOM 1024 CA ASP A 63 75.009 -5.309 18.187 1.00 0.00 C ATOM 1025 C ASP A 63 74.370 -6.473 18.955 1.00 0.00 C ATOM 1026 O ASP A 63 74.474 -6.558 20.163 1.00 0.00 O ATOM 1027 CB ASP A 63 74.171 -4.045 18.389 1.00 0.00 C ATOM 1028 CG ASP A 63 72.757 -4.278 17.854 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.552 -5.287 17.199 1.00 0.00 O ATOM 1030 OD2 ASP A 63 71.905 -3.442 18.104 1.00 0.00 O ATOM 0 H ASP A 63 74.320 -5.234 16.167 1.00 0.00 H new ATOM 0 HA ASP A 63 76.019 -5.150 18.564 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.133 -3.787 19.447 1.00 0.00 H new ATOM 0 HB3 ASP A 63 74.633 -3.204 17.872 1.00 0.00 H new ATOM 1035 N GLY A 64 73.717 -7.375 18.272 1.00 0.00 N ATOM 1036 CA GLY A 64 73.082 -8.527 18.980 1.00 0.00 C ATOM 1037 C GLY A 64 71.883 -8.040 19.800 1.00 0.00 C ATOM 1038 O GLY A 64 71.558 -8.594 20.831 1.00 0.00 O ATOM 0 H GLY A 64 73.596 -7.365 17.259 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.759 -9.276 18.257 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.809 -9.008 19.634 1.00 0.00 H new ATOM 1042 N ASP A 65 71.232 -6.998 19.360 1.00 0.00 N ATOM 1043 CA ASP A 65 70.068 -6.463 20.124 1.00 0.00 C ATOM 1044 C ASP A 65 68.834 -7.348 19.913 1.00 0.00 C ATOM 1045 O ASP A 65 67.780 -7.092 20.462 1.00 0.00 O ATOM 1046 CB ASP A 65 69.759 -5.043 19.649 1.00 0.00 C ATOM 1047 CG ASP A 65 69.417 -5.062 18.158 1.00 0.00 C ATOM 1048 OD1 ASP A 65 69.674 -6.073 17.525 1.00 0.00 O ATOM 1049 OD2 ASP A 65 68.908 -4.065 17.674 1.00 0.00 O ATOM 0 H ASP A 65 71.456 -6.493 18.503 1.00 0.00 H new ATOM 0 HA ASP A 65 70.318 -6.455 21.185 1.00 0.00 H new ATOM 0 HB2 ASP A 65 68.925 -4.632 20.218 1.00 0.00 H new ATOM 0 HB3 ASP A 65 70.617 -4.395 19.827 1.00 0.00 H new ATOM 1054 N GLY A 66 68.950 -8.393 19.142 1.00 0.00 N ATOM 1055 CA GLY A 66 67.776 -9.291 18.928 1.00 0.00 C ATOM 1056 C GLY A 66 66.772 -8.632 17.981 1.00 0.00 C ATOM 1057 O GLY A 66 65.728 -9.182 17.691 1.00 0.00 O ATOM 0 H GLY A 66 69.802 -8.665 18.652 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.108 -10.243 18.513 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.297 -9.509 19.883 1.00 0.00 H new ATOM 1061 N GLU A 67 67.081 -7.465 17.487 1.00 0.00 N ATOM 1062 CA GLU A 67 66.163 -6.761 16.545 1.00 0.00 C ATOM 1063 C GLU A 67 67.025 -6.118 15.464 1.00 0.00 C ATOM 1064 O GLU A 67 68.205 -5.910 15.663 1.00 0.00 O ATOM 1065 CB GLU A 67 65.390 -5.670 17.293 1.00 0.00 C ATOM 1066 CG GLU A 67 64.505 -6.304 18.366 1.00 0.00 C ATOM 1067 CD GLU A 67 63.737 -5.206 19.106 1.00 0.00 C ATOM 1068 OE1 GLU A 67 64.054 -4.046 18.900 1.00 0.00 O ATOM 1069 OE2 GLU A 67 62.841 -5.544 19.863 1.00 0.00 O ATOM 0 H GLU A 67 67.943 -6.962 17.699 1.00 0.00 H new ATOM 0 HA GLU A 67 65.449 -7.460 16.111 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.086 -4.968 17.751 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.778 -5.101 16.593 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.808 -7.006 17.909 1.00 0.00 H new ATOM 0 HG3 GLU A 67 65.116 -6.872 19.068 1.00 0.00 H new ATOM 1076 N CYS A 68 66.466 -5.787 14.324 1.00 0.00 N ATOM 1077 CA CYS A 68 67.282 -5.144 13.245 1.00 0.00 C ATOM 1078 C CYS A 68 66.908 -3.665 13.150 1.00 0.00 C ATOM 1079 O CYS A 68 65.831 -3.314 12.714 1.00 0.00 O ATOM 1080 CB CYS A 68 66.981 -5.829 11.911 1.00 0.00 C ATOM 1081 SG CYS A 68 68.096 -5.188 10.637 1.00 0.00 S ATOM 0 H CYS A 68 65.483 -5.934 14.095 1.00 0.00 H new ATOM 0 HA CYS A 68 68.343 -5.241 13.475 1.00 0.00 H new ATOM 0 HB2 CYS A 68 67.105 -6.908 12.008 1.00 0.00 H new ATOM 0 HB3 CYS A 68 65.944 -5.651 11.625 1.00 0.00 H new ATOM 0 HG CYS A 68 67.914 -5.845 9.530 1.00 0.00 H new ATOM 1087 N ASP A 69 67.782 -2.796 13.576 1.00 0.00 N ATOM 1088 CA ASP A 69 67.465 -1.342 13.533 1.00 0.00 C ATOM 1089 C ASP A 69 67.445 -0.848 12.082 1.00 0.00 C ATOM 1090 O ASP A 69 67.643 -1.599 11.147 1.00 0.00 O ATOM 1091 CB ASP A 69 68.506 -0.557 14.340 1.00 0.00 C ATOM 1092 CG ASP A 69 69.854 -0.577 13.618 1.00 0.00 C ATOM 1093 OD1 ASP A 69 69.984 -1.325 12.667 1.00 0.00 O ATOM 1094 OD2 ASP A 69 70.735 0.160 14.032 1.00 0.00 O ATOM 0 H ASP A 69 68.701 -3.030 13.952 1.00 0.00 H new ATOM 0 HA ASP A 69 66.480 -1.182 13.972 1.00 0.00 H new ATOM 0 HB2 ASP A 69 68.172 0.472 14.475 1.00 0.00 H new ATOM 0 HB3 ASP A 69 68.610 -0.992 15.334 1.00 0.00 H new ATOM 1099 N PHE A 70 67.204 0.418 11.904 1.00 0.00 N ATOM 1100 CA PHE A 70 67.164 0.989 10.529 1.00 0.00 C ATOM 1101 C PHE A 70 68.518 0.776 9.845 1.00 0.00 C ATOM 1102 O PHE A 70 68.597 0.334 8.718 1.00 0.00 O ATOM 1103 CB PHE A 70 66.865 2.486 10.596 1.00 0.00 C ATOM 1104 CG PHE A 70 66.681 3.012 9.193 1.00 0.00 C ATOM 1105 CD1 PHE A 70 67.793 3.403 8.438 1.00 0.00 C ATOM 1106 CD2 PHE A 70 65.397 3.103 8.646 1.00 0.00 C ATOM 1107 CE1 PHE A 70 67.620 3.887 7.136 1.00 0.00 C ATOM 1108 CE2 PHE A 70 65.223 3.587 7.344 1.00 0.00 C ATOM 1109 CZ PHE A 70 66.335 3.979 6.588 1.00 0.00 C ATOM 0 H PHE A 70 67.032 1.087 12.655 1.00 0.00 H new ATOM 0 HA PHE A 70 66.381 0.488 9.959 1.00 0.00 H new ATOM 0 HB2 PHE A 70 65.966 2.665 11.186 1.00 0.00 H new ATOM 0 HB3 PHE A 70 67.681 3.012 11.091 1.00 0.00 H new ATOM 0 HD1 PHE A 70 68.785 3.331 8.860 1.00 0.00 H new ATOM 0 HD2 PHE A 70 64.539 2.800 9.228 1.00 0.00 H new ATOM 0 HE1 PHE A 70 68.478 4.190 6.554 1.00 0.00 H new ATOM 0 HE2 PHE A 70 64.231 3.658 6.922 1.00 0.00 H new ATOM 0 HZ PHE A 70 66.201 4.352 5.583 1.00 0.00 H new ATOM 1119 N GLN A 71 69.582 1.134 10.505 1.00 0.00 N ATOM 1120 CA GLN A 71 70.924 0.996 9.870 1.00 0.00 C ATOM 1121 C GLN A 71 71.173 -0.474 9.506 1.00 0.00 C ATOM 1122 O GLN A 71 71.512 -0.784 8.381 1.00 0.00 O ATOM 1123 CB GLN A 71 71.992 1.483 10.849 1.00 0.00 C ATOM 1124 CG GLN A 71 71.877 3.000 11.011 1.00 0.00 C ATOM 1125 CD GLN A 71 72.930 3.490 12.006 1.00 0.00 C ATOM 1126 OE1 GLN A 71 74.069 3.070 11.960 1.00 0.00 O ATOM 1127 NE2 GLN A 71 72.590 4.359 12.918 1.00 0.00 N ATOM 0 H GLN A 71 69.583 1.514 11.451 1.00 0.00 H new ATOM 0 HA GLN A 71 70.967 1.595 8.961 1.00 0.00 H new ATOM 0 HB2 GLN A 71 71.867 0.992 11.814 1.00 0.00 H new ATOM 0 HB3 GLN A 71 72.984 1.219 10.483 1.00 0.00 H new ATOM 0 HG2 GLN A 71 72.016 3.490 10.048 1.00 0.00 H new ATOM 0 HG3 GLN A 71 70.879 3.264 11.362 1.00 0.00 H new ATOM 0 HE21 GLN A 71 71.633 4.711 12.956 1.00 0.00 H new ATOM 0 HE22 GLN A 71 73.281 4.686 13.593 1.00 0.00 H new ATOM 1136 N GLU A 72 71.015 -1.387 10.430 1.00 0.00 N ATOM 1137 CA GLU A 72 71.259 -2.823 10.084 1.00 0.00 C ATOM 1138 C GLU A 72 70.296 -3.214 8.964 1.00 0.00 C ATOM 1139 O GLU A 72 70.661 -3.866 8.007 1.00 0.00 O ATOM 1140 CB GLU A 72 70.995 -3.706 11.308 1.00 0.00 C ATOM 1141 CG GLU A 72 72.085 -3.471 12.356 1.00 0.00 C ATOM 1142 CD GLU A 72 71.803 -4.334 13.588 1.00 0.00 C ATOM 1143 OE1 GLU A 72 70.807 -5.040 13.579 1.00 0.00 O ATOM 1144 OE2 GLU A 72 72.587 -4.275 14.521 1.00 0.00 O ATOM 0 H GLU A 72 70.733 -1.207 11.393 1.00 0.00 H new ATOM 0 HA GLU A 72 72.293 -2.959 9.766 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.016 -3.477 11.729 1.00 0.00 H new ATOM 0 HB3 GLU A 72 70.979 -4.756 11.015 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.062 -3.718 11.941 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.115 -2.418 12.636 1.00 0.00 H new ATOM 1151 N PHE A 73 69.061 -2.816 9.095 1.00 0.00 N ATOM 1152 CA PHE A 73 68.056 -3.162 8.047 1.00 0.00 C ATOM 1153 C PHE A 73 68.673 -2.850 6.681 1.00 0.00 C ATOM 1154 O PHE A 73 68.593 -3.634 5.755 1.00 0.00 O ATOM 1155 CB PHE A 73 66.777 -2.349 8.244 1.00 0.00 C ATOM 1156 CG PHE A 73 65.820 -2.651 7.117 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.017 -3.795 7.170 1.00 0.00 C ATOM 1158 CD2 PHE A 73 65.740 -1.790 6.017 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.131 -4.079 6.125 1.00 0.00 C ATOM 1160 CE2 PHE A 73 64.854 -2.072 4.970 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.049 -3.216 5.025 1.00 0.00 C ATOM 0 H PHE A 73 68.704 -2.269 9.878 1.00 0.00 H new ATOM 0 HA PHE A 73 67.795 -4.218 8.114 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.319 -2.595 9.202 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.008 -1.284 8.265 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.081 -4.460 8.019 1.00 0.00 H new ATOM 0 HD2 PHE A 73 66.362 -0.908 5.975 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.511 -4.962 6.167 1.00 0.00 H new ATOM 0 HE2 PHE A 73 64.792 -1.408 4.121 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.364 -3.433 4.219 1.00 0.00 H new ATOM 1171 N MET A 74 69.338 -1.735 6.571 1.00 0.00 N ATOM 1172 CA MET A 74 70.016 -1.394 5.290 1.00 0.00 C ATOM 1173 C MET A 74 71.211 -2.341 5.103 1.00 0.00 C ATOM 1174 O MET A 74 71.492 -2.804 4.018 1.00 0.00 O ATOM 1175 CB MET A 74 70.512 0.056 5.340 1.00 0.00 C ATOM 1176 CG MET A 74 69.318 1.015 5.324 1.00 0.00 C ATOM 1177 SD MET A 74 68.452 0.896 3.736 1.00 0.00 S ATOM 1178 CE MET A 74 69.755 1.594 2.690 1.00 0.00 C ATOM 0 H MET A 74 69.442 -1.044 7.314 1.00 0.00 H new ATOM 0 HA MET A 74 69.320 -1.502 4.459 1.00 0.00 H new ATOM 0 HB2 MET A 74 71.106 0.216 6.240 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.163 0.257 4.489 1.00 0.00 H new ATOM 0 HG2 MET A 74 68.636 0.774 6.139 1.00 0.00 H new ATOM 0 HG3 MET A 74 69.659 2.037 5.486 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.312 2.004 1.782 1.00 0.00 H new ATOM 0 HE2 MET A 74 70.272 2.386 3.232 1.00 0.00 H new ATOM 0 HE3 MET A 74 70.467 0.812 2.425 1.00 0.00 H new ATOM 1188 N ALA A 75 71.923 -2.628 6.161 1.00 0.00 N ATOM 1189 CA ALA A 75 73.103 -3.536 6.058 1.00 0.00 C ATOM 1190 C ALA A 75 72.692 -4.864 5.430 1.00 0.00 C ATOM 1191 O ALA A 75 73.523 -5.635 4.986 1.00 0.00 O ATOM 1192 CB ALA A 75 73.654 -3.808 7.452 1.00 0.00 C ATOM 0 H ALA A 75 71.736 -2.270 7.098 1.00 0.00 H new ATOM 0 HA ALA A 75 73.861 -3.058 5.437 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.516 -4.471 7.379 1.00 0.00 H new ATOM 0 HB2 ALA A 75 73.957 -2.868 7.913 1.00 0.00 H new ATOM 0 HB3 ALA A 75 72.884 -4.280 8.062 1.00 0.00 H new ATOM 1198 N PHE A 76 71.420 -5.117 5.326 1.00 0.00 N ATOM 1199 CA PHE A 76 70.942 -6.362 4.664 1.00 0.00 C ATOM 1200 C PHE A 76 70.725 -6.023 3.190 1.00 0.00 C ATOM 1201 O PHE A 76 70.883 -6.836 2.303 1.00 0.00 O ATOM 1202 CB PHE A 76 69.615 -6.779 5.301 1.00 0.00 C ATOM 1203 CG PHE A 76 69.092 -8.028 4.639 1.00 0.00 C ATOM 1204 CD1 PHE A 76 68.258 -7.926 3.523 1.00 0.00 C ATOM 1205 CD2 PHE A 76 69.427 -9.286 5.150 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.758 -9.086 2.914 1.00 0.00 C ATOM 1207 CE2 PHE A 76 68.931 -10.444 4.543 1.00 0.00 C ATOM 1208 CZ PHE A 76 68.098 -10.346 3.426 1.00 0.00 C ATOM 0 H PHE A 76 70.681 -4.507 5.676 1.00 0.00 H new ATOM 0 HA PHE A 76 71.657 -7.178 4.772 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.754 -6.955 6.368 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.887 -5.974 5.203 1.00 0.00 H new ATOM 0 HD1 PHE A 76 67.998 -6.954 3.129 1.00 0.00 H new ATOM 0 HD2 PHE A 76 70.070 -9.363 6.015 1.00 0.00 H new ATOM 0 HE1 PHE A 76 67.112 -9.009 2.052 1.00 0.00 H new ATOM 0 HE2 PHE A 76 69.192 -11.415 4.938 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.716 -11.241 2.957 1.00 0.00 H new ATOM 1218 N VAL A 77 70.382 -4.788 2.956 1.00 0.00 N ATOM 1219 CA VAL A 77 70.162 -4.311 1.563 1.00 0.00 C ATOM 1220 C VAL A 77 71.501 -4.345 0.813 1.00 0.00 C ATOM 1221 O VAL A 77 71.560 -4.712 -0.345 1.00 0.00 O ATOM 1222 CB VAL A 77 69.591 -2.883 1.569 1.00 0.00 C ATOM 1223 CG1 VAL A 77 69.602 -2.310 0.147 1.00 0.00 C ATOM 1224 CG2 VAL A 77 68.151 -2.919 2.095 1.00 0.00 C ATOM 0 H VAL A 77 70.243 -4.081 3.678 1.00 0.00 H new ATOM 0 HA VAL A 77 69.443 -4.960 1.063 1.00 0.00 H new ATOM 0 HB VAL A 77 70.204 -2.251 2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 77 69.196 -1.298 0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 77 70.625 -2.286 -0.228 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.992 -2.938 -0.503 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.741 -1.909 2.102 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.544 -3.553 1.449 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.144 -3.320 3.108 1.00 0.00 H new ATOM 1234 N SER A 78 72.579 -3.969 1.458 1.00 0.00 N ATOM 1235 CA SER A 78 73.906 -3.987 0.771 1.00 0.00 C ATOM 1236 C SER A 78 74.371 -5.428 0.561 1.00 0.00 C ATOM 1237 O SER A 78 74.768 -5.810 -0.522 1.00 0.00 O ATOM 1238 CB SER A 78 74.931 -3.247 1.630 1.00 0.00 C ATOM 1239 OG SER A 78 75.187 -4.002 2.807 1.00 0.00 O ATOM 0 H SER A 78 72.596 -3.652 2.427 1.00 0.00 H new ATOM 0 HA SER A 78 73.811 -3.498 -0.198 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.854 -3.100 1.070 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.557 -2.258 1.893 1.00 0.00 H new ATOM 0 HG SER A 78 75.845 -3.532 3.360 1.00 0.00 H new ATOM 1245 N MET A 79 74.353 -6.228 1.589 1.00 0.00 N ATOM 1246 CA MET A 79 74.827 -7.634 1.432 1.00 0.00 C ATOM 1247 C MET A 79 74.058 -8.284 0.285 1.00 0.00 C ATOM 1248 O MET A 79 74.614 -9.001 -0.523 1.00 0.00 O ATOM 1249 CB MET A 79 74.576 -8.405 2.731 1.00 0.00 C ATOM 1250 CG MET A 79 75.214 -9.794 2.636 1.00 0.00 C ATOM 1251 SD MET A 79 74.945 -10.691 4.186 1.00 0.00 S ATOM 1252 CE MET A 79 75.941 -12.148 3.786 1.00 0.00 C ATOM 0 H MET A 79 74.034 -5.974 2.524 1.00 0.00 H new ATOM 0 HA MET A 79 75.895 -7.648 1.213 1.00 0.00 H new ATOM 0 HB2 MET A 79 74.994 -7.859 3.576 1.00 0.00 H new ATOM 0 HB3 MET A 79 73.505 -8.497 2.910 1.00 0.00 H new ATOM 0 HG2 MET A 79 74.781 -10.348 1.803 1.00 0.00 H new ATOM 0 HG3 MET A 79 76.282 -9.702 2.437 1.00 0.00 H new ATOM 0 HE1 MET A 79 75.914 -12.847 4.622 1.00 0.00 H new ATOM 0 HE2 MET A 79 75.538 -12.631 2.896 1.00 0.00 H new ATOM 0 HE3 MET A 79 76.971 -11.845 3.600 1.00 0.00 H new ATOM 1262 N VAL A 80 72.792 -8.011 0.192 1.00 0.00 N ATOM 1263 CA VAL A 80 71.985 -8.578 -0.921 1.00 0.00 C ATOM 1264 C VAL A 80 72.412 -7.907 -2.232 1.00 0.00 C ATOM 1265 O VAL A 80 72.410 -8.516 -3.283 1.00 0.00 O ATOM 1266 CB VAL A 80 70.496 -8.322 -0.659 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.681 -8.628 -1.922 1.00 0.00 C ATOM 1268 CG2 VAL A 80 70.024 -9.233 0.476 1.00 0.00 C ATOM 0 H VAL A 80 72.277 -7.417 0.841 1.00 0.00 H new ATOM 0 HA VAL A 80 72.149 -9.653 -0.991 1.00 0.00 H new ATOM 0 HB VAL A 80 70.353 -7.277 -0.385 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.625 -8.443 -1.727 1.00 0.00 H new ATOM 0 HG12 VAL A 80 70.017 -7.986 -2.736 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.821 -9.672 -2.201 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.966 -9.056 0.668 1.00 0.00 H new ATOM 0 HG22 VAL A 80 70.172 -10.275 0.192 1.00 0.00 H new ATOM 0 HG23 VAL A 80 70.597 -9.018 1.378 1.00 0.00 H new ATOM 1278 N THR A 81 72.787 -6.657 -2.170 1.00 0.00 N ATOM 1279 CA THR A 81 73.223 -5.953 -3.409 1.00 0.00 C ATOM 1280 C THR A 81 74.471 -6.642 -3.966 1.00 0.00 C ATOM 1281 O THR A 81 74.589 -6.866 -5.155 1.00 0.00 O ATOM 1282 CB THR A 81 73.539 -4.487 -3.094 1.00 0.00 C ATOM 1283 OG1 THR A 81 72.376 -3.855 -2.579 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.991 -3.768 -4.370 1.00 0.00 C ATOM 0 H THR A 81 72.810 -6.096 -1.319 1.00 0.00 H new ATOM 0 HA THR A 81 72.423 -5.990 -4.148 1.00 0.00 H new ATOM 0 HB THR A 81 74.338 -4.440 -2.355 1.00 0.00 H new ATOM 0 HG1 THR A 81 72.336 -3.984 -1.608 1.00 0.00 H new ATOM 0 HG21 THR A 81 74.214 -2.726 -4.141 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.884 -4.253 -4.764 1.00 0.00 H new ATOM 0 HG23 THR A 81 73.196 -3.813 -5.114 1.00 0.00 H new ATOM 1292 N THR A 82 75.401 -6.993 -3.116 1.00 0.00 N ATOM 1293 CA THR A 82 76.627 -7.679 -3.599 1.00 0.00 C ATOM 1294 C THR A 82 76.254 -9.094 -4.045 1.00 0.00 C ATOM 1295 O THR A 82 76.571 -9.520 -5.138 1.00 0.00 O ATOM 1296 CB THR A 82 77.643 -7.746 -2.454 1.00 0.00 C ATOM 1297 OG1 THR A 82 77.046 -8.387 -1.334 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.079 -6.331 -2.061 1.00 0.00 C ATOM 0 H THR A 82 75.361 -6.833 -2.110 1.00 0.00 H new ATOM 0 HA THR A 82 77.063 -7.135 -4.437 1.00 0.00 H new ATOM 0 HB THR A 82 78.517 -8.311 -2.779 1.00 0.00 H new ATOM 0 HG1 THR A 82 76.102 -8.129 -1.274 1.00 0.00 H new ATOM 0 HG21 THR A 82 78.801 -6.386 -1.246 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.537 -5.840 -2.920 1.00 0.00 H new ATOM 0 HG23 THR A 82 77.209 -5.759 -1.737 1.00 0.00 H new ATOM 1306 N ALA A 83 75.587 -9.826 -3.195 1.00 0.00 N ATOM 1307 CA ALA A 83 75.191 -11.219 -3.548 1.00 0.00 C ATOM 1308 C ALA A 83 74.545 -11.231 -4.937 1.00 0.00 C ATOM 1309 O ALA A 83 74.764 -12.129 -5.725 1.00 0.00 O ATOM 1310 CB ALA A 83 74.189 -11.743 -2.516 1.00 0.00 C ATOM 0 H ALA A 83 75.298 -9.518 -2.267 1.00 0.00 H new ATOM 0 HA ALA A 83 76.075 -11.856 -3.553 1.00 0.00 H new ATOM 0 HB1 ALA A 83 73.900 -12.762 -2.774 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.648 -11.736 -1.527 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.305 -11.105 -2.510 1.00 0.00 H new ATOM 1316 N CYS A 84 73.744 -10.247 -5.240 1.00 0.00 N ATOM 1317 CA CYS A 84 73.079 -10.214 -6.574 1.00 0.00 C ATOM 1318 C CYS A 84 74.145 -10.270 -7.673 1.00 0.00 C ATOM 1319 O CYS A 84 75.193 -9.664 -7.567 1.00 0.00 O ATOM 1320 CB CYS A 84 72.278 -8.918 -6.706 1.00 0.00 C ATOM 1321 SG CYS A 84 70.859 -8.970 -5.583 1.00 0.00 S ATOM 0 H CYS A 84 73.521 -9.466 -4.623 1.00 0.00 H new ATOM 0 HA CYS A 84 72.409 -11.068 -6.673 1.00 0.00 H new ATOM 0 HB2 CYS A 84 72.910 -8.062 -6.471 1.00 0.00 H new ATOM 0 HB3 CYS A 84 71.938 -8.791 -7.734 1.00 0.00 H new ATOM 0 HG CYS A 84 71.245 -8.659 -4.381 1.00 0.00 H new ATOM 1327 N HIS A 85 73.888 -11.005 -8.724 1.00 0.00 N ATOM 1328 CA HIS A 85 74.891 -11.112 -9.822 1.00 0.00 C ATOM 1329 C HIS A 85 75.159 -9.729 -10.414 1.00 0.00 C ATOM 1330 O HIS A 85 74.256 -8.942 -10.618 1.00 0.00 O ATOM 1331 CB HIS A 85 74.351 -12.031 -10.921 1.00 0.00 C ATOM 1332 CG HIS A 85 74.163 -13.419 -10.375 1.00 0.00 C ATOM 1333 ND1 HIS A 85 72.958 -13.843 -9.829 1.00 0.00 N ATOM 1334 CD2 HIS A 85 75.012 -14.494 -10.288 1.00 0.00 C ATOM 1335 CE1 HIS A 85 73.116 -15.123 -9.442 1.00 0.00 C ATOM 1336 NE2 HIS A 85 74.348 -15.564 -9.699 1.00 0.00 N ATOM 0 H HIS A 85 73.028 -11.534 -8.868 1.00 0.00 H new ATOM 0 HA HIS A 85 75.817 -11.522 -9.420 1.00 0.00 H new ATOM 0 HB2 HIS A 85 73.403 -11.646 -11.297 1.00 0.00 H new ATOM 0 HB3 HIS A 85 75.043 -12.052 -11.763 1.00 0.00 H new ATOM 0 HD2 HIS A 85 76.038 -14.507 -10.625 1.00 0.00 H new ATOM 0 HE1 HIS A 85 72.342 -15.718 -8.981 1.00 0.00 H new ATOM 0 HE2 HIS A 85 74.724 -16.492 -9.504 1.00 0.00 H new ATOM 1345 N GLU A 86 76.396 -9.432 -10.700 1.00 0.00 N ATOM 1346 CA GLU A 86 76.728 -8.107 -11.286 1.00 0.00 C ATOM 1347 C GLU A 86 76.309 -8.085 -12.758 1.00 0.00 C ATOM 1348 O GLU A 86 76.478 -9.050 -13.476 1.00 0.00 O ATOM 1349 CB GLU A 86 78.235 -7.867 -11.173 1.00 0.00 C ATOM 1350 CG GLU A 86 78.607 -7.679 -9.701 1.00 0.00 C ATOM 1351 CD GLU A 86 80.112 -7.437 -9.578 1.00 0.00 C ATOM 1352 OE1 GLU A 86 80.760 -7.328 -10.606 1.00 0.00 O ATOM 1353 OE2 GLU A 86 80.591 -7.363 -8.459 1.00 0.00 O ATOM 0 H GLU A 86 77.192 -10.052 -10.552 1.00 0.00 H new ATOM 0 HA GLU A 86 76.196 -7.322 -10.748 1.00 0.00 H new ATOM 0 HB2 GLU A 86 78.782 -8.711 -11.593 1.00 0.00 H new ATOM 0 HB3 GLU A 86 78.519 -6.985 -11.747 1.00 0.00 H new ATOM 0 HG2 GLU A 86 78.058 -6.836 -9.282 1.00 0.00 H new ATOM 0 HG3 GLU A 86 78.323 -8.562 -9.128 1.00 0.00 H new ATOM 1360 N PHE A 87 75.766 -6.990 -13.215 1.00 0.00 N ATOM 1361 CA PHE A 87 75.337 -6.905 -14.641 1.00 0.00 C ATOM 1362 C PHE A 87 74.481 -8.128 -14.987 1.00 0.00 C ATOM 1363 O PHE A 87 74.895 -8.998 -15.728 1.00 0.00 O ATOM 1364 CB PHE A 87 76.573 -6.861 -15.548 1.00 0.00 C ATOM 1365 CG PHE A 87 76.155 -7.010 -16.996 1.00 0.00 C ATOM 1366 CD1 PHE A 87 75.467 -5.969 -17.629 1.00 0.00 C ATOM 1367 CD2 PHE A 87 76.446 -8.187 -17.702 1.00 0.00 C ATOM 1368 CE1 PHE A 87 75.073 -6.100 -18.966 1.00 0.00 C ATOM 1369 CE2 PHE A 87 76.050 -8.317 -19.039 1.00 0.00 C ATOM 1370 CZ PHE A 87 75.364 -7.273 -19.671 1.00 0.00 C ATOM 0 H PHE A 87 75.600 -6.149 -12.662 1.00 0.00 H new ATOM 0 HA PHE A 87 74.751 -5.999 -14.793 1.00 0.00 H new ATOM 0 HB2 PHE A 87 77.104 -5.919 -15.409 1.00 0.00 H new ATOM 0 HB3 PHE A 87 77.263 -7.659 -15.276 1.00 0.00 H new ATOM 0 HD1 PHE A 87 75.240 -5.064 -17.086 1.00 0.00 H new ATOM 0 HD2 PHE A 87 76.975 -8.992 -17.215 1.00 0.00 H new ATOM 0 HE1 PHE A 87 74.544 -5.295 -19.454 1.00 0.00 H new ATOM 0 HE2 PHE A 87 76.274 -9.223 -19.583 1.00 0.00 H new ATOM 0 HZ PHE A 87 75.060 -7.373 -20.702 1.00 0.00 H new ATOM 1380 N PHE A 88 73.293 -8.202 -14.455 1.00 0.00 N ATOM 1381 CA PHE A 88 72.412 -9.364 -14.752 1.00 0.00 C ATOM 1382 C PHE A 88 72.100 -9.384 -16.253 1.00 0.00 C ATOM 1383 O PHE A 88 71.897 -8.353 -16.865 1.00 0.00 O ATOM 1384 CB PHE A 88 71.118 -9.226 -13.946 1.00 0.00 C ATOM 1385 CG PHE A 88 70.233 -10.424 -14.177 1.00 0.00 C ATOM 1386 CD1 PHE A 88 70.346 -11.545 -13.347 1.00 0.00 C ATOM 1387 CD2 PHE A 88 69.292 -10.412 -15.212 1.00 0.00 C ATOM 1388 CE1 PHE A 88 69.519 -12.655 -13.552 1.00 0.00 C ATOM 1389 CE2 PHE A 88 68.466 -11.522 -15.420 1.00 0.00 C ATOM 1390 CZ PHE A 88 68.578 -12.643 -14.589 1.00 0.00 C ATOM 0 H PHE A 88 72.894 -7.506 -13.826 1.00 0.00 H new ATOM 0 HA PHE A 88 72.908 -10.295 -14.478 1.00 0.00 H new ATOM 0 HB2 PHE A 88 71.350 -9.135 -12.885 1.00 0.00 H new ATOM 0 HB3 PHE A 88 70.594 -8.316 -14.238 1.00 0.00 H new ATOM 0 HD1 PHE A 88 71.072 -11.553 -12.548 1.00 0.00 H new ATOM 0 HD2 PHE A 88 69.203 -9.546 -15.851 1.00 0.00 H new ATOM 0 HE1 PHE A 88 69.606 -13.520 -12.911 1.00 0.00 H new ATOM 0 HE2 PHE A 88 67.742 -11.514 -16.221 1.00 0.00 H new ATOM 0 HZ PHE A 88 67.939 -13.499 -14.748 1.00 0.00 H new ATOM 1400 N GLU A 89 72.081 -10.543 -16.858 1.00 0.00 N ATOM 1401 CA GLU A 89 71.800 -10.615 -18.323 1.00 0.00 C ATOM 1402 C GLU A 89 70.294 -10.515 -18.574 1.00 0.00 C ATOM 1403 O GLU A 89 69.488 -10.922 -17.762 1.00 0.00 O ATOM 1404 CB GLU A 89 72.333 -11.942 -18.881 1.00 0.00 C ATOM 1405 CG GLU A 89 71.634 -13.119 -18.194 1.00 0.00 C ATOM 1406 CD GLU A 89 72.202 -14.434 -18.733 1.00 0.00 C ATOM 1407 OE1 GLU A 89 72.814 -14.405 -19.787 1.00 0.00 O ATOM 1408 OE2 GLU A 89 72.018 -15.447 -18.078 1.00 0.00 O ATOM 0 H GLU A 89 72.247 -11.440 -16.403 1.00 0.00 H new ATOM 0 HA GLU A 89 72.297 -9.784 -18.825 1.00 0.00 H new ATOM 0 HB2 GLU A 89 72.165 -11.987 -19.957 1.00 0.00 H new ATOM 0 HB3 GLU A 89 73.410 -12.006 -18.723 1.00 0.00 H new ATOM 0 HG2 GLU A 89 71.779 -13.063 -17.115 1.00 0.00 H new ATOM 0 HG3 GLU A 89 70.560 -13.073 -18.374 1.00 0.00 H new ATOM 1415 N HIS A 90 69.909 -9.974 -19.696 1.00 0.00 N ATOM 1416 CA HIS A 90 68.457 -9.845 -20.000 1.00 0.00 C ATOM 1417 C HIS A 90 67.762 -9.118 -18.852 1.00 0.00 C ATOM 1418 O HIS A 90 67.459 -9.696 -17.827 1.00 0.00 O ATOM 1419 CB HIS A 90 67.829 -11.224 -20.173 1.00 0.00 C ATOM 1420 CG HIS A 90 68.693 -12.070 -21.067 1.00 0.00 C ATOM 1421 ND1 HIS A 90 69.192 -13.301 -20.663 1.00 0.00 N ATOM 1422 CD2 HIS A 90 69.153 -11.882 -22.348 1.00 0.00 C ATOM 1423 CE1 HIS A 90 69.914 -13.801 -21.683 1.00 0.00 C ATOM 1424 NE2 HIS A 90 69.922 -12.975 -22.729 1.00 0.00 N ATOM 0 H HIS A 90 70.537 -9.616 -20.415 1.00 0.00 H new ATOM 0 HA HIS A 90 68.339 -9.280 -20.925 1.00 0.00 H new ATOM 0 HB2 HIS A 90 67.714 -11.705 -19.202 1.00 0.00 H new ATOM 0 HB3 HIS A 90 66.831 -11.128 -20.601 1.00 0.00 H new ATOM 0 HD2 HIS A 90 68.949 -11.018 -22.964 1.00 0.00 H new ATOM 0 HE1 HIS A 90 70.423 -14.753 -21.657 1.00 0.00 H new ATOM 0 HE2 HIS A 90 70.394 -13.116 -23.622 1.00 0.00 H new ATOM 1433 N GLU A 91 67.512 -7.854 -19.015 1.00 0.00 N ATOM 1434 CA GLU A 91 66.840 -7.079 -17.935 1.00 0.00 C ATOM 1435 C GLU A 91 65.421 -7.615 -17.730 1.00 0.00 C ATOM 1436 O GLU A 91 65.079 -7.911 -16.597 1.00 0.00 O ATOM 1437 CB GLU A 91 66.782 -5.603 -18.332 1.00 0.00 C ATOM 1438 CG GLU A 91 66.105 -4.796 -17.222 1.00 0.00 C ATOM 1439 CD GLU A 91 66.170 -3.307 -17.562 1.00 0.00 C ATOM 1440 OE1 GLU A 91 66.741 -2.979 -18.590 1.00 0.00 O ATOM 1441 OE2 GLU A 91 65.648 -2.520 -16.790 1.00 0.00 O ATOM 1442 OXT GLU A 91 64.701 -7.723 -18.710 1.00 0.00 O ATOM 0 H GLU A 91 67.744 -7.319 -19.852 1.00 0.00 H new ATOM 0 HA GLU A 91 67.401 -7.182 -17.006 1.00 0.00 H new ATOM 0 HB2 GLU A 91 67.789 -5.224 -18.508 1.00 0.00 H new ATOM 0 HB3 GLU A 91 66.231 -5.489 -19.265 1.00 0.00 H new ATOM 0 HG2 GLU A 91 65.067 -5.110 -17.111 1.00 0.00 H new ATOM 0 HG3 GLU A 91 66.598 -4.984 -16.268 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 60.072 -7.068 -8.416 1.00 0.00 N ATOM 1451 CA SER B 1 59.304 -6.108 -7.574 1.00 0.00 C ATOM 1452 C SER B 1 59.938 -4.720 -7.676 1.00 0.00 C ATOM 1453 O SER B 1 61.031 -4.564 -8.184 1.00 0.00 O ATOM 1454 CB SER B 1 59.337 -6.571 -6.116 1.00 0.00 C ATOM 1455 OG SER B 1 60.581 -6.202 -5.535 1.00 0.00 O ATOM 0 H1 SER B 1 60.185 -7.966 -7.904 1.00 0.00 H new ATOM 0 H2 SER B 1 59.559 -7.238 -9.304 1.00 0.00 H new ATOM 0 H3 SER B 1 61.009 -6.671 -8.628 1.00 0.00 H new ATOM 0 HA SER B 1 58.272 -6.065 -7.922 1.00 0.00 H new ATOM 0 HB2 SER B 1 58.515 -6.120 -5.560 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.203 -7.651 -6.062 1.00 0.00 H new ATOM 0 HG SER B 1 60.671 -6.628 -4.657 1.00 0.00 H new ATOM 1463 N GLU B 2 59.260 -3.709 -7.207 1.00 0.00 N ATOM 1464 CA GLU B 2 59.816 -2.330 -7.286 1.00 0.00 C ATOM 1465 C GLU B 2 61.141 -2.249 -6.524 1.00 0.00 C ATOM 1466 O GLU B 2 62.046 -1.542 -6.921 1.00 0.00 O ATOM 1467 CB GLU B 2 58.814 -1.346 -6.677 1.00 0.00 C ATOM 1468 CG GLU B 2 57.594 -1.222 -7.592 1.00 0.00 C ATOM 1469 CD GLU B 2 56.597 -0.236 -6.979 1.00 0.00 C ATOM 1470 OE1 GLU B 2 56.793 0.140 -5.836 1.00 0.00 O ATOM 1471 OE2 GLU B 2 55.653 0.123 -7.665 1.00 0.00 O ATOM 0 H GLU B 2 58.341 -3.780 -6.771 1.00 0.00 H new ATOM 0 HA GLU B 2 59.995 -2.076 -8.331 1.00 0.00 H new ATOM 0 HB2 GLU B 2 58.507 -1.689 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU B 2 59.282 -0.371 -6.544 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.900 -0.879 -8.580 1.00 0.00 H new ATOM 0 HG3 GLU B 2 57.124 -2.197 -7.724 1.00 0.00 H new ATOM 1478 N LEU B 3 61.277 -2.963 -5.440 1.00 0.00 N ATOM 1479 CA LEU B 3 62.555 -2.915 -4.673 1.00 0.00 C ATOM 1480 C LEU B 3 63.677 -3.542 -5.503 1.00 0.00 C ATOM 1481 O LEU B 3 64.821 -3.143 -5.417 1.00 0.00 O ATOM 1482 CB LEU B 3 62.416 -3.724 -3.381 1.00 0.00 C ATOM 1483 CG LEU B 3 61.465 -3.032 -2.398 1.00 0.00 C ATOM 1484 CD1 LEU B 3 61.225 -3.975 -1.214 1.00 0.00 C ATOM 1485 CD2 LEU B 3 62.078 -1.710 -1.893 1.00 0.00 C ATOM 0 H LEU B 3 60.560 -3.577 -5.053 1.00 0.00 H new ATOM 0 HA LEU B 3 62.785 -1.874 -4.445 1.00 0.00 H new ATOM 0 HB2 LEU B 3 62.043 -4.722 -3.611 1.00 0.00 H new ATOM 0 HB3 LEU B 3 63.395 -3.848 -2.919 1.00 0.00 H new ATOM 0 HG LEU B 3 60.524 -2.803 -2.899 1.00 0.00 H new ATOM 0 HD11 LEU B 3 60.550 -3.500 -0.502 1.00 0.00 H new ATOM 0 HD12 LEU B 3 60.780 -4.903 -1.573 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.174 -4.193 -0.724 1.00 0.00 H new ATOM 0 HD21 LEU B 3 61.389 -1.232 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU B 3 63.021 -1.916 -1.387 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.257 -1.046 -2.738 1.00 0.00 H new ATOM 1497 N GLU B 4 63.363 -4.531 -6.295 1.00 0.00 N ATOM 1498 CA GLU B 4 64.418 -5.191 -7.116 1.00 0.00 C ATOM 1499 C GLU B 4 65.015 -4.188 -8.101 1.00 0.00 C ATOM 1500 O GLU B 4 66.211 -4.145 -8.311 1.00 0.00 O ATOM 1501 CB GLU B 4 63.792 -6.354 -7.887 1.00 0.00 C ATOM 1502 CG GLU B 4 63.425 -7.471 -6.910 1.00 0.00 C ATOM 1503 CD GLU B 4 62.730 -8.605 -7.666 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.560 -8.472 -8.867 1.00 0.00 O ATOM 1505 OE2 GLU B 4 62.380 -9.586 -7.032 1.00 0.00 O ATOM 0 H GLU B 4 62.423 -4.910 -6.409 1.00 0.00 H new ATOM 0 HA GLU B 4 65.209 -5.560 -6.464 1.00 0.00 H new ATOM 0 HB2 GLU B 4 62.904 -6.015 -8.420 1.00 0.00 H new ATOM 0 HB3 GLU B 4 64.491 -6.726 -8.636 1.00 0.00 H new ATOM 0 HG2 GLU B 4 64.322 -7.845 -6.416 1.00 0.00 H new ATOM 0 HG3 GLU B 4 62.769 -7.085 -6.130 1.00 0.00 H new ATOM 1512 N LYS B 5 64.191 -3.387 -8.712 1.00 0.00 N ATOM 1513 CA LYS B 5 64.692 -2.385 -9.694 1.00 0.00 C ATOM 1514 C LYS B 5 65.670 -1.430 -9.010 1.00 0.00 C ATOM 1515 O LYS B 5 66.675 -1.044 -9.574 1.00 0.00 O ATOM 1516 CB LYS B 5 63.500 -1.599 -10.248 1.00 0.00 C ATOM 1517 CG LYS B 5 63.966 -0.644 -11.348 1.00 0.00 C ATOM 1518 CD LYS B 5 62.759 0.129 -11.886 1.00 0.00 C ATOM 1519 CE LYS B 5 63.208 1.081 -12.997 1.00 0.00 C ATOM 1520 NZ LYS B 5 63.774 0.292 -14.126 1.00 0.00 N ATOM 0 H LYS B 5 63.181 -3.383 -8.572 1.00 0.00 H new ATOM 0 HA LYS B 5 65.210 -2.893 -10.507 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.754 -2.287 -10.645 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.021 -1.037 -9.446 1.00 0.00 H new ATOM 0 HG2 LYS B 5 64.710 0.048 -10.954 1.00 0.00 H new ATOM 0 HG3 LYS B 5 64.444 -1.202 -12.153 1.00 0.00 H new ATOM 0 HD2 LYS B 5 62.012 -0.566 -12.269 1.00 0.00 H new ATOM 0 HD3 LYS B 5 62.287 0.692 -11.081 1.00 0.00 H new ATOM 0 HE2 LYS B 5 62.364 1.678 -13.343 1.00 0.00 H new ATOM 0 HE3 LYS B 5 63.955 1.777 -12.615 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 63.765 0.869 -14.991 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 64.752 0.019 -13.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 63.201 -0.563 -14.274 1.00 0.00 H new ATOM 1534 N ALA B 6 65.380 -1.038 -7.804 1.00 0.00 N ATOM 1535 CA ALA B 6 66.289 -0.098 -7.092 1.00 0.00 C ATOM 1536 C ALA B 6 67.675 -0.735 -6.952 1.00 0.00 C ATOM 1537 O ALA B 6 68.679 -0.118 -7.240 1.00 0.00 O ATOM 1538 CB ALA B 6 65.721 0.203 -5.703 1.00 0.00 C ATOM 0 H ALA B 6 64.554 -1.327 -7.280 1.00 0.00 H new ATOM 0 HA ALA B 6 66.373 0.829 -7.659 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.385 0.891 -5.180 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.735 0.656 -5.804 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.638 -0.724 -5.135 1.00 0.00 H new ATOM 1544 N MET B 7 67.740 -1.963 -6.520 1.00 0.00 N ATOM 1545 CA MET B 7 69.069 -2.625 -6.370 1.00 0.00 C ATOM 1546 C MET B 7 69.767 -2.666 -7.733 1.00 0.00 C ATOM 1547 O MET B 7 70.939 -2.369 -7.856 1.00 0.00 O ATOM 1548 CB MET B 7 68.860 -4.060 -5.883 1.00 0.00 C ATOM 1549 CG MET B 7 68.364 -4.053 -4.437 1.00 0.00 C ATOM 1550 SD MET B 7 68.086 -5.758 -3.894 1.00 0.00 S ATOM 1551 CE MET B 7 67.386 -5.372 -2.272 1.00 0.00 C ATOM 0 H MET B 7 66.936 -2.536 -6.265 1.00 0.00 H new ATOM 0 HA MET B 7 69.677 -2.071 -5.655 1.00 0.00 H new ATOM 0 HB2 MET B 7 68.138 -4.568 -6.522 1.00 0.00 H new ATOM 0 HB3 MET B 7 69.795 -4.617 -5.953 1.00 0.00 H new ATOM 0 HG2 MET B 7 69.096 -3.568 -3.791 1.00 0.00 H new ATOM 0 HG3 MET B 7 67.441 -3.479 -4.360 1.00 0.00 H new ATOM 0 HE1 MET B 7 67.137 -6.298 -1.753 1.00 0.00 H new ATOM 0 HE2 MET B 7 68.114 -4.812 -1.685 1.00 0.00 H new ATOM 0 HE3 MET B 7 66.484 -4.773 -2.398 1.00 0.00 H new ATOM 1561 N VAL B 8 69.057 -3.076 -8.746 1.00 0.00 N ATOM 1562 CA VAL B 8 69.664 -3.195 -10.103 1.00 0.00 C ATOM 1563 C VAL B 8 70.191 -1.839 -10.592 1.00 0.00 C ATOM 1564 O VAL B 8 71.235 -1.767 -11.210 1.00 0.00 O ATOM 1565 CB VAL B 8 68.590 -3.700 -11.076 1.00 0.00 C ATOM 1566 CG1 VAL B 8 69.112 -3.642 -12.515 1.00 0.00 C ATOM 1567 CG2 VAL B 8 68.224 -5.144 -10.723 1.00 0.00 C ATOM 0 H VAL B 8 68.072 -3.337 -8.692 1.00 0.00 H new ATOM 0 HA VAL B 8 70.502 -3.891 -10.056 1.00 0.00 H new ATOM 0 HB VAL B 8 67.708 -3.065 -10.994 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.341 -4.003 -13.196 1.00 0.00 H new ATOM 0 HG12 VAL B 8 69.368 -2.613 -12.768 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.999 -4.269 -12.606 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.461 -5.505 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL B 8 69.111 -5.773 -10.801 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.839 -5.183 -9.704 1.00 0.00 H new ATOM 1577 N ALA B 9 69.486 -0.769 -10.350 1.00 0.00 N ATOM 1578 CA ALA B 9 69.971 0.554 -10.840 1.00 0.00 C ATOM 1579 C ALA B 9 71.340 0.883 -10.239 1.00 0.00 C ATOM 1580 O ALA B 9 72.235 1.330 -10.929 1.00 0.00 O ATOM 1581 CB ALA B 9 68.967 1.640 -10.451 1.00 0.00 C ATOM 0 H ALA B 9 68.603 -0.751 -9.839 1.00 0.00 H new ATOM 0 HA ALA B 9 70.068 0.511 -11.925 1.00 0.00 H new ATOM 0 HB1 ALA B 9 69.320 2.607 -10.809 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.999 1.419 -10.901 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.865 1.669 -9.366 1.00 0.00 H new ATOM 1587 N LEU B 10 71.514 0.675 -8.966 1.00 0.00 N ATOM 1588 CA LEU B 10 72.832 0.992 -8.341 1.00 0.00 C ATOM 1589 C LEU B 10 73.930 0.158 -9.011 1.00 0.00 C ATOM 1590 O LEU B 10 74.959 0.673 -9.398 1.00 0.00 O ATOM 1591 CB LEU B 10 72.782 0.674 -6.833 1.00 0.00 C ATOM 1592 CG LEU B 10 72.188 1.856 -6.036 1.00 0.00 C ATOM 1593 CD1 LEU B 10 73.203 3.010 -5.932 1.00 0.00 C ATOM 1594 CD2 LEU B 10 70.904 2.362 -6.711 1.00 0.00 C ATOM 0 H LEU B 10 70.808 0.302 -8.332 1.00 0.00 H new ATOM 0 HA LEU B 10 73.051 2.051 -8.475 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.181 -0.220 -6.666 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.786 0.455 -6.471 1.00 0.00 H new ATOM 0 HG LEU B 10 71.953 1.502 -5.032 1.00 0.00 H new ATOM 0 HD11 LEU B 10 72.763 3.832 -5.367 1.00 0.00 H new ATOM 0 HD12 LEU B 10 74.101 2.660 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU B 10 73.464 3.356 -6.932 1.00 0.00 H new ATOM 0 HD21 LEU B 10 70.496 3.195 -6.139 1.00 0.00 H new ATOM 0 HD22 LEU B 10 71.132 2.695 -7.724 1.00 0.00 H new ATOM 0 HD23 LEU B 10 70.172 1.556 -6.750 1.00 0.00 H new ATOM 1606 N ILE B 11 73.731 -1.125 -9.140 1.00 0.00 N ATOM 1607 CA ILE B 11 74.779 -1.974 -9.773 1.00 0.00 C ATOM 1608 C ILE B 11 75.041 -1.495 -11.204 1.00 0.00 C ATOM 1609 O ILE B 11 76.167 -1.266 -11.597 1.00 0.00 O ATOM 1610 CB ILE B 11 74.286 -3.421 -9.811 1.00 0.00 C ATOM 1611 CG1 ILE B 11 74.099 -3.936 -8.381 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.311 -4.291 -10.540 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.369 -5.280 -8.413 1.00 0.00 C ATOM 0 H ILE B 11 72.893 -1.620 -8.836 1.00 0.00 H new ATOM 0 HA ILE B 11 75.701 -1.905 -9.196 1.00 0.00 H new ATOM 0 HB ILE B 11 73.333 -3.466 -10.339 1.00 0.00 H new ATOM 0 HG12 ILE B 11 75.068 -4.048 -7.894 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.529 -3.215 -7.795 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.959 -5.322 -10.567 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.440 -3.925 -11.559 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.265 -4.247 -10.015 1.00 0.00 H new ATOM 0 HD11 ILE B 11 73.236 -5.646 -7.395 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.394 -5.153 -8.883 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.956 -5.999 -8.984 1.00 0.00 H new ATOM 1625 N ASP B 12 74.008 -1.361 -11.988 1.00 0.00 N ATOM 1626 CA ASP B 12 74.196 -0.919 -13.399 1.00 0.00 C ATOM 1627 C ASP B 12 74.854 0.464 -13.426 1.00 0.00 C ATOM 1628 O ASP B 12 75.748 0.721 -14.208 1.00 0.00 O ATOM 1629 CB ASP B 12 72.833 -0.844 -14.092 1.00 0.00 C ATOM 1630 CG ASP B 12 73.026 -0.462 -15.560 1.00 0.00 C ATOM 1631 OD1 ASP B 12 74.132 -0.090 -15.914 1.00 0.00 O ATOM 1632 OD2 ASP B 12 72.064 -0.548 -16.305 1.00 0.00 O ATOM 0 H ASP B 12 73.042 -1.538 -11.713 1.00 0.00 H new ATOM 0 HA ASP B 12 74.835 -1.633 -13.918 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.323 -1.805 -14.019 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.200 -0.109 -13.594 1.00 0.00 H new ATOM 1637 N VAL B 13 74.422 1.354 -12.577 1.00 0.00 N ATOM 1638 CA VAL B 13 75.028 2.716 -12.558 1.00 0.00 C ATOM 1639 C VAL B 13 76.477 2.624 -12.064 1.00 0.00 C ATOM 1640 O VAL B 13 77.365 3.261 -12.596 1.00 0.00 O ATOM 1641 CB VAL B 13 74.212 3.625 -11.630 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.957 4.945 -11.406 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.850 3.918 -12.268 1.00 0.00 C ATOM 0 H VAL B 13 73.678 1.199 -11.897 1.00 0.00 H new ATOM 0 HA VAL B 13 75.021 3.135 -13.564 1.00 0.00 H new ATOM 0 HB VAL B 13 74.071 3.122 -10.673 1.00 0.00 H new ATOM 0 HG11 VAL B 13 74.372 5.586 -10.746 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.926 4.743 -10.950 1.00 0.00 H new ATOM 0 HG13 VAL B 13 75.104 5.447 -12.362 1.00 0.00 H new ATOM 0 HG21 VAL B 13 72.271 4.564 -11.608 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.997 4.416 -13.226 1.00 0.00 H new ATOM 0 HG23 VAL B 13 72.312 2.983 -12.424 1.00 0.00 H new ATOM 1653 N PHE B 14 76.726 1.838 -11.049 1.00 0.00 N ATOM 1654 CA PHE B 14 78.119 1.715 -10.524 1.00 0.00 C ATOM 1655 C PHE B 14 79.050 1.190 -11.622 1.00 0.00 C ATOM 1656 O PHE B 14 80.094 1.756 -11.885 1.00 0.00 O ATOM 1657 CB PHE B 14 78.117 0.727 -9.353 1.00 0.00 C ATOM 1658 CG PHE B 14 79.524 0.516 -8.840 1.00 0.00 C ATOM 1659 CD1 PHE B 14 80.319 -0.500 -9.386 1.00 0.00 C ATOM 1660 CD2 PHE B 14 80.027 1.319 -7.807 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.617 -0.713 -8.901 1.00 0.00 C ATOM 1662 CE2 PHE B 14 81.326 1.105 -7.324 1.00 0.00 C ATOM 1663 CZ PHE B 14 82.118 0.090 -7.871 1.00 0.00 C ATOM 0 H PHE B 14 76.027 1.277 -10.562 1.00 0.00 H new ATOM 0 HA PHE B 14 78.472 2.693 -10.196 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.483 1.105 -8.551 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.693 -0.225 -9.673 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.932 -1.120 -10.181 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.415 2.102 -7.384 1.00 0.00 H new ATOM 0 HE1 PHE B 14 82.230 -1.496 -9.322 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.715 1.724 -6.529 1.00 0.00 H new ATOM 0 HZ PHE B 14 83.118 -0.074 -7.497 1.00 0.00 H new ATOM 1673 N HIS B 15 78.712 0.082 -12.223 1.00 0.00 N ATOM 1674 CA HIS B 15 79.602 -0.527 -13.255 1.00 0.00 C ATOM 1675 C HIS B 15 79.841 0.414 -14.436 1.00 0.00 C ATOM 1676 O HIS B 15 80.957 0.539 -14.902 1.00 0.00 O ATOM 1677 CB HIS B 15 78.940 -1.809 -13.763 1.00 0.00 C ATOM 1678 CG HIS B 15 79.796 -2.440 -14.825 1.00 0.00 C ATOM 1679 ND1 HIS B 15 81.006 -3.053 -14.533 1.00 0.00 N ATOM 1680 CD2 HIS B 15 79.631 -2.558 -16.183 1.00 0.00 C ATOM 1681 CE1 HIS B 15 81.518 -3.509 -15.693 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.719 -3.232 -16.724 1.00 0.00 N ATOM 0 H HIS B 15 77.850 -0.433 -12.042 1.00 0.00 H new ATOM 0 HA HIS B 15 80.569 -0.733 -12.797 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.796 -2.506 -12.938 1.00 0.00 H new ATOM 0 HB3 HIS B 15 77.952 -1.584 -14.166 1.00 0.00 H new ATOM 0 HD2 HIS B 15 78.787 -2.185 -16.744 1.00 0.00 H new ATOM 0 HE1 HIS B 15 82.458 -4.033 -15.777 1.00 0.00 H new ATOM 0 HE2 HIS B 15 80.874 -3.466 -17.705 1.00 0.00 H new ATOM 1691 N GLN B 16 78.842 1.076 -14.939 1.00 0.00 N ATOM 1692 CA GLN B 16 79.094 1.986 -16.094 1.00 0.00 C ATOM 1693 C GLN B 16 79.907 3.190 -15.622 1.00 0.00 C ATOM 1694 O GLN B 16 80.810 3.649 -16.294 1.00 0.00 O ATOM 1695 CB GLN B 16 77.761 2.456 -16.682 1.00 0.00 C ATOM 1696 CG GLN B 16 77.071 1.281 -17.380 1.00 0.00 C ATOM 1697 CD GLN B 16 75.732 1.743 -17.958 1.00 0.00 C ATOM 1698 OE1 GLN B 16 74.803 0.967 -18.063 1.00 0.00 O ATOM 1699 NE2 GLN B 16 75.592 2.983 -18.337 1.00 0.00 N ATOM 0 H GLN B 16 77.877 1.031 -14.611 1.00 0.00 H new ATOM 0 HA GLN B 16 79.652 1.452 -16.863 1.00 0.00 H new ATOM 0 HB2 GLN B 16 77.122 2.851 -15.892 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.929 3.267 -17.391 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.707 0.893 -18.175 1.00 0.00 H new ATOM 0 HG3 GLN B 16 76.912 0.467 -16.673 1.00 0.00 H new ATOM 0 HE21 GLN B 16 76.372 3.634 -18.249 1.00 0.00 H new ATOM 0 HE22 GLN B 16 74.703 3.301 -18.722 1.00 0.00 H new ATOM 1708 N TYR B 17 79.599 3.696 -14.463 1.00 0.00 N ATOM 1709 CA TYR B 17 80.358 4.863 -13.931 1.00 0.00 C ATOM 1710 C TYR B 17 81.781 4.422 -13.577 1.00 0.00 C ATOM 1711 O TYR B 17 82.752 5.073 -13.912 1.00 0.00 O ATOM 1712 CB TYR B 17 79.652 5.396 -12.682 1.00 0.00 C ATOM 1713 CG TYR B 17 80.409 6.581 -12.128 1.00 0.00 C ATOM 1714 CD1 TYR B 17 81.422 6.389 -11.180 1.00 0.00 C ATOM 1715 CD2 TYR B 17 80.096 7.874 -12.565 1.00 0.00 C ATOM 1716 CE1 TYR B 17 82.120 7.490 -10.669 1.00 0.00 C ATOM 1717 CE2 TYR B 17 80.794 8.974 -12.054 1.00 0.00 C ATOM 1718 CZ TYR B 17 81.805 8.783 -11.105 1.00 0.00 C ATOM 1719 OH TYR B 17 82.491 9.869 -10.600 1.00 0.00 O ATOM 0 H TYR B 17 78.853 3.352 -13.858 1.00 0.00 H new ATOM 0 HA TYR B 17 80.403 5.651 -14.683 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.631 5.688 -12.928 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.586 4.611 -11.928 1.00 0.00 H new ATOM 0 HD1 TYR B 17 81.665 5.392 -10.843 1.00 0.00 H new ATOM 0 HD2 TYR B 17 79.316 8.022 -13.297 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.902 7.342 -9.938 1.00 0.00 H new ATOM 0 HE2 TYR B 17 80.552 9.971 -12.392 1.00 0.00 H new ATOM 0 HH TYR B 17 82.993 9.597 -9.803 1.00 0.00 H new ATOM 1729 N SER B 18 81.902 3.312 -12.902 1.00 0.00 N ATOM 1730 CA SER B 18 83.246 2.797 -12.512 1.00 0.00 C ATOM 1731 C SER B 18 83.943 2.168 -13.720 1.00 0.00 C ATOM 1732 O SER B 18 85.142 1.969 -13.718 1.00 0.00 O ATOM 1733 CB SER B 18 83.083 1.740 -11.420 1.00 0.00 C ATOM 1734 OG SER B 18 84.360 1.225 -11.069 1.00 0.00 O ATOM 0 H SER B 18 81.118 2.733 -12.601 1.00 0.00 H new ATOM 0 HA SER B 18 83.851 3.626 -12.144 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.601 2.176 -10.545 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.438 0.935 -11.771 1.00 0.00 H new ATOM 1740 N GLY B 19 83.202 1.838 -14.745 1.00 0.00 N ATOM 1741 CA GLY B 19 83.817 1.204 -15.950 1.00 0.00 C ATOM 1742 C GLY B 19 84.285 2.273 -16.940 1.00 0.00 C ATOM 1743 O GLY B 19 84.615 1.973 -18.071 1.00 0.00 O ATOM 0 H GLY B 19 82.194 1.981 -14.800 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.661 0.583 -15.650 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.093 0.546 -16.431 1.00 0.00 H new ATOM 1747 N ARG B 20 84.353 3.510 -16.531 1.00 0.00 N ATOM 1748 CA ARG B 20 84.842 4.564 -17.463 1.00 0.00 C ATOM 1749 C ARG B 20 86.351 4.387 -17.652 1.00 0.00 C ATOM 1750 O ARG B 20 86.881 4.535 -18.734 1.00 0.00 O ATOM 1751 CB ARG B 20 84.559 5.952 -16.888 1.00 0.00 C ATOM 1752 CG ARG B 20 83.056 6.227 -16.916 1.00 0.00 C ATOM 1753 CD ARG B 20 82.788 7.618 -16.339 1.00 0.00 C ATOM 1754 NE ARG B 20 83.310 7.686 -14.945 1.00 0.00 N ATOM 1755 CZ ARG B 20 83.194 8.791 -14.260 1.00 0.00 C ATOM 1756 NH1 ARG B 20 82.591 9.822 -14.785 1.00 0.00 N ATOM 1757 NH2 ARG B 20 83.681 8.863 -13.052 1.00 0.00 N ATOM 0 H ARG B 20 84.093 3.835 -15.600 1.00 0.00 H new ATOM 0 HA ARG B 20 84.328 4.472 -18.420 1.00 0.00 H new ATOM 0 HB2 ARG B 20 84.930 6.015 -15.865 1.00 0.00 H new ATOM 0 HB3 ARG B 20 85.088 6.710 -17.466 1.00 0.00 H new ATOM 0 HG2 ARG B 20 82.682 6.166 -17.938 1.00 0.00 H new ATOM 0 HG3 ARG B 20 82.525 5.472 -16.337 1.00 0.00 H new ATOM 0 HD2 ARG B 20 83.268 8.378 -16.956 1.00 0.00 H new ATOM 0 HD3 ARG B 20 81.718 7.828 -16.349 1.00 0.00 H new ATOM 0 HE ARG B 20 83.757 6.870 -14.527 1.00 0.00 H new ATOM 0 HH11 ARG B 20 82.211 9.764 -15.730 1.00 0.00 H new ATOM 0 HH12 ARG B 20 82.500 10.686 -14.251 1.00 0.00 H new ATOM 0 HH21 ARG B 20 84.152 8.056 -12.643 1.00 0.00 H new ATOM 0 HH22 ARG B 20 83.591 9.726 -12.516 1.00 0.00 H new ATOM 1771 N GLU B 21 87.038 4.062 -16.582 1.00 0.00 N ATOM 1772 CA GLU B 21 88.518 3.857 -16.637 1.00 0.00 C ATOM 1773 C GLU B 21 88.822 2.367 -16.473 1.00 0.00 C ATOM 1774 O GLU B 21 87.999 1.606 -16.006 1.00 0.00 O ATOM 1775 CB GLU B 21 89.197 4.636 -15.505 1.00 0.00 C ATOM 1776 CG GLU B 21 89.106 6.138 -15.780 1.00 0.00 C ATOM 1777 CD GLU B 21 87.665 6.606 -15.586 1.00 0.00 C ATOM 1778 OE1 GLU B 21 86.977 6.009 -14.774 1.00 0.00 O ATOM 1779 OE2 GLU B 21 87.274 7.550 -16.250 1.00 0.00 O ATOM 0 H GLU B 21 86.627 3.928 -15.658 1.00 0.00 H new ATOM 0 HA GLU B 21 88.896 4.214 -17.595 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.720 4.402 -14.553 1.00 0.00 H new ATOM 0 HB3 GLU B 21 90.241 4.335 -15.420 1.00 0.00 H new ATOM 0 HG2 GLU B 21 89.770 6.682 -15.108 1.00 0.00 H new ATOM 0 HG3 GLU B 21 89.435 6.353 -16.797 1.00 0.00 H new ATOM 1786 N GLY B 22 89.997 1.943 -16.854 1.00 0.00 N ATOM 1787 CA GLY B 22 90.354 0.499 -16.722 1.00 0.00 C ATOM 1788 C GLY B 22 90.416 0.099 -15.241 1.00 0.00 C ATOM 1789 O GLY B 22 91.250 -0.688 -14.840 1.00 0.00 O ATOM 0 H GLY B 22 90.727 2.534 -17.252 1.00 0.00 H new ATOM 0 HA2 GLY B 22 89.617 -0.114 -17.241 1.00 0.00 H new ATOM 0 HA3 GLY B 22 91.317 0.310 -17.197 1.00 0.00 H new ATOM 1793 N ASP B 23 89.535 0.632 -14.429 1.00 0.00 N ATOM 1794 CA ASP B 23 89.518 0.293 -12.969 1.00 0.00 C ATOM 1795 C ASP B 23 88.114 -0.191 -12.588 1.00 0.00 C ATOM 1796 O ASP B 23 87.243 0.592 -12.265 1.00 0.00 O ATOM 1797 CB ASP B 23 89.868 1.549 -12.170 1.00 0.00 C ATOM 1798 CG ASP B 23 88.841 2.645 -12.463 1.00 0.00 C ATOM 1799 OD1 ASP B 23 88.080 2.480 -13.402 1.00 0.00 O ATOM 1800 OD2 ASP B 23 88.831 3.630 -11.741 1.00 0.00 O ATOM 0 H ASP B 23 88.817 1.296 -14.719 1.00 0.00 H new ATOM 0 HA ASP B 23 90.242 -0.492 -12.751 1.00 0.00 H new ATOM 0 HB2 ASP B 23 89.880 1.323 -11.104 1.00 0.00 H new ATOM 0 HB3 ASP B 23 90.868 1.893 -12.434 1.00 0.00 H new ATOM 1805 N LYS B 24 87.880 -1.478 -12.647 1.00 0.00 N ATOM 1806 CA LYS B 24 86.523 -2.020 -12.315 1.00 0.00 C ATOM 1807 C LYS B 24 86.481 -2.581 -10.888 1.00 0.00 C ATOM 1808 O LYS B 24 87.246 -3.457 -10.542 1.00 0.00 O ATOM 1809 CB LYS B 24 86.185 -3.141 -13.298 1.00 0.00 C ATOM 1810 CG LYS B 24 86.005 -2.552 -14.699 1.00 0.00 C ATOM 1811 CD LYS B 24 85.669 -3.671 -15.684 1.00 0.00 C ATOM 1812 CE LYS B 24 85.487 -3.083 -17.084 1.00 0.00 C ATOM 1813 NZ LYS B 24 85.231 -4.183 -18.057 1.00 0.00 N ATOM 0 H LYS B 24 88.571 -2.180 -12.911 1.00 0.00 H new ATOM 0 HA LYS B 24 85.799 -1.208 -12.387 1.00 0.00 H new ATOM 0 HB2 LYS B 24 86.981 -3.886 -13.304 1.00 0.00 H new ATOM 0 HB3 LYS B 24 85.273 -3.651 -12.986 1.00 0.00 H new ATOM 0 HG2 LYS B 24 85.209 -1.808 -14.692 1.00 0.00 H new ATOM 0 HG3 LYS B 24 86.916 -2.041 -15.010 1.00 0.00 H new ATOM 0 HD2 LYS B 24 86.466 -4.414 -15.691 1.00 0.00 H new ATOM 0 HD3 LYS B 24 84.759 -4.183 -15.372 1.00 0.00 H new ATOM 0 HE2 LYS B 24 84.655 -2.378 -17.089 1.00 0.00 H new ATOM 0 HE3 LYS B 24 86.378 -2.526 -17.375 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 85.107 -3.783 -19.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 86.038 -4.839 -18.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 84.369 -4.696 -17.782 1.00 0.00 H new ATOM 1827 N HIS B 25 85.579 -2.072 -10.074 1.00 0.00 N ATOM 1828 CA HIS B 25 85.417 -2.531 -8.655 1.00 0.00 C ATOM 1829 C HIS B 25 86.340 -1.746 -7.718 1.00 0.00 C ATOM 1830 O HIS B 25 86.737 -2.231 -6.677 1.00 0.00 O ATOM 1831 CB HIS B 25 85.710 -4.031 -8.546 1.00 0.00 C ATOM 1832 CG HIS B 25 85.004 -4.610 -7.346 1.00 0.00 C ATOM 1833 ND1 HIS B 25 85.697 -5.127 -6.258 1.00 0.00 N ATOM 1834 CD2 HIS B 25 83.672 -4.752 -7.044 1.00 0.00 C ATOM 1835 CE1 HIS B 25 84.786 -5.549 -5.361 1.00 0.00 C ATOM 1836 NE2 HIS B 25 83.541 -5.343 -5.793 1.00 0.00 N ATOM 0 H HIS B 25 84.930 -1.334 -10.346 1.00 0.00 H new ATOM 0 HA HIS B 25 84.386 -2.347 -8.354 1.00 0.00 H new ATOM 0 HB2 HIS B 25 85.382 -4.541 -9.452 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.784 -4.194 -8.460 1.00 0.00 H new ATOM 0 HD2 HIS B 25 82.853 -4.451 -7.680 1.00 0.00 H new ATOM 0 HE1 HIS B 25 85.033 -5.998 -4.410 1.00 0.00 H new ATOM 0 HE2 HIS B 25 82.674 -5.571 -5.307 1.00 0.00 H new ATOM 1845 N LYS B 26 86.655 -0.528 -8.059 1.00 0.00 N ATOM 1846 CA LYS B 26 87.518 0.294 -7.166 1.00 0.00 C ATOM 1847 C LYS B 26 87.543 1.737 -7.680 1.00 0.00 C ATOM 1848 O LYS B 26 87.861 1.995 -8.826 1.00 0.00 O ATOM 1849 CB LYS B 26 88.933 -0.294 -7.121 1.00 0.00 C ATOM 1850 CG LYS B 26 89.485 -0.442 -8.537 1.00 0.00 C ATOM 1851 CD LYS B 26 90.774 -1.268 -8.489 1.00 0.00 C ATOM 1852 CE LYS B 26 91.408 -1.315 -9.882 1.00 0.00 C ATOM 1853 NZ LYS B 26 90.637 -2.252 -10.744 1.00 0.00 N ATOM 0 H LYS B 26 86.353 -0.066 -8.917 1.00 0.00 H new ATOM 0 HA LYS B 26 87.116 0.287 -6.153 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.585 0.352 -6.534 1.00 0.00 H new ATOM 0 HB3 LYS B 26 88.916 -1.265 -6.626 1.00 0.00 H new ATOM 0 HG2 LYS B 26 88.750 -0.929 -9.178 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.683 0.539 -8.968 1.00 0.00 H new ATOM 0 HD2 LYS B 26 91.472 -0.830 -7.776 1.00 0.00 H new ATOM 0 HD3 LYS B 26 90.557 -2.279 -8.143 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.415 -0.319 -10.324 1.00 0.00 H new ATOM 0 HE3 LYS B 26 92.446 -1.640 -9.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 91.105 -2.338 -11.669 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 90.595 -3.187 -10.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 89.672 -1.888 -10.877 1.00 0.00 H new ATOM 1867 N LEU B 27 87.172 2.677 -6.842 1.00 0.00 N ATOM 1868 CA LEU B 27 87.130 4.115 -7.265 1.00 0.00 C ATOM 1869 C LEU B 27 88.241 4.917 -6.583 1.00 0.00 C ATOM 1870 O LEU B 27 88.564 4.712 -5.430 1.00 0.00 O ATOM 1871 CB LEU B 27 85.775 4.708 -6.877 1.00 0.00 C ATOM 1872 CG LEU B 27 84.646 3.934 -7.576 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.292 4.412 -7.034 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.708 4.161 -9.100 1.00 0.00 C ATOM 0 H LEU B 27 86.894 2.508 -5.875 1.00 0.00 H new ATOM 0 HA LEU B 27 87.275 4.167 -8.344 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.644 4.662 -5.796 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.735 5.760 -7.158 1.00 0.00 H new ATOM 0 HG LEU B 27 84.765 2.869 -7.376 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.489 3.865 -7.528 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.246 4.233 -5.960 1.00 0.00 H new ATOM 0 HD13 LEU B 27 83.178 5.478 -7.229 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.903 3.607 -9.583 1.00 0.00 H new ATOM 0 HD22 LEU B 27 84.597 5.224 -9.314 1.00 0.00 H new ATOM 0 HD23 LEU B 27 85.668 3.812 -9.481 1.00 0.00 H new ATOM 1886 N LYS B 28 88.812 5.842 -7.307 1.00 0.00 N ATOM 1887 CA LYS B 28 89.900 6.704 -6.754 1.00 0.00 C ATOM 1888 C LYS B 28 89.291 8.033 -6.283 1.00 0.00 C ATOM 1889 O LYS B 28 88.153 8.335 -6.580 1.00 0.00 O ATOM 1890 CB LYS B 28 90.929 6.958 -7.859 1.00 0.00 C ATOM 1891 CG LYS B 28 92.169 7.642 -7.277 1.00 0.00 C ATOM 1892 CD LYS B 28 93.303 7.637 -8.312 1.00 0.00 C ATOM 1893 CE LYS B 28 92.971 8.589 -9.466 1.00 0.00 C ATOM 1894 NZ LYS B 28 94.166 8.739 -10.343 1.00 0.00 N ATOM 0 H LYS B 28 88.566 6.041 -8.277 1.00 0.00 H new ATOM 0 HA LYS B 28 90.387 6.216 -5.910 1.00 0.00 H new ATOM 0 HB2 LYS B 28 91.211 6.015 -8.328 1.00 0.00 H new ATOM 0 HB3 LYS B 28 90.491 7.583 -8.637 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.930 8.666 -6.992 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.489 7.126 -6.372 1.00 0.00 H new ATOM 0 HD2 LYS B 28 94.238 7.939 -7.839 1.00 0.00 H new ATOM 0 HD3 LYS B 28 93.451 6.627 -8.695 1.00 0.00 H new ATOM 0 HE2 LYS B 28 92.130 8.201 -10.041 1.00 0.00 H new ATOM 0 HE3 LYS B 28 92.669 9.561 -9.075 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 93.942 9.385 -11.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 94.956 9.127 -9.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.435 7.810 -10.726 1.00 0.00 H new ATOM 1908 N LYS B 29 90.025 8.827 -5.546 1.00 0.00 N ATOM 1909 CA LYS B 29 89.453 10.122 -5.064 1.00 0.00 C ATOM 1910 C LYS B 29 89.008 10.966 -6.263 1.00 0.00 C ATOM 1911 O LYS B 29 87.976 11.603 -6.233 1.00 0.00 O ATOM 1912 CB LYS B 29 90.500 10.885 -4.237 1.00 0.00 C ATOM 1913 CG LYS B 29 91.643 11.374 -5.135 1.00 0.00 C ATOM 1914 CD LYS B 29 92.743 11.990 -4.267 1.00 0.00 C ATOM 1915 CE LYS B 29 93.860 12.530 -5.164 1.00 0.00 C ATOM 1916 NZ LYS B 29 94.661 11.391 -5.697 1.00 0.00 N ATOM 0 H LYS B 29 90.986 8.639 -5.259 1.00 0.00 H new ATOM 0 HA LYS B 29 88.589 9.919 -4.431 1.00 0.00 H new ATOM 0 HB2 LYS B 29 90.031 11.735 -3.741 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.896 10.238 -3.455 1.00 0.00 H new ATOM 0 HG2 LYS B 29 92.045 10.544 -5.716 1.00 0.00 H new ATOM 0 HG3 LYS B 29 91.271 12.111 -5.847 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.332 12.794 -3.657 1.00 0.00 H new ATOM 0 HD3 LYS B 29 93.142 11.242 -3.582 1.00 0.00 H new ATOM 0 HE2 LYS B 29 93.435 13.106 -5.986 1.00 0.00 H new ATOM 0 HE3 LYS B 29 94.501 13.206 -4.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 95.498 11.758 -6.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 94.964 10.782 -4.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 94.080 10.838 -6.359 1.00 0.00 H new ATOM 1930 N SER B 30 89.768 10.966 -7.325 1.00 0.00 N ATOM 1931 CA SER B 30 89.367 11.760 -8.523 1.00 0.00 C ATOM 1932 C SER B 30 88.013 11.250 -9.021 1.00 0.00 C ATOM 1933 O SER B 30 87.156 12.008 -9.433 1.00 0.00 O ATOM 1934 CB SER B 30 90.409 11.578 -9.626 1.00 0.00 C ATOM 1935 OG SER B 30 90.303 10.263 -10.156 1.00 0.00 O ATOM 0 H SER B 30 90.645 10.453 -7.415 1.00 0.00 H new ATOM 0 HA SER B 30 89.297 12.816 -8.261 1.00 0.00 H new ATOM 0 HB2 SER B 30 90.254 12.314 -10.414 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.410 11.743 -9.228 1.00 0.00 H new ATOM 0 HG SER B 30 90.968 10.142 -10.865 1.00 0.00 H new ATOM 1941 N GLU B 31 87.816 9.963 -8.962 1.00 0.00 N ATOM 1942 CA GLU B 31 86.522 9.374 -9.403 1.00 0.00 C ATOM 1943 C GLU B 31 85.437 9.765 -8.399 1.00 0.00 C ATOM 1944 O GLU B 31 84.291 9.977 -8.743 1.00 0.00 O ATOM 1945 CB GLU B 31 86.638 7.850 -9.445 1.00 0.00 C ATOM 1946 CG GLU B 31 87.569 7.435 -10.585 1.00 0.00 C ATOM 1947 CD GLU B 31 87.697 5.910 -10.604 1.00 0.00 C ATOM 1948 OE1 GLU B 31 86.890 5.276 -11.263 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.600 5.403 -9.958 1.00 0.00 O ATOM 0 H GLU B 31 88.502 9.288 -8.624 1.00 0.00 H new ATOM 0 HA GLU B 31 86.269 9.745 -10.396 1.00 0.00 H new ATOM 0 HB2 GLU B 31 87.023 7.479 -8.495 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.653 7.404 -9.586 1.00 0.00 H new ATOM 0 HG2 GLU B 31 87.177 7.790 -11.538 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.550 7.892 -10.454 1.00 0.00 H new ATOM 1956 N LEU B 32 85.808 9.852 -7.151 1.00 0.00 N ATOM 1957 CA LEU B 32 84.821 10.218 -6.099 1.00 0.00 C ATOM 1958 C LEU B 32 84.411 11.684 -6.274 1.00 0.00 C ATOM 1959 O LEU B 32 83.254 12.035 -6.155 1.00 0.00 O ATOM 1960 CB LEU B 32 85.466 10.011 -4.723 1.00 0.00 C ATOM 1961 CG LEU B 32 84.476 10.361 -3.604 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.248 9.436 -3.678 1.00 0.00 C ATOM 1963 CD2 LEU B 32 85.176 10.180 -2.251 1.00 0.00 C ATOM 0 H LEU B 32 86.756 9.684 -6.815 1.00 0.00 H new ATOM 0 HA LEU B 32 83.933 9.591 -6.182 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.789 8.975 -4.619 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.357 10.633 -4.636 1.00 0.00 H new ATOM 0 HG LEU B 32 84.145 11.393 -3.718 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.551 9.692 -2.880 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.756 9.560 -4.643 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.566 8.400 -3.564 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.483 10.426 -1.447 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.502 9.145 -2.146 1.00 0.00 H new ATOM 0 HD23 LEU B 32 86.042 10.840 -2.198 1.00 0.00 H new ATOM 1975 N LYS B 33 85.355 12.542 -6.552 1.00 0.00 N ATOM 1976 CA LYS B 33 85.022 13.987 -6.729 1.00 0.00 C ATOM 1977 C LYS B 33 84.169 14.182 -7.985 1.00 0.00 C ATOM 1978 O LYS B 33 83.243 14.967 -8.000 1.00 0.00 O ATOM 1979 CB LYS B 33 86.312 14.802 -6.859 1.00 0.00 C ATOM 1980 CG LYS B 33 85.958 16.282 -7.030 1.00 0.00 C ATOM 1981 CD LYS B 33 87.218 17.146 -6.877 1.00 0.00 C ATOM 1982 CE LYS B 33 88.171 16.914 -8.055 1.00 0.00 C ATOM 1983 NZ LYS B 33 88.953 15.667 -7.824 1.00 0.00 N ATOM 0 H LYS B 33 86.341 12.307 -6.664 1.00 0.00 H new ATOM 0 HA LYS B 33 84.460 14.327 -5.859 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.934 14.664 -5.974 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.892 14.453 -7.714 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.512 16.446 -8.011 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.215 16.574 -6.288 1.00 0.00 H new ATOM 0 HD2 LYS B 33 86.941 18.199 -6.827 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.721 16.904 -5.941 1.00 0.00 H new ATOM 0 HE2 LYS B 33 87.606 16.835 -8.984 1.00 0.00 H new ATOM 0 HE3 LYS B 33 88.845 17.764 -8.164 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 89.965 15.860 -7.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 88.798 15.335 -6.850 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 88.643 14.934 -8.493 1.00 0.00 H new ATOM 1997 N GLU B 34 84.475 13.481 -9.044 1.00 0.00 N ATOM 1998 CA GLU B 34 83.677 13.644 -10.294 1.00 0.00 C ATOM 1999 C GLU B 34 82.218 13.285 -10.019 1.00 0.00 C ATOM 2000 O GLU B 34 81.307 13.945 -10.477 1.00 0.00 O ATOM 2001 CB GLU B 34 84.240 12.734 -11.388 1.00 0.00 C ATOM 2002 CG GLU B 34 83.429 12.921 -12.673 1.00 0.00 C ATOM 2003 CD GLU B 34 84.064 12.108 -13.803 1.00 0.00 C ATOM 2004 OE1 GLU B 34 85.120 11.541 -13.577 1.00 0.00 O ATOM 2005 OE2 GLU B 34 83.485 12.069 -14.875 1.00 0.00 O ATOM 0 H GLU B 34 85.238 12.806 -9.098 1.00 0.00 H new ATOM 0 HA GLU B 34 83.735 14.680 -10.628 1.00 0.00 H new ATOM 0 HB2 GLU B 34 85.288 12.971 -11.569 1.00 0.00 H new ATOM 0 HB3 GLU B 34 84.199 11.693 -11.067 1.00 0.00 H new ATOM 0 HG2 GLU B 34 82.399 12.601 -12.515 1.00 0.00 H new ATOM 0 HG3 GLU B 34 83.396 13.976 -12.944 1.00 0.00 H new ATOM 2012 N LEU B 35 81.988 12.225 -9.299 1.00 0.00 N ATOM 2013 CA LEU B 35 80.588 11.796 -9.021 1.00 0.00 C ATOM 2014 C LEU B 35 79.839 12.922 -8.299 1.00 0.00 C ATOM 2015 O LEU B 35 78.706 13.225 -8.615 1.00 0.00 O ATOM 2016 CB LEU B 35 80.632 10.546 -8.130 1.00 0.00 C ATOM 2017 CG LEU B 35 79.215 10.052 -7.806 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.479 9.662 -9.097 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.314 8.830 -6.884 1.00 0.00 C ATOM 0 H LEU B 35 82.711 11.634 -8.889 1.00 0.00 H new ATOM 0 HA LEU B 35 80.071 11.571 -9.954 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.190 9.756 -8.632 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.162 10.773 -7.205 1.00 0.00 H new ATOM 0 HG LEU B 35 78.659 10.849 -7.313 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.476 9.314 -8.853 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.412 10.529 -9.754 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.027 8.866 -9.602 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.313 8.471 -6.647 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.874 8.040 -7.385 1.00 0.00 H new ATOM 0 HD23 LEU B 35 79.826 9.109 -5.963 1.00 0.00 H new ATOM 2031 N ILE B 36 80.464 13.554 -7.346 1.00 0.00 N ATOM 2032 CA ILE B 36 79.788 14.670 -6.622 1.00 0.00 C ATOM 2033 C ILE B 36 79.467 15.797 -7.612 1.00 0.00 C ATOM 2034 O ILE B 36 78.405 16.383 -7.581 1.00 0.00 O ATOM 2035 CB ILE B 36 80.732 15.194 -5.534 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.872 14.137 -4.434 1.00 0.00 C ATOM 2037 CG2 ILE B 36 80.176 16.488 -4.932 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.009 14.528 -3.485 1.00 0.00 C ATOM 0 H ILE B 36 81.413 13.347 -7.036 1.00 0.00 H new ATOM 0 HA ILE B 36 78.862 14.316 -6.169 1.00 0.00 H new ATOM 0 HB ILE B 36 81.707 15.400 -5.975 1.00 0.00 H new ATOM 0 HG12 ILE B 36 79.937 14.048 -3.880 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.074 13.162 -4.877 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.855 16.851 -4.160 1.00 0.00 H new ATOM 0 HG22 ILE B 36 80.080 17.241 -5.714 1.00 0.00 H new ATOM 0 HG23 ILE B 36 79.198 16.294 -4.493 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.106 13.774 -2.704 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.943 14.594 -4.044 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.788 15.494 -3.032 1.00 0.00 H new ATOM 2050 N ASN B 37 80.379 16.115 -8.485 1.00 0.00 N ATOM 2051 CA ASN B 37 80.114 17.207 -9.462 1.00 0.00 C ATOM 2052 C ASN B 37 78.892 16.846 -10.312 1.00 0.00 C ATOM 2053 O ASN B 37 78.018 17.658 -10.542 1.00 0.00 O ATOM 2054 CB ASN B 37 81.334 17.380 -10.370 1.00 0.00 C ATOM 2055 CG ASN B 37 81.069 18.501 -11.377 1.00 0.00 C ATOM 2056 OD1 ASN B 37 79.936 18.875 -11.603 1.00 0.00 O ATOM 2057 ND2 ASN B 37 82.075 19.055 -11.996 1.00 0.00 N ATOM 0 H ASN B 37 81.293 15.669 -8.565 1.00 0.00 H new ATOM 0 HA ASN B 37 79.921 18.137 -8.927 1.00 0.00 H new ATOM 0 HB2 ASN B 37 82.215 17.615 -9.772 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.545 16.448 -10.895 1.00 0.00 H new ATOM 0 HD21 ASN B 37 81.910 19.803 -12.670 1.00 0.00 H new ATOM 0 HD22 ASN B 37 83.027 18.741 -11.806 1.00 0.00 H new ATOM 2064 N ASN B 38 78.835 15.631 -10.783 1.00 0.00 N ATOM 2065 CA ASN B 38 77.683 15.197 -11.626 1.00 0.00 C ATOM 2066 C ASN B 38 76.477 14.831 -10.752 1.00 0.00 C ATOM 2067 O ASN B 38 75.350 15.162 -11.069 1.00 0.00 O ATOM 2068 CB ASN B 38 78.100 13.975 -12.448 1.00 0.00 C ATOM 2069 CG ASN B 38 77.021 13.657 -13.485 1.00 0.00 C ATOM 2070 OD1 ASN B 38 76.175 14.479 -13.772 1.00 0.00 O ATOM 2071 ND2 ASN B 38 77.016 12.486 -14.063 1.00 0.00 N ATOM 0 H ASN B 38 79.542 14.914 -10.619 1.00 0.00 H new ATOM 0 HA ASN B 38 77.399 16.018 -12.284 1.00 0.00 H new ATOM 0 HB2 ASN B 38 79.051 14.167 -12.946 1.00 0.00 H new ATOM 0 HB3 ASN B 38 78.251 13.118 -11.792 1.00 0.00 H new ATOM 0 HD21 ASN B 38 76.301 12.262 -14.756 1.00 0.00 H new ATOM 0 HD22 ASN B 38 77.727 11.795 -13.822 1.00 0.00 H new ATOM 2078 N GLU B 39 76.703 14.122 -9.670 1.00 0.00 N ATOM 2079 CA GLU B 39 75.576 13.690 -8.776 1.00 0.00 C ATOM 2080 C GLU B 39 75.681 14.386 -7.411 1.00 0.00 C ATOM 2081 O GLU B 39 76.702 14.927 -7.054 1.00 0.00 O ATOM 2082 CB GLU B 39 75.667 12.165 -8.591 1.00 0.00 C ATOM 2083 CG GLU B 39 74.332 11.600 -8.086 1.00 0.00 C ATOM 2084 CD GLU B 39 73.268 11.733 -9.177 1.00 0.00 C ATOM 2085 OE1 GLU B 39 73.601 11.524 -10.332 1.00 0.00 O ATOM 2086 OE2 GLU B 39 72.136 12.037 -8.839 1.00 0.00 O ATOM 0 H GLU B 39 77.628 13.821 -9.364 1.00 0.00 H new ATOM 0 HA GLU B 39 74.621 13.962 -9.226 1.00 0.00 H new ATOM 0 HB2 GLU B 39 75.932 11.694 -9.537 1.00 0.00 H new ATOM 0 HB3 GLU B 39 76.460 11.926 -7.883 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.452 10.553 -7.807 1.00 0.00 H new ATOM 0 HG3 GLU B 39 74.016 12.134 -7.190 1.00 0.00 H new ATOM 2093 N LEU B 40 74.625 14.350 -6.640 1.00 0.00 N ATOM 2094 CA LEU B 40 74.626 14.977 -5.284 1.00 0.00 C ATOM 2095 C LEU B 40 74.882 16.489 -5.393 1.00 0.00 C ATOM 2096 O LEU B 40 75.287 17.124 -4.439 1.00 0.00 O ATOM 2097 CB LEU B 40 75.707 14.292 -4.412 1.00 0.00 C ATOM 2098 CG LEU B 40 75.065 13.313 -3.415 1.00 0.00 C ATOM 2099 CD1 LEU B 40 74.398 12.165 -4.178 1.00 0.00 C ATOM 2100 CD2 LEU B 40 76.149 12.745 -2.495 1.00 0.00 C ATOM 0 H LEU B 40 73.745 13.904 -6.898 1.00 0.00 H new ATOM 0 HA LEU B 40 73.651 14.840 -4.815 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.411 13.758 -5.050 1.00 0.00 H new ATOM 0 HB3 LEU B 40 76.277 15.048 -3.871 1.00 0.00 H new ATOM 0 HG LEU B 40 74.316 13.838 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU B 40 73.944 11.473 -3.469 1.00 0.00 H new ATOM 0 HD12 LEU B 40 73.629 12.565 -4.838 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.146 11.639 -4.771 1.00 0.00 H new ATOM 0 HD21 LEU B 40 75.698 12.050 -1.787 1.00 0.00 H new ATOM 0 HD22 LEU B 40 76.895 12.221 -3.092 1.00 0.00 H new ATOM 0 HD23 LEU B 40 76.627 13.559 -1.950 1.00 0.00 H new ATOM 2112 N SER B 41 74.637 17.074 -6.533 1.00 0.00 N ATOM 2113 CA SER B 41 74.857 18.542 -6.665 1.00 0.00 C ATOM 2114 C SER B 41 73.895 19.288 -5.730 1.00 0.00 C ATOM 2115 O SER B 41 74.278 20.202 -5.028 1.00 0.00 O ATOM 2116 CB SER B 41 74.593 18.968 -8.110 1.00 0.00 C ATOM 2117 OG SER B 41 75.596 18.418 -8.953 1.00 0.00 O ATOM 0 H SER B 41 74.297 16.604 -7.372 1.00 0.00 H new ATOM 0 HA SER B 41 75.886 18.782 -6.397 1.00 0.00 H new ATOM 0 HB2 SER B 41 73.608 18.627 -8.428 1.00 0.00 H new ATOM 0 HB3 SER B 41 74.594 20.055 -8.187 1.00 0.00 H new ATOM 0 HG SER B 41 75.428 18.688 -9.880 1.00 0.00 H new ATOM 2123 N HIS B 42 72.644 18.903 -5.721 1.00 0.00 N ATOM 2124 CA HIS B 42 71.649 19.585 -4.841 1.00 0.00 C ATOM 2125 C HIS B 42 71.744 19.032 -3.414 1.00 0.00 C ATOM 2126 O HIS B 42 71.362 19.682 -2.461 1.00 0.00 O ATOM 2127 CB HIS B 42 70.241 19.351 -5.392 1.00 0.00 C ATOM 2128 CG HIS B 42 69.234 20.071 -4.536 1.00 0.00 C ATOM 2129 ND1 HIS B 42 69.219 21.454 -4.417 1.00 0.00 N ATOM 2130 CD2 HIS B 42 68.196 19.616 -3.760 1.00 0.00 C ATOM 2131 CE1 HIS B 42 68.202 21.779 -3.597 1.00 0.00 C ATOM 2132 NE2 HIS B 42 67.551 20.696 -3.171 1.00 0.00 N ATOM 0 H HIS B 42 72.268 18.143 -6.288 1.00 0.00 H new ATOM 0 HA HIS B 42 71.860 20.654 -4.820 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.179 19.707 -6.420 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.020 18.284 -5.410 1.00 0.00 H new ATOM 0 HD2 HIS B 42 67.924 18.579 -3.628 1.00 0.00 H new ATOM 0 HE1 HIS B 42 67.945 22.791 -3.319 1.00 0.00 H new ATOM 0 HE2 HIS B 42 66.747 20.667 -2.544 1.00 0.00 H new ATOM 2141 N PHE B 43 72.231 17.826 -3.263 1.00 0.00 N ATOM 2142 CA PHE B 43 72.332 17.213 -1.897 1.00 0.00 C ATOM 2143 C PHE B 43 73.754 17.370 -1.354 1.00 0.00 C ATOM 2144 O PHE B 43 74.050 16.964 -0.247 1.00 0.00 O ATOM 2145 CB PHE B 43 71.976 15.723 -1.975 1.00 0.00 C ATOM 2146 CG PHE B 43 70.479 15.564 -2.112 1.00 0.00 C ATOM 2147 CD1 PHE B 43 69.684 15.454 -0.964 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.885 15.529 -3.380 1.00 0.00 C ATOM 2149 CE1 PHE B 43 68.297 15.309 -1.083 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.497 15.384 -3.497 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.703 15.274 -2.350 1.00 0.00 C ATOM 0 H PHE B 43 72.564 17.236 -4.026 1.00 0.00 H new ATOM 0 HA PHE B 43 71.637 17.721 -1.228 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.480 15.263 -2.825 1.00 0.00 H new ATOM 0 HB3 PHE B 43 72.326 15.208 -1.080 1.00 0.00 H new ATOM 0 HD1 PHE B 43 70.142 15.481 0.014 1.00 0.00 H new ATOM 0 HD2 PHE B 43 70.496 15.614 -4.266 1.00 0.00 H new ATOM 0 HE1 PHE B 43 67.685 15.224 -0.197 1.00 0.00 H new ATOM 0 HE2 PHE B 43 68.038 15.357 -4.474 1.00 0.00 H new ATOM 0 HZ PHE B 43 66.633 15.162 -2.442 1.00 0.00 H new ATOM 2161 N LEU B 44 74.630 17.977 -2.104 1.00 0.00 N ATOM 2162 CA LEU B 44 76.019 18.178 -1.602 1.00 0.00 C ATOM 2163 C LEU B 44 76.674 19.311 -2.396 1.00 0.00 C ATOM 2164 O LEU B 44 76.592 19.364 -3.607 1.00 0.00 O ATOM 2165 CB LEU B 44 76.831 16.880 -1.763 1.00 0.00 C ATOM 2166 CG LEU B 44 77.964 16.820 -0.713 1.00 0.00 C ATOM 2167 CD1 LEU B 44 77.425 16.263 0.613 1.00 0.00 C ATOM 2168 CD2 LEU B 44 79.088 15.903 -1.212 1.00 0.00 C ATOM 0 H LEU B 44 74.447 18.342 -3.039 1.00 0.00 H new ATOM 0 HA LEU B 44 75.993 18.440 -0.544 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.175 16.017 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU B 44 77.253 16.830 -2.767 1.00 0.00 H new ATOM 0 HG LEU B 44 78.348 17.828 -0.559 1.00 0.00 H new ATOM 0 HD11 LEU B 44 78.231 16.225 1.346 1.00 0.00 H new ATOM 0 HD12 LEU B 44 76.629 16.909 0.982 1.00 0.00 H new ATOM 0 HD13 LEU B 44 77.032 15.259 0.453 1.00 0.00 H new ATOM 0 HD21 LEU B 44 79.884 15.865 -0.468 1.00 0.00 H new ATOM 0 HD22 LEU B 44 78.694 14.900 -1.374 1.00 0.00 H new ATOM 0 HD23 LEU B 44 79.486 16.292 -2.149 1.00 0.00 H new ATOM 2180 N GLU B 45 77.323 20.215 -1.723 1.00 0.00 N ATOM 2181 CA GLU B 45 77.985 21.342 -2.437 1.00 0.00 C ATOM 2182 C GLU B 45 79.220 20.825 -3.172 1.00 0.00 C ATOM 2183 O GLU B 45 79.946 19.989 -2.672 1.00 0.00 O ATOM 2184 CB GLU B 45 78.400 22.424 -1.435 1.00 0.00 C ATOM 2185 CG GLU B 45 77.154 23.128 -0.888 1.00 0.00 C ATOM 2186 CD GLU B 45 76.377 22.175 0.021 1.00 0.00 C ATOM 2187 OE1 GLU B 45 76.957 21.191 0.451 1.00 0.00 O ATOM 2188 OE2 GLU B 45 75.213 22.444 0.271 1.00 0.00 O ATOM 0 H GLU B 45 77.425 20.224 -0.708 1.00 0.00 H new ATOM 0 HA GLU B 45 77.286 21.770 -3.155 1.00 0.00 H new ATOM 0 HB2 GLU B 45 78.966 21.978 -0.617 1.00 0.00 H new ATOM 0 HB3 GLU B 45 79.056 23.148 -1.918 1.00 0.00 H new ATOM 0 HG2 GLU B 45 77.444 24.020 -0.332 1.00 0.00 H new ATOM 0 HG3 GLU B 45 76.520 23.457 -1.711 1.00 0.00 H new ATOM 2195 N GLU B 46 79.469 21.314 -4.356 1.00 0.00 N ATOM 2196 CA GLU B 46 80.661 20.842 -5.111 1.00 0.00 C ATOM 2197 C GLU B 46 81.918 21.213 -4.325 1.00 0.00 C ATOM 2198 O GLU B 46 82.029 22.304 -3.802 1.00 0.00 O ATOM 2199 CB GLU B 46 80.700 21.520 -6.481 1.00 0.00 C ATOM 2200 CG GLU B 46 79.474 21.099 -7.294 1.00 0.00 C ATOM 2201 CD GLU B 46 79.514 21.777 -8.665 1.00 0.00 C ATOM 2202 OE1 GLU B 46 80.344 22.652 -8.847 1.00 0.00 O ATOM 2203 OE2 GLU B 46 78.717 21.405 -9.510 1.00 0.00 O ATOM 0 H GLU B 46 78.901 22.016 -4.830 1.00 0.00 H new ATOM 0 HA GLU B 46 80.611 19.762 -5.246 1.00 0.00 H new ATOM 0 HB2 GLU B 46 80.716 22.603 -6.362 1.00 0.00 H new ATOM 0 HB3 GLU B 46 81.612 21.244 -7.009 1.00 0.00 H new ATOM 0 HG2 GLU B 46 79.457 20.016 -7.413 1.00 0.00 H new ATOM 0 HG3 GLU B 46 78.562 21.376 -6.766 1.00 0.00 H new ATOM 2210 N ILE B 47 82.862 20.312 -4.235 1.00 0.00 N ATOM 2211 CA ILE B 47 84.119 20.600 -3.476 1.00 0.00 C ATOM 2212 C ILE B 47 85.269 20.809 -4.463 1.00 0.00 C ATOM 2213 O ILE B 47 85.600 19.936 -5.240 1.00 0.00 O ATOM 2214 CB ILE B 47 84.424 19.409 -2.566 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.254 19.214 -1.595 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.704 19.683 -1.773 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.416 17.891 -0.846 1.00 0.00 C ATOM 0 H ILE B 47 82.817 19.384 -4.656 1.00 0.00 H new ATOM 0 HA ILE B 47 83.999 21.501 -2.874 1.00 0.00 H new ATOM 0 HB ILE B 47 84.561 18.511 -3.168 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.216 20.041 -0.886 1.00 0.00 H new ATOM 0 HG13 ILE B 47 82.311 19.220 -2.142 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.920 18.833 -1.125 1.00 0.00 H new ATOM 0 HG22 ILE B 47 86.534 19.833 -2.463 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.571 20.578 -1.165 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.582 17.758 -0.157 1.00 0.00 H new ATOM 0 HD12 ILE B 47 83.432 17.068 -1.560 1.00 0.00 H new ATOM 0 HD13 ILE B 47 84.351 17.902 -0.285 1.00 0.00 H new ATOM 2229 N LYS B 48 85.879 21.966 -4.438 1.00 0.00 N ATOM 2230 CA LYS B 48 87.011 22.248 -5.373 1.00 0.00 C ATOM 2231 C LYS B 48 88.338 21.980 -4.658 1.00 0.00 C ATOM 2232 O LYS B 48 89.384 21.915 -5.274 1.00 0.00 O ATOM 2233 CB LYS B 48 86.944 23.716 -5.809 1.00 0.00 C ATOM 2234 CG LYS B 48 87.998 23.991 -6.886 1.00 0.00 C ATOM 2235 CD LYS B 48 87.846 25.426 -7.396 1.00 0.00 C ATOM 2236 CE LYS B 48 88.963 25.734 -8.393 1.00 0.00 C ATOM 2237 NZ LYS B 48 90.280 25.664 -7.701 1.00 0.00 N ATOM 0 H LYS B 48 85.641 22.732 -3.807 1.00 0.00 H new ATOM 0 HA LYS B 48 86.940 21.604 -6.249 1.00 0.00 H new ATOM 0 HB2 LYS B 48 85.950 23.945 -6.194 1.00 0.00 H new ATOM 0 HB3 LYS B 48 87.111 24.367 -4.951 1.00 0.00 H new ATOM 0 HG2 LYS B 48 88.998 23.843 -6.477 1.00 0.00 H new ATOM 0 HG3 LYS B 48 87.883 23.287 -7.710 1.00 0.00 H new ATOM 0 HD2 LYS B 48 86.874 25.553 -7.872 1.00 0.00 H new ATOM 0 HD3 LYS B 48 87.886 26.126 -6.561 1.00 0.00 H new ATOM 0 HE2 LYS B 48 88.935 25.022 -9.218 1.00 0.00 H new ATOM 0 HE3 LYS B 48 88.818 26.725 -8.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 90.974 26.242 -8.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 90.182 26.025 -6.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 90.605 24.676 -7.672 1.00 0.00 H new ATOM 2251 N GLU B 49 88.305 21.824 -3.359 1.00 0.00 N ATOM 2252 CA GLU B 49 89.566 21.564 -2.596 1.00 0.00 C ATOM 2253 C GLU B 49 89.687 20.069 -2.296 1.00 0.00 C ATOM 2254 O GLU B 49 88.860 19.491 -1.619 1.00 0.00 O ATOM 2255 CB GLU B 49 89.520 22.337 -1.276 1.00 0.00 C ATOM 2256 CG GLU B 49 89.509 23.843 -1.558 1.00 0.00 C ATOM 2257 CD GLU B 49 88.119 24.274 -2.033 1.00 0.00 C ATOM 2258 OE1 GLU B 49 87.206 23.469 -1.948 1.00 0.00 O ATOM 2259 OE2 GLU B 49 87.992 25.403 -2.477 1.00 0.00 O ATOM 0 H GLU B 49 87.458 21.865 -2.792 1.00 0.00 H new ATOM 0 HA GLU B 49 90.422 21.886 -3.188 1.00 0.00 H new ATOM 0 HB2 GLU B 49 88.631 22.057 -0.710 1.00 0.00 H new ATOM 0 HB3 GLU B 49 90.383 22.079 -0.662 1.00 0.00 H new ATOM 0 HG2 GLU B 49 89.782 24.393 -0.657 1.00 0.00 H new ATOM 0 HG3 GLU B 49 90.253 24.085 -2.316 1.00 0.00 H new ATOM 2266 N GLN B 50 90.719 19.440 -2.790 1.00 0.00 N ATOM 2267 CA GLN B 50 90.903 17.983 -2.532 1.00 0.00 C ATOM 2268 C GLN B 50 91.091 17.755 -1.031 1.00 0.00 C ATOM 2269 O GLN B 50 90.609 16.791 -0.471 1.00 0.00 O ATOM 2270 CB GLN B 50 92.132 17.473 -3.289 1.00 0.00 C ATOM 2271 CG GLN B 50 91.836 17.470 -4.792 1.00 0.00 C ATOM 2272 CD GLN B 50 93.062 16.961 -5.554 1.00 0.00 C ATOM 2273 OE1 GLN B 50 93.717 16.033 -5.121 1.00 0.00 O ATOM 2274 NE2 GLN B 50 93.408 17.536 -6.673 1.00 0.00 N ATOM 0 H GLN B 50 91.444 19.873 -3.362 1.00 0.00 H new ATOM 0 HA GLN B 50 90.023 17.440 -2.876 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.993 18.107 -3.078 1.00 0.00 H new ATOM 0 HB3 GLN B 50 92.388 16.467 -2.955 1.00 0.00 H new ATOM 0 HG2 GLN B 50 90.975 16.836 -5.002 1.00 0.00 H new ATOM 0 HG3 GLN B 50 91.580 18.476 -5.125 1.00 0.00 H new ATOM 0 HE21 GLN B 50 92.859 18.315 -7.037 1.00 0.00 H new ATOM 0 HE22 GLN B 50 94.227 17.207 -7.184 1.00 0.00 H new ATOM 2283 N GLU B 51 91.810 18.628 -0.382 1.00 0.00 N ATOM 2284 CA GLU B 51 92.059 18.462 1.079 1.00 0.00 C ATOM 2285 C GLU B 51 90.727 18.300 1.813 1.00 0.00 C ATOM 2286 O GLU B 51 90.620 17.539 2.754 1.00 0.00 O ATOM 2287 CB GLU B 51 92.795 19.696 1.617 1.00 0.00 C ATOM 2288 CG GLU B 51 93.147 19.496 3.097 1.00 0.00 C ATOM 2289 CD GLU B 51 94.134 18.335 3.242 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.753 17.983 2.252 1.00 0.00 O ATOM 2291 OE2 GLU B 51 94.252 17.817 4.340 1.00 0.00 O ATOM 0 H GLU B 51 92.238 19.453 -0.802 1.00 0.00 H new ATOM 0 HA GLU B 51 92.671 17.575 1.242 1.00 0.00 H new ATOM 0 HB2 GLU B 51 93.703 19.868 1.039 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.170 20.581 1.500 1.00 0.00 H new ATOM 0 HG2 GLU B 51 93.583 20.409 3.503 1.00 0.00 H new ATOM 0 HG3 GLU B 51 92.243 19.291 3.671 1.00 0.00 H new ATOM 2298 N VAL B 52 89.703 18.972 1.375 1.00 0.00 N ATOM 2299 CA VAL B 52 88.375 18.811 2.028 1.00 0.00 C ATOM 2300 C VAL B 52 87.841 17.415 1.698 1.00 0.00 C ATOM 2301 O VAL B 52 87.206 16.764 2.505 1.00 0.00 O ATOM 2302 CB VAL B 52 87.411 19.884 1.511 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.988 19.575 1.986 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.840 21.252 2.050 1.00 0.00 C ATOM 0 H VAL B 52 89.727 19.626 0.593 1.00 0.00 H new ATOM 0 HA VAL B 52 88.469 18.924 3.108 1.00 0.00 H new ATOM 0 HB VAL B 52 87.433 19.894 0.421 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.306 20.341 1.616 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.681 18.601 1.605 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.963 19.563 3.076 1.00 0.00 H new ATOM 0 HG21 VAL B 52 87.156 22.018 1.684 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.818 21.237 3.140 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.851 21.476 1.710 1.00 0.00 H new ATOM 2314 N VAL B 53 88.104 16.958 0.502 1.00 0.00 N ATOM 2315 CA VAL B 53 87.630 15.605 0.091 1.00 0.00 C ATOM 2316 C VAL B 53 88.416 14.539 0.859 1.00 0.00 C ATOM 2317 O VAL B 53 87.879 13.531 1.272 1.00 0.00 O ATOM 2318 CB VAL B 53 87.859 15.420 -1.416 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.601 13.959 -1.808 1.00 0.00 C ATOM 2320 CG2 VAL B 53 86.911 16.337 -2.194 1.00 0.00 C ATOM 0 H VAL B 53 88.629 17.466 -0.210 1.00 0.00 H new ATOM 0 HA VAL B 53 86.567 15.507 0.312 1.00 0.00 H new ATOM 0 HB VAL B 53 88.891 15.676 -1.656 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.765 13.835 -2.878 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.282 13.309 -1.259 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.572 13.694 -1.566 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.074 16.205 -3.264 1.00 0.00 H new ATOM 0 HG22 VAL B 53 85.879 16.084 -1.950 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.104 17.375 -1.923 1.00 0.00 H new ATOM 2330 N ASP B 54 89.693 14.747 1.030 1.00 0.00 N ATOM 2331 CA ASP B 54 90.528 13.740 1.747 1.00 0.00 C ATOM 2332 C ASP B 54 90.006 13.539 3.170 1.00 0.00 C ATOM 2333 O ASP B 54 89.957 12.434 3.669 1.00 0.00 O ATOM 2334 CB ASP B 54 91.977 14.230 1.800 1.00 0.00 C ATOM 2335 CG ASP B 54 92.856 13.189 2.501 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.312 12.350 3.201 1.00 0.00 O ATOM 2337 OD2 ASP B 54 94.062 13.246 2.323 1.00 0.00 O ATOM 0 H ASP B 54 90.196 15.572 0.704 1.00 0.00 H new ATOM 0 HA ASP B 54 90.478 12.790 1.214 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.346 14.409 0.790 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.029 15.180 2.332 1.00 0.00 H new ATOM 2342 N LYS B 55 89.614 14.591 3.829 1.00 0.00 N ATOM 2343 CA LYS B 55 89.098 14.430 5.217 1.00 0.00 C ATOM 2344 C LYS B 55 87.851 13.550 5.184 1.00 0.00 C ATOM 2345 O LYS B 55 87.693 12.650 5.986 1.00 0.00 O ATOM 2346 CB LYS B 55 88.767 15.800 5.811 1.00 0.00 C ATOM 2347 CG LYS B 55 90.071 16.565 6.068 1.00 0.00 C ATOM 2348 CD LYS B 55 89.773 17.895 6.776 1.00 0.00 C ATOM 2349 CE LYS B 55 89.266 18.932 5.769 1.00 0.00 C ATOM 2350 NZ LYS B 55 89.195 20.265 6.430 1.00 0.00 N ATOM 0 H LYS B 55 89.627 15.547 3.473 1.00 0.00 H new ATOM 0 HA LYS B 55 89.857 13.958 5.841 1.00 0.00 H new ATOM 0 HB2 LYS B 55 88.130 16.362 5.128 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.211 15.682 6.741 1.00 0.00 H new ATOM 0 HG2 LYS B 55 90.741 15.961 6.679 1.00 0.00 H new ATOM 0 HG3 LYS B 55 90.583 16.753 5.124 1.00 0.00 H new ATOM 0 HD2 LYS B 55 89.027 17.740 7.556 1.00 0.00 H new ATOM 0 HD3 LYS B 55 90.674 18.264 7.266 1.00 0.00 H new ATOM 0 HE2 LYS B 55 89.932 18.975 4.907 1.00 0.00 H new ATOM 0 HE3 LYS B 55 88.282 18.645 5.397 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 88.851 20.972 5.749 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 88.543 20.217 7.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 90.141 20.538 6.764 1.00 0.00 H new ATOM 2364 N VAL B 56 86.969 13.791 4.257 1.00 0.00 N ATOM 2365 CA VAL B 56 85.740 12.958 4.161 1.00 0.00 C ATOM 2366 C VAL B 56 86.107 11.551 3.682 1.00 0.00 C ATOM 2367 O VAL B 56 85.590 10.564 4.165 1.00 0.00 O ATOM 2368 CB VAL B 56 84.767 13.616 3.168 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.610 12.659 2.842 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.204 14.895 3.794 1.00 0.00 C ATOM 0 H VAL B 56 87.046 14.531 3.559 1.00 0.00 H new ATOM 0 HA VAL B 56 85.266 12.883 5.140 1.00 0.00 H new ATOM 0 HB VAL B 56 85.301 13.851 2.247 1.00 0.00 H new ATOM 0 HG11 VAL B 56 82.929 13.138 2.138 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.007 11.746 2.399 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.072 12.414 3.758 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.513 15.368 3.096 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.677 14.648 4.715 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.021 15.581 4.017 1.00 0.00 H new ATOM 2380 N MET B 57 86.987 11.455 2.724 1.00 0.00 N ATOM 2381 CA MET B 57 87.382 10.116 2.196 1.00 0.00 C ATOM 2382 C MET B 57 87.992 9.248 3.302 1.00 0.00 C ATOM 2383 O MET B 57 87.643 8.094 3.455 1.00 0.00 O ATOM 2384 CB MET B 57 88.397 10.298 1.065 1.00 0.00 C ATOM 2385 CG MET B 57 88.739 8.935 0.460 1.00 0.00 C ATOM 2386 SD MET B 57 89.795 9.172 -0.991 1.00 0.00 S ATOM 2387 CE MET B 57 89.382 7.622 -1.827 1.00 0.00 C ATOM 0 H MET B 57 87.452 12.248 2.282 1.00 0.00 H new ATOM 0 HA MET B 57 86.491 9.613 1.820 1.00 0.00 H new ATOM 0 HB2 MET B 57 87.988 10.956 0.298 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.300 10.775 1.446 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.248 8.315 1.197 1.00 0.00 H new ATOM 0 HG3 MET B 57 87.826 8.410 0.178 1.00 0.00 H new ATOM 0 HE1 MET B 57 90.010 7.506 -2.710 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.552 6.786 -1.149 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.334 7.638 -2.127 1.00 0.00 H new ATOM 2397 N GLU B 58 88.906 9.778 4.065 1.00 0.00 N ATOM 2398 CA GLU B 58 89.533 8.955 5.143 1.00 0.00 C ATOM 2399 C GLU B 58 88.448 8.490 6.114 1.00 0.00 C ATOM 2400 O GLU B 58 88.436 7.359 6.556 1.00 0.00 O ATOM 2401 CB GLU B 58 90.577 9.793 5.892 1.00 0.00 C ATOM 2402 CG GLU B 58 91.282 8.936 6.952 1.00 0.00 C ATOM 2403 CD GLU B 58 92.067 7.813 6.270 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.325 7.932 5.084 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.399 6.854 6.947 1.00 0.00 O ATOM 0 H GLU B 58 89.246 10.737 3.992 1.00 0.00 H new ATOM 0 HA GLU B 58 90.024 8.087 4.703 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.309 10.189 5.188 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.096 10.648 6.366 1.00 0.00 H new ATOM 0 HG2 GLU B 58 91.955 9.555 7.545 1.00 0.00 H new ATOM 0 HG3 GLU B 58 90.548 8.514 7.639 1.00 0.00 H new ATOM 2412 N THR B 59 87.530 9.352 6.435 1.00 0.00 N ATOM 2413 CA THR B 59 86.432 8.964 7.362 1.00 0.00 C ATOM 2414 C THR B 59 85.610 7.838 6.735 1.00 0.00 C ATOM 2415 O THR B 59 85.199 6.905 7.398 1.00 0.00 O ATOM 2416 CB THR B 59 85.527 10.170 7.621 1.00 0.00 C ATOM 2417 OG1 THR B 59 86.290 11.218 8.203 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.396 9.768 8.568 1.00 0.00 C ATOM 0 H THR B 59 87.491 10.313 6.095 1.00 0.00 H new ATOM 0 HA THR B 59 86.860 8.623 8.305 1.00 0.00 H new ATOM 0 HB THR B 59 85.101 10.514 6.679 1.00 0.00 H new ATOM 0 HG1 THR B 59 86.765 11.707 7.499 1.00 0.00 H new ATOM 0 HG21 THR B 59 83.752 10.628 8.752 1.00 0.00 H new ATOM 0 HG22 THR B 59 83.811 8.967 8.117 1.00 0.00 H new ATOM 0 HG23 THR B 59 84.817 9.422 9.512 1.00 0.00 H new ATOM 2426 N LEU B 60 85.370 7.921 5.456 1.00 0.00 N ATOM 2427 CA LEU B 60 84.576 6.856 4.781 1.00 0.00 C ATOM 2428 C LEU B 60 85.395 5.573 4.656 1.00 0.00 C ATOM 2429 O LEU B 60 84.875 4.485 4.813 1.00 0.00 O ATOM 2430 CB LEU B 60 84.139 7.321 3.384 1.00 0.00 C ATOM 2431 CG LEU B 60 83.023 8.377 3.492 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.962 9.189 2.194 1.00 0.00 C ATOM 2433 CD2 LEU B 60 81.660 7.694 3.703 1.00 0.00 C ATOM 0 H LEU B 60 85.688 8.678 4.850 1.00 0.00 H new ATOM 0 HA LEU B 60 83.693 6.656 5.387 1.00 0.00 H new ATOM 0 HB2 LEU B 60 84.992 7.738 2.850 1.00 0.00 H new ATOM 0 HB3 LEU B 60 83.786 6.468 2.804 1.00 0.00 H new ATOM 0 HG LEU B 60 83.241 9.028 4.339 1.00 0.00 H new ATOM 0 HD11 LEU B 60 82.172 9.937 2.269 1.00 0.00 H new ATOM 0 HD12 LEU B 60 83.918 9.686 2.031 1.00 0.00 H new ATOM 0 HD13 LEU B 60 82.752 8.523 1.357 1.00 0.00 H new ATOM 0 HD21 LEU B 60 80.881 8.452 3.778 1.00 0.00 H new ATOM 0 HD22 LEU B 60 81.448 7.037 2.859 1.00 0.00 H new ATOM 0 HD23 LEU B 60 81.685 7.108 4.622 1.00 0.00 H new ATOM 2445 N ASP B 61 86.658 5.668 4.339 1.00 0.00 N ATOM 2446 CA ASP B 61 87.471 4.432 4.171 1.00 0.00 C ATOM 2447 C ASP B 61 87.710 3.755 5.521 1.00 0.00 C ATOM 2448 O ASP B 61 88.643 4.070 6.233 1.00 0.00 O ATOM 2449 CB ASP B 61 88.819 4.802 3.547 1.00 0.00 C ATOM 2450 CG ASP B 61 88.610 5.224 2.092 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.585 4.870 1.535 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.478 5.899 1.562 1.00 0.00 O ATOM 0 H ASP B 61 87.159 6.544 4.190 1.00 0.00 H new ATOM 0 HA ASP B 61 86.931 3.740 3.524 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.281 5.613 4.109 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.500 3.952 3.596 1.00 0.00 H new ATOM 2457 N GLU B 62 86.881 2.811 5.862 1.00 0.00 N ATOM 2458 CA GLU B 62 87.066 2.094 7.153 1.00 0.00 C ATOM 2459 C GLU B 62 88.436 1.412 7.155 1.00 0.00 C ATOM 2460 O GLU B 62 89.127 1.392 8.154 1.00 0.00 O ATOM 2461 CB GLU B 62 85.962 1.047 7.336 1.00 0.00 C ATOM 2462 CG GLU B 62 84.622 1.744 7.586 1.00 0.00 C ATOM 2463 CD GLU B 62 84.146 2.432 6.305 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.662 2.100 5.250 1.00 0.00 O ATOM 2465 OE2 GLU B 62 83.275 3.280 6.400 1.00 0.00 O ATOM 0 H GLU B 62 86.084 2.505 5.304 1.00 0.00 H new ATOM 0 HA GLU B 62 87.010 2.807 7.976 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.895 0.417 6.449 1.00 0.00 H new ATOM 0 HB3 GLU B 62 86.204 0.393 8.174 1.00 0.00 H new ATOM 0 HG2 GLU B 62 83.880 1.017 7.916 1.00 0.00 H new ATOM 0 HG3 GLU B 62 84.727 2.477 8.386 1.00 0.00 H new ATOM 2472 N ASP B 63 88.832 0.846 6.047 1.00 0.00 N ATOM 2473 CA ASP B 63 90.154 0.158 5.992 1.00 0.00 C ATOM 2474 C ASP B 63 91.274 1.178 5.749 1.00 0.00 C ATOM 2475 O ASP B 63 92.438 0.888 5.947 1.00 0.00 O ATOM 2476 CB ASP B 63 90.141 -0.862 4.852 1.00 0.00 C ATOM 2477 CG ASP B 63 89.886 -0.144 3.526 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.543 1.027 3.565 1.00 0.00 O ATOM 2479 OD2 ASP B 63 90.031 -0.778 2.494 1.00 0.00 O ATOM 0 H ASP B 63 88.298 0.830 5.178 1.00 0.00 H new ATOM 0 HA ASP B 63 90.335 -0.345 6.942 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.093 -1.392 4.813 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.367 -1.609 5.028 1.00 0.00 H new ATOM 2484 N GLY B 64 90.943 2.370 5.331 1.00 0.00 N ATOM 2485 CA GLY B 64 92.003 3.394 5.087 1.00 0.00 C ATOM 2486 C GLY B 64 92.829 3.007 3.854 1.00 0.00 C ATOM 2487 O GLY B 64 94.003 3.310 3.765 1.00 0.00 O ATOM 0 H GLY B 64 89.988 2.680 5.148 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.548 4.373 4.938 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.651 3.474 5.959 1.00 0.00 H new ATOM 2491 N ASP B 65 92.233 2.327 2.913 1.00 0.00 N ATOM 2492 CA ASP B 65 92.990 1.904 1.697 1.00 0.00 C ATOM 2493 C ASP B 65 93.185 3.089 0.747 1.00 0.00 C ATOM 2494 O ASP B 65 93.794 2.960 -0.296 1.00 0.00 O ATOM 2495 CB ASP B 65 92.215 0.799 0.977 1.00 0.00 C ATOM 2496 CG ASP B 65 90.841 1.325 0.558 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.457 2.377 1.041 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.194 0.665 -0.239 1.00 0.00 O ATOM 0 H ASP B 65 91.253 2.045 2.932 1.00 0.00 H new ATOM 0 HA ASP B 65 93.969 1.534 2.003 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.770 0.464 0.101 1.00 0.00 H new ATOM 0 HB3 ASP B 65 92.101 -0.065 1.632 1.00 0.00 H new ATOM 2503 N GLY B 66 92.695 4.246 1.096 1.00 0.00 N ATOM 2504 CA GLY B 66 92.883 5.429 0.208 1.00 0.00 C ATOM 2505 C GLY B 66 91.950 5.338 -1.000 1.00 0.00 C ATOM 2506 O GLY B 66 91.957 6.188 -1.868 1.00 0.00 O ATOM 0 H GLY B 66 92.174 4.424 1.955 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.682 6.345 0.763 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.919 5.480 -0.127 1.00 0.00 H new ATOM 2510 N GLU B 67 91.136 4.320 -1.058 1.00 0.00 N ATOM 2511 CA GLU B 67 90.183 4.162 -2.195 1.00 0.00 C ATOM 2512 C GLU B 67 88.863 3.658 -1.618 1.00 0.00 C ATOM 2513 O GLU B 67 88.836 3.117 -0.530 1.00 0.00 O ATOM 2514 CB GLU B 67 90.727 3.130 -3.188 1.00 0.00 C ATOM 2515 CG GLU B 67 92.039 3.634 -3.794 1.00 0.00 C ATOM 2516 CD GLU B 67 92.573 2.597 -4.785 1.00 0.00 C ATOM 2517 OE1 GLU B 67 92.036 1.501 -4.812 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.506 2.917 -5.503 1.00 0.00 O ATOM 0 H GLU B 67 91.090 3.581 -0.357 1.00 0.00 H new ATOM 0 HA GLU B 67 90.047 5.110 -2.715 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.891 2.178 -2.683 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.997 2.951 -3.977 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.877 4.586 -4.299 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.771 3.812 -3.007 1.00 0.00 H new ATOM 2525 N CYS B 68 87.767 3.813 -2.321 1.00 0.00 N ATOM 2526 CA CYS B 68 86.456 3.321 -1.788 1.00 0.00 C ATOM 2527 C CYS B 68 86.041 2.070 -2.561 1.00 0.00 C ATOM 2528 O CYS B 68 85.682 2.134 -3.719 1.00 0.00 O ATOM 2529 CB CYS B 68 85.396 4.407 -1.981 1.00 0.00 C ATOM 2530 SG CYS B 68 83.863 3.904 -1.159 1.00 0.00 S ATOM 0 H CYS B 68 87.723 4.257 -3.238 1.00 0.00 H new ATOM 0 HA CYS B 68 86.552 3.085 -0.728 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.749 5.352 -1.569 1.00 0.00 H new ATOM 0 HB3 CYS B 68 85.215 4.570 -3.044 1.00 0.00 H new ATOM 0 HG CYS B 68 83.034 4.905 -1.136 1.00 0.00 H new ATOM 2536 N ASP B 69 86.106 0.929 -1.935 1.00 0.00 N ATOM 2537 CA ASP B 69 85.736 -0.329 -2.642 1.00 0.00 C ATOM 2538 C ASP B 69 84.225 -0.369 -2.892 1.00 0.00 C ATOM 2539 O ASP B 69 83.496 0.542 -2.555 1.00 0.00 O ATOM 2540 CB ASP B 69 86.162 -1.542 -1.808 1.00 0.00 C ATOM 2541 CG ASP B 69 85.290 -1.653 -0.557 1.00 0.00 C ATOM 2542 OD1 ASP B 69 84.553 -0.722 -0.288 1.00 0.00 O ATOM 2543 OD2 ASP B 69 85.374 -2.671 0.110 1.00 0.00 O ATOM 0 H ASP B 69 86.399 0.812 -0.965 1.00 0.00 H new ATOM 0 HA ASP B 69 86.252 -0.359 -3.602 1.00 0.00 H new ATOM 0 HB2 ASP B 69 86.075 -2.451 -2.403 1.00 0.00 H new ATOM 0 HB3 ASP B 69 87.210 -1.447 -1.523 1.00 0.00 H new ATOM 2548 N PHE B 70 83.764 -1.433 -3.485 1.00 0.00 N ATOM 2549 CA PHE B 70 82.309 -1.561 -3.769 1.00 0.00 C ATOM 2550 C PHE B 70 81.521 -1.507 -2.457 1.00 0.00 C ATOM 2551 O PHE B 70 80.544 -0.798 -2.333 1.00 0.00 O ATOM 2552 CB PHE B 70 82.030 -2.893 -4.466 1.00 0.00 C ATOM 2553 CG PHE B 70 80.579 -2.938 -4.880 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.603 -3.369 -3.973 1.00 0.00 C ATOM 2555 CD2 PHE B 70 80.210 -2.543 -6.170 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.257 -3.404 -4.358 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.864 -2.580 -6.557 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.888 -3.009 -5.650 1.00 0.00 C ATOM 0 H PHE B 70 84.335 -2.223 -3.786 1.00 0.00 H new ATOM 0 HA PHE B 70 82.002 -0.740 -4.417 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.674 -3.003 -5.339 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.256 -3.723 -3.796 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.888 -3.674 -2.977 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.963 -2.209 -6.868 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.504 -3.736 -3.659 1.00 0.00 H new ATOM 0 HE2 PHE B 70 78.580 -2.278 -7.554 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.850 -3.035 -5.947 1.00 0.00 H new ATOM 2568 N GLN B 71 81.914 -2.288 -1.493 1.00 0.00 N ATOM 2569 CA GLN B 71 81.155 -2.313 -0.210 1.00 0.00 C ATOM 2570 C GLN B 71 81.147 -0.910 0.412 1.00 0.00 C ATOM 2571 O GLN B 71 80.102 -0.388 0.749 1.00 0.00 O ATOM 2572 CB GLN B 71 81.819 -3.305 0.745 1.00 0.00 C ATOM 2573 CG GLN B 71 81.610 -4.726 0.221 1.00 0.00 C ATOM 2574 CD GLN B 71 82.283 -5.726 1.162 1.00 0.00 C ATOM 2575 OE1 GLN B 71 82.187 -5.605 2.367 1.00 0.00 O ATOM 2576 NE2 GLN B 71 82.978 -6.708 0.657 1.00 0.00 N ATOM 0 H GLN B 71 82.723 -2.908 -1.535 1.00 0.00 H new ATOM 0 HA GLN B 71 80.126 -2.622 -0.396 1.00 0.00 H new ATOM 0 HB2 GLN B 71 82.884 -3.089 0.830 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.393 -3.207 1.744 1.00 0.00 H new ATOM 0 HG2 GLN B 71 80.545 -4.943 0.146 1.00 0.00 H new ATOM 0 HG3 GLN B 71 82.026 -4.819 -0.782 1.00 0.00 H new ATOM 0 HE21 GLN B 71 83.058 -6.809 -0.355 1.00 0.00 H new ATOM 0 HE22 GLN B 71 83.441 -7.375 1.274 1.00 0.00 H new ATOM 2585 N GLU B 72 82.286 -0.288 0.573 1.00 0.00 N ATOM 2586 CA GLU B 72 82.288 1.081 1.181 1.00 0.00 C ATOM 2587 C GLU B 72 81.449 1.998 0.292 1.00 0.00 C ATOM 2588 O GLU B 72 80.652 2.786 0.758 1.00 0.00 O ATOM 2589 CB GLU B 72 83.721 1.617 1.252 1.00 0.00 C ATOM 2590 CG GLU B 72 84.513 0.834 2.301 1.00 0.00 C ATOM 2591 CD GLU B 72 85.951 1.354 2.346 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.259 2.257 1.584 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.720 0.842 3.143 1.00 0.00 O ATOM 0 H GLU B 72 83.201 -0.658 0.316 1.00 0.00 H new ATOM 0 HA GLU B 72 81.875 1.042 2.189 1.00 0.00 H new ATOM 0 HB2 GLU B 72 84.202 1.527 0.278 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.711 2.677 1.506 1.00 0.00 H new ATOM 0 HG2 GLU B 72 84.045 0.941 3.280 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.507 -0.229 2.059 1.00 0.00 H new ATOM 2600 N PHE B 73 81.644 1.898 -0.994 1.00 0.00 N ATOM 2601 CA PHE B 73 80.870 2.766 -1.930 1.00 0.00 C ATOM 2602 C PHE B 73 79.397 2.713 -1.515 1.00 0.00 C ATOM 2603 O PHE B 73 78.721 3.721 -1.439 1.00 0.00 O ATOM 2604 CB PHE B 73 81.029 2.273 -3.371 1.00 0.00 C ATOM 2605 CG PHE B 73 80.161 3.109 -4.279 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.617 4.350 -4.731 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.897 2.644 -4.662 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.812 5.130 -5.570 1.00 0.00 C ATOM 2609 CE2 PHE B 73 78.090 3.423 -5.500 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.547 4.666 -5.954 1.00 0.00 C ATOM 0 H PHE B 73 82.302 1.257 -1.437 1.00 0.00 H new ATOM 0 HA PHE B 73 81.241 3.790 -1.883 1.00 0.00 H new ATOM 0 HB2 PHE B 73 82.072 2.343 -3.679 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.745 1.223 -3.442 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.591 4.708 -4.433 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.545 1.685 -4.311 1.00 0.00 H new ATOM 0 HE1 PHE B 73 80.166 6.088 -5.921 1.00 0.00 H new ATOM 0 HE2 PHE B 73 77.115 3.065 -5.796 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.924 5.267 -6.600 1.00 0.00 H new ATOM 2620 N MET B 74 78.914 1.545 -1.192 1.00 0.00 N ATOM 2621 CA MET B 74 77.508 1.424 -0.718 1.00 0.00 C ATOM 2622 C MET B 74 77.405 2.058 0.675 1.00 0.00 C ATOM 2623 O MET B 74 76.447 2.726 1.002 1.00 0.00 O ATOM 2624 CB MET B 74 77.114 -0.056 -0.642 1.00 0.00 C ATOM 2625 CG MET B 74 77.022 -0.645 -2.052 1.00 0.00 C ATOM 2626 SD MET B 74 75.655 0.132 -2.956 1.00 0.00 S ATOM 2627 CE MET B 74 74.288 -0.549 -1.979 1.00 0.00 C ATOM 0 H MET B 74 79.434 0.668 -1.236 1.00 0.00 H new ATOM 0 HA MET B 74 76.837 1.933 -1.410 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.849 -0.607 -0.056 1.00 0.00 H new ATOM 0 HB3 MET B 74 76.156 -0.160 -0.132 1.00 0.00 H new ATOM 0 HG2 MET B 74 77.959 -0.485 -2.585 1.00 0.00 H new ATOM 0 HG3 MET B 74 76.867 -1.722 -1.996 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.389 -0.593 -2.593 1.00 0.00 H new ATOM 0 HE2 MET B 74 74.547 -1.553 -1.641 1.00 0.00 H new ATOM 0 HE3 MET B 74 74.106 0.089 -1.114 1.00 0.00 H new ATOM 2637 N ALA B 75 78.393 1.848 1.505 1.00 0.00 N ATOM 2638 CA ALA B 75 78.362 2.427 2.882 1.00 0.00 C ATOM 2639 C ALA B 75 78.157 3.937 2.814 1.00 0.00 C ATOM 2640 O ALA B 75 77.814 4.570 3.795 1.00 0.00 O ATOM 2641 CB ALA B 75 79.688 2.146 3.577 1.00 0.00 C ATOM 0 H ALA B 75 79.224 1.298 1.288 1.00 0.00 H new ATOM 0 HA ALA B 75 77.540 1.973 3.436 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.668 2.567 4.582 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.846 1.069 3.638 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.500 2.600 3.009 1.00 0.00 H new ATOM 2647 N PHE B 76 78.299 4.518 1.657 1.00 0.00 N ATOM 2648 CA PHE B 76 78.051 5.976 1.504 1.00 0.00 C ATOM 2649 C PHE B 76 76.584 6.134 1.104 1.00 0.00 C ATOM 2650 O PHE B 76 75.921 7.100 1.422 1.00 0.00 O ATOM 2651 CB PHE B 76 78.951 6.511 0.388 1.00 0.00 C ATOM 2652 CG PHE B 76 78.710 7.983 0.188 1.00 0.00 C ATOM 2653 CD1 PHE B 76 77.734 8.410 -0.716 1.00 0.00 C ATOM 2654 CD2 PHE B 76 79.471 8.922 0.891 1.00 0.00 C ATOM 2655 CE1 PHE B 76 77.518 9.779 -0.918 1.00 0.00 C ATOM 2656 CE2 PHE B 76 79.256 10.289 0.695 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.280 10.720 -0.210 1.00 0.00 C ATOM 0 H PHE B 76 78.580 4.039 0.801 1.00 0.00 H new ATOM 0 HA PHE B 76 78.263 6.522 2.423 1.00 0.00 H new ATOM 0 HB2 PHE B 76 79.997 6.337 0.640 1.00 0.00 H new ATOM 0 HB3 PHE B 76 78.752 5.973 -0.539 1.00 0.00 H new ATOM 0 HD1 PHE B 76 77.146 7.685 -1.259 1.00 0.00 H new ATOM 0 HD2 PHE B 76 80.227 8.590 1.587 1.00 0.00 H new ATOM 0 HE1 PHE B 76 76.765 10.110 -1.618 1.00 0.00 H new ATOM 0 HE2 PHE B 76 79.843 11.012 1.242 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.113 11.776 -0.363 1.00 0.00 H new ATOM 2667 N VAL B 77 76.091 5.141 0.419 1.00 0.00 N ATOM 2668 CA VAL B 77 74.667 5.148 -0.016 1.00 0.00 C ATOM 2669 C VAL B 77 73.772 5.060 1.227 1.00 0.00 C ATOM 2670 O VAL B 77 72.750 5.713 1.310 1.00 0.00 O ATOM 2671 CB VAL B 77 74.388 3.966 -0.959 1.00 0.00 C ATOM 2672 CG1 VAL B 77 72.879 3.836 -1.200 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.096 4.208 -2.297 1.00 0.00 C ATOM 0 H VAL B 77 76.620 4.315 0.139 1.00 0.00 H new ATOM 0 HA VAL B 77 74.455 6.069 -0.558 1.00 0.00 H new ATOM 0 HB VAL B 77 74.760 3.048 -0.504 1.00 0.00 H new ATOM 0 HG11 VAL B 77 72.688 2.997 -1.869 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.372 3.665 -0.250 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.502 4.753 -1.652 1.00 0.00 H new ATOM 0 HG21 VAL B 77 74.901 3.372 -2.968 1.00 0.00 H new ATOM 0 HG22 VAL B 77 74.722 5.129 -2.745 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.170 4.296 -2.130 1.00 0.00 H new ATOM 2683 N SER B 78 74.144 4.260 2.198 1.00 0.00 N ATOM 2684 CA SER B 78 73.307 4.141 3.429 1.00 0.00 C ATOM 2685 C SER B 78 73.409 5.420 4.263 1.00 0.00 C ATOM 2686 O SER B 78 72.417 5.981 4.679 1.00 0.00 O ATOM 2687 CB SER B 78 73.800 2.957 4.261 1.00 0.00 C ATOM 2688 OG SER B 78 75.079 3.265 4.802 1.00 0.00 O ATOM 0 H SER B 78 74.988 3.687 2.190 1.00 0.00 H new ATOM 0 HA SER B 78 72.268 3.987 3.139 1.00 0.00 H new ATOM 0 HB2 SER B 78 73.095 2.743 5.064 1.00 0.00 H new ATOM 0 HB3 SER B 78 73.860 2.062 3.642 1.00 0.00 H new ATOM 0 HG SER B 78 74.970 3.696 5.675 1.00 0.00 H new ATOM 2694 N MET B 79 74.600 5.875 4.534 1.00 0.00 N ATOM 2695 CA MET B 79 74.744 7.105 5.367 1.00 0.00 C ATOM 2696 C MET B 79 73.919 8.222 4.734 1.00 0.00 C ATOM 2697 O MET B 79 73.251 8.977 5.412 1.00 0.00 O ATOM 2698 CB MET B 79 76.219 7.513 5.429 1.00 0.00 C ATOM 2699 CG MET B 79 76.393 8.671 6.412 1.00 0.00 C ATOM 2700 SD MET B 79 78.143 9.127 6.503 1.00 0.00 S ATOM 2701 CE MET B 79 77.996 10.344 7.834 1.00 0.00 C ATOM 0 H MET B 79 75.474 5.454 4.219 1.00 0.00 H new ATOM 0 HA MET B 79 74.390 6.916 6.380 1.00 0.00 H new ATOM 0 HB2 MET B 79 76.828 6.664 5.740 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.566 7.808 4.439 1.00 0.00 H new ATOM 0 HG2 MET B 79 75.799 9.527 6.091 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.029 8.383 7.398 1.00 0.00 H new ATOM 0 HE1 MET B 79 78.978 10.761 8.056 1.00 0.00 H new ATOM 0 HE2 MET B 79 77.325 11.144 7.523 1.00 0.00 H new ATOM 0 HE3 MET B 79 77.596 9.861 8.726 1.00 0.00 H new ATOM 2711 N VAL B 80 73.936 8.310 3.439 1.00 0.00 N ATOM 2712 CA VAL B 80 73.127 9.350 2.749 1.00 0.00 C ATOM 2713 C VAL B 80 71.643 8.994 2.888 1.00 0.00 C ATOM 2714 O VAL B 80 70.793 9.856 2.988 1.00 0.00 O ATOM 2715 CB VAL B 80 73.517 9.404 1.268 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.500 10.244 0.488 1.00 0.00 C ATOM 2717 CG2 VAL B 80 74.901 10.042 1.138 1.00 0.00 C ATOM 0 H VAL B 80 74.478 7.704 2.823 1.00 0.00 H new ATOM 0 HA VAL B 80 73.312 10.326 3.197 1.00 0.00 H new ATOM 0 HB VAL B 80 73.531 8.392 0.863 1.00 0.00 H new ATOM 0 HG11 VAL B 80 72.785 10.277 -0.563 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.510 9.797 0.582 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.480 11.257 0.890 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.185 10.084 0.087 1.00 0.00 H new ATOM 0 HG22 VAL B 80 74.876 11.052 1.547 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.630 9.446 1.687 1.00 0.00 H new ATOM 2727 N THR B 81 71.329 7.726 2.904 1.00 0.00 N ATOM 2728 CA THR B 81 69.903 7.318 3.048 1.00 0.00 C ATOM 2729 C THR B 81 69.376 7.804 4.398 1.00 0.00 C ATOM 2730 O THR B 81 68.280 8.320 4.497 1.00 0.00 O ATOM 2731 CB THR B 81 69.788 5.793 2.969 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.279 5.348 1.713 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.321 5.383 3.116 1.00 0.00 C ATOM 0 H THR B 81 71.996 6.958 2.824 1.00 0.00 H new ATOM 0 HA THR B 81 69.315 7.760 2.244 1.00 0.00 H new ATOM 0 HB THR B 81 70.373 5.342 3.771 1.00 0.00 H new ATOM 0 HG1 THR B 81 71.237 5.157 1.786 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.239 4.298 3.060 1.00 0.00 H new ATOM 0 HG22 THR B 81 67.942 5.726 4.079 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.735 5.833 2.314 1.00 0.00 H new ATOM 2741 N THR B 82 70.150 7.657 5.443 1.00 0.00 N ATOM 2742 CA THR B 82 69.692 8.124 6.776 1.00 0.00 C ATOM 2743 C THR B 82 69.679 9.655 6.782 1.00 0.00 C ATOM 2744 O THR B 82 68.698 10.280 7.132 1.00 0.00 O ATOM 2745 CB THR B 82 70.663 7.611 7.844 1.00 0.00 C ATOM 2746 OG1 THR B 82 71.981 8.035 7.523 1.00 0.00 O ATOM 2747 CG2 THR B 82 70.616 6.079 7.899 1.00 0.00 C ATOM 0 H THR B 82 71.078 7.234 5.426 1.00 0.00 H new ATOM 0 HA THR B 82 68.691 7.748 6.987 1.00 0.00 H new ATOM 0 HB THR B 82 70.375 8.012 8.816 1.00 0.00 H new ATOM 0 HG1 THR B 82 72.074 8.105 6.550 1.00 0.00 H new ATOM 0 HG21 THR B 82 71.309 5.721 8.660 1.00 0.00 H new ATOM 0 HG22 THR B 82 69.605 5.755 8.147 1.00 0.00 H new ATOM 0 HG23 THR B 82 70.900 5.671 6.929 1.00 0.00 H new ATOM 2755 N ALA B 83 70.771 10.259 6.400 1.00 0.00 N ATOM 2756 CA ALA B 83 70.842 11.749 6.385 1.00 0.00 C ATOM 2757 C ALA B 83 69.606 12.313 5.678 1.00 0.00 C ATOM 2758 O ALA B 83 69.051 13.314 6.084 1.00 0.00 O ATOM 2759 CB ALA B 83 72.104 12.191 5.639 1.00 0.00 C ATOM 0 H ALA B 83 71.621 9.783 6.096 1.00 0.00 H new ATOM 0 HA ALA B 83 70.875 12.122 7.409 1.00 0.00 H new ATOM 0 HB1 ALA B 83 72.157 13.280 5.627 1.00 0.00 H new ATOM 0 HB2 ALA B 83 72.984 11.790 6.143 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.071 11.818 4.615 1.00 0.00 H new ATOM 2765 N CYS B 84 69.179 11.686 4.616 1.00 0.00 N ATOM 2766 CA CYS B 84 67.987 12.198 3.882 1.00 0.00 C ATOM 2767 C CYS B 84 66.802 12.296 4.846 1.00 0.00 C ATOM 2768 O CYS B 84 66.603 11.445 5.691 1.00 0.00 O ATOM 2769 CB CYS B 84 67.639 11.234 2.746 1.00 0.00 C ATOM 2770 SG CYS B 84 68.926 11.309 1.476 1.00 0.00 S ATOM 0 H CYS B 84 69.602 10.844 4.226 1.00 0.00 H new ATOM 0 HA CYS B 84 68.206 13.183 3.471 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.552 10.218 3.131 1.00 0.00 H new ATOM 0 HB3 CYS B 84 66.673 11.496 2.315 1.00 0.00 H new ATOM 0 HG CYS B 84 69.981 10.671 1.889 1.00 0.00 H new ATOM 2776 N HIS B 85 66.020 13.337 4.733 1.00 0.00 N ATOM 2777 CA HIS B 85 64.856 13.501 5.652 1.00 0.00 C ATOM 2778 C HIS B 85 63.899 12.320 5.489 1.00 0.00 C ATOM 2779 O HIS B 85 63.626 11.873 4.393 1.00 0.00 O ATOM 2780 CB HIS B 85 64.115 14.797 5.314 1.00 0.00 C ATOM 2781 CG HIS B 85 65.017 15.975 5.557 1.00 0.00 C ATOM 2782 ND1 HIS B 85 65.818 16.511 4.558 1.00 0.00 N ATOM 2783 CD2 HIS B 85 65.253 16.736 6.676 1.00 0.00 C ATOM 2784 CE1 HIS B 85 66.493 17.547 5.091 1.00 0.00 C ATOM 2785 NE2 HIS B 85 66.182 17.724 6.377 1.00 0.00 N ATOM 0 H HIS B 85 66.137 14.080 4.044 1.00 0.00 H new ATOM 0 HA HIS B 85 65.216 13.540 6.680 1.00 0.00 H new ATOM 0 HB2 HIS B 85 63.793 14.782 4.273 1.00 0.00 H new ATOM 0 HB3 HIS B 85 63.216 14.883 5.924 1.00 0.00 H new ATOM 0 HD2 HIS B 85 64.788 16.589 7.640 1.00 0.00 H new ATOM 0 HE1 HIS B 85 67.198 18.158 4.546 1.00 0.00 H new ATOM 0 HE2 HIS B 85 66.550 18.436 7.008 1.00 0.00 H new ATOM 2794 N GLU B 86 63.379 11.817 6.575 1.00 0.00 N ATOM 2795 CA GLU B 86 62.432 10.673 6.486 1.00 0.00 C ATOM 2796 C GLU B 86 61.075 11.175 5.984 1.00 0.00 C ATOM 2797 O GLU B 86 60.615 12.233 6.366 1.00 0.00 O ATOM 2798 CB GLU B 86 62.269 10.039 7.869 1.00 0.00 C ATOM 2799 CG GLU B 86 63.583 9.370 8.280 1.00 0.00 C ATOM 2800 CD GLU B 86 63.426 8.735 9.663 1.00 0.00 C ATOM 2801 OE1 GLU B 86 62.324 8.766 10.185 1.00 0.00 O ATOM 2802 OE2 GLU B 86 64.410 8.229 10.175 1.00 0.00 O ATOM 0 H GLU B 86 63.570 12.150 7.520 1.00 0.00 H new ATOM 0 HA GLU B 86 62.821 9.928 5.792 1.00 0.00 H new ATOM 0 HB2 GLU B 86 61.991 10.799 8.599 1.00 0.00 H new ATOM 0 HB3 GLU B 86 61.464 9.304 7.852 1.00 0.00 H new ATOM 0 HG2 GLU B 86 63.860 8.610 7.549 1.00 0.00 H new ATOM 0 HG3 GLU B 86 64.388 10.105 8.296 1.00 0.00 H new ATOM 2809 N PHE B 87 60.432 10.426 5.131 1.00 0.00 N ATOM 2810 CA PHE B 87 59.106 10.859 4.606 1.00 0.00 C ATOM 2811 C PHE B 87 59.208 12.302 4.101 1.00 0.00 C ATOM 2812 O PHE B 87 58.662 13.216 4.687 1.00 0.00 O ATOM 2813 CB PHE B 87 58.057 10.768 5.721 1.00 0.00 C ATOM 2814 CG PHE B 87 56.768 11.420 5.265 1.00 0.00 C ATOM 2815 CD1 PHE B 87 55.991 10.805 4.277 1.00 0.00 C ATOM 2816 CD2 PHE B 87 56.355 12.637 5.823 1.00 0.00 C ATOM 2817 CE1 PHE B 87 54.801 11.403 3.847 1.00 0.00 C ATOM 2818 CE2 PHE B 87 55.163 13.235 5.392 1.00 0.00 C ATOM 2819 CZ PHE B 87 54.386 12.617 4.405 1.00 0.00 C ATOM 0 H PHE B 87 60.768 9.531 4.774 1.00 0.00 H new ATOM 0 HA PHE B 87 58.807 10.209 3.783 1.00 0.00 H new ATOM 0 HB2 PHE B 87 57.876 9.725 5.979 1.00 0.00 H new ATOM 0 HB3 PHE B 87 58.426 11.260 6.621 1.00 0.00 H new ATOM 0 HD1 PHE B 87 56.310 9.868 3.846 1.00 0.00 H new ATOM 0 HD2 PHE B 87 56.955 13.114 6.584 1.00 0.00 H new ATOM 0 HE1 PHE B 87 54.203 10.927 3.084 1.00 0.00 H new ATOM 0 HE2 PHE B 87 54.844 14.173 5.822 1.00 0.00 H new ATOM 0 HZ PHE B 87 53.467 13.077 4.074 1.00 0.00 H new ATOM 2829 N PHE B 88 59.903 12.513 3.017 1.00 0.00 N ATOM 2830 CA PHE B 88 60.038 13.893 2.473 1.00 0.00 C ATOM 2831 C PHE B 88 58.649 14.412 2.082 1.00 0.00 C ATOM 2832 O PHE B 88 57.831 13.683 1.559 1.00 0.00 O ATOM 2833 CB PHE B 88 60.953 13.854 1.246 1.00 0.00 C ATOM 2834 CG PHE B 88 61.162 15.251 0.715 1.00 0.00 C ATOM 2835 CD1 PHE B 88 62.227 16.024 1.187 1.00 0.00 C ATOM 2836 CD2 PHE B 88 60.298 15.766 -0.257 1.00 0.00 C ATOM 2837 CE1 PHE B 88 62.429 17.317 0.688 1.00 0.00 C ATOM 2838 CE2 PHE B 88 60.498 17.058 -0.755 1.00 0.00 C ATOM 2839 CZ PHE B 88 61.564 17.834 -0.283 1.00 0.00 C ATOM 0 H PHE B 88 60.384 11.788 2.484 1.00 0.00 H new ATOM 0 HA PHE B 88 60.470 14.557 3.221 1.00 0.00 H new ATOM 0 HB2 PHE B 88 61.912 13.409 1.511 1.00 0.00 H new ATOM 0 HB3 PHE B 88 60.512 13.224 0.473 1.00 0.00 H new ATOM 0 HD1 PHE B 88 62.894 15.624 1.936 1.00 0.00 H new ATOM 0 HD2 PHE B 88 59.477 15.167 -0.623 1.00 0.00 H new ATOM 0 HE1 PHE B 88 63.252 17.915 1.052 1.00 0.00 H new ATOM 0 HE2 PHE B 88 59.830 17.457 -1.504 1.00 0.00 H new ATOM 0 HZ PHE B 88 61.718 18.831 -0.668 1.00 0.00 H new ATOM 2849 N GLU B 89 58.370 15.663 2.346 1.00 0.00 N ATOM 2850 CA GLU B 89 57.026 16.215 2.001 1.00 0.00 C ATOM 2851 C GLU B 89 56.967 16.565 0.513 1.00 0.00 C ATOM 2852 O GLU B 89 57.960 16.910 -0.094 1.00 0.00 O ATOM 2853 CB GLU B 89 56.758 17.469 2.843 1.00 0.00 C ATOM 2854 CG GLU B 89 57.801 18.547 2.528 1.00 0.00 C ATOM 2855 CD GLU B 89 57.550 19.769 3.413 1.00 0.00 C ATOM 2856 OE1 GLU B 89 56.451 19.888 3.927 1.00 0.00 O ATOM 2857 OE2 GLU B 89 58.463 20.566 3.563 1.00 0.00 O ATOM 0 H GLU B 89 59.012 16.324 2.784 1.00 0.00 H new ATOM 0 HA GLU B 89 56.265 15.465 2.215 1.00 0.00 H new ATOM 0 HB2 GLU B 89 55.757 17.849 2.636 1.00 0.00 H new ATOM 0 HB3 GLU B 89 56.791 17.219 3.903 1.00 0.00 H new ATOM 0 HG2 GLU B 89 58.805 18.159 2.701 1.00 0.00 H new ATOM 0 HG3 GLU B 89 57.744 18.828 1.476 1.00 0.00 H new ATOM 2864 N HIS B 90 55.808 16.480 -0.080 1.00 0.00 N ATOM 2865 CA HIS B 90 55.685 16.805 -1.528 1.00 0.00 C ATOM 2866 C HIS B 90 56.697 15.979 -2.321 1.00 0.00 C ATOM 2867 O HIS B 90 57.867 16.303 -2.386 1.00 0.00 O ATOM 2868 CB HIS B 90 55.957 18.288 -1.761 1.00 0.00 C ATOM 2869 CG HIS B 90 55.199 19.111 -0.756 1.00 0.00 C ATOM 2870 ND1 HIS B 90 55.834 20.011 0.090 1.00 0.00 N ATOM 2871 CD2 HIS B 90 53.862 19.186 -0.450 1.00 0.00 C ATOM 2872 CE1 HIS B 90 54.887 20.585 0.856 1.00 0.00 C ATOM 2873 NE2 HIS B 90 53.671 20.117 0.565 1.00 0.00 N ATOM 0 H HIS B 90 54.940 16.199 0.377 1.00 0.00 H new ATOM 0 HA HIS B 90 54.673 16.571 -1.858 1.00 0.00 H new ATOM 0 HB2 HIS B 90 57.025 18.488 -1.677 1.00 0.00 H new ATOM 0 HB3 HIS B 90 55.659 18.567 -2.772 1.00 0.00 H new ATOM 0 HD2 HIS B 90 53.080 18.611 -0.924 1.00 0.00 H new ATOM 0 HE1 HIS B 90 55.086 21.331 1.611 1.00 0.00 H new ATOM 0 HE2 HIS B 90 52.787 20.386 0.997 1.00 0.00 H new ATOM 2882 N GLU B 91 56.254 14.916 -2.920 1.00 0.00 N ATOM 2883 CA GLU B 91 57.182 14.058 -3.708 1.00 0.00 C ATOM 2884 C GLU B 91 57.710 14.848 -4.908 1.00 0.00 C ATOM 2885 O GLU B 91 58.917 14.883 -5.083 1.00 0.00 O ATOM 2886 CB GLU B 91 56.431 12.819 -4.200 1.00 0.00 C ATOM 2887 CG GLU B 91 57.385 11.919 -4.987 1.00 0.00 C ATOM 2888 CD GLU B 91 56.667 10.623 -5.367 1.00 0.00 C ATOM 2889 OE1 GLU B 91 55.520 10.470 -4.980 1.00 0.00 O ATOM 2890 OE2 GLU B 91 57.276 9.806 -6.037 1.00 0.00 O ATOM 2891 OXT GLU B 91 56.899 15.403 -5.630 1.00 0.00 O ATOM 0 H GLU B 91 55.284 14.600 -2.900 1.00 0.00 H new ATOM 0 HA GLU B 91 58.019 13.751 -3.081 1.00 0.00 H new ATOM 0 HB2 GLU B 91 56.016 12.273 -3.353 1.00 0.00 H new ATOM 0 HB3 GLU B 91 55.592 13.116 -4.830 1.00 0.00 H new ATOM 0 HG2 GLU B 91 57.730 12.433 -5.884 1.00 0.00 H new ATOM 0 HG3 GLU B 91 58.268 11.696 -4.389 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 58.394 -1.695 12.936 1.00 0.00 CA HETATM 2900 CA CA B 102 86.447 2.498 -11.248 1.00 0.00 CA HETATM 2901 CA CA A 103 70.442 -5.862 15.392 1.00 0.00 CA HETATM 2902 CA CA B 104 88.334 2.306 1.539 1.00 0.00 CA