USER MOD reduce.3.24.130724 H: found=0, std=0, add=1667, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1666 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 NoAdj : A 66 ASNHD21 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : A 66 ASNHD22 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD21 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD22 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD Set 1.1: B 61 LYS NZ :NH3+ -168:sc= 1.16 (180deg=-0.139) USER MOD Set 1.2: B 67 GLN : amide:sc= 0.834 K(o=2,f=-8.9!) USER MOD Set 2.1: B 60 MET CE :methyl -177:sc= -0.111 (180deg=-0.113) USER MOD Set 2.2: B 69 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 48 HIS : no HE2:sc= 1.86 K(o=4.6,f=-9.3!) USER MOD Set 3.2: B 51 LYS NZ :NH3+ 180:sc= 2.72 (180deg=1.42) USER MOD Set 4.1: B 44 GLN : amide:sc= 1.05 K(o=3.1,f=1.1) USER MOD Set 4.2: B 45 GLN : amide:sc= 2.04 K(o=3.1,f=-0.096) USER MOD Set 5.1: B 1 MET CE :methyl -130:sc=-0.00894 (180deg=-0.287) USER MOD Set 5.2: B 30 LYS NZ :NH3+ -174:sc= 1.24 (180deg=0.736) USER MOD Set 6.1: A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 69 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 44 GLN : amide:sc= 0.538 K(o=2.2,f=1.1) USER MOD Set 7.2: A 45 GLN : amide:sc= 1.63 K(o=2.2,f=0.45) USER MOD Set 8.1: A 32 SER OG : rot -149:sc= 1.57 USER MOD Set 8.2: A 72 LYS NZ :NH3+ 157:sc= 2.3 (180deg=1.71) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= 1.28 (180deg=1.11) USER MOD Single : A 7 THR OG1 : rot -172:sc= 1.24 USER MOD Single : A 12 SER OG : rot -70:sc= -0.0862 USER MOD Single : A 15 THR OG1 : rot -26:sc= 0.00222 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 93:sc= 1.11 USER MOD Single : A 22 THR OG1 : rot -76:sc= 1.04 USER MOD Single : A 26 GLN : amide:sc= 1.07 K(o=1.1,f=-2.1!) USER MOD Single : A 30 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0612) USER MOD Single : A 36 ASN : amide:sc= 1.07 K(o=1.1,f=-0.16) USER MOD Single : A 39 LYS NZ :NH3+ 153:sc= 1.31 (180deg=-1.41!) USER MOD Single : A 43 THR OG1 : rot 85:sc= 1.19 USER MOD Single : A 48 HIS : no HE2:sc=-0.00799 K(o=-0.008,f=-3.2!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -94:sc= 1.26 USER MOD Single : A 59 LYS NZ :NH3+ -156:sc= 2.04 (180deg=1.41!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 74 ASN : amide:sc= -0.0292 X(o=-0.029,f=0) USER MOD Single : A 76 TYR OH : rot 162:sc= -0.14 USER MOD Single : A 85 LYS NZ :NH3+ 169:sc= 0.916 (180deg=-0.306!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -171:sc= 0.859 (180deg=0.184) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 158:sc= -0.0489 (180deg=-0.29) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -141:sc= 0.547 (180deg=-3.35!) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.279 USER MOD Single : B 12 SER OG : rot -60:sc= -0.0052 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 74:sc= 1.21 USER MOD Single : B 22 THR OG1 : rot -78:sc= 1 USER MOD Single : B 26 GLN : amide:sc= 0.31 X(o=0.31,f=-0.014) USER MOD Single : B 32 SER OG : rot -150:sc= 0.307 USER MOD Single : B 34 SER OG : rot 61:sc= 1.14 USER MOD Single : B 36 ASN : amide:sc= 0.594 K(o=0.59,f=-0.017) USER MOD Single : B 39 LYS NZ :NH3+ 174:sc= 2.01 (180deg=1.87) USER MOD Single : B 43 THR OG1 : rot 80:sc= 1.17 USER MOD Single : B 55 SER OG : rot -36:sc= 1.24 USER MOD Single : B 59 LYS NZ :NH3+ 173:sc= 1.78! (180deg=1.62) USER MOD Single : B 62 SER OG : rot 78:sc= 1.18 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -2.22 K(o=-2.2,f=-4.8!) USER MOD Single : B 76 TYR OH : rot 53:sc= 0.00146 USER MOD Single : B 85 LYS NZ :NH3+ -112:sc= 1.84 (180deg=-1.45!) USER MOD Single : B 89 LYS NZ :NH3+ -142:sc= 1.13 (180deg=-0.359) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 144:sc= 0.679 (180deg=-2.97!) USER MOD Single : B 94 LYS NZ :NH3+ -163:sc= 1.26 (180deg=1.19) USER MOD Single : B 97 LYS NZ :NH3+ -145:sc= -0.073 (180deg=-1.75!) USER MOD Single : B 98 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0147) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.435 -21.336 -19.840 1.00 4.53 N ATOM 2 CA MET A 1 6.398 -21.950 -20.774 1.00 3.53 C ATOM 3 C MET A 1 7.649 -21.084 -20.673 1.00 2.68 C ATOM 4 O MET A 1 8.263 -21.061 -19.611 1.00 3.09 O ATOM 5 CB MET A 1 5.826 -22.036 -22.201 1.00 3.64 C ATOM 6 CG MET A 1 4.752 -23.119 -22.368 1.00 4.56 C ATOM 7 SD MET A 1 4.062 -23.186 -24.043 1.00 5.20 S ATOM 8 CE MET A 1 2.948 -24.599 -23.892 1.00 6.53 C ATOM 0 H1 MET A 1 4.491 -21.743 -19.998 1.00 4.53 H new ATOM 0 H2 MET A 1 5.733 -21.523 -18.861 1.00 4.53 H new ATOM 0 H3 MET A 1 5.401 -20.309 -20.002 1.00 4.53 H new ATOM 0 HA MET A 1 6.625 -22.985 -20.520 1.00 3.53 H new ATOM 0 HB2 MET A 1 5.401 -21.070 -22.472 1.00 3.64 H new ATOM 0 HB3 MET A 1 6.640 -22.233 -22.899 1.00 3.64 H new ATOM 0 HG2 MET A 1 5.182 -24.089 -22.120 1.00 4.56 H new ATOM 0 HG3 MET A 1 3.946 -22.936 -21.657 1.00 4.56 H new ATOM 0 HE1 MET A 1 2.446 -24.770 -24.844 1.00 6.53 H new ATOM 0 HE2 MET A 1 3.520 -25.486 -23.619 1.00 6.53 H new ATOM 0 HE3 MET A 1 2.205 -24.396 -23.121 1.00 6.53 H new ATOM 20 N ALA A 2 7.876 -20.218 -21.664 1.00 2.40 N ATOM 21 CA ALA A 2 8.280 -18.852 -21.358 1.00 2.33 C ATOM 22 C ALA A 2 7.142 -18.166 -20.595 1.00 2.21 C ATOM 23 O ALA A 2 6.091 -18.778 -20.363 1.00 2.47 O ATOM 24 CB ALA A 2 8.612 -18.124 -22.665 1.00 2.98 C ATOM 0 H ALA A 2 7.789 -20.433 -22.657 1.00 2.40 H new ATOM 0 HA ALA A 2 9.172 -18.836 -20.731 1.00 2.33 H new ATOM 0 HB1 ALA A 2 8.915 -17.101 -22.444 1.00 2.98 H new ATOM 0 HB2 ALA A 2 9.425 -18.642 -23.174 1.00 2.98 H new ATOM 0 HB3 ALA A 2 7.732 -18.111 -23.308 1.00 2.98 H new ATOM 30 N ALA A 3 7.380 -16.914 -20.207 1.00 2.40 N ATOM 31 CA ALA A 3 6.547 -16.125 -19.320 1.00 2.64 C ATOM 32 C ALA A 3 6.698 -16.639 -17.891 1.00 2.11 C ATOM 33 O ALA A 3 5.965 -17.521 -17.443 1.00 2.61 O ATOM 34 CB ALA A 3 5.089 -16.025 -19.791 1.00 3.56 C ATOM 0 H ALA A 3 8.204 -16.402 -20.523 1.00 2.40 H new ATOM 0 HA ALA A 3 6.897 -15.093 -19.343 1.00 2.64 H new ATOM 0 HB1 ALA A 3 4.519 -15.422 -19.084 1.00 3.56 H new ATOM 0 HB2 ALA A 3 5.056 -15.558 -20.776 1.00 3.56 H new ATOM 0 HB3 ALA A 3 4.656 -17.024 -19.848 1.00 3.56 H new ATOM 40 N GLU A 4 7.696 -16.100 -17.197 1.00 1.65 N ATOM 41 CA GLU A 4 8.081 -16.474 -15.856 1.00 1.55 C ATOM 42 C GLU A 4 7.053 -15.907 -14.870 1.00 1.45 C ATOM 43 O GLU A 4 6.830 -14.697 -14.869 1.00 1.51 O ATOM 44 CB GLU A 4 9.519 -15.993 -15.561 1.00 2.07 C ATOM 45 CG GLU A 4 9.929 -14.651 -16.204 1.00 2.82 C ATOM 46 CD GLU A 4 10.411 -14.801 -17.645 1.00 3.62 C ATOM 47 OE1 GLU A 4 9.538 -14.727 -18.541 1.00 4.44 O ATOM 48 OE2 GLU A 4 11.625 -15.026 -17.825 1.00 4.22 O ATOM 0 H GLU A 4 8.280 -15.357 -17.580 1.00 1.65 H new ATOM 0 HA GLU A 4 8.088 -17.559 -15.747 1.00 1.55 H new ATOM 0 HB2 GLU A 4 9.638 -15.907 -14.481 1.00 2.07 H new ATOM 0 HB3 GLU A 4 10.214 -16.762 -15.898 1.00 2.07 H new ATOM 0 HG2 GLU A 4 9.079 -13.969 -16.180 1.00 2.82 H new ATOM 0 HG3 GLU A 4 10.720 -14.196 -15.608 1.00 2.82 H new ATOM 55 N PRO A 5 6.411 -16.743 -14.037 1.00 1.61 N ATOM 56 CA PRO A 5 5.578 -16.241 -12.962 1.00 1.68 C ATOM 57 C PRO A 5 6.496 -15.556 -11.950 1.00 1.45 C ATOM 58 O PRO A 5 7.612 -16.023 -11.714 1.00 1.83 O ATOM 59 CB PRO A 5 4.883 -17.471 -12.376 1.00 2.13 C ATOM 60 CG PRO A 5 5.895 -18.591 -12.619 1.00 2.25 C ATOM 61 CD PRO A 5 6.571 -18.186 -13.932 1.00 1.97 C ATOM 0 HA PRO A 5 4.831 -15.513 -13.277 1.00 1.68 H new ATOM 0 HB2 PRO A 5 4.668 -17.345 -11.315 1.00 2.13 H new ATOM 0 HB3 PRO A 5 3.933 -17.672 -12.872 1.00 2.13 H new ATOM 0 HG2 PRO A 5 6.615 -18.665 -11.804 1.00 2.25 H new ATOM 0 HG3 PRO A 5 5.406 -19.562 -12.702 1.00 2.25 H new ATOM 0 HD2 PRO A 5 7.625 -18.463 -13.930 1.00 1.97 H new ATOM 0 HD3 PRO A 5 6.111 -18.692 -14.780 1.00 1.97 H new ATOM 69 N LEU A 6 6.044 -14.447 -11.374 1.00 1.06 N ATOM 70 CA LEU A 6 6.796 -13.698 -10.386 1.00 1.02 C ATOM 71 C LEU A 6 6.304 -14.140 -9.004 1.00 1.02 C ATOM 72 O LEU A 6 5.385 -14.956 -8.906 1.00 1.04 O ATOM 73 CB LEU A 6 6.606 -12.205 -10.675 1.00 1.05 C ATOM 74 CG LEU A 6 7.120 -11.804 -12.076 1.00 1.01 C ATOM 75 CD1 LEU A 6 6.607 -10.396 -12.402 1.00 1.33 C ATOM 76 CD2 LEU A 6 8.653 -11.802 -12.127 1.00 1.31 C ATOM 0 H LEU A 6 5.132 -14.042 -11.586 1.00 1.06 H new ATOM 0 HA LEU A 6 7.869 -13.886 -10.422 1.00 1.02 H new ATOM 0 HB2 LEU A 6 5.548 -11.954 -10.594 1.00 1.05 H new ATOM 0 HB3 LEU A 6 7.131 -11.622 -9.918 1.00 1.05 H new ATOM 0 HG LEU A 6 6.755 -12.530 -12.803 1.00 1.01 H new ATOM 0 HD11 LEU A 6 6.962 -10.099 -13.389 1.00 1.33 H new ATOM 0 HD12 LEU A 6 5.517 -10.395 -12.393 1.00 1.33 H new ATOM 0 HD13 LEU A 6 6.977 -9.692 -11.656 1.00 1.33 H new ATOM 0 HD21 LEU A 6 8.983 -11.516 -13.126 1.00 1.31 H new ATOM 0 HD22 LEU A 6 9.040 -11.090 -11.399 1.00 1.31 H new ATOM 0 HD23 LEU A 6 9.026 -12.799 -11.893 1.00 1.31 H new ATOM 88 N THR A 7 6.931 -13.682 -7.917 1.00 1.05 N ATOM 89 CA THR A 7 6.491 -14.142 -6.606 1.00 1.13 C ATOM 90 C THR A 7 5.145 -13.514 -6.241 1.00 1.01 C ATOM 91 O THR A 7 4.703 -12.548 -6.854 1.00 1.06 O ATOM 92 CB THR A 7 7.557 -13.933 -5.528 1.00 1.25 C ATOM 93 OG1 THR A 7 7.255 -14.818 -4.466 1.00 1.85 O ATOM 94 CG2 THR A 7 7.594 -12.501 -4.991 1.00 0.92 C ATOM 0 H THR A 7 7.710 -13.023 -7.917 1.00 1.05 H new ATOM 0 HA THR A 7 6.343 -15.221 -6.660 1.00 1.13 H new ATOM 0 HB THR A 7 8.536 -14.125 -5.967 1.00 1.25 H new ATOM 0 HG1 THR A 7 7.836 -14.622 -3.701 1.00 1.85 H new ATOM 0 HG21 THR A 7 8.370 -12.418 -4.230 1.00 0.92 H new ATOM 0 HG22 THR A 7 7.810 -11.812 -5.807 1.00 0.92 H new ATOM 0 HG23 THR A 7 6.628 -12.252 -4.552 1.00 0.92 H new ATOM 102 N GLU A 8 4.502 -14.051 -5.209 1.00 1.14 N ATOM 103 CA GLU A 8 3.125 -13.740 -4.868 1.00 1.15 C ATOM 104 C GLU A 8 2.908 -12.227 -4.742 1.00 0.93 C ATOM 105 O GLU A 8 2.081 -11.627 -5.431 1.00 1.00 O ATOM 106 CB GLU A 8 2.801 -14.489 -3.574 1.00 1.42 C ATOM 107 CG GLU A 8 1.311 -14.450 -3.250 1.00 1.32 C ATOM 108 CD GLU A 8 1.027 -15.298 -2.013 1.00 1.61 C ATOM 109 OE1 GLU A 8 1.870 -15.245 -1.086 1.00 2.19 O ATOM 110 OE2 GLU A 8 -0.006 -15.997 -2.023 1.00 1.99 O ATOM 0 H GLU A 8 4.934 -14.726 -4.578 1.00 1.14 H new ATOM 0 HA GLU A 8 2.447 -14.062 -5.658 1.00 1.15 H new ATOM 0 HB2 GLU A 8 3.126 -15.526 -3.664 1.00 1.42 H new ATOM 0 HB3 GLU A 8 3.363 -14.049 -2.750 1.00 1.42 H new ATOM 0 HG2 GLU A 8 0.994 -13.421 -3.077 1.00 1.32 H new ATOM 0 HG3 GLU A 8 0.736 -14.823 -4.097 1.00 1.32 H new ATOM 117 N LEU A 9 3.674 -11.589 -3.857 1.00 0.76 N ATOM 118 CA LEU A 9 3.574 -10.153 -3.675 1.00 0.67 C ATOM 119 C LEU A 9 4.044 -9.378 -4.919 1.00 0.62 C ATOM 120 O LEU A 9 3.459 -8.334 -5.189 1.00 0.57 O ATOM 121 CB LEU A 9 4.210 -9.734 -2.340 1.00 0.62 C ATOM 122 CG LEU A 9 3.202 -9.960 -1.189 1.00 0.80 C ATOM 123 CD1 LEU A 9 3.855 -10.219 0.170 1.00 1.15 C ATOM 124 CD2 LEU A 9 2.306 -8.730 -0.995 1.00 1.64 C ATOM 0 H LEU A 9 4.364 -12.046 -3.261 1.00 0.76 H new ATOM 0 HA LEU A 9 2.525 -9.869 -3.588 1.00 0.67 H new ATOM 0 HB2 LEU A 9 5.117 -10.312 -2.161 1.00 0.62 H new ATOM 0 HB3 LEU A 9 4.503 -8.685 -2.379 1.00 0.62 H new ATOM 0 HG LEU A 9 2.641 -10.843 -1.496 1.00 0.80 H new ATOM 0 HD11 LEU A 9 3.081 -10.367 0.923 1.00 1.15 H new ATOM 0 HD12 LEU A 9 4.479 -11.111 0.110 1.00 1.15 H new ATOM 0 HD13 LEU A 9 4.471 -9.363 0.447 1.00 1.15 H new ATOM 0 HD21 LEU A 9 1.606 -8.915 -0.180 1.00 1.64 H new ATOM 0 HD22 LEU A 9 2.923 -7.864 -0.754 1.00 1.64 H new ATOM 0 HD23 LEU A 9 1.751 -8.536 -1.913 1.00 1.64 H new ATOM 136 N GLU A 10 5.006 -9.872 -5.715 1.00 0.67 N ATOM 137 CA GLU A 10 5.302 -9.291 -7.027 1.00 0.67 C ATOM 138 C GLU A 10 4.044 -9.251 -7.905 1.00 0.67 C ATOM 139 O GLU A 10 3.653 -8.174 -8.352 1.00 0.71 O ATOM 140 CB GLU A 10 6.466 -9.998 -7.738 1.00 0.76 C ATOM 141 CG GLU A 10 7.822 -9.616 -7.128 1.00 0.99 C ATOM 142 CD GLU A 10 8.989 -10.463 -7.633 1.00 1.16 C ATOM 143 OE1 GLU A 10 8.752 -11.654 -7.936 1.00 1.95 O ATOM 144 OE2 GLU A 10 10.110 -9.908 -7.676 1.00 1.92 O ATOM 0 H GLU A 10 5.590 -10.672 -5.470 1.00 0.67 H new ATOM 0 HA GLU A 10 5.628 -8.265 -6.855 1.00 0.67 H new ATOM 0 HB2 GLU A 10 6.330 -11.078 -7.674 1.00 0.76 H new ATOM 0 HB3 GLU A 10 6.457 -9.738 -8.797 1.00 0.76 H new ATOM 0 HG2 GLU A 10 8.025 -8.568 -7.347 1.00 0.99 H new ATOM 0 HG3 GLU A 10 7.761 -9.709 -6.044 1.00 0.99 H new ATOM 151 N GLU A 11 3.385 -10.396 -8.127 1.00 0.68 N ATOM 152 CA GLU A 11 2.116 -10.446 -8.855 1.00 0.69 C ATOM 153 C GLU A 11 1.167 -9.381 -8.288 1.00 0.68 C ATOM 154 O GLU A 11 0.599 -8.558 -9.012 1.00 0.79 O ATOM 155 CB GLU A 11 1.466 -11.838 -8.724 1.00 0.73 C ATOM 156 CG GLU A 11 2.307 -13.030 -9.214 1.00 1.67 C ATOM 157 CD GLU A 11 2.413 -13.121 -10.736 1.00 2.43 C ATOM 158 OE1 GLU A 11 1.417 -12.754 -11.397 1.00 2.94 O ATOM 159 OE2 GLU A 11 3.476 -13.572 -11.220 1.00 3.39 O ATOM 0 H GLU A 11 3.716 -11.307 -7.808 1.00 0.68 H new ATOM 0 HA GLU A 11 2.308 -10.252 -9.910 1.00 0.69 H new ATOM 0 HB2 GLU A 11 1.217 -12.002 -7.676 1.00 0.73 H new ATOM 0 HB3 GLU A 11 0.527 -11.831 -9.277 1.00 0.73 H new ATOM 0 HG2 GLU A 11 3.309 -12.954 -8.792 1.00 1.67 H new ATOM 0 HG3 GLU A 11 1.870 -13.953 -8.833 1.00 1.67 H new ATOM 166 N SER A 12 1.011 -9.404 -6.961 1.00 0.68 N ATOM 167 CA SER A 12 0.057 -8.563 -6.260 1.00 0.81 C ATOM 168 C SER A 12 0.323 -7.069 -6.479 1.00 0.77 C ATOM 169 O SER A 12 -0.597 -6.341 -6.849 1.00 0.94 O ATOM 170 CB SER A 12 0.012 -8.929 -4.774 1.00 0.94 C ATOM 171 OG SER A 12 -1.241 -8.566 -4.228 1.00 1.83 O ATOM 0 H SER A 12 1.550 -10.013 -6.346 1.00 0.68 H new ATOM 0 HA SER A 12 -0.928 -8.755 -6.684 1.00 0.81 H new ATOM 0 HB2 SER A 12 0.177 -9.999 -4.649 1.00 0.94 H new ATOM 0 HB3 SER A 12 0.813 -8.418 -4.240 1.00 0.94 H new ATOM 0 HG SER A 12 -1.306 -7.589 -4.180 1.00 1.83 H new ATOM 177 N ILE A 13 1.542 -6.573 -6.223 1.00 0.64 N ATOM 178 CA ILE A 13 1.783 -5.144 -6.403 1.00 0.73 C ATOM 179 C ILE A 13 1.796 -4.788 -7.892 1.00 0.73 C ATOM 180 O ILE A 13 1.302 -3.721 -8.253 1.00 0.81 O ATOM 181 CB ILE A 13 2.907 -4.537 -5.527 1.00 0.83 C ATOM 182 CG1 ILE A 13 4.333 -4.496 -6.095 1.00 1.17 C ATOM 183 CG2 ILE A 13 2.804 -5.082 -4.095 1.00 0.85 C ATOM 184 CD1 ILE A 13 4.980 -5.862 -6.223 1.00 1.45 C ATOM 0 H ILE A 13 2.343 -7.118 -5.904 1.00 0.64 H new ATOM 0 HA ILE A 13 0.931 -4.614 -5.978 1.00 0.73 H new ATOM 0 HB ILE A 13 2.705 -3.466 -5.523 1.00 0.83 H new ATOM 0 HG12 ILE A 13 4.310 -4.022 -7.076 1.00 1.17 H new ATOM 0 HG13 ILE A 13 4.952 -3.870 -5.453 1.00 1.17 H new ATOM 0 HG21 ILE A 13 3.597 -4.651 -3.484 1.00 0.85 H new ATOM 0 HG22 ILE A 13 1.835 -4.815 -3.673 1.00 0.85 H new ATOM 0 HG23 ILE A 13 2.906 -6.167 -4.110 1.00 0.85 H new ATOM 0 HD11 ILE A 13 5.985 -5.752 -6.631 1.00 1.45 H new ATOM 0 HD12 ILE A 13 5.036 -6.331 -5.241 1.00 1.45 H new ATOM 0 HD13 ILE A 13 4.384 -6.486 -6.889 1.00 1.45 H new ATOM 196 N GLU A 14 2.265 -5.685 -8.773 1.00 0.67 N ATOM 197 CA GLU A 14 2.159 -5.441 -10.207 1.00 0.70 C ATOM 198 C GLU A 14 0.702 -5.129 -10.572 1.00 0.72 C ATOM 199 O GLU A 14 0.425 -4.076 -11.139 1.00 0.74 O ATOM 200 CB GLU A 14 2.733 -6.596 -11.046 1.00 0.77 C ATOM 201 CG GLU A 14 3.294 -6.101 -12.390 1.00 0.77 C ATOM 202 CD GLU A 14 2.297 -5.289 -13.210 1.00 1.78 C ATOM 203 OE1 GLU A 14 1.245 -5.863 -13.564 1.00 2.60 O ATOM 204 OE2 GLU A 14 2.593 -4.097 -13.447 1.00 2.67 O ATOM 0 H GLU A 14 2.711 -6.566 -8.519 1.00 0.67 H new ATOM 0 HA GLU A 14 2.771 -4.573 -10.450 1.00 0.70 H new ATOM 0 HB2 GLU A 14 3.522 -7.096 -10.485 1.00 0.77 H new ATOM 0 HB3 GLU A 14 1.953 -7.336 -11.228 1.00 0.77 H new ATOM 0 HG2 GLU A 14 4.178 -5.491 -12.202 1.00 0.77 H new ATOM 0 HG3 GLU A 14 3.618 -6.960 -12.977 1.00 0.77 H new ATOM 211 N THR A 15 -0.252 -5.990 -10.195 1.00 0.74 N ATOM 212 CA THR A 15 -1.626 -5.784 -10.651 1.00 0.73 C ATOM 213 C THR A 15 -2.230 -4.430 -10.227 1.00 0.77 C ATOM 214 O THR A 15 -3.130 -3.945 -10.915 1.00 1.02 O ATOM 215 CB THR A 15 -2.540 -6.986 -10.369 1.00 0.83 C ATOM 216 OG1 THR A 15 -3.782 -6.808 -11.025 1.00 1.49 O ATOM 217 CG2 THR A 15 -2.797 -7.236 -8.885 1.00 0.92 C ATOM 0 H THR A 15 -0.105 -6.804 -9.599 1.00 0.74 H new ATOM 0 HA THR A 15 -1.560 -5.720 -11.737 1.00 0.73 H new ATOM 0 HB THR A 15 -2.011 -7.860 -10.750 1.00 0.83 H new ATOM 0 HG1 THR A 15 -3.952 -5.851 -11.150 1.00 1.49 H new ATOM 0 HG21 THR A 15 -3.450 -8.101 -8.770 1.00 0.92 H new ATOM 0 HG22 THR A 15 -1.851 -7.426 -8.379 1.00 0.92 H new ATOM 0 HG23 THR A 15 -3.274 -6.360 -8.446 1.00 0.92 H new ATOM 225 N VAL A 16 -1.771 -3.796 -9.138 1.00 0.63 N ATOM 226 CA VAL A 16 -2.167 -2.415 -8.849 1.00 0.60 C ATOM 227 C VAL A 16 -1.327 -1.426 -9.666 1.00 0.59 C ATOM 228 O VAL A 16 -1.864 -0.459 -10.206 1.00 0.65 O ATOM 229 CB VAL A 16 -2.210 -2.083 -7.343 1.00 0.57 C ATOM 230 CG1 VAL A 16 -3.132 -3.055 -6.604 1.00 0.62 C ATOM 231 CG2 VAL A 16 -0.851 -2.069 -6.639 1.00 0.56 C ATOM 0 H VAL A 16 -1.137 -4.211 -8.455 1.00 0.63 H new ATOM 0 HA VAL A 16 -3.203 -2.307 -9.172 1.00 0.60 H new ATOM 0 HB VAL A 16 -2.590 -1.062 -7.303 1.00 0.57 H new ATOM 0 HG11 VAL A 16 -3.149 -2.805 -5.543 1.00 0.62 H new ATOM 0 HG12 VAL A 16 -4.140 -2.981 -7.011 1.00 0.62 H new ATOM 0 HG13 VAL A 16 -2.764 -4.073 -6.731 1.00 0.62 H new ATOM 0 HG21 VAL A 16 -0.989 -1.826 -5.586 1.00 0.56 H new ATOM 0 HG22 VAL A 16 -0.386 -3.051 -6.727 1.00 0.56 H new ATOM 0 HG23 VAL A 16 -0.209 -1.320 -7.103 1.00 0.56 H new ATOM 241 N VAL A 17 -0.016 -1.663 -9.772 1.00 0.57 N ATOM 242 CA VAL A 17 0.905 -0.817 -10.521 1.00 0.56 C ATOM 243 C VAL A 17 0.452 -0.665 -11.974 1.00 0.56 C ATOM 244 O VAL A 17 0.430 0.452 -12.485 1.00 0.56 O ATOM 245 CB VAL A 17 2.339 -1.356 -10.397 1.00 0.63 C ATOM 246 CG1 VAL A 17 3.311 -0.670 -11.366 1.00 0.64 C ATOM 247 CG2 VAL A 17 2.840 -1.158 -8.960 1.00 0.74 C ATOM 0 H VAL A 17 0.438 -2.463 -9.331 1.00 0.57 H new ATOM 0 HA VAL A 17 0.899 0.185 -10.093 1.00 0.56 H new ATOM 0 HB VAL A 17 2.308 -2.415 -10.653 1.00 0.63 H new ATOM 0 HG11 VAL A 17 4.309 -1.088 -11.237 1.00 0.64 H new ATOM 0 HG12 VAL A 17 2.979 -0.834 -12.391 1.00 0.64 H new ATOM 0 HG13 VAL A 17 3.336 0.400 -11.159 1.00 0.64 H new ATOM 0 HG21 VAL A 17 3.857 -1.541 -8.873 1.00 0.74 H new ATOM 0 HG22 VAL A 17 2.830 -0.096 -8.714 1.00 0.74 H new ATOM 0 HG23 VAL A 17 2.190 -1.696 -8.271 1.00 0.74 H new ATOM 257 N THR A 18 0.070 -1.747 -12.652 1.00 0.59 N ATOM 258 CA THR A 18 -0.427 -1.660 -14.021 1.00 0.62 C ATOM 259 C THR A 18 -1.691 -0.787 -14.084 1.00 0.57 C ATOM 260 O THR A 18 -1.774 0.123 -14.912 1.00 0.58 O ATOM 261 CB THR A 18 -0.594 -3.062 -14.627 1.00 0.72 C ATOM 262 OG1 THR A 18 -0.903 -2.971 -16.002 1.00 0.76 O ATOM 263 CG2 THR A 18 -1.673 -3.895 -13.932 1.00 0.74 C ATOM 0 H THR A 18 0.096 -2.694 -12.273 1.00 0.59 H new ATOM 0 HA THR A 18 0.309 -1.156 -14.648 1.00 0.62 H new ATOM 0 HB THR A 18 0.360 -3.568 -14.481 1.00 0.72 H new ATOM 0 HG1 THR A 18 -1.005 -3.872 -16.375 1.00 0.76 H new ATOM 0 HG21 THR A 18 -1.740 -4.873 -14.408 1.00 0.74 H new ATOM 0 HG22 THR A 18 -1.415 -4.020 -12.880 1.00 0.74 H new ATOM 0 HG23 THR A 18 -2.633 -3.386 -14.012 1.00 0.74 H new ATOM 271 N THR A 19 -2.659 -1.002 -13.187 1.00 0.58 N ATOM 272 CA THR A 19 -3.894 -0.231 -13.136 1.00 0.63 C ATOM 273 C THR A 19 -3.577 1.261 -12.946 1.00 0.64 C ATOM 274 O THR A 19 -4.072 2.115 -13.680 1.00 0.68 O ATOM 275 CB THR A 19 -4.795 -0.828 -12.039 1.00 0.68 C ATOM 276 OG1 THR A 19 -4.859 -2.230 -12.226 1.00 0.67 O ATOM 277 CG2 THR A 19 -6.231 -0.298 -12.111 1.00 0.83 C ATOM 0 H THR A 19 -2.601 -1.726 -12.470 1.00 0.58 H new ATOM 0 HA THR A 19 -4.444 -0.294 -14.075 1.00 0.63 H new ATOM 0 HB THR A 19 -4.366 -0.551 -11.076 1.00 0.68 H new ATOM 0 HG1 THR A 19 -4.169 -2.664 -11.682 1.00 0.67 H new ATOM 0 HG21 THR A 19 -6.826 -0.749 -11.317 1.00 0.83 H new ATOM 0 HG22 THR A 19 -6.226 0.785 -11.990 1.00 0.83 H new ATOM 0 HG23 THR A 19 -6.665 -0.552 -13.078 1.00 0.83 H new ATOM 285 N PHE A 20 -2.688 1.568 -11.997 1.00 0.64 N ATOM 286 CA PHE A 20 -2.123 2.897 -11.791 1.00 0.66 C ATOM 287 C PHE A 20 -1.538 3.448 -13.102 1.00 0.64 C ATOM 288 O PHE A 20 -1.908 4.528 -13.557 1.00 0.68 O ATOM 289 CB PHE A 20 -1.077 2.795 -10.662 1.00 0.72 C ATOM 290 CG PHE A 20 -0.122 3.963 -10.492 1.00 1.10 C ATOM 291 CD1 PHE A 20 1.008 4.084 -11.324 1.00 2.37 C ATOM 292 CD2 PHE A 20 -0.273 4.843 -9.406 1.00 2.17 C ATOM 293 CE1 PHE A 20 1.863 5.190 -11.196 1.00 3.01 C ATOM 294 CE2 PHE A 20 0.662 5.871 -9.196 1.00 2.83 C ATOM 295 CZ PHE A 20 1.706 6.069 -10.115 1.00 2.83 C ATOM 0 H PHE A 20 -2.334 0.877 -11.335 1.00 0.64 H new ATOM 0 HA PHE A 20 -2.893 3.607 -11.491 1.00 0.66 H new ATOM 0 HB2 PHE A 20 -1.609 2.654 -9.721 1.00 0.72 H new ATOM 0 HB3 PHE A 20 -0.484 1.896 -10.831 1.00 0.72 H new ATOM 0 HD1 PHE A 20 1.217 3.324 -12.062 1.00 2.37 H new ATOM 0 HD2 PHE A 20 -1.109 4.729 -8.732 1.00 2.17 H new ATOM 0 HE1 PHE A 20 2.639 5.363 -11.927 1.00 3.01 H new ATOM 0 HE2 PHE A 20 0.578 6.509 -8.328 1.00 2.83 H new ATOM 0 HZ PHE A 20 2.387 6.898 -9.989 1.00 2.83 H new ATOM 305 N PHE A 21 -0.601 2.710 -13.701 1.00 0.64 N ATOM 306 CA PHE A 21 0.253 3.197 -14.776 1.00 0.72 C ATOM 307 C PHE A 21 -0.553 3.434 -16.046 1.00 0.89 C ATOM 308 O PHE A 21 -0.341 4.425 -16.742 1.00 1.13 O ATOM 309 CB PHE A 21 1.407 2.212 -15.010 1.00 0.83 C ATOM 310 CG PHE A 21 2.593 2.809 -15.739 1.00 1.09 C ATOM 311 CD1 PHE A 21 3.516 3.599 -15.029 1.00 2.22 C ATOM 312 CD2 PHE A 21 2.819 2.521 -17.097 1.00 2.20 C ATOM 313 CE1 PHE A 21 4.681 4.064 -15.662 1.00 2.66 C ATOM 314 CE2 PHE A 21 3.995 2.969 -17.726 1.00 2.66 C ATOM 315 CZ PHE A 21 4.932 3.729 -17.003 1.00 2.36 C ATOM 0 H PHE A 21 -0.415 1.740 -13.445 1.00 0.64 H new ATOM 0 HA PHE A 21 0.679 4.157 -14.485 1.00 0.72 H new ATOM 0 HB2 PHE A 21 1.743 1.827 -14.047 1.00 0.83 H new ATOM 0 HB3 PHE A 21 1.034 1.362 -15.581 1.00 0.83 H new ATOM 0 HD1 PHE A 21 3.328 3.848 -13.995 1.00 2.22 H new ATOM 0 HD2 PHE A 21 2.089 1.955 -17.657 1.00 2.20 H new ATOM 0 HE1 PHE A 21 5.383 4.679 -15.118 1.00 2.66 H new ATOM 0 HE2 PHE A 21 4.178 2.730 -18.763 1.00 2.66 H new ATOM 0 HZ PHE A 21 5.845 4.055 -17.479 1.00 2.36 H new ATOM 325 N THR A 22 -1.500 2.541 -16.334 1.00 0.84 N ATOM 326 CA THR A 22 -2.468 2.776 -17.387 1.00 0.94 C ATOM 327 C THR A 22 -3.220 4.073 -17.079 1.00 0.99 C ATOM 328 O THR A 22 -3.108 5.021 -17.851 1.00 1.37 O ATOM 329 CB THR A 22 -3.392 1.564 -17.571 1.00 0.90 C ATOM 330 OG1 THR A 22 -3.934 1.152 -16.338 1.00 2.18 O ATOM 331 CG2 THR A 22 -2.640 0.386 -18.196 1.00 2.46 C ATOM 0 H THR A 22 -1.611 1.651 -15.849 1.00 0.84 H new ATOM 0 HA THR A 22 -1.963 2.900 -18.345 1.00 0.94 H new ATOM 0 HB THR A 22 -4.197 1.874 -18.238 1.00 0.90 H new ATOM 0 HG1 THR A 22 -3.250 0.674 -15.824 1.00 2.18 H new ATOM 0 HG21 THR A 22 -3.320 -0.458 -18.314 1.00 2.46 H new ATOM 0 HG22 THR A 22 -2.252 0.679 -19.171 1.00 2.46 H new ATOM 0 HG23 THR A 22 -1.813 0.097 -17.548 1.00 2.46 H new ATOM 339 N PHE A 23 -3.922 4.159 -15.942 1.00 0.88 N ATOM 340 CA PHE A 23 -4.674 5.364 -15.576 1.00 0.92 C ATOM 341 C PHE A 23 -3.850 6.648 -15.708 1.00 0.92 C ATOM 342 O PHE A 23 -4.339 7.660 -16.187 1.00 1.01 O ATOM 343 CB PHE A 23 -5.232 5.262 -14.148 1.00 0.92 C ATOM 344 CG PHE A 23 -6.738 5.135 -14.102 1.00 0.98 C ATOM 345 CD1 PHE A 23 -7.532 6.189 -14.587 1.00 2.47 C ATOM 346 CD2 PHE A 23 -7.348 3.972 -13.599 1.00 1.83 C ATOM 347 CE1 PHE A 23 -8.930 6.085 -14.553 1.00 3.00 C ATOM 348 CE2 PHE A 23 -8.748 3.913 -13.474 1.00 2.11 C ATOM 349 CZ PHE A 23 -9.539 4.979 -13.940 1.00 2.24 C ATOM 0 H PHE A 23 -3.984 3.405 -15.258 1.00 0.88 H new ATOM 0 HA PHE A 23 -5.498 5.423 -16.287 1.00 0.92 H new ATOM 0 HB2 PHE A 23 -4.786 4.400 -13.652 1.00 0.92 H new ATOM 0 HB3 PHE A 23 -4.931 6.145 -13.584 1.00 0.92 H new ATOM 0 HD1 PHE A 23 -7.066 7.078 -14.985 1.00 2.47 H new ATOM 0 HD2 PHE A 23 -6.743 3.126 -13.309 1.00 1.83 H new ATOM 0 HE1 PHE A 23 -9.539 6.857 -14.999 1.00 3.00 H new ATOM 0 HE2 PHE A 23 -9.215 3.051 -13.021 1.00 2.11 H new ATOM 0 HZ PHE A 23 -10.613 4.946 -13.826 1.00 2.24 H new ATOM 359 N ALA A 24 -2.590 6.598 -15.291 1.00 0.88 N ATOM 360 CA ALA A 24 -1.650 7.701 -15.215 1.00 0.94 C ATOM 361 C ALA A 24 -1.528 8.429 -16.545 1.00 0.95 C ATOM 362 O ALA A 24 -1.143 9.604 -16.554 1.00 0.98 O ATOM 363 CB ALA A 24 -0.275 7.182 -14.780 1.00 1.10 C ATOM 0 H ALA A 24 -2.173 5.722 -14.976 1.00 0.88 H new ATOM 0 HA ALA A 24 -2.027 8.411 -14.479 1.00 0.94 H new ATOM 0 HB1 ALA A 24 0.427 8.014 -14.725 1.00 1.10 H new ATOM 0 HB2 ALA A 24 -0.357 6.711 -13.801 1.00 1.10 H new ATOM 0 HB3 ALA A 24 0.084 6.452 -15.505 1.00 1.10 H new ATOM 369 N ARG A 25 -1.812 7.717 -17.643 1.00 0.98 N ATOM 370 CA ARG A 25 -1.825 8.242 -18.994 1.00 1.08 C ATOM 371 C ARG A 25 -2.809 9.395 -19.159 1.00 0.92 C ATOM 372 O ARG A 25 -2.573 10.251 -20.007 1.00 1.02 O ATOM 373 CB ARG A 25 -2.155 7.107 -19.983 1.00 1.40 C ATOM 374 CG ARG A 25 -3.670 6.821 -20.068 1.00 1.97 C ATOM 375 CD ARG A 25 -4.025 5.458 -20.681 1.00 2.35 C ATOM 376 NE ARG A 25 -4.706 5.597 -21.978 1.00 2.65 N ATOM 377 CZ ARG A 25 -4.102 5.689 -23.173 1.00 3.02 C ATOM 378 NH1 ARG A 25 -2.768 5.712 -23.240 1.00 3.44 N ATOM 379 NH2 ARG A 25 -4.836 5.757 -24.290 1.00 4.15 N ATOM 0 H ARG A 25 -2.046 6.725 -17.602 1.00 0.98 H new ATOM 0 HA ARG A 25 -0.833 8.641 -19.206 1.00 1.08 H new ATOM 0 HB2 ARG A 25 -1.782 7.371 -20.973 1.00 1.40 H new ATOM 0 HB3 ARG A 25 -1.634 6.200 -19.678 1.00 1.40 H new ATOM 0 HG2 ARG A 25 -4.095 6.877 -19.066 1.00 1.97 H new ATOM 0 HG3 ARG A 25 -4.143 7.606 -20.659 1.00 1.97 H new ATOM 0 HD2 ARG A 25 -3.116 4.871 -20.810 1.00 2.35 H new ATOM 0 HD3 ARG A 25 -4.665 4.907 -19.993 1.00 2.35 H new ATOM 0 HE ARG A 25 -5.726 5.626 -21.968 1.00 2.65 H new ATOM 0 HH11 ARG A 25 -2.213 5.660 -22.386 1.00 3.44 H new ATOM 0 HH12 ARG A 25 -2.304 5.782 -24.146 1.00 3.44 H new ATOM 0 HH21 ARG A 25 -5.854 5.739 -24.233 1.00 4.15 H new ATOM 0 HH22 ARG A 25 -4.377 5.827 -25.198 1.00 4.15 H new ATOM 393 N GLN A 26 -3.941 9.353 -18.442 1.00 0.82 N ATOM 394 CA GLN A 26 -5.134 10.085 -18.841 1.00 0.83 C ATOM 395 C GLN A 26 -4.856 11.569 -19.088 1.00 0.87 C ATOM 396 O GLN A 26 -5.196 12.124 -20.131 1.00 1.05 O ATOM 397 CB GLN A 26 -6.181 9.922 -17.739 1.00 0.75 C ATOM 398 CG GLN A 26 -7.587 9.839 -18.288 1.00 1.01 C ATOM 399 CD GLN A 26 -7.933 8.441 -18.807 1.00 1.39 C ATOM 400 OE1 GLN A 26 -7.300 7.934 -19.732 1.00 1.98 O ATOM 401 NE2 GLN A 26 -8.929 7.790 -18.218 1.00 1.91 N ATOM 0 H GLN A 26 -4.047 8.816 -17.581 1.00 0.82 H new ATOM 0 HA GLN A 26 -5.493 9.676 -19.786 1.00 0.83 H new ATOM 0 HB2 GLN A 26 -5.964 9.021 -17.166 1.00 0.75 H new ATOM 0 HB3 GLN A 26 -6.112 10.763 -17.049 1.00 0.75 H new ATOM 0 HG2 GLN A 26 -8.295 10.119 -17.508 1.00 1.01 H new ATOM 0 HG3 GLN A 26 -7.701 10.561 -19.096 1.00 1.01 H new ATOM 0 HE21 GLN A 26 -9.442 8.227 -17.453 1.00 1.91 H new ATOM 0 HE22 GLN A 26 -9.181 6.853 -18.531 1.00 1.91 H new ATOM 410 N GLU A 27 -4.231 12.181 -18.090 1.00 0.82 N ATOM 411 CA GLU A 27 -3.760 13.543 -18.044 1.00 0.96 C ATOM 412 C GLU A 27 -2.247 13.457 -17.840 1.00 0.97 C ATOM 413 O GLU A 27 -1.753 12.429 -17.369 1.00 1.51 O ATOM 414 CB GLU A 27 -4.342 14.219 -16.799 1.00 1.17 C ATOM 415 CG GLU A 27 -5.854 14.113 -16.557 1.00 1.30 C ATOM 416 CD GLU A 27 -6.150 14.644 -15.156 1.00 1.95 C ATOM 417 OE1 GLU A 27 -6.121 15.879 -14.988 1.00 2.55 O ATOM 418 OE2 GLU A 27 -6.303 13.815 -14.232 1.00 2.70 O ATOM 0 H GLU A 27 -4.027 11.687 -17.221 1.00 0.82 H new ATOM 0 HA GLU A 27 -4.038 14.093 -18.943 1.00 0.96 H new ATOM 0 HB2 GLU A 27 -3.835 13.805 -15.927 1.00 1.17 H new ATOM 0 HB3 GLU A 27 -4.085 15.277 -16.844 1.00 1.17 H new ATOM 0 HG2 GLU A 27 -6.400 14.688 -17.305 1.00 1.30 H new ATOM 0 HG3 GLU A 27 -6.182 13.078 -16.649 1.00 1.30 H new ATOM 425 N GLY A 28 -1.537 14.566 -18.063 1.00 1.20 N ATOM 426 CA GLY A 28 -0.153 14.815 -17.663 1.00 1.46 C ATOM 427 C GLY A 28 0.610 13.603 -17.108 1.00 1.22 C ATOM 428 O GLY A 28 0.350 13.167 -15.977 1.00 1.38 O ATOM 0 H GLY A 28 -1.940 15.362 -18.558 1.00 1.20 H new ATOM 0 HA2 GLY A 28 0.391 15.199 -18.526 1.00 1.46 H new ATOM 0 HA3 GLY A 28 -0.149 15.601 -16.907 1.00 1.46 H new ATOM 432 N ARG A 29 1.543 13.074 -17.912 1.00 1.18 N ATOM 433 CA ARG A 29 2.573 12.134 -17.487 1.00 1.40 C ATOM 434 C ARG A 29 2.026 10.769 -17.047 1.00 1.35 C ATOM 435 O ARG A 29 1.454 10.643 -15.963 1.00 1.32 O ATOM 436 CB ARG A 29 3.540 12.767 -16.466 1.00 1.77 C ATOM 437 CG ARG A 29 4.870 13.201 -17.105 1.00 2.43 C ATOM 438 CD ARG A 29 4.725 14.321 -18.147 1.00 2.95 C ATOM 439 NE ARG A 29 6.007 14.564 -18.831 1.00 3.87 N ATOM 440 CZ ARG A 29 6.174 15.337 -19.919 1.00 4.82 C ATOM 441 NH1 ARG A 29 5.145 16.047 -20.398 1.00 5.21 N ATOM 442 NH2 ARG A 29 7.365 15.390 -20.528 1.00 5.88 N ATOM 0 H ARG A 29 1.598 13.300 -18.905 1.00 1.18 H new ATOM 0 HA ARG A 29 3.163 11.909 -18.376 1.00 1.40 H new ATOM 0 HB2 ARG A 29 3.062 13.632 -16.006 1.00 1.77 H new ATOM 0 HB3 ARG A 29 3.740 12.052 -15.668 1.00 1.77 H new ATOM 0 HG2 ARG A 29 5.547 13.535 -16.319 1.00 2.43 H new ATOM 0 HG3 ARG A 29 5.334 12.336 -17.579 1.00 2.43 H new ATOM 0 HD2 ARG A 29 3.963 14.049 -18.877 1.00 2.95 H new ATOM 0 HD3 ARG A 29 4.387 15.236 -17.660 1.00 2.95 H new ATOM 0 HE ARG A 29 6.836 14.109 -18.448 1.00 3.87 H new ATOM 0 HH11 ARG A 29 4.236 16.001 -19.938 1.00 5.21 H new ATOM 0 HH12 ARG A 29 5.270 16.634 -21.223 1.00 5.21 H new ATOM 0 HH21 ARG A 29 8.147 14.844 -20.167 1.00 5.88 H new ATOM 0 HH22 ARG A 29 7.490 15.977 -21.353 1.00 5.88 H new ATOM 456 N LYS A 30 2.199 9.743 -17.894 1.00 1.47 N ATOM 457 CA LYS A 30 2.041 8.341 -17.507 1.00 1.46 C ATOM 458 C LYS A 30 3.109 7.922 -16.476 1.00 1.57 C ATOM 459 O LYS A 30 3.968 7.086 -16.754 1.00 1.91 O ATOM 460 CB LYS A 30 2.030 7.425 -18.744 1.00 1.65 C ATOM 461 CG LYS A 30 3.260 7.559 -19.658 1.00 1.95 C ATOM 462 CD LYS A 30 3.364 6.320 -20.562 1.00 2.47 C ATOM 463 CE LYS A 30 4.692 6.266 -21.331 1.00 2.98 C ATOM 464 NZ LYS A 30 5.844 6.005 -20.440 1.00 3.53 N ATOM 0 H LYS A 30 2.454 9.869 -18.873 1.00 1.47 H new ATOM 0 HA LYS A 30 1.073 8.229 -17.019 1.00 1.46 H new ATOM 0 HB2 LYS A 30 1.953 6.390 -18.411 1.00 1.65 H new ATOM 0 HB3 LYS A 30 1.135 7.639 -19.329 1.00 1.65 H new ATOM 0 HG2 LYS A 30 3.178 8.460 -20.266 1.00 1.95 H new ATOM 0 HG3 LYS A 30 4.164 7.661 -19.057 1.00 1.95 H new ATOM 0 HD2 LYS A 30 3.262 5.421 -19.954 1.00 2.47 H new ATOM 0 HD3 LYS A 30 2.536 6.321 -21.271 1.00 2.47 H new ATOM 0 HE2 LYS A 30 4.638 5.486 -22.091 1.00 2.98 H new ATOM 0 HE3 LYS A 30 4.846 7.210 -21.854 1.00 2.98 H new ATOM 0 HZ1 LYS A 30 6.693 5.826 -21.014 1.00 3.53 H new ATOM 0 HZ2 LYS A 30 6.006 6.832 -19.831 1.00 3.53 H new ATOM 0 HZ3 LYS A 30 5.644 5.173 -19.849 1.00 3.53 H new ATOM 478 N ASP A 31 3.062 8.541 -15.296 1.00 1.55 N ATOM 479 CA ASP A 31 3.998 8.388 -14.190 1.00 1.75 C ATOM 480 C ASP A 31 3.406 9.136 -12.999 1.00 1.70 C ATOM 481 O ASP A 31 3.207 8.569 -11.927 1.00 1.91 O ATOM 482 CB ASP A 31 5.375 8.958 -14.566 1.00 2.03 C ATOM 483 CG ASP A 31 6.288 9.035 -13.352 1.00 2.39 C ATOM 484 OD1 ASP A 31 6.922 8.000 -13.041 1.00 3.68 O ATOM 485 OD2 ASP A 31 6.332 10.125 -12.743 1.00 2.85 O ATOM 0 H ASP A 31 2.319 9.205 -15.077 1.00 1.55 H new ATOM 0 HA ASP A 31 4.145 7.336 -13.947 1.00 1.75 H new ATOM 0 HB2 ASP A 31 5.834 8.332 -15.331 1.00 2.03 H new ATOM 0 HB3 ASP A 31 5.255 9.952 -14.998 1.00 2.03 H new ATOM 490 N SER A 32 3.080 10.409 -13.230 1.00 1.58 N ATOM 491 CA SER A 32 2.398 11.263 -12.280 1.00 1.56 C ATOM 492 C SER A 32 0.891 11.044 -12.377 1.00 1.42 C ATOM 493 O SER A 32 0.286 11.170 -13.458 1.00 1.24 O ATOM 494 CB SER A 32 2.722 12.728 -12.572 1.00 1.65 C ATOM 495 OG SER A 32 4.047 12.875 -13.040 1.00 2.58 O ATOM 0 H SER A 32 3.293 10.879 -14.110 1.00 1.58 H new ATOM 0 HA SER A 32 2.735 11.014 -11.274 1.00 1.56 H new ATOM 0 HB2 SER A 32 2.026 13.116 -13.316 1.00 1.65 H new ATOM 0 HB3 SER A 32 2.585 13.321 -11.668 1.00 1.65 H new ATOM 0 HG SER A 32 4.398 13.746 -12.759 1.00 2.58 H new ATOM 501 N LEU A 33 0.262 10.781 -11.236 1.00 1.53 N ATOM 502 CA LEU A 33 -1.180 10.721 -11.208 1.00 1.55 C ATOM 503 C LEU A 33 -1.691 12.146 -11.088 1.00 1.54 C ATOM 504 O LEU A 33 -1.029 13.025 -10.540 1.00 1.75 O ATOM 505 CB LEU A 33 -1.692 9.795 -10.107 1.00 1.62 C ATOM 506 CG LEU A 33 -1.843 8.339 -10.583 1.00 1.57 C ATOM 507 CD1 LEU A 33 -3.140 8.139 -11.373 1.00 1.62 C ATOM 508 CD2 LEU A 33 -0.645 7.867 -11.406 1.00 2.59 C ATOM 0 H LEU A 33 0.722 10.611 -10.342 1.00 1.53 H new ATOM 0 HA LEU A 33 -1.565 10.281 -12.128 1.00 1.55 H new ATOM 0 HB2 LEU A 33 -1.005 9.828 -9.261 1.00 1.62 H new ATOM 0 HB3 LEU A 33 -2.655 10.159 -9.750 1.00 1.62 H new ATOM 0 HG LEU A 33 -1.886 7.727 -9.682 1.00 1.57 H new ATOM 0 HD11 LEU A 33 -3.214 7.100 -11.694 1.00 1.62 H new ATOM 0 HD12 LEU A 33 -3.993 8.385 -10.741 1.00 1.62 H new ATOM 0 HD13 LEU A 33 -3.137 8.789 -12.248 1.00 1.62 H new ATOM 0 HD21 LEU A 33 -0.802 6.834 -11.717 1.00 2.59 H new ATOM 0 HD22 LEU A 33 -0.537 8.499 -12.287 1.00 2.59 H new ATOM 0 HD23 LEU A 33 0.260 7.931 -10.801 1.00 2.59 H new ATOM 520 N SER A 34 -2.827 12.376 -11.721 1.00 1.61 N ATOM 521 CA SER A 34 -3.404 13.681 -11.948 1.00 1.78 C ATOM 522 C SER A 34 -4.798 13.700 -11.294 1.00 1.57 C ATOM 523 O SER A 34 -5.302 12.654 -10.880 1.00 1.37 O ATOM 524 CB SER A 34 -3.395 13.857 -13.468 1.00 2.37 C ATOM 525 OG SER A 34 -2.100 13.555 -14.017 1.00 4.23 O ATOM 0 H SER A 34 -3.395 11.622 -12.107 1.00 1.61 H new ATOM 0 HA SER A 34 -2.865 14.518 -11.504 1.00 1.78 H new ATOM 0 HB2 SER A 34 -4.145 13.205 -13.917 1.00 2.37 H new ATOM 0 HB3 SER A 34 -3.670 14.881 -13.720 1.00 2.37 H new ATOM 531 N VAL A 35 -5.401 14.874 -11.092 1.00 1.68 N ATOM 532 CA VAL A 35 -6.588 14.946 -10.243 1.00 1.59 C ATOM 533 C VAL A 35 -7.799 14.259 -10.882 1.00 1.36 C ATOM 534 O VAL A 35 -8.598 13.642 -10.174 1.00 1.09 O ATOM 535 CB VAL A 35 -6.887 16.391 -9.807 1.00 1.75 C ATOM 536 CG1 VAL A 35 -7.434 17.251 -10.949 1.00 2.63 C ATOM 537 CG2 VAL A 35 -7.903 16.405 -8.657 1.00 1.97 C ATOM 0 H VAL A 35 -5.097 15.762 -11.492 1.00 1.68 H new ATOM 0 HA VAL A 35 -6.369 14.385 -9.335 1.00 1.59 H new ATOM 0 HB VAL A 35 -5.936 16.815 -9.484 1.00 1.75 H new ATOM 0 HG11 VAL A 35 -7.627 18.260 -10.584 1.00 2.63 H new ATOM 0 HG12 VAL A 35 -6.703 17.291 -11.757 1.00 2.63 H new ATOM 0 HG13 VAL A 35 -8.362 16.816 -11.320 1.00 2.63 H new ATOM 0 HG21 VAL A 35 -8.103 17.435 -8.361 1.00 1.97 H new ATOM 0 HG22 VAL A 35 -8.830 15.935 -8.985 1.00 1.97 H new ATOM 0 HG23 VAL A 35 -7.498 15.855 -7.807 1.00 1.97 H new ATOM 547 N ASN A 36 -7.950 14.351 -12.208 1.00 1.53 N ATOM 548 CA ASN A 36 -9.074 13.714 -12.870 1.00 1.37 C ATOM 549 C ASN A 36 -8.862 12.208 -12.788 1.00 1.19 C ATOM 550 O ASN A 36 -9.744 11.524 -12.290 1.00 1.02 O ATOM 551 CB ASN A 36 -9.276 14.230 -14.300 1.00 1.57 C ATOM 552 CG ASN A 36 -10.754 14.227 -14.674 1.00 1.14 C ATOM 553 OD1 ASN A 36 -11.449 15.219 -14.476 1.00 1.99 O ATOM 554 ND2 ASN A 36 -11.262 13.126 -15.207 1.00 1.51 N ATOM 0 H ASN A 36 -7.315 14.854 -12.828 1.00 1.53 H new ATOM 0 HA ASN A 36 -10.006 13.969 -12.366 1.00 1.37 H new ATOM 0 HB2 ASN A 36 -8.877 15.241 -14.386 1.00 1.57 H new ATOM 0 HB3 ASN A 36 -8.718 13.606 -14.999 1.00 1.57 H new ATOM 0 HD21 ASN A 36 -12.249 13.091 -15.462 1.00 1.51 H new ATOM 0 HD22 ASN A 36 -10.666 12.313 -15.363 1.00 1.51 H new ATOM 561 N GLU A 37 -7.668 11.715 -13.139 1.00 1.29 N ATOM 562 CA GLU A 37 -7.268 10.317 -12.938 1.00 1.28 C ATOM 563 C GLU A 37 -7.659 9.830 -11.543 1.00 1.02 C ATOM 564 O GLU A 37 -8.326 8.809 -11.378 1.00 1.02 O ATOM 565 CB GLU A 37 -5.747 10.168 -13.100 1.00 1.60 C ATOM 566 CG GLU A 37 -5.336 10.364 -14.553 1.00 1.06 C ATOM 567 CD GLU A 37 -3.859 10.651 -14.756 1.00 1.13 C ATOM 568 OE1 GLU A 37 -3.044 10.732 -13.817 1.00 1.95 O ATOM 569 OE2 GLU A 37 -3.418 10.919 -15.882 1.00 1.80 O ATOM 0 H GLU A 37 -6.943 12.284 -13.576 1.00 1.29 H new ATOM 0 HA GLU A 37 -7.784 9.717 -13.688 1.00 1.28 H new ATOM 0 HB2 GLU A 37 -5.237 10.898 -12.471 1.00 1.60 H new ATOM 0 HB3 GLU A 37 -5.435 9.181 -12.759 1.00 1.60 H new ATOM 0 HG2 GLU A 37 -5.600 9.469 -15.116 1.00 1.06 H new ATOM 0 HG3 GLU A 37 -5.914 11.187 -14.973 1.00 1.06 H new ATOM 576 N PHE A 38 -7.211 10.568 -10.527 1.00 0.94 N ATOM 577 CA PHE A 38 -7.525 10.285 -9.141 1.00 0.76 C ATOM 578 C PHE A 38 -9.038 10.121 -8.956 1.00 0.71 C ATOM 579 O PHE A 38 -9.488 9.059 -8.523 1.00 0.72 O ATOM 580 CB PHE A 38 -6.913 11.386 -8.267 1.00 0.80 C ATOM 581 CG PHE A 38 -7.065 11.201 -6.775 1.00 0.78 C ATOM 582 CD1 PHE A 38 -6.501 10.083 -6.138 1.00 1.69 C ATOM 583 CD2 PHE A 38 -7.640 12.222 -5.999 1.00 2.22 C ATOM 584 CE1 PHE A 38 -6.467 10.010 -4.740 1.00 1.97 C ATOM 585 CE2 PHE A 38 -7.685 12.101 -4.600 1.00 2.76 C ATOM 586 CZ PHE A 38 -7.103 10.993 -3.968 1.00 2.09 C ATOM 0 H PHE A 38 -6.614 11.386 -10.653 1.00 0.94 H new ATOM 0 HA PHE A 38 -7.089 9.336 -8.828 1.00 0.76 H new ATOM 0 HB2 PHE A 38 -5.850 11.459 -8.499 1.00 0.80 H new ATOM 0 HB3 PHE A 38 -7.366 12.338 -8.544 1.00 0.80 H new ATOM 0 HD1 PHE A 38 -6.092 9.277 -6.729 1.00 1.69 H new ATOM 0 HD2 PHE A 38 -8.047 13.100 -6.478 1.00 2.22 H new ATOM 0 HE1 PHE A 38 -5.950 9.195 -4.255 1.00 1.97 H new ATOM 0 HE2 PHE A 38 -8.170 12.864 -4.009 1.00 2.76 H new ATOM 0 HZ PHE A 38 -7.144 10.897 -2.893 1.00 2.09 H new ATOM 596 N LYS A 39 -9.835 11.131 -9.327 1.00 0.76 N ATOM 597 CA LYS A 39 -11.284 11.042 -9.184 1.00 0.80 C ATOM 598 C LYS A 39 -11.867 9.862 -9.980 1.00 0.77 C ATOM 599 O LYS A 39 -12.734 9.147 -9.478 1.00 0.78 O ATOM 600 CB LYS A 39 -11.963 12.380 -9.506 1.00 0.95 C ATOM 601 CG LYS A 39 -13.442 12.370 -9.072 1.00 1.08 C ATOM 602 CD LYS A 39 -14.015 13.805 -9.044 1.00 1.42 C ATOM 603 CE LYS A 39 -13.838 14.396 -7.635 1.00 2.32 C ATOM 604 NZ LYS A 39 -14.013 15.863 -7.530 1.00 3.82 N ATOM 0 H LYS A 39 -9.500 12.009 -9.724 1.00 0.76 H new ATOM 0 HA LYS A 39 -11.502 10.832 -8.137 1.00 0.80 H new ATOM 0 HB2 LYS A 39 -11.437 13.189 -8.999 1.00 0.95 H new ATOM 0 HB3 LYS A 39 -11.896 12.577 -10.576 1.00 0.95 H new ATOM 0 HG2 LYS A 39 -14.023 11.755 -9.759 1.00 1.08 H new ATOM 0 HG3 LYS A 39 -13.533 11.918 -8.084 1.00 1.08 H new ATOM 0 HD2 LYS A 39 -13.504 14.427 -9.779 1.00 1.42 H new ATOM 0 HD3 LYS A 39 -15.071 13.793 -9.316 1.00 1.42 H new ATOM 0 HE2 LYS A 39 -14.551 13.914 -6.966 1.00 2.32 H new ATOM 0 HE3 LYS A 39 -12.841 14.140 -7.276 1.00 2.32 H new ATOM 0 HZ1 LYS A 39 -14.327 16.107 -6.569 1.00 3.82 H new ATOM 0 HZ2 LYS A 39 -13.108 16.336 -7.729 1.00 3.82 H new ATOM 0 HZ3 LYS A 39 -14.726 16.178 -8.218 1.00 3.82 H new ATOM 618 N GLU A 40 -11.401 9.627 -11.206 1.00 0.78 N ATOM 619 CA GLU A 40 -11.831 8.504 -12.023 1.00 0.78 C ATOM 620 C GLU A 40 -11.592 7.187 -11.288 1.00 0.73 C ATOM 621 O GLU A 40 -12.436 6.300 -11.355 1.00 0.77 O ATOM 622 CB GLU A 40 -11.109 8.489 -13.375 1.00 0.83 C ATOM 623 CG GLU A 40 -11.492 9.661 -14.286 1.00 0.95 C ATOM 624 CD GLU A 40 -10.507 9.789 -15.441 1.00 1.72 C ATOM 625 OE1 GLU A 40 -10.389 8.810 -16.207 1.00 2.48 O ATOM 626 OE2 GLU A 40 -9.876 10.863 -15.542 1.00 2.42 O ATOM 0 H GLU A 40 -10.707 10.220 -11.661 1.00 0.78 H new ATOM 0 HA GLU A 40 -12.899 8.619 -12.209 1.00 0.78 H new ATOM 0 HB2 GLU A 40 -10.033 8.509 -13.203 1.00 0.83 H new ATOM 0 HB3 GLU A 40 -11.333 7.553 -13.887 1.00 0.83 H new ATOM 0 HG2 GLU A 40 -12.499 9.512 -14.675 1.00 0.95 H new ATOM 0 HG3 GLU A 40 -11.507 10.586 -13.710 1.00 0.95 H new ATOM 633 N LEU A 41 -10.470 7.044 -10.577 1.00 0.69 N ATOM 634 CA LEU A 41 -10.118 5.783 -9.940 1.00 0.67 C ATOM 635 C LEU A 41 -11.184 5.470 -8.889 1.00 0.66 C ATOM 636 O LEU A 41 -11.735 4.368 -8.857 1.00 0.68 O ATOM 637 CB LEU A 41 -8.687 5.871 -9.368 1.00 0.70 C ATOM 638 CG LEU A 41 -8.014 4.547 -8.949 1.00 0.81 C ATOM 639 CD1 LEU A 41 -8.690 3.870 -7.762 1.00 2.09 C ATOM 640 CD2 LEU A 41 -7.852 3.562 -10.107 1.00 1.88 C ATOM 0 H LEU A 41 -9.792 7.791 -10.431 1.00 0.69 H new ATOM 0 HA LEU A 41 -10.105 4.958 -10.652 1.00 0.67 H new ATOM 0 HB2 LEU A 41 -8.054 6.351 -10.114 1.00 0.70 H new ATOM 0 HB3 LEU A 41 -8.710 6.528 -8.499 1.00 0.70 H new ATOM 0 HG LEU A 41 -7.016 4.844 -8.626 1.00 0.81 H new ATOM 0 HD11 LEU A 41 -8.164 2.946 -7.523 1.00 2.09 H new ATOM 0 HD12 LEU A 41 -8.664 4.536 -6.900 1.00 2.09 H new ATOM 0 HD13 LEU A 41 -9.726 3.644 -8.014 1.00 2.09 H new ATOM 0 HD21 LEU A 41 -7.373 2.652 -9.746 1.00 1.88 H new ATOM 0 HD22 LEU A 41 -8.832 3.318 -10.517 1.00 1.88 H new ATOM 0 HD23 LEU A 41 -7.236 4.013 -10.885 1.00 1.88 H new ATOM 652 N VAL A 42 -11.524 6.467 -8.065 1.00 0.67 N ATOM 653 CA VAL A 42 -12.513 6.281 -7.013 1.00 0.70 C ATOM 654 C VAL A 42 -13.885 6.033 -7.626 1.00 0.76 C ATOM 655 O VAL A 42 -14.528 5.024 -7.336 1.00 0.88 O ATOM 656 CB VAL A 42 -12.518 7.436 -5.993 1.00 0.74 C ATOM 657 CG1 VAL A 42 -11.435 7.223 -4.929 1.00 0.83 C ATOM 658 CG2 VAL A 42 -12.407 8.854 -6.539 1.00 0.85 C ATOM 0 H VAL A 42 -11.127 7.406 -8.111 1.00 0.67 H new ATOM 0 HA VAL A 42 -12.235 5.397 -6.440 1.00 0.70 H new ATOM 0 HB VAL A 42 -13.523 7.382 -5.574 1.00 0.74 H new ATOM 0 HG11 VAL A 42 -11.455 8.049 -4.219 1.00 0.83 H new ATOM 0 HG12 VAL A 42 -11.621 6.287 -4.402 1.00 0.83 H new ATOM 0 HG13 VAL A 42 -10.457 7.181 -5.409 1.00 0.83 H new ATOM 0 HG21 VAL A 42 -12.423 9.564 -5.712 1.00 0.85 H new ATOM 0 HG22 VAL A 42 -11.473 8.960 -7.090 1.00 0.85 H new ATOM 0 HG23 VAL A 42 -13.246 9.054 -7.206 1.00 0.85 H new ATOM 668 N THR A 43 -14.301 6.953 -8.496 1.00 0.80 N ATOM 669 CA THR A 43 -15.574 6.918 -9.191 1.00 0.91 C ATOM 670 C THR A 43 -15.801 5.553 -9.845 1.00 0.91 C ATOM 671 O THR A 43 -16.874 4.968 -9.716 1.00 1.04 O ATOM 672 CB THR A 43 -15.564 8.054 -10.223 1.00 0.97 C ATOM 673 OG1 THR A 43 -15.442 9.291 -9.551 1.00 1.04 O ATOM 674 CG2 THR A 43 -16.833 8.098 -11.077 1.00 1.13 C ATOM 0 H THR A 43 -13.738 7.768 -8.740 1.00 0.80 H new ATOM 0 HA THR A 43 -16.400 7.061 -8.494 1.00 0.91 H new ATOM 0 HB THR A 43 -14.720 7.869 -10.887 1.00 0.97 H new ATOM 0 HG1 THR A 43 -14.496 9.477 -9.378 1.00 1.04 H new ATOM 0 HG21 THR A 43 -16.765 8.922 -11.787 1.00 1.13 H new ATOM 0 HG22 THR A 43 -16.939 7.159 -11.620 1.00 1.13 H new ATOM 0 HG23 THR A 43 -17.700 8.244 -10.433 1.00 1.13 H new ATOM 682 N GLN A 44 -14.794 5.058 -10.566 1.00 0.84 N ATOM 683 CA GLN A 44 -14.892 3.837 -11.336 1.00 0.92 C ATOM 684 C GLN A 44 -14.809 2.610 -10.425 1.00 0.95 C ATOM 685 O GLN A 44 -15.566 1.665 -10.634 1.00 0.97 O ATOM 686 CB GLN A 44 -13.792 3.866 -12.405 1.00 0.99 C ATOM 687 CG GLN A 44 -13.923 2.796 -13.494 1.00 1.23 C ATOM 688 CD GLN A 44 -12.794 2.984 -14.501 1.00 1.43 C ATOM 689 OE1 GLN A 44 -12.969 3.661 -15.508 1.00 2.40 O ATOM 690 NE2 GLN A 44 -11.607 2.450 -14.227 1.00 2.04 N ATOM 0 H GLN A 44 -13.880 5.506 -10.626 1.00 0.84 H new ATOM 0 HA GLN A 44 -15.860 3.767 -11.833 1.00 0.92 H new ATOM 0 HB2 GLN A 44 -13.792 4.848 -12.879 1.00 0.99 H new ATOM 0 HB3 GLN A 44 -12.826 3.748 -11.915 1.00 0.99 H new ATOM 0 HG2 GLN A 44 -13.875 1.800 -13.053 1.00 1.23 H new ATOM 0 HG3 GLN A 44 -14.890 2.878 -13.990 1.00 1.23 H new ATOM 0 HE21 GLN A 44 -11.482 1.890 -13.384 1.00 2.04 H new ATOM 0 HE22 GLN A 44 -10.822 2.601 -14.860 1.00 2.04 H new ATOM 699 N GLN A 45 -13.862 2.579 -9.473 1.00 1.08 N ATOM 700 CA GLN A 45 -13.455 1.320 -8.849 1.00 1.14 C ATOM 701 C GLN A 45 -13.309 1.328 -7.324 1.00 1.27 C ATOM 702 O GLN A 45 -12.839 0.321 -6.800 1.00 2.32 O ATOM 703 CB GLN A 45 -12.160 0.824 -9.501 1.00 1.36 C ATOM 704 CG GLN A 45 -12.332 0.665 -11.013 1.00 1.87 C ATOM 705 CD GLN A 45 -11.203 -0.124 -11.656 1.00 2.24 C ATOM 706 OE1 GLN A 45 -10.486 0.415 -12.495 1.00 3.51 O ATOM 707 NE2 GLN A 45 -11.087 -1.391 -11.276 1.00 2.59 N ATOM 0 H GLN A 45 -13.372 3.403 -9.125 1.00 1.08 H new ATOM 0 HA GLN A 45 -14.287 0.639 -9.029 1.00 1.14 H new ATOM 0 HB2 GLN A 45 -11.353 1.527 -9.295 1.00 1.36 H new ATOM 0 HB3 GLN A 45 -11.870 -0.131 -9.062 1.00 1.36 H new ATOM 0 HG2 GLN A 45 -13.279 0.165 -11.215 1.00 1.87 H new ATOM 0 HG3 GLN A 45 -12.387 1.652 -11.473 1.00 1.87 H new ATOM 0 HE21 GLN A 45 -11.719 -1.772 -10.572 1.00 2.59 H new ATOM 0 HE22 GLN A 45 -10.366 -1.983 -11.688 1.00 2.59 H new ATOM 716 N LEU A 46 -13.743 2.361 -6.593 1.00 1.18 N ATOM 717 CA LEU A 46 -13.927 2.243 -5.140 1.00 1.12 C ATOM 718 C LEU A 46 -15.392 2.532 -4.782 1.00 1.28 C ATOM 719 O LEU A 46 -15.681 3.561 -4.169 1.00 1.60 O ATOM 720 CB LEU A 46 -12.969 3.156 -4.354 1.00 1.15 C ATOM 721 CG LEU A 46 -11.493 2.729 -4.259 1.00 1.00 C ATOM 722 CD1 LEU A 46 -11.293 1.241 -3.961 1.00 1.57 C ATOM 723 CD2 LEU A 46 -10.666 3.113 -5.481 1.00 1.87 C ATOM 0 H LEU A 46 -13.971 3.278 -6.977 1.00 1.18 H new ATOM 0 HA LEU A 46 -13.682 1.221 -4.849 1.00 1.12 H new ATOM 0 HB2 LEU A 46 -13.003 4.147 -4.806 1.00 1.15 H new ATOM 0 HB3 LEU A 46 -13.356 3.255 -3.340 1.00 1.15 H new ATOM 0 HG LEU A 46 -11.127 3.296 -3.403 1.00 1.00 H new ATOM 0 HD11 LEU A 46 -10.227 1.020 -3.910 1.00 1.57 H new ATOM 0 HD12 LEU A 46 -11.761 0.995 -3.008 1.00 1.57 H new ATOM 0 HD13 LEU A 46 -11.749 0.647 -4.753 1.00 1.57 H new ATOM 0 HD21 LEU A 46 -9.637 2.780 -5.343 1.00 1.87 H new ATOM 0 HD22 LEU A 46 -11.085 2.638 -6.368 1.00 1.87 H new ATOM 0 HD23 LEU A 46 -10.684 4.196 -5.607 1.00 1.87 H new ATOM 735 N PRO A 47 -16.329 1.638 -5.143 1.00 1.20 N ATOM 736 CA PRO A 47 -17.744 1.825 -4.892 1.00 1.39 C ATOM 737 C PRO A 47 -18.059 1.755 -3.399 1.00 1.41 C ATOM 738 O PRO A 47 -18.903 2.516 -2.930 1.00 1.80 O ATOM 739 CB PRO A 47 -18.452 0.710 -5.668 1.00 1.44 C ATOM 740 CG PRO A 47 -17.415 -0.410 -5.700 1.00 1.29 C ATOM 741 CD PRO A 47 -16.099 0.361 -5.792 1.00 1.14 C ATOM 0 HA PRO A 47 -18.080 2.810 -5.217 1.00 1.39 H new ATOM 0 HB2 PRO A 47 -19.369 0.394 -5.171 1.00 1.44 H new ATOM 0 HB3 PRO A 47 -18.728 1.032 -6.672 1.00 1.44 H new ATOM 0 HG2 PRO A 47 -17.460 -1.031 -4.805 1.00 1.29 H new ATOM 0 HG3 PRO A 47 -17.558 -1.072 -6.554 1.00 1.29 H new ATOM 0 HD2 PRO A 47 -15.293 -0.185 -5.301 1.00 1.14 H new ATOM 0 HD3 PRO A 47 -15.802 0.501 -6.831 1.00 1.14 H new ATOM 749 N HIS A 48 -17.424 0.839 -2.654 1.00 1.24 N ATOM 750 CA HIS A 48 -17.709 0.673 -1.237 1.00 1.35 C ATOM 751 C HIS A 48 -16.670 1.421 -0.412 1.00 1.59 C ATOM 752 O HIS A 48 -17.036 2.137 0.524 1.00 2.38 O ATOM 753 CB HIS A 48 -17.758 -0.814 -0.860 1.00 1.62 C ATOM 754 CG HIS A 48 -18.274 -1.058 0.542 1.00 2.25 C ATOM 755 ND1 HIS A 48 -18.218 -0.176 1.601 1.00 3.59 N ATOM 756 CD2 HIS A 48 -18.948 -2.170 0.973 1.00 2.67 C ATOM 757 CE1 HIS A 48 -18.841 -0.748 2.643 1.00 3.83 C ATOM 758 NE2 HIS A 48 -19.312 -1.959 2.308 1.00 3.25 N ATOM 0 H HIS A 48 -16.711 0.206 -3.017 1.00 1.24 H new ATOM 0 HA HIS A 48 -18.690 1.095 -1.020 1.00 1.35 H new ATOM 0 HB2 HIS A 48 -18.394 -1.341 -1.571 1.00 1.62 H new ATOM 0 HB3 HIS A 48 -16.758 -1.238 -0.951 1.00 1.62 H new ATOM 0 HD1 HIS A 48 -17.781 0.746 1.594 1.00 3.59 H new ATOM 0 HD2 HIS A 48 -19.161 -3.052 0.387 1.00 2.67 H new ATOM 0 HE1 HIS A 48 -18.949 -0.296 3.618 1.00 3.83 H new ATOM 766 N LEU A 49 -15.387 1.197 -0.700 1.00 1.24 N ATOM 767 CA LEU A 49 -14.295 1.634 0.157 1.00 1.35 C ATOM 768 C LEU A 49 -14.355 3.135 0.425 1.00 1.44 C ATOM 769 O LEU A 49 -14.524 3.576 1.560 1.00 1.79 O ATOM 770 CB LEU A 49 -12.958 1.260 -0.498 1.00 1.35 C ATOM 771 CG LEU A 49 -12.069 0.441 0.429 1.00 1.06 C ATOM 772 CD1 LEU A 49 -12.620 -0.976 0.617 1.00 1.02 C ATOM 773 CD2 LEU A 49 -10.701 0.326 -0.219 1.00 1.23 C ATOM 0 H LEU A 49 -15.080 0.705 -1.539 1.00 1.24 H new ATOM 0 HA LEU A 49 -14.388 1.130 1.119 1.00 1.35 H new ATOM 0 HB2 LEU A 49 -13.148 0.693 -1.409 1.00 1.35 H new ATOM 0 HB3 LEU A 49 -12.433 2.169 -0.792 1.00 1.35 H new ATOM 0 HG LEU A 49 -12.024 0.934 1.400 1.00 1.06 H new ATOM 0 HD11 LEU A 49 -11.964 -1.536 1.283 1.00 1.02 H new ATOM 0 HD12 LEU A 49 -13.619 -0.923 1.051 1.00 1.02 H new ATOM 0 HD13 LEU A 49 -12.670 -1.478 -0.349 1.00 1.02 H new ATOM 0 HD21 LEU A 49 -10.042 -0.257 0.424 1.00 1.23 H new ATOM 0 HD22 LEU A 49 -10.797 -0.169 -1.185 1.00 1.23 H new ATOM 0 HD23 LEU A 49 -10.281 1.322 -0.362 1.00 1.23 H new ATOM 785 N LEU A 50 -14.188 3.916 -0.639 1.00 1.34 N ATOM 786 CA LEU A 50 -14.029 5.356 -0.593 1.00 1.61 C ATOM 787 C LEU A 50 -15.202 5.992 -1.326 1.00 1.98 C ATOM 788 O LEU A 50 -15.035 6.831 -2.208 1.00 2.97 O ATOM 789 CB LEU A 50 -12.665 5.745 -1.176 1.00 1.40 C ATOM 790 CG LEU A 50 -11.490 5.329 -0.271 1.00 1.13 C ATOM 791 CD1 LEU A 50 -10.186 5.534 -1.044 1.00 1.15 C ATOM 792 CD2 LEU A 50 -11.431 6.190 0.996 1.00 1.35 C ATOM 0 H LEU A 50 -14.160 3.544 -1.588 1.00 1.34 H new ATOM 0 HA LEU A 50 -14.040 5.726 0.432 1.00 1.61 H new ATOM 0 HB2 LEU A 50 -12.547 5.280 -2.154 1.00 1.40 H new ATOM 0 HB3 LEU A 50 -12.635 6.824 -1.330 1.00 1.40 H new ATOM 0 HG LEU A 50 -11.628 4.287 0.016 1.00 1.13 H new ATOM 0 HD11 LEU A 50 -9.342 5.244 -0.418 1.00 1.15 H new ATOM 0 HD12 LEU A 50 -10.197 4.921 -1.945 1.00 1.15 H new ATOM 0 HD13 LEU A 50 -10.088 6.584 -1.321 1.00 1.15 H new ATOM 0 HD21 LEU A 50 -10.591 5.872 1.614 1.00 1.35 H new ATOM 0 HD22 LEU A 50 -11.302 7.236 0.719 1.00 1.35 H new ATOM 0 HD23 LEU A 50 -12.358 6.075 1.557 1.00 1.35 H new ATOM 804 N LYS A 51 -16.409 5.656 -0.869 1.00 1.64 N ATOM 805 CA LYS A 51 -17.669 6.267 -1.286 1.00 1.82 C ATOM 806 C LYS A 51 -17.817 7.723 -0.798 1.00 1.66 C ATOM 807 O LYS A 51 -18.922 8.192 -0.541 1.00 2.80 O ATOM 808 CB LYS A 51 -18.817 5.373 -0.793 1.00 2.12 C ATOM 809 CG LYS A 51 -18.834 5.187 0.738 1.00 2.14 C ATOM 810 CD LYS A 51 -20.034 5.872 1.403 1.00 3.07 C ATOM 811 CE LYS A 51 -21.337 5.102 1.145 1.00 4.13 C ATOM 812 NZ LYS A 51 -22.524 5.872 1.571 1.00 5.21 N ATOM 0 H LYS A 51 -16.539 4.923 -0.172 1.00 1.64 H new ATOM 0 HA LYS A 51 -17.692 6.333 -2.374 1.00 1.82 H new ATOM 0 HB2 LYS A 51 -19.766 5.805 -1.110 1.00 2.12 H new ATOM 0 HB3 LYS A 51 -18.737 4.396 -1.269 1.00 2.12 H new ATOM 0 HG2 LYS A 51 -18.854 4.122 0.971 1.00 2.14 H new ATOM 0 HG3 LYS A 51 -17.912 5.588 1.159 1.00 2.14 H new ATOM 0 HD2 LYS A 51 -19.862 5.948 2.477 1.00 3.07 H new ATOM 0 HD3 LYS A 51 -20.130 6.889 1.023 1.00 3.07 H new ATOM 0 HE2 LYS A 51 -21.417 4.869 0.083 1.00 4.13 H new ATOM 0 HE3 LYS A 51 -21.309 4.152 1.679 1.00 4.13 H new ATOM 0 HZ1 LYS A 51 -23.384 5.319 1.380 1.00 5.21 H new ATOM 0 HZ2 LYS A 51 -22.460 6.073 2.589 1.00 5.21 H new ATOM 0 HZ3 LYS A 51 -22.565 6.767 1.043 1.00 5.21 H new ATOM 826 N ASP A 52 -16.702 8.446 -0.686 1.00 2.04 N ATOM 827 CA ASP A 52 -16.562 9.794 -0.167 1.00 2.07 C ATOM 828 C ASP A 52 -16.205 10.720 -1.333 1.00 1.89 C ATOM 829 O ASP A 52 -15.521 11.725 -1.171 1.00 2.08 O ATOM 830 CB ASP A 52 -15.456 9.763 0.901 1.00 2.71 C ATOM 831 CG ASP A 52 -15.291 11.099 1.607 1.00 3.56 C ATOM 832 OD1 ASP A 52 -16.319 11.610 2.093 1.00 3.60 O ATOM 833 OD2 ASP A 52 -14.137 11.583 1.675 1.00 4.87 O ATOM 0 H ASP A 52 -15.803 8.066 -0.982 1.00 2.04 H new ATOM 0 HA ASP A 52 -17.481 10.163 0.289 1.00 2.07 H new ATOM 0 HB2 ASP A 52 -15.688 8.993 1.637 1.00 2.71 H new ATOM 0 HB3 ASP A 52 -14.512 9.484 0.434 1.00 2.71 H new ATOM 838 N VAL A 53 -16.661 10.372 -2.542 1.00 1.78 N ATOM 839 CA VAL A 53 -16.293 11.063 -3.773 1.00 1.86 C ATOM 840 C VAL A 53 -16.629 12.558 -3.708 1.00 1.97 C ATOM 841 O VAL A 53 -15.942 13.383 -4.307 1.00 2.32 O ATOM 842 CB VAL A 53 -16.931 10.373 -4.992 1.00 2.12 C ATOM 843 CG1 VAL A 53 -16.374 8.952 -5.155 1.00 2.09 C ATOM 844 CG2 VAL A 53 -18.464 10.319 -4.922 1.00 2.75 C ATOM 0 H VAL A 53 -17.303 9.593 -2.690 1.00 1.78 H new ATOM 0 HA VAL A 53 -15.211 10.998 -3.888 1.00 1.86 H new ATOM 0 HB VAL A 53 -16.669 10.980 -5.858 1.00 2.12 H new ATOM 0 HG11 VAL A 53 -16.835 8.478 -6.021 1.00 2.09 H new ATOM 0 HG12 VAL A 53 -15.294 8.999 -5.299 1.00 2.09 H new ATOM 0 HG13 VAL A 53 -16.596 8.369 -4.261 1.00 2.09 H new ATOM 0 HG21 VAL A 53 -18.851 9.821 -5.811 1.00 2.75 H new ATOM 0 HG22 VAL A 53 -18.768 9.765 -4.034 1.00 2.75 H new ATOM 0 HG23 VAL A 53 -18.862 11.333 -4.872 1.00 2.75 H new ATOM 854 N GLY A 54 -17.674 12.903 -2.950 1.00 1.82 N ATOM 855 CA GLY A 54 -18.042 14.289 -2.686 1.00 2.02 C ATOM 856 C GLY A 54 -16.880 15.062 -2.053 1.00 1.94 C ATOM 857 O GLY A 54 -16.651 16.222 -2.382 1.00 2.39 O ATOM 0 H GLY A 54 -18.288 12.223 -2.502 1.00 1.82 H new ATOM 0 HA2 GLY A 54 -18.339 14.772 -3.617 1.00 2.02 H new ATOM 0 HA3 GLY A 54 -18.906 14.318 -2.022 1.00 2.02 H new ATOM 861 N SER A 55 -16.143 14.392 -1.167 1.00 1.61 N ATOM 862 CA SER A 55 -14.981 14.898 -0.457 1.00 1.59 C ATOM 863 C SER A 55 -13.726 14.178 -0.972 1.00 1.31 C ATOM 864 O SER A 55 -12.869 13.748 -0.199 1.00 1.36 O ATOM 865 CB SER A 55 -15.237 14.717 1.050 1.00 1.67 C ATOM 866 OG SER A 55 -15.875 15.868 1.573 1.00 2.06 O ATOM 0 H SER A 55 -16.358 13.427 -0.915 1.00 1.61 H new ATOM 0 HA SER A 55 -14.812 15.960 -0.633 1.00 1.59 H new ATOM 0 HB2 SER A 55 -15.859 13.838 1.219 1.00 1.67 H new ATOM 0 HB3 SER A 55 -14.294 14.545 1.570 1.00 1.67 H new ATOM 0 HG SER A 55 -15.201 16.480 1.935 1.00 2.06 H new ATOM 872 N LEU A 56 -13.598 14.078 -2.300 1.00 1.21 N ATOM 873 CA LEU A 56 -12.414 13.590 -2.977 1.00 1.09 C ATOM 874 C LEU A 56 -11.337 14.670 -2.995 1.00 1.12 C ATOM 875 O LEU A 56 -10.179 14.414 -2.685 1.00 1.17 O ATOM 876 CB LEU A 56 -12.817 13.206 -4.406 1.00 1.03 C ATOM 877 CG LEU A 56 -11.692 12.682 -5.307 1.00 1.01 C ATOM 878 CD1 LEU A 56 -10.740 13.770 -5.827 1.00 0.98 C ATOM 879 CD2 LEU A 56 -10.915 11.584 -4.589 1.00 1.04 C ATOM 0 H LEU A 56 -14.343 14.345 -2.943 1.00 1.21 H new ATOM 0 HA LEU A 56 -12.006 12.723 -2.457 1.00 1.09 H new ATOM 0 HB2 LEU A 56 -13.595 12.444 -4.350 1.00 1.03 H new ATOM 0 HB3 LEU A 56 -13.260 14.080 -4.884 1.00 1.03 H new ATOM 0 HG LEU A 56 -12.179 12.276 -6.193 1.00 1.01 H new ATOM 0 HD11 LEU A 56 -9.975 13.314 -6.455 1.00 0.98 H new ATOM 0 HD12 LEU A 56 -11.303 14.498 -6.411 1.00 0.98 H new ATOM 0 HD13 LEU A 56 -10.265 14.271 -4.984 1.00 0.98 H new ATOM 0 HD21 LEU A 56 -10.118 11.219 -5.237 1.00 1.04 H new ATOM 0 HD22 LEU A 56 -10.482 11.985 -3.672 1.00 1.04 H new ATOM 0 HD23 LEU A 56 -11.588 10.763 -4.343 1.00 1.04 H new ATOM 891 N ASP A 57 -11.689 15.879 -3.425 1.00 1.29 N ATOM 892 CA ASP A 57 -10.713 16.880 -3.832 1.00 1.77 C ATOM 893 C ASP A 57 -9.842 17.307 -2.638 1.00 2.04 C ATOM 894 O ASP A 57 -8.629 17.474 -2.754 1.00 2.18 O ATOM 895 CB ASP A 57 -11.448 18.019 -4.556 1.00 2.37 C ATOM 896 CG ASP A 57 -12.409 17.459 -5.608 1.00 3.64 C ATOM 897 OD1 ASP A 57 -13.436 16.869 -5.197 1.00 3.97 O ATOM 898 OD2 ASP A 57 -12.115 17.491 -6.824 1.00 5.01 O ATOM 0 H ASP A 57 -12.658 16.190 -3.500 1.00 1.29 H new ATOM 0 HA ASP A 57 -9.999 16.474 -4.549 1.00 1.77 H new ATOM 0 HB2 ASP A 57 -12.001 18.619 -3.833 1.00 2.37 H new ATOM 0 HB3 ASP A 57 -10.725 18.681 -5.032 1.00 2.37 H new ATOM 903 N GLU A 58 -10.451 17.397 -1.453 1.00 2.22 N ATOM 904 CA GLU A 58 -9.742 17.532 -0.186 1.00 2.53 C ATOM 905 C GLU A 58 -8.780 16.355 0.055 1.00 2.16 C ATOM 906 O GLU A 58 -7.661 16.555 0.530 1.00 2.17 O ATOM 907 CB GLU A 58 -10.747 17.680 0.968 1.00 2.91 C ATOM 908 CG GLU A 58 -11.964 16.761 0.804 1.00 3.20 C ATOM 909 CD GLU A 58 -12.646 16.483 2.130 1.00 3.14 C ATOM 910 OE1 GLU A 58 -12.168 15.554 2.822 1.00 2.97 O ATOM 911 OE2 GLU A 58 -13.684 17.127 2.382 1.00 4.01 O ATOM 0 H GLU A 58 -11.466 17.377 -1.349 1.00 2.22 H new ATOM 0 HA GLU A 58 -9.132 18.434 -0.231 1.00 2.53 H new ATOM 0 HB2 GLU A 58 -10.249 17.455 1.911 1.00 2.91 H new ATOM 0 HB3 GLU A 58 -11.082 18.716 1.024 1.00 2.91 H new ATOM 0 HG2 GLU A 58 -12.676 17.221 0.119 1.00 3.20 H new ATOM 0 HG3 GLU A 58 -11.650 15.820 0.353 1.00 3.20 H new ATOM 918 N LYS A 59 -9.193 15.125 -0.270 1.00 1.88 N ATOM 919 CA LYS A 59 -8.318 13.962 -0.207 1.00 1.66 C ATOM 920 C LYS A 59 -7.131 14.228 -1.134 1.00 1.49 C ATOM 921 O LYS A 59 -5.990 14.095 -0.705 1.00 1.51 O ATOM 922 CB LYS A 59 -9.053 12.651 -0.581 1.00 1.50 C ATOM 923 CG LYS A 59 -9.101 11.584 0.529 1.00 1.82 C ATOM 924 CD LYS A 59 -10.470 11.533 1.225 1.00 1.81 C ATOM 925 CE LYS A 59 -10.772 12.859 1.940 1.00 2.41 C ATOM 926 NZ LYS A 59 -12.158 12.953 2.429 1.00 2.95 N ATOM 0 H LYS A 59 -10.141 14.914 -0.582 1.00 1.88 H new ATOM 0 HA LYS A 59 -7.974 13.817 0.817 1.00 1.66 H new ATOM 0 HB2 LYS A 59 -10.075 12.897 -0.871 1.00 1.50 H new ATOM 0 HB3 LYS A 59 -8.568 12.219 -1.457 1.00 1.50 H new ATOM 0 HG2 LYS A 59 -8.876 10.607 0.102 1.00 1.82 H new ATOM 0 HG3 LYS A 59 -8.327 11.795 1.267 1.00 1.82 H new ATOM 0 HD2 LYS A 59 -11.248 11.326 0.490 1.00 1.81 H new ATOM 0 HD3 LYS A 59 -10.486 10.715 1.945 1.00 1.81 H new ATOM 0 HE2 LYS A 59 -10.088 12.974 2.781 1.00 2.41 H new ATOM 0 HE3 LYS A 59 -10.578 13.685 1.256 1.00 2.41 H new ATOM 0 HZ1 LYS A 59 -12.426 13.954 2.523 1.00 2.95 H new ATOM 0 HZ2 LYS A 59 -12.797 12.486 1.754 1.00 2.95 H new ATOM 0 HZ3 LYS A 59 -12.232 12.486 3.356 1.00 2.95 H new ATOM 940 N MET A 60 -7.392 14.644 -2.379 1.00 1.42 N ATOM 941 CA MET A 60 -6.347 14.973 -3.347 1.00 1.41 C ATOM 942 C MET A 60 -5.341 15.915 -2.697 1.00 1.60 C ATOM 943 O MET A 60 -4.154 15.611 -2.671 1.00 1.53 O ATOM 944 CB MET A 60 -6.935 15.487 -4.682 1.00 1.56 C ATOM 945 CG MET A 60 -6.499 16.883 -5.162 1.00 1.38 C ATOM 946 SD MET A 60 -4.757 17.055 -5.634 1.00 2.34 S ATOM 947 CE MET A 60 -4.719 18.795 -6.111 1.00 1.86 C ATOM 0 H MET A 60 -8.338 14.761 -2.741 1.00 1.42 H new ATOM 0 HA MET A 60 -5.806 14.070 -3.628 1.00 1.41 H new ATOM 0 HB2 MET A 60 -6.679 14.769 -5.461 1.00 1.56 H new ATOM 0 HB3 MET A 60 -8.021 15.486 -4.593 1.00 1.56 H new ATOM 0 HG2 MET A 60 -7.115 17.160 -6.017 1.00 1.38 H new ATOM 0 HG3 MET A 60 -6.712 17.601 -4.370 1.00 1.38 H new ATOM 0 HE1 MET A 60 -3.712 19.063 -6.429 1.00 1.86 H new ATOM 0 HE2 MET A 60 -5.416 18.962 -6.932 1.00 1.86 H new ATOM 0 HE3 MET A 60 -5.007 19.412 -5.260 1.00 1.86 H new ATOM 957 N LYS A 61 -5.824 17.012 -2.110 1.00 1.84 N ATOM 958 CA LYS A 61 -4.973 17.957 -1.404 1.00 2.02 C ATOM 959 C LYS A 61 -4.155 17.243 -0.319 1.00 2.05 C ATOM 960 O LYS A 61 -2.962 17.489 -0.171 1.00 2.19 O ATOM 961 CB LYS A 61 -5.841 19.067 -0.799 1.00 2.09 C ATOM 962 CG LYS A 61 -5.001 20.288 -0.405 1.00 2.60 C ATOM 963 CD LYS A 61 -5.671 21.094 0.715 1.00 2.84 C ATOM 964 CE LYS A 61 -7.087 21.557 0.337 1.00 2.55 C ATOM 965 NZ LYS A 61 -7.732 22.291 1.443 1.00 3.51 N ATOM 0 H LYS A 61 -6.812 17.265 -2.113 1.00 1.84 H new ATOM 0 HA LYS A 61 -4.268 18.403 -2.106 1.00 2.02 H new ATOM 0 HB2 LYS A 61 -6.604 19.366 -1.518 1.00 2.09 H new ATOM 0 HB3 LYS A 61 -6.362 18.685 0.079 1.00 2.09 H new ATOM 0 HG2 LYS A 61 -4.013 19.962 -0.079 1.00 2.60 H new ATOM 0 HG3 LYS A 61 -4.854 20.926 -1.276 1.00 2.60 H new ATOM 0 HD2 LYS A 61 -5.720 20.485 1.618 1.00 2.84 H new ATOM 0 HD3 LYS A 61 -5.058 21.964 0.950 1.00 2.84 H new ATOM 0 HE2 LYS A 61 -7.038 22.196 -0.545 1.00 2.55 H new ATOM 0 HE3 LYS A 61 -7.694 20.692 0.071 1.00 2.55 H new ATOM 0 HZ1 LYS A 61 -8.685 22.588 1.153 1.00 3.51 H new ATOM 0 HZ2 LYS A 61 -7.801 21.673 2.276 1.00 3.51 H new ATOM 0 HZ3 LYS A 61 -7.165 23.130 1.680 1.00 3.51 H new ATOM 979 N SER A 62 -4.802 16.373 0.461 1.00 1.96 N ATOM 980 CA SER A 62 -4.139 15.627 1.522 1.00 1.97 C ATOM 981 C SER A 62 -3.015 14.736 0.975 1.00 1.77 C ATOM 982 O SER A 62 -1.965 14.629 1.606 1.00 1.84 O ATOM 983 CB SER A 62 -5.167 14.809 2.317 1.00 2.01 C ATOM 984 OG SER A 62 -4.624 14.402 3.559 1.00 2.44 O ATOM 0 H SER A 62 -5.798 16.170 0.371 1.00 1.96 H new ATOM 0 HA SER A 62 -3.671 16.343 2.198 1.00 1.97 H new ATOM 0 HB2 SER A 62 -6.064 15.405 2.484 1.00 2.01 H new ATOM 0 HB3 SER A 62 -5.468 13.934 1.741 1.00 2.01 H new ATOM 0 HG SER A 62 -5.292 13.883 4.054 1.00 2.44 H new ATOM 990 N LEU A 63 -3.231 14.059 -0.159 1.00 1.56 N ATOM 991 CA LEU A 63 -2.198 13.226 -0.766 1.00 1.46 C ATOM 992 C LEU A 63 -1.092 14.103 -1.344 1.00 1.50 C ATOM 993 O LEU A 63 0.088 13.890 -1.063 1.00 1.56 O ATOM 994 CB LEU A 63 -2.762 12.326 -1.874 1.00 1.35 C ATOM 995 CG LEU A 63 -3.488 11.082 -1.348 1.00 1.41 C ATOM 996 CD1 LEU A 63 -4.926 11.379 -0.937 1.00 1.66 C ATOM 997 CD2 LEU A 63 -3.512 10.011 -2.438 1.00 1.69 C ATOM 0 H LEU A 63 -4.113 14.075 -0.671 1.00 1.56 H new ATOM 0 HA LEU A 63 -1.797 12.585 0.019 1.00 1.46 H new ATOM 0 HB2 LEU A 63 -3.452 12.907 -2.486 1.00 1.35 H new ATOM 0 HB3 LEU A 63 -1.946 12.012 -2.525 1.00 1.35 H new ATOM 0 HG LEU A 63 -2.945 10.740 -0.467 1.00 1.41 H new ATOM 0 HD11 LEU A 63 -5.396 10.466 -0.572 1.00 1.66 H new ATOM 0 HD12 LEU A 63 -4.931 12.130 -0.147 1.00 1.66 H new ATOM 0 HD13 LEU A 63 -5.480 11.753 -1.798 1.00 1.66 H new ATOM 0 HD21 LEU A 63 -4.028 9.125 -2.067 1.00 1.69 H new ATOM 0 HD22 LEU A 63 -4.035 10.395 -3.314 1.00 1.69 H new ATOM 0 HD23 LEU A 63 -2.490 9.748 -2.712 1.00 1.69 H new ATOM 1009 N ASP A 64 -1.473 15.064 -2.186 1.00 1.52 N ATOM 1010 CA ASP A 64 -0.557 15.996 -2.809 1.00 1.56 C ATOM 1011 C ASP A 64 -0.083 17.009 -1.771 1.00 1.69 C ATOM 1012 O ASP A 64 -0.496 18.168 -1.775 1.00 1.86 O ATOM 1013 CB ASP A 64 -1.211 16.682 -4.014 1.00 1.60 C ATOM 1014 CG ASP A 64 -0.282 17.699 -4.653 1.00 1.63 C ATOM 1015 OD1 ASP A 64 0.946 17.642 -4.400 1.00 1.72 O ATOM 1016 OD2 ASP A 64 -0.789 18.536 -5.422 1.00 2.00 O ATOM 0 H ASP A 64 -2.446 15.212 -2.453 1.00 1.52 H new ATOM 0 HA ASP A 64 0.311 15.454 -3.185 1.00 1.56 H new ATOM 0 HB2 ASP A 64 -1.492 15.931 -4.752 1.00 1.60 H new ATOM 0 HB3 ASP A 64 -2.129 17.176 -3.697 1.00 1.60 H new ATOM 1021 N VAL A 65 0.819 16.569 -0.895 1.00 1.70 N ATOM 1022 CA VAL A 65 1.403 17.387 0.161 1.00 1.93 C ATOM 1023 C VAL A 65 1.948 18.725 -0.362 1.00 2.03 C ATOM 1024 O VAL A 65 2.008 19.697 0.386 1.00 2.23 O ATOM 1025 CB VAL A 65 2.486 16.593 0.916 1.00 2.01 C ATOM 1026 CG1 VAL A 65 1.868 15.418 1.686 1.00 2.06 C ATOM 1027 CG2 VAL A 65 3.598 16.076 -0.010 1.00 2.12 C ATOM 0 H VAL A 65 1.171 15.612 -0.902 1.00 1.70 H new ATOM 0 HA VAL A 65 0.604 17.637 0.859 1.00 1.93 H new ATOM 0 HB VAL A 65 2.940 17.291 1.619 1.00 2.01 H new ATOM 0 HG11 VAL A 65 2.653 14.873 2.210 1.00 2.06 H new ATOM 0 HG12 VAL A 65 1.144 15.796 2.408 1.00 2.06 H new ATOM 0 HG13 VAL A 65 1.367 14.748 0.987 1.00 2.06 H new ATOM 0 HG21 VAL A 65 4.333 15.524 0.577 1.00 2.12 H new ATOM 0 HG22 VAL A 65 3.167 15.417 -0.764 1.00 2.12 H new ATOM 0 HG23 VAL A 65 4.084 16.919 -0.500 1.00 2.12 H new ATOM 1037 N ASN A 66 2.360 18.784 -1.633 1.00 1.95 N ATOM 1038 CA ASN A 66 2.877 20.010 -2.236 1.00 2.08 C ATOM 1039 C ASN A 66 1.748 20.975 -2.600 1.00 1.91 C ATOM 1040 O ASN A 66 1.972 22.182 -2.651 1.00 1.96 O ATOM 1041 CB ASN A 66 3.651 19.703 -3.520 1.00 2.32 C ATOM 1042 CG ASN A 66 4.623 18.537 -3.400 1.00 1.74 C ATOM 1043 OD1 ASN A 66 4.385 17.481 -3.984 1.00 2.06 O ATOM 1044 ND2 ASN A 66 5.703 18.698 -2.643 1.00 2.31 N ATOM 0 H ASN A 66 2.343 17.985 -2.267 1.00 1.95 H new ATOM 0 HA ASN A 66 3.532 20.467 -1.494 1.00 2.08 H new ATOM 0 HB2 ASN A 66 2.939 19.487 -4.317 1.00 2.32 H new ATOM 0 HB3 ASN A 66 4.204 20.593 -3.819 1.00 2.32 H new ATOM 0 HD21 ASN A 66 6.367 17.931 -2.532 1.00 2.31 H new ATOM 0 HD22 ASN A 66 5.868 19.588 -2.173 1.00 2.31 H new ATOM 1051 N GLN A 67 0.570 20.440 -2.939 1.00 1.83 N ATOM 1052 CA GLN A 67 -0.496 21.147 -3.634 1.00 1.89 C ATOM 1053 C GLN A 67 0.028 21.671 -4.982 1.00 1.90 C ATOM 1054 O GLN A 67 -0.088 22.857 -5.288 1.00 2.08 O ATOM 1055 CB GLN A 67 -1.115 22.218 -2.721 1.00 2.10 C ATOM 1056 CG GLN A 67 -2.529 22.598 -3.180 1.00 2.93 C ATOM 1057 CD GLN A 67 -3.149 23.648 -2.265 1.00 3.24 C ATOM 1058 OE1 GLN A 67 -4.089 23.370 -1.524 1.00 2.88 O ATOM 1059 NE2 GLN A 67 -2.628 24.870 -2.309 1.00 4.62 N ATOM 0 H GLN A 67 0.331 19.471 -2.728 1.00 1.83 H new ATOM 0 HA GLN A 67 -1.317 20.471 -3.873 1.00 1.89 H new ATOM 0 HB2 GLN A 67 -1.151 21.848 -1.696 1.00 2.10 H new ATOM 0 HB3 GLN A 67 -0.482 23.105 -2.717 1.00 2.10 H new ATOM 0 HG2 GLN A 67 -2.491 22.979 -4.200 1.00 2.93 H new ATOM 0 HG3 GLN A 67 -3.159 21.709 -3.195 1.00 2.93 H new ATOM 0 HE21 GLN A 67 -1.848 25.069 -2.935 1.00 4.62 H new ATOM 0 HE22 GLN A 67 -3.008 25.608 -1.717 1.00 4.62 H new ATOM 1068 N ASP A 68 0.612 20.765 -5.775 1.00 1.77 N ATOM 1069 CA ASP A 68 1.201 21.007 -7.094 1.00 1.78 C ATOM 1070 C ASP A 68 0.367 20.399 -8.235 1.00 1.99 C ATOM 1071 O ASP A 68 0.602 20.729 -9.394 1.00 2.57 O ATOM 1072 CB ASP A 68 2.658 20.505 -7.138 1.00 1.58 C ATOM 1073 CG ASP A 68 2.800 19.007 -6.926 1.00 1.46 C ATOM 1074 OD1 ASP A 68 1.831 18.247 -7.073 1.00 1.54 O ATOM 1075 OD2 ASP A 68 3.825 18.512 -6.419 1.00 1.43 O ATOM 0 H ASP A 68 0.690 19.787 -5.496 1.00 1.77 H new ATOM 0 HA ASP A 68 1.200 22.085 -7.253 1.00 1.78 H new ATOM 0 HB2 ASP A 68 3.094 20.769 -8.102 1.00 1.58 H new ATOM 0 HB3 ASP A 68 3.235 21.026 -6.374 1.00 1.58 H new ATOM 1080 N SER A 69 -0.598 19.523 -7.931 1.00 1.75 N ATOM 1081 CA SER A 69 -1.433 18.788 -8.877 1.00 1.94 C ATOM 1082 C SER A 69 -0.712 17.631 -9.585 1.00 1.85 C ATOM 1083 O SER A 69 -1.342 16.940 -10.385 1.00 1.93 O ATOM 1084 CB SER A 69 -2.157 19.718 -9.857 1.00 2.27 C ATOM 1085 OG SER A 69 -2.820 20.743 -9.140 1.00 2.20 O ATOM 0 H SER A 69 -0.827 19.298 -6.963 1.00 1.75 H new ATOM 0 HA SER A 69 -2.199 18.308 -8.268 1.00 1.94 H new ATOM 0 HB2 SER A 69 -1.443 20.153 -10.556 1.00 2.27 H new ATOM 0 HB3 SER A 69 -2.876 19.151 -10.448 1.00 2.27 H new ATOM 0 HG SER A 69 -3.280 21.337 -9.769 1.00 2.20 H new ATOM 1091 N GLU A 70 0.553 17.356 -9.250 1.00 1.81 N ATOM 1092 CA GLU A 70 1.104 16.019 -9.397 1.00 1.55 C ATOM 1093 C GLU A 70 0.742 15.274 -8.117 1.00 1.03 C ATOM 1094 O GLU A 70 1.273 15.581 -7.046 1.00 0.86 O ATOM 1095 CB GLU A 70 2.638 16.013 -9.559 1.00 1.75 C ATOM 1096 CG GLU A 70 3.135 16.255 -10.990 1.00 2.41 C ATOM 1097 CD GLU A 70 4.586 15.801 -11.150 1.00 3.24 C ATOM 1098 OE1 GLU A 70 4.793 14.572 -11.298 1.00 4.13 O ATOM 1099 OE2 GLU A 70 5.477 16.670 -11.124 1.00 3.73 O ATOM 0 H GLU A 70 1.207 18.044 -8.877 1.00 1.81 H new ATOM 0 HA GLU A 70 0.697 15.559 -10.297 1.00 1.55 H new ATOM 0 HB2 GLU A 70 3.061 16.778 -8.908 1.00 1.75 H new ATOM 0 HB3 GLU A 70 3.022 15.053 -9.214 1.00 1.75 H new ATOM 0 HG2 GLU A 70 2.502 15.716 -11.695 1.00 2.41 H new ATOM 0 HG3 GLU A 70 3.053 17.314 -11.233 1.00 2.41 H new ATOM 1106 N LEU A 71 -0.072 14.230 -8.238 1.00 0.97 N ATOM 1107 CA LEU A 71 -0.057 13.152 -7.273 1.00 0.82 C ATOM 1108 C LEU A 71 1.116 12.292 -7.752 1.00 0.76 C ATOM 1109 O LEU A 71 0.939 11.361 -8.541 1.00 0.81 O ATOM 1110 CB LEU A 71 -1.372 12.350 -7.302 1.00 0.90 C ATOM 1111 CG LEU A 71 -2.683 13.014 -6.846 1.00 1.15 C ATOM 1112 CD1 LEU A 71 -2.765 13.106 -5.317 1.00 1.20 C ATOM 1113 CD2 LEU A 71 -2.951 14.377 -7.495 1.00 1.42 C ATOM 0 H LEU A 71 -0.746 14.114 -8.995 1.00 0.97 H new ATOM 0 HA LEU A 71 0.044 13.499 -6.245 1.00 0.82 H new ATOM 0 HB2 LEU A 71 -1.521 12.006 -8.326 1.00 0.90 H new ATOM 0 HB3 LEU A 71 -1.225 11.463 -6.686 1.00 0.90 H new ATOM 0 HG LEU A 71 -3.477 12.356 -7.199 1.00 1.15 H new ATOM 0 HD11 LEU A 71 -3.704 13.580 -5.031 1.00 1.20 H new ATOM 0 HD12 LEU A 71 -2.719 12.104 -4.889 1.00 1.20 H new ATOM 0 HD13 LEU A 71 -1.930 13.699 -4.943 1.00 1.20 H new ATOM 0 HD21 LEU A 71 -3.893 14.779 -7.122 1.00 1.42 H new ATOM 0 HD22 LEU A 71 -2.141 15.063 -7.248 1.00 1.42 H new ATOM 0 HD23 LEU A 71 -3.010 14.259 -8.577 1.00 1.42 H new ATOM 1125 N LYS A 72 2.342 12.644 -7.350 1.00 0.78 N ATOM 1126 CA LYS A 72 3.513 11.859 -7.714 1.00 0.80 C ATOM 1127 C LYS A 72 3.314 10.443 -7.169 1.00 0.66 C ATOM 1128 O LYS A 72 2.591 10.272 -6.193 1.00 0.63 O ATOM 1129 CB LYS A 72 4.756 12.524 -7.109 1.00 1.02 C ATOM 1130 CG LYS A 72 6.129 12.000 -7.557 1.00 1.21 C ATOM 1131 CD LYS A 72 6.538 12.561 -8.933 1.00 2.14 C ATOM 1132 CE LYS A 72 6.201 11.632 -10.108 1.00 4.15 C ATOM 1133 NZ LYS A 72 6.231 12.341 -11.400 1.00 5.38 N ATOM 0 H LYS A 72 2.543 13.463 -6.776 1.00 0.78 H new ATOM 0 HA LYS A 72 3.647 11.808 -8.795 1.00 0.80 H new ATOM 0 HB2 LYS A 72 4.712 13.589 -7.336 1.00 1.02 H new ATOM 0 HB3 LYS A 72 4.696 12.426 -6.025 1.00 1.02 H new ATOM 0 HG2 LYS A 72 6.881 12.272 -6.816 1.00 1.21 H new ATOM 0 HG3 LYS A 72 6.105 10.911 -7.602 1.00 1.21 H new ATOM 0 HD2 LYS A 72 6.041 13.519 -9.086 1.00 2.14 H new ATOM 0 HD3 LYS A 72 7.611 12.754 -8.931 1.00 2.14 H new ATOM 0 HE2 LYS A 72 6.911 10.805 -10.132 1.00 4.15 H new ATOM 0 HE3 LYS A 72 5.213 11.199 -9.955 1.00 4.15 H new ATOM 0 HZ1 LYS A 72 6.388 11.657 -12.168 1.00 5.38 H new ATOM 0 HZ2 LYS A 72 5.324 12.828 -11.550 1.00 5.38 H new ATOM 0 HZ3 LYS A 72 7.002 13.039 -11.395 1.00 5.38 H new ATOM 1147 N PHE A 73 3.951 9.430 -7.763 1.00 0.66 N ATOM 1148 CA PHE A 73 3.774 8.023 -7.396 1.00 0.64 C ATOM 1149 C PHE A 73 3.664 7.825 -5.874 1.00 0.62 C ATOM 1150 O PHE A 73 2.694 7.260 -5.374 1.00 0.67 O ATOM 1151 CB PHE A 73 4.927 7.201 -7.999 1.00 0.72 C ATOM 1152 CG PHE A 73 4.617 5.745 -8.297 1.00 1.87 C ATOM 1153 CD1 PHE A 73 4.198 4.870 -7.276 1.00 3.48 C ATOM 1154 CD2 PHE A 73 4.773 5.255 -9.608 1.00 3.03 C ATOM 1155 CE1 PHE A 73 3.966 3.514 -7.561 1.00 5.02 C ATOM 1156 CE2 PHE A 73 4.552 3.895 -9.889 1.00 4.53 C ATOM 1157 CZ PHE A 73 4.170 3.022 -8.859 1.00 5.30 C ATOM 0 H PHE A 73 4.615 9.567 -8.525 1.00 0.66 H new ATOM 0 HA PHE A 73 2.828 7.670 -7.807 1.00 0.64 H new ATOM 0 HB2 PHE A 73 5.245 7.682 -8.924 1.00 0.72 H new ATOM 0 HB3 PHE A 73 5.773 7.239 -7.313 1.00 0.72 H new ATOM 0 HD1 PHE A 73 4.055 5.242 -6.272 1.00 3.48 H new ATOM 0 HD2 PHE A 73 5.064 5.927 -10.402 1.00 3.03 H new ATOM 0 HE1 PHE A 73 3.630 2.849 -6.779 1.00 5.02 H new ATOM 0 HE2 PHE A 73 4.676 3.523 -10.895 1.00 4.53 H new ATOM 0 HZ PHE A 73 4.033 1.971 -9.065 1.00 5.30 H new ATOM 1167 N ASN A 74 4.658 8.321 -5.131 1.00 0.63 N ATOM 1168 CA ASN A 74 4.711 8.217 -3.675 1.00 0.75 C ATOM 1169 C ASN A 74 3.583 8.992 -2.975 1.00 0.82 C ATOM 1170 O ASN A 74 3.129 8.574 -1.904 1.00 1.00 O ATOM 1171 CB ASN A 74 6.098 8.660 -3.190 1.00 0.88 C ATOM 1172 CG ASN A 74 6.109 8.963 -1.698 1.00 1.31 C ATOM 1173 OD1 ASN A 74 6.177 10.113 -1.286 1.00 3.00 O ATOM 1174 ND2 ASN A 74 6.037 7.926 -0.876 1.00 1.58 N ATOM 0 H ASN A 74 5.457 8.812 -5.532 1.00 0.63 H new ATOM 0 HA ASN A 74 4.550 7.174 -3.403 1.00 0.75 H new ATOM 0 HB2 ASN A 74 6.825 7.877 -3.407 1.00 0.88 H new ATOM 0 HB3 ASN A 74 6.410 9.546 -3.743 1.00 0.88 H new ATOM 0 HD21 ASN A 74 6.037 8.074 0.133 1.00 1.58 H new ATOM 0 HD22 ASN A 74 5.981 6.980 -1.253 1.00 1.58 H new ATOM 1181 N GLU A 75 3.124 10.109 -3.545 1.00 0.73 N ATOM 1182 CA GLU A 75 1.987 10.854 -3.025 1.00 0.78 C ATOM 1183 C GLU A 75 0.722 10.030 -3.262 1.00 0.74 C ATOM 1184 O GLU A 75 0.067 9.610 -2.306 1.00 0.83 O ATOM 1185 CB GLU A 75 1.881 12.227 -3.701 1.00 0.82 C ATOM 1186 CG GLU A 75 3.133 13.084 -3.486 1.00 0.93 C ATOM 1187 CD GLU A 75 2.994 14.406 -4.215 1.00 0.99 C ATOM 1188 OE1 GLU A 75 3.161 14.479 -5.450 1.00 2.01 O ATOM 1189 OE2 GLU A 75 2.658 15.435 -3.604 1.00 1.71 O ATOM 0 H GLU A 75 3.536 10.519 -4.383 1.00 0.73 H new ATOM 0 HA GLU A 75 2.117 11.029 -1.957 1.00 0.78 H new ATOM 0 HB2 GLU A 75 1.717 12.091 -4.770 1.00 0.82 H new ATOM 0 HB3 GLU A 75 1.011 12.755 -3.310 1.00 0.82 H new ATOM 0 HG2 GLU A 75 3.283 13.262 -2.421 1.00 0.93 H new ATOM 0 HG3 GLU A 75 4.013 12.552 -3.847 1.00 0.93 H new ATOM 1196 N TYR A 76 0.426 9.753 -4.536 1.00 0.71 N ATOM 1197 CA TYR A 76 -0.745 9.010 -4.975 1.00 0.72 C ATOM 1198 C TYR A 76 -0.893 7.716 -4.197 1.00 0.73 C ATOM 1199 O TYR A 76 -2.004 7.371 -3.786 1.00 0.75 O ATOM 1200 CB TYR A 76 -0.648 8.654 -6.455 1.00 0.69 C ATOM 1201 CG TYR A 76 -1.939 8.057 -6.980 1.00 0.94 C ATOM 1202 CD1 TYR A 76 -2.982 8.905 -7.391 1.00 2.50 C ATOM 1203 CD2 TYR A 76 -2.129 6.663 -7.019 1.00 1.44 C ATOM 1204 CE1 TYR A 76 -4.084 8.375 -8.079 1.00 3.03 C ATOM 1205 CE2 TYR A 76 -3.277 6.128 -7.629 1.00 1.73 C ATOM 1206 CZ TYR A 76 -4.220 6.986 -8.218 1.00 2.19 C ATOM 1207 OH TYR A 76 -5.224 6.470 -8.979 1.00 2.92 O ATOM 0 H TYR A 76 1.019 10.053 -5.310 1.00 0.71 H new ATOM 0 HA TYR A 76 -1.607 9.654 -4.801 1.00 0.72 H new ATOM 0 HB2 TYR A 76 -0.402 9.548 -7.028 1.00 0.69 H new ATOM 0 HB3 TYR A 76 0.167 7.946 -6.605 1.00 0.69 H new ATOM 0 HD1 TYR A 76 -2.935 9.963 -7.178 1.00 2.50 H new ATOM 0 HD2 TYR A 76 -1.393 6.005 -6.581 1.00 1.44 H new ATOM 0 HE1 TYR A 76 -4.827 9.036 -8.501 1.00 3.03 H new ATOM 0 HE2 TYR A 76 -3.433 5.060 -7.645 1.00 1.73 H new ATOM 0 HH TYR A 76 -5.014 5.542 -9.212 1.00 2.92 H new ATOM 1217 N TRP A 77 0.234 7.009 -4.019 1.00 0.74 N ATOM 1218 CA TRP A 77 0.278 5.762 -3.282 1.00 0.75 C ATOM 1219 C TRP A 77 -0.617 5.850 -2.045 1.00 0.77 C ATOM 1220 O TRP A 77 -1.318 4.874 -1.814 1.00 0.79 O ATOM 1221 CB TRP A 77 1.720 5.280 -2.979 1.00 0.81 C ATOM 1222 CG TRP A 77 1.871 4.490 -1.708 1.00 1.01 C ATOM 1223 CD1 TRP A 77 1.024 3.555 -1.225 1.00 1.67 C ATOM 1224 CD2 TRP A 77 2.890 4.583 -0.681 1.00 2.31 C ATOM 1225 NE1 TRP A 77 1.151 3.548 0.149 1.00 1.96 N ATOM 1226 CE2 TRP A 77 2.336 4.119 0.548 1.00 2.34 C ATOM 1227 CE3 TRP A 77 4.244 4.953 -0.638 1.00 4.06 C ATOM 1228 CZ2 TRP A 77 3.029 4.256 1.772 1.00 3.63 C ATOM 1229 CZ3 TRP A 77 4.970 4.518 0.481 1.00 5.08 C ATOM 1230 CH2 TRP A 77 4.352 4.702 1.715 1.00 5.05 C ATOM 0 H TRP A 77 1.139 7.299 -4.389 1.00 0.74 H new ATOM 0 HA TRP A 77 -0.128 4.978 -3.922 1.00 0.75 H new ATOM 0 HB2 TRP A 77 2.066 4.669 -3.813 1.00 0.81 H new ATOM 0 HB3 TRP A 77 2.375 6.150 -2.929 1.00 0.81 H new ATOM 0 HD1 TRP A 77 0.367 2.927 -1.808 1.00 1.67 H new ATOM 0 HE1 TRP A 77 0.453 3.167 0.788 1.00 1.96 H new ATOM 0 HE3 TRP A 77 4.701 5.539 -1.422 1.00 4.06 H new ATOM 0 HZ2 TRP A 77 2.555 4.025 2.714 1.00 3.63 H new ATOM 0 HZ3 TRP A 77 5.948 4.068 0.391 1.00 5.08 H new ATOM 0 HH2 TRP A 77 4.854 5.152 2.559 1.00 5.05 H new ATOM 1241 N ARG A 78 -0.668 6.961 -1.284 1.00 0.83 N ATOM 1242 CA ARG A 78 -1.509 6.997 -0.083 1.00 0.84 C ATOM 1243 C ARG A 78 -2.865 6.337 -0.319 1.00 0.76 C ATOM 1244 O ARG A 78 -3.264 5.528 0.498 1.00 0.79 O ATOM 1245 CB ARG A 78 -1.757 8.399 0.496 1.00 0.95 C ATOM 1246 CG ARG A 78 -1.549 8.464 2.019 1.00 1.95 C ATOM 1247 CD ARG A 78 -0.130 8.859 2.457 1.00 1.71 C ATOM 1248 NE ARG A 78 0.919 7.973 1.921 1.00 3.09 N ATOM 1249 CZ ARG A 78 1.681 8.228 0.844 1.00 4.48 C ATOM 1250 NH1 ARG A 78 1.461 9.293 0.078 1.00 4.78 N ATOM 1251 NH2 ARG A 78 2.685 7.423 0.498 1.00 6.45 N ATOM 0 H ARG A 78 -0.151 7.819 -1.475 1.00 0.83 H new ATOM 0 HA ARG A 78 -0.925 6.439 0.649 1.00 0.84 H new ATOM 0 HB2 ARG A 78 -1.087 9.110 0.012 1.00 0.95 H new ATOM 0 HB3 ARG A 78 -2.775 8.709 0.260 1.00 0.95 H new ATOM 0 HG2 ARG A 78 -2.256 9.179 2.438 1.00 1.95 H new ATOM 0 HG3 ARG A 78 -1.789 7.491 2.447 1.00 1.95 H new ATOM 0 HD2 ARG A 78 0.070 9.881 2.135 1.00 1.71 H new ATOM 0 HD3 ARG A 78 -0.079 8.852 3.546 1.00 1.71 H new ATOM 0 HE ARG A 78 1.080 7.092 2.409 1.00 3.09 H new ATOM 0 HH11 ARG A 78 0.701 9.935 0.304 1.00 4.78 H new ATOM 0 HH12 ARG A 78 2.052 9.467 -0.735 1.00 4.78 H new ATOM 0 HH21 ARG A 78 2.888 6.593 1.055 1.00 6.45 H new ATOM 0 HH22 ARG A 78 3.250 7.637 -0.324 1.00 6.45 H new ATOM 1265 N LEU A 79 -3.539 6.601 -1.443 1.00 0.71 N ATOM 1266 CA LEU A 79 -4.835 5.988 -1.715 1.00 0.69 C ATOM 1267 C LEU A 79 -4.767 4.461 -1.595 1.00 0.74 C ATOM 1268 O LEU A 79 -5.570 3.846 -0.904 1.00 0.77 O ATOM 1269 CB LEU A 79 -5.320 6.397 -3.113 1.00 0.70 C ATOM 1270 CG LEU A 79 -6.841 6.233 -3.277 1.00 0.76 C ATOM 1271 CD1 LEU A 79 -7.612 7.301 -2.484 1.00 0.73 C ATOM 1272 CD2 LEU A 79 -7.214 6.296 -4.763 1.00 0.86 C ATOM 0 H LEU A 79 -3.208 7.232 -2.173 1.00 0.71 H new ATOM 0 HA LEU A 79 -5.546 6.345 -0.970 1.00 0.69 H new ATOM 0 HB2 LEU A 79 -5.047 7.436 -3.300 1.00 0.70 H new ATOM 0 HB3 LEU A 79 -4.809 5.793 -3.863 1.00 0.70 H new ATOM 0 HG LEU A 79 -7.123 5.259 -2.876 1.00 0.76 H new ATOM 0 HD11 LEU A 79 -8.683 7.155 -2.623 1.00 0.73 H new ATOM 0 HD12 LEU A 79 -7.368 7.214 -1.425 1.00 0.73 H new ATOM 0 HD13 LEU A 79 -7.332 8.292 -2.841 1.00 0.73 H new ATOM 0 HD21 LEU A 79 -8.292 6.179 -4.873 1.00 0.86 H new ATOM 0 HD22 LEU A 79 -6.909 7.258 -5.174 1.00 0.86 H new ATOM 0 HD23 LEU A 79 -6.706 5.495 -5.300 1.00 0.86 H new ATOM 1284 N ILE A 80 -3.777 3.854 -2.245 1.00 0.82 N ATOM 1285 CA ILE A 80 -3.591 2.411 -2.350 1.00 0.98 C ATOM 1286 C ILE A 80 -3.096 1.897 -1.000 1.00 1.12 C ATOM 1287 O ILE A 80 -3.498 0.833 -0.536 1.00 1.19 O ATOM 1288 CB ILE A 80 -2.599 2.085 -3.489 1.00 1.18 C ATOM 1289 CG1 ILE A 80 -3.066 2.705 -4.821 1.00 1.28 C ATOM 1290 CG2 ILE A 80 -2.434 0.564 -3.633 1.00 1.40 C ATOM 1291 CD1 ILE A 80 -2.081 2.470 -5.972 1.00 1.71 C ATOM 0 H ILE A 80 -3.051 4.378 -2.734 1.00 0.82 H new ATOM 0 HA ILE A 80 -4.531 1.916 -2.595 1.00 0.98 H new ATOM 0 HB ILE A 80 -1.632 2.520 -3.234 1.00 1.18 H new ATOM 0 HG12 ILE A 80 -4.036 2.286 -5.090 1.00 1.28 H new ATOM 0 HG13 ILE A 80 -3.208 3.777 -4.686 1.00 1.28 H new ATOM 0 HG21 ILE A 80 -1.732 0.349 -4.439 1.00 1.40 H new ATOM 0 HG22 ILE A 80 -2.053 0.149 -2.700 1.00 1.40 H new ATOM 0 HG23 ILE A 80 -3.400 0.113 -3.863 1.00 1.40 H new ATOM 0 HD11 ILE A 80 -2.467 2.931 -6.881 1.00 1.71 H new ATOM 0 HD12 ILE A 80 -1.117 2.913 -5.722 1.00 1.71 H new ATOM 0 HD13 ILE A 80 -1.957 1.399 -6.132 1.00 1.71 H new ATOM 1303 N GLY A 81 -2.245 2.702 -0.360 1.00 1.26 N ATOM 1304 CA GLY A 81 -1.885 2.587 1.030 1.00 1.38 C ATOM 1305 C GLY A 81 -3.136 2.305 1.864 1.00 1.33 C ATOM 1306 O GLY A 81 -3.228 1.350 2.631 1.00 1.56 O ATOM 0 H GLY A 81 -1.776 3.479 -0.827 1.00 1.26 H new ATOM 0 HA2 GLY A 81 -1.159 1.785 1.163 1.00 1.38 H new ATOM 0 HA3 GLY A 81 -1.409 3.507 1.370 1.00 1.38 H new ATOM 1310 N GLU A 82 -4.063 3.250 1.731 1.00 1.12 N ATOM 1311 CA GLU A 82 -5.171 3.527 2.613 1.00 1.10 C ATOM 1312 C GLU A 82 -6.298 2.555 2.354 1.00 1.03 C ATOM 1313 O GLU A 82 -6.916 2.110 3.307 1.00 1.11 O ATOM 1314 CB GLU A 82 -5.595 4.986 2.413 1.00 0.98 C ATOM 1315 CG GLU A 82 -4.520 5.901 3.042 1.00 0.93 C ATOM 1316 CD GLU A 82 -4.725 6.064 4.545 1.00 1.49 C ATOM 1317 OE1 GLU A 82 -5.815 5.714 5.053 1.00 2.42 O ATOM 1318 OE2 GLU A 82 -3.755 6.395 5.261 1.00 2.38 O ATOM 0 H GLU A 82 -4.049 3.888 0.936 1.00 1.12 H new ATOM 0 HA GLU A 82 -4.880 3.394 3.655 1.00 1.10 H new ATOM 0 HB2 GLU A 82 -5.705 5.206 1.351 1.00 0.98 H new ATOM 0 HB3 GLU A 82 -6.564 5.166 2.878 1.00 0.98 H new ATOM 0 HG2 GLU A 82 -3.531 5.483 2.853 1.00 0.93 H new ATOM 0 HG3 GLU A 82 -4.550 6.880 2.563 1.00 0.93 H new ATOM 1325 N LEU A 83 -6.518 2.163 1.100 1.00 0.96 N ATOM 1326 CA LEU A 83 -7.422 1.083 0.733 1.00 0.95 C ATOM 1327 C LEU A 83 -7.311 -0.074 1.747 1.00 0.83 C ATOM 1328 O LEU A 83 -8.296 -0.478 2.371 1.00 0.86 O ATOM 1329 CB LEU A 83 -7.048 0.596 -0.681 1.00 1.23 C ATOM 1330 CG LEU A 83 -7.899 1.072 -1.874 1.00 1.02 C ATOM 1331 CD1 LEU A 83 -8.043 2.587 -1.997 1.00 1.89 C ATOM 1332 CD2 LEU A 83 -7.386 0.508 -3.200 1.00 2.45 C ATOM 0 H LEU A 83 -6.062 2.598 0.298 1.00 0.96 H new ATOM 0 HA LEU A 83 -8.452 1.440 0.741 1.00 0.95 H new ATOM 0 HB2 LEU A 83 -6.016 0.892 -0.871 1.00 1.23 H new ATOM 0 HB3 LEU A 83 -7.070 -0.494 -0.672 1.00 1.23 H new ATOM 0 HG LEU A 83 -8.892 0.678 -1.657 1.00 1.02 H new ATOM 0 HD11 LEU A 83 -8.658 2.825 -2.865 1.00 1.89 H new ATOM 0 HD12 LEU A 83 -8.516 2.982 -1.098 1.00 1.89 H new ATOM 0 HD13 LEU A 83 -7.058 3.038 -2.116 1.00 1.89 H new ATOM 0 HD21 LEU A 83 -8.014 0.868 -4.015 1.00 2.45 H new ATOM 0 HD22 LEU A 83 -6.359 0.835 -3.361 1.00 2.45 H new ATOM 0 HD23 LEU A 83 -7.420 -0.581 -3.170 1.00 2.45 H new ATOM 1344 N ALA A 84 -6.082 -0.567 1.940 1.00 0.81 N ATOM 1345 CA ALA A 84 -5.772 -1.680 2.832 1.00 0.85 C ATOM 1346 C ALA A 84 -6.128 -1.404 4.300 1.00 0.88 C ATOM 1347 O ALA A 84 -6.314 -2.340 5.073 1.00 1.04 O ATOM 1348 CB ALA A 84 -4.287 -2.028 2.691 1.00 0.90 C ATOM 0 H ALA A 84 -5.260 -0.192 1.467 1.00 0.81 H new ATOM 0 HA ALA A 84 -6.393 -2.525 2.533 1.00 0.85 H new ATOM 0 HB1 ALA A 84 -4.044 -2.859 3.353 1.00 0.90 H new ATOM 0 HB2 ALA A 84 -4.076 -2.312 1.660 1.00 0.90 H new ATOM 0 HB3 ALA A 84 -3.683 -1.161 2.959 1.00 0.90 H new ATOM 1354 N LYS A 85 -6.176 -0.134 4.707 1.00 0.85 N ATOM 1355 CA LYS A 85 -6.634 0.300 6.020 1.00 0.91 C ATOM 1356 C LYS A 85 -8.170 0.400 6.056 1.00 0.94 C ATOM 1357 O LYS A 85 -8.817 -0.134 6.959 1.00 1.06 O ATOM 1358 CB LYS A 85 -5.875 1.594 6.365 1.00 1.05 C ATOM 1359 CG LYS A 85 -6.233 2.249 7.704 1.00 0.92 C ATOM 1360 CD LYS A 85 -4.996 2.778 8.431 1.00 1.53 C ATOM 1361 CE LYS A 85 -4.130 3.727 7.591 1.00 1.14 C ATOM 1362 NZ LYS A 85 -4.763 5.014 7.245 1.00 1.41 N ATOM 0 H LYS A 85 -5.887 0.641 4.110 1.00 0.85 H new ATOM 0 HA LYS A 85 -6.407 -0.426 6.801 1.00 0.91 H new ATOM 0 HB2 LYS A 85 -4.807 1.376 6.364 1.00 1.05 H new ATOM 0 HB3 LYS A 85 -6.053 2.318 5.570 1.00 1.05 H new ATOM 0 HG2 LYS A 85 -6.931 3.069 7.532 1.00 0.92 H new ATOM 0 HG3 LYS A 85 -6.744 1.524 8.338 1.00 0.92 H new ATOM 0 HD2 LYS A 85 -5.314 3.298 9.334 1.00 1.53 H new ATOM 0 HD3 LYS A 85 -4.386 1.933 8.748 1.00 1.53 H new ATOM 0 HE2 LYS A 85 -3.207 3.929 8.135 1.00 1.14 H new ATOM 0 HE3 LYS A 85 -3.851 3.218 6.668 1.00 1.14 H new ATOM 0 HZ1 LYS A 85 -4.049 5.655 6.844 1.00 1.41 H new ATOM 0 HZ2 LYS A 85 -5.516 4.854 6.546 1.00 1.41 H new ATOM 0 HZ3 LYS A 85 -5.171 5.441 8.101 1.00 1.41 H new ATOM 1376 N GLU A 86 -8.757 1.092 5.080 1.00 0.94 N ATOM 1377 CA GLU A 86 -10.177 1.399 4.993 1.00 1.03 C ATOM 1378 C GLU A 86 -11.031 0.142 5.031 1.00 1.08 C ATOM 1379 O GLU A 86 -12.063 0.140 5.701 1.00 1.23 O ATOM 1380 CB GLU A 86 -10.466 2.195 3.713 1.00 1.07 C ATOM 1381 CG GLU A 86 -9.839 3.594 3.748 1.00 1.15 C ATOM 1382 CD GLU A 86 -10.665 4.588 4.557 1.00 1.58 C ATOM 1383 OE1 GLU A 86 -11.188 4.227 5.636 1.00 1.91 O ATOM 1384 OE2 GLU A 86 -10.915 5.705 4.056 1.00 2.76 O ATOM 0 H GLU A 86 -8.228 1.469 4.294 1.00 0.94 H new ATOM 0 HA GLU A 86 -10.439 2.002 5.863 1.00 1.03 H new ATOM 0 HB2 GLU A 86 -10.082 1.648 2.852 1.00 1.07 H new ATOM 0 HB3 GLU A 86 -11.544 2.285 3.578 1.00 1.07 H new ATOM 0 HG2 GLU A 86 -8.838 3.529 4.174 1.00 1.15 H new ATOM 0 HG3 GLU A 86 -9.729 3.964 2.729 1.00 1.15 H new ATOM 1391 N ILE A 87 -10.592 -0.924 4.350 1.00 1.05 N ATOM 1392 CA ILE A 87 -11.251 -2.223 4.373 1.00 1.16 C ATOM 1393 C ILE A 87 -11.668 -2.669 5.786 1.00 1.33 C ATOM 1394 O ILE A 87 -12.643 -3.405 5.929 1.00 1.50 O ATOM 1395 CB ILE A 87 -10.332 -3.251 3.699 1.00 1.05 C ATOM 1396 CG1 ILE A 87 -11.121 -4.529 3.385 1.00 1.11 C ATOM 1397 CG2 ILE A 87 -9.135 -3.567 4.602 1.00 1.18 C ATOM 1398 CD1 ILE A 87 -10.455 -5.257 2.229 1.00 0.87 C ATOM 0 H ILE A 87 -9.759 -0.902 3.762 1.00 1.05 H new ATOM 0 HA ILE A 87 -12.186 -2.142 3.818 1.00 1.16 H new ATOM 0 HB ILE A 87 -9.956 -2.832 2.765 1.00 1.05 H new ATOM 0 HG12 ILE A 87 -11.157 -5.173 4.263 1.00 1.11 H new ATOM 0 HG13 ILE A 87 -12.151 -4.281 3.129 1.00 1.11 H new ATOM 0 HG21 ILE A 87 -8.492 -4.297 4.111 1.00 1.18 H new ATOM 0 HG22 ILE A 87 -8.570 -2.654 4.790 1.00 1.18 H new ATOM 0 HG23 ILE A 87 -9.491 -3.975 5.548 1.00 1.18 H new ATOM 0 HD11 ILE A 87 -11.012 -6.166 2.002 1.00 0.87 H new ATOM 0 HD12 ILE A 87 -10.442 -4.611 1.351 1.00 0.87 H new ATOM 0 HD13 ILE A 87 -9.433 -5.517 2.503 1.00 0.87 H new ATOM 1410 N ARG A 88 -10.937 -2.231 6.821 1.00 1.42 N ATOM 1411 CA ARG A 88 -11.362 -2.340 8.210 1.00 1.84 C ATOM 1412 C ARG A 88 -11.890 -0.986 8.699 1.00 2.02 C ATOM 1413 O ARG A 88 -13.069 -0.853 9.041 1.00 2.81 O ATOM 1414 CB ARG A 88 -10.253 -2.957 9.092 1.00 2.05 C ATOM 1415 CG ARG A 88 -8.796 -2.586 8.759 1.00 2.36 C ATOM 1416 CD ARG A 88 -7.797 -3.508 9.480 1.00 2.10 C ATOM 1417 NE ARG A 88 -7.564 -3.103 10.878 1.00 2.68 N ATOM 1418 CZ ARG A 88 -7.059 -3.885 11.848 1.00 3.25 C ATOM 1419 NH1 ARG A 88 -6.905 -5.200 11.685 1.00 3.60 N ATOM 1420 NH2 ARG A 88 -6.689 -3.370 13.018 1.00 4.43 N ATOM 0 H ARG A 88 -10.025 -1.787 6.708 1.00 1.42 H new ATOM 0 HA ARG A 88 -12.194 -3.039 8.290 1.00 1.84 H new ATOM 0 HB2 ARG A 88 -10.446 -2.670 10.126 1.00 2.05 H new ATOM 0 HB3 ARG A 88 -10.345 -4.042 9.040 1.00 2.05 H new ATOM 0 HG2 ARG A 88 -8.640 -2.652 7.682 1.00 2.36 H new ATOM 0 HG3 ARG A 88 -8.609 -1.551 9.046 1.00 2.36 H new ATOM 0 HD2 ARG A 88 -8.171 -4.531 9.459 1.00 2.10 H new ATOM 0 HD3 ARG A 88 -6.850 -3.504 8.941 1.00 2.10 H new ATOM 0 HE ARG A 88 -7.807 -2.145 11.132 1.00 2.68 H new ATOM 0 HH11 ARG A 88 -7.173 -5.640 10.805 1.00 3.60 H new ATOM 0 HH12 ARG A 88 -6.519 -5.766 12.441 1.00 3.60 H new ATOM 0 HH21 ARG A 88 -6.787 -2.369 13.188 1.00 4.43 H new ATOM 0 HH22 ARG A 88 -6.308 -3.976 13.744 1.00 4.43 H new ATOM 1434 N LYS A 89 -11.018 0.028 8.725 1.00 1.50 N ATOM 1435 CA LYS A 89 -11.256 1.265 9.457 1.00 1.55 C ATOM 1436 C LYS A 89 -12.549 1.984 9.057 1.00 2.03 C ATOM 1437 O LYS A 89 -13.117 2.690 9.888 1.00 2.54 O ATOM 1438 CB LYS A 89 -10.042 2.205 9.342 1.00 1.32 C ATOM 1439 CG LYS A 89 -10.203 3.397 10.300 1.00 1.45 C ATOM 1440 CD LYS A 89 -8.972 4.305 10.324 1.00 1.55 C ATOM 1441 CE LYS A 89 -9.263 5.483 11.271 1.00 2.24 C ATOM 1442 NZ LYS A 89 -8.168 6.474 11.318 1.00 3.38 N ATOM 0 H LYS A 89 -10.124 0.008 8.234 1.00 1.50 H new ATOM 0 HA LYS A 89 -11.391 0.978 10.500 1.00 1.55 H new ATOM 0 HB2 LYS A 89 -9.127 1.661 9.577 1.00 1.32 H new ATOM 0 HB3 LYS A 89 -9.945 2.563 8.317 1.00 1.32 H new ATOM 0 HG2 LYS A 89 -11.074 3.981 10.004 1.00 1.45 H new ATOM 0 HG3 LYS A 89 -10.395 3.026 11.307 1.00 1.45 H new ATOM 0 HD2 LYS A 89 -8.097 3.751 10.664 1.00 1.55 H new ATOM 0 HD3 LYS A 89 -8.749 4.669 9.321 1.00 1.55 H new ATOM 0 HE2 LYS A 89 -10.180 5.979 10.953 1.00 2.24 H new ATOM 0 HE3 LYS A 89 -9.440 5.099 12.275 1.00 2.24 H new ATOM 0 HZ1 LYS A 89 -8.423 7.242 11.972 1.00 3.38 H new ATOM 0 HZ2 LYS A 89 -7.296 6.013 11.648 1.00 3.38 H new ATOM 0 HZ3 LYS A 89 -8.013 6.866 10.367 1.00 3.38 H new ATOM 1456 N LYS A 90 -13.003 1.854 7.806 1.00 2.73 N ATOM 1457 CA LYS A 90 -14.124 2.634 7.294 1.00 3.42 C ATOM 1458 C LYS A 90 -15.365 2.543 8.193 1.00 3.04 C ATOM 1459 O LYS A 90 -16.123 3.510 8.270 1.00 3.60 O ATOM 1460 CB LYS A 90 -14.409 2.227 5.840 1.00 4.59 C ATOM 1461 CG LYS A 90 -15.576 2.971 5.170 1.00 5.70 C ATOM 1462 CD LYS A 90 -15.467 4.505 5.164 1.00 7.09 C ATOM 1463 CE LYS A 90 -14.284 5.026 4.328 1.00 8.03 C ATOM 1464 NZ LYS A 90 -13.248 5.691 5.140 1.00 8.88 N ATOM 0 H LYS A 90 -12.603 1.207 7.126 1.00 2.73 H new ATOM 0 HA LYS A 90 -13.847 3.688 7.306 1.00 3.42 H new ATOM 0 HB2 LYS A 90 -13.507 2.391 5.250 1.00 4.59 H new ATOM 0 HB3 LYS A 90 -14.617 1.157 5.813 1.00 4.59 H new ATOM 0 HG2 LYS A 90 -15.660 2.626 4.139 1.00 5.70 H new ATOM 0 HG3 LYS A 90 -16.500 2.692 5.676 1.00 5.70 H new ATOM 0 HD2 LYS A 90 -16.393 4.927 4.774 1.00 7.09 H new ATOM 0 HD3 LYS A 90 -15.363 4.859 6.190 1.00 7.09 H new ATOM 0 HE2 LYS A 90 -13.834 4.193 3.788 1.00 8.03 H new ATOM 0 HE3 LYS A 90 -14.656 5.727 3.581 1.00 8.03 H new ATOM 0 HZ1 LYS A 90 -12.558 6.151 4.513 1.00 8.88 H new ATOM 0 HZ2 LYS A 90 -13.692 6.406 5.751 1.00 8.88 H new ATOM 0 HZ3 LYS A 90 -12.763 4.985 5.730 1.00 8.88 H new ATOM 1478 N LYS A 91 -15.578 1.407 8.870 1.00 2.86 N ATOM 1479 CA LYS A 91 -16.643 1.267 9.863 1.00 3.39 C ATOM 1480 C LYS A 91 -16.205 0.518 11.124 1.00 3.41 C ATOM 1481 O LYS A 91 -16.657 0.882 12.206 1.00 4.01 O ATOM 1482 CB LYS A 91 -17.903 0.643 9.233 1.00 4.60 C ATOM 1483 CG LYS A 91 -18.860 1.692 8.641 1.00 5.71 C ATOM 1484 CD LYS A 91 -19.613 2.476 9.734 1.00 6.38 C ATOM 1485 CE LYS A 91 -20.388 3.656 9.131 1.00 7.37 C ATOM 1486 NZ LYS A 91 -21.041 4.480 10.171 1.00 8.30 N ATOM 0 H LYS A 91 -15.018 0.564 8.743 1.00 2.86 H new ATOM 0 HA LYS A 91 -16.891 2.275 10.196 1.00 3.39 H new ATOM 0 HB2 LYS A 91 -17.604 -0.052 8.449 1.00 4.60 H new ATOM 0 HB3 LYS A 91 -18.431 0.062 9.989 1.00 4.60 H new ATOM 0 HG2 LYS A 91 -18.295 2.388 8.021 1.00 5.71 H new ATOM 0 HG3 LYS A 91 -19.580 1.197 7.989 1.00 5.71 H new ATOM 0 HD2 LYS A 91 -20.303 1.811 10.253 1.00 6.38 H new ATOM 0 HD3 LYS A 91 -18.904 2.843 10.476 1.00 6.38 H new ATOM 0 HE2 LYS A 91 -19.707 4.278 8.550 1.00 7.37 H new ATOM 0 HE3 LYS A 91 -21.142 3.279 8.440 1.00 7.37 H new ATOM 0 HZ1 LYS A 91 -21.553 5.265 9.721 1.00 8.30 H new ATOM 0 HZ2 LYS A 91 -21.710 3.893 10.709 1.00 8.30 H new ATOM 0 HZ3 LYS A 91 -20.319 4.861 10.815 1.00 8.30 H new ATOM 1500 N ASP A 92 -15.381 -0.525 10.981 1.00 3.45 N ATOM 1501 CA ASP A 92 -14.970 -1.465 12.022 1.00 4.15 C ATOM 1502 C ASP A 92 -15.836 -1.497 13.295 1.00 4.93 C ATOM 1503 O ASP A 92 -15.390 -1.145 14.386 1.00 5.11 O ATOM 1504 CB ASP A 92 -13.469 -1.325 12.315 1.00 3.98 C ATOM 1505 CG ASP A 92 -12.872 -2.706 12.469 1.00 4.91 C ATOM 1506 OD1 ASP A 92 -12.616 -3.352 11.429 1.00 5.38 O ATOM 1507 OD2 ASP A 92 -12.769 -3.214 13.605 1.00 5.88 O ATOM 0 H ASP A 92 -14.959 -0.747 10.079 1.00 3.45 H new ATOM 0 HA ASP A 92 -15.155 -2.453 11.600 1.00 4.15 H new ATOM 0 HB2 ASP A 92 -12.975 -0.788 11.505 1.00 3.98 H new ATOM 0 HB3 ASP A 92 -13.314 -0.743 13.224 1.00 3.98 H new ATOM 1512 N LEU A 93 -17.075 -1.980 13.156 1.00 5.83 N ATOM 1513 CA LEU A 93 -17.956 -2.294 14.283 1.00 6.91 C ATOM 1514 C LEU A 93 -18.683 -3.615 14.045 1.00 7.71 C ATOM 1515 O LEU A 93 -18.699 -4.473 14.924 1.00 8.61 O ATOM 1516 CB LEU A 93 -18.899 -1.131 14.651 1.00 7.56 C ATOM 1517 CG LEU A 93 -20.142 -0.900 13.769 1.00 8.50 C ATOM 1518 CD1 LEU A 93 -21.066 0.097 14.480 1.00 9.19 C ATOM 1519 CD2 LEU A 93 -19.783 -0.328 12.397 1.00 8.85 C ATOM 0 H LEU A 93 -17.498 -2.166 12.247 1.00 5.83 H new ATOM 0 HA LEU A 93 -17.331 -2.427 15.166 1.00 6.91 H new ATOM 0 HB2 LEU A 93 -19.240 -1.289 15.674 1.00 7.56 H new ATOM 0 HB3 LEU A 93 -18.313 -0.212 14.649 1.00 7.56 H new ATOM 0 HG LEU A 93 -20.626 -1.865 13.616 1.00 8.50 H new ATOM 0 HD11 LEU A 93 -21.951 0.272 13.869 1.00 9.19 H new ATOM 0 HD12 LEU A 93 -21.366 -0.310 15.446 1.00 9.19 H new ATOM 0 HD13 LEU A 93 -20.538 1.038 14.631 1.00 9.19 H new ATOM 0 HD21 LEU A 93 -20.692 -0.183 11.814 1.00 8.85 H new ATOM 0 HD22 LEU A 93 -19.277 0.629 12.523 1.00 8.85 H new ATOM 0 HD23 LEU A 93 -19.124 -1.021 11.875 1.00 8.85 H new ATOM 1531 N LYS A 94 -19.241 -3.785 12.838 1.00 7.64 N ATOM 1532 CA LYS A 94 -19.953 -4.984 12.401 1.00 8.63 C ATOM 1533 C LYS A 94 -19.264 -6.257 12.900 1.00 8.83 C ATOM 1534 O LYS A 94 -19.855 -7.053 13.624 1.00 9.35 O ATOM 1535 CB LYS A 94 -19.994 -4.999 10.867 1.00 9.60 C ATOM 1536 CG LYS A 94 -20.970 -3.996 10.245 1.00 10.13 C ATOM 1537 CD LYS A 94 -22.429 -4.398 10.512 1.00 11.40 C ATOM 1538 CE LYS A 94 -23.341 -4.032 9.330 1.00 12.62 C ATOM 1539 NZ LYS A 94 -23.040 -4.827 8.111 1.00 14.08 N ATOM 0 H LYS A 94 -19.205 -3.064 12.118 1.00 7.64 H new ATOM 0 HA LYS A 94 -20.961 -4.961 12.816 1.00 8.63 H new ATOM 0 HB2 LYS A 94 -18.993 -4.794 10.488 1.00 9.60 H new ATOM 0 HB3 LYS A 94 -20.262 -6.001 10.534 1.00 9.60 H new ATOM 0 HG2 LYS A 94 -20.784 -3.003 10.653 1.00 10.13 H new ATOM 0 HG3 LYS A 94 -20.798 -3.936 9.170 1.00 10.13 H new ATOM 0 HD2 LYS A 94 -22.484 -5.471 10.696 1.00 11.40 H new ATOM 0 HD3 LYS A 94 -22.785 -3.901 11.415 1.00 11.40 H new ATOM 0 HE2 LYS A 94 -24.381 -4.190 9.615 1.00 12.62 H new ATOM 0 HE3 LYS A 94 -23.230 -2.971 9.105 1.00 12.62 H new ATOM 0 HZ1 LYS A 94 -23.871 -4.832 7.486 1.00 14.08 H new ATOM 0 HZ2 LYS A 94 -22.233 -4.403 7.611 1.00 14.08 H new ATOM 0 HZ3 LYS A 94 -22.805 -5.803 8.382 1.00 14.08 H new ATOM 1553 N ILE A 95 -17.998 -6.419 12.514 1.00 9.01 N ATOM 1554 CA ILE A 95 -17.122 -7.498 12.947 1.00 9.75 C ATOM 1555 C ILE A 95 -15.999 -6.887 13.795 1.00 9.26 C ATOM 1556 O ILE A 95 -14.795 -7.037 13.548 1.00 10.03 O ATOM 1557 CB ILE A 95 -16.713 -8.371 11.741 1.00 11.04 C ATOM 1558 CG1 ILE A 95 -16.311 -7.538 10.510 1.00 11.34 C ATOM 1559 CG2 ILE A 95 -17.901 -9.286 11.393 1.00 11.44 C ATOM 1560 CD1 ILE A 95 -15.982 -8.404 9.290 1.00 12.80 C ATOM 0 H ILE A 95 -17.541 -5.776 11.867 1.00 9.01 H new ATOM 0 HA ILE A 95 -17.615 -8.215 13.603 1.00 9.75 H new ATOM 0 HB ILE A 95 -15.833 -8.952 12.018 1.00 11.04 H new ATOM 0 HG12 ILE A 95 -17.123 -6.856 10.258 1.00 11.34 H new ATOM 0 HG13 ILE A 95 -15.445 -6.925 10.759 1.00 11.34 H new ATOM 0 HG21 ILE A 95 -17.639 -9.915 10.542 1.00 11.44 H new ATOM 0 HG22 ILE A 95 -18.139 -9.916 12.250 1.00 11.44 H new ATOM 0 HG23 ILE A 95 -18.768 -8.676 11.139 1.00 11.44 H new ATOM 0 HD11 ILE A 95 -15.706 -7.763 8.453 1.00 12.80 H new ATOM 0 HD12 ILE A 95 -15.151 -9.068 9.529 1.00 12.80 H new ATOM 0 HD13 ILE A 95 -16.855 -8.998 9.019 1.00 12.80 H new ATOM 1572 N ARG A 96 -16.457 -6.174 14.826 1.00 8.60 N ATOM 1573 CA ARG A 96 -15.730 -5.532 15.905 1.00 9.01 C ATOM 1574 C ARG A 96 -15.107 -6.501 16.901 1.00 10.02 C ATOM 1575 O ARG A 96 -15.350 -6.332 18.098 1.00 10.81 O ATOM 1576 CB ARG A 96 -14.729 -4.482 15.423 1.00 9.52 C ATOM 1577 CG ARG A 96 -14.048 -3.727 16.577 1.00 10.87 C ATOM 1578 CD ARG A 96 -15.028 -2.943 17.465 1.00 11.16 C ATOM 1579 NE ARG A 96 -14.373 -2.452 18.687 1.00 12.81 N ATOM 1580 CZ ARG A 96 -14.208 -3.160 19.819 1.00 14.31 C ATOM 1581 NH1 ARG A 96 -14.552 -4.453 19.882 1.00 14.47 N ATOM 1582 NH2 ARG A 96 -13.695 -2.561 20.901 1.00 15.87 N ATOM 0 H ARG A 96 -17.460 -6.020 14.929 1.00 8.60 H new ATOM 0 HA ARG A 96 -16.500 -4.996 16.459 1.00 9.01 H new ATOM 0 HB2 ARG A 96 -13.967 -4.967 14.814 1.00 9.52 H new ATOM 0 HB3 ARG A 96 -15.242 -3.766 14.781 1.00 9.52 H new ATOM 0 HG2 ARG A 96 -13.503 -4.441 17.195 1.00 10.87 H new ATOM 0 HG3 ARG A 96 -13.313 -3.036 16.164 1.00 10.87 H new ATOM 0 HD2 ARG A 96 -15.434 -2.101 16.905 1.00 11.16 H new ATOM 0 HD3 ARG A 96 -15.869 -3.582 17.733 1.00 11.16 H new ATOM 0 HE ARG A 96 -14.015 -1.497 18.675 1.00 12.81 H new ATOM 0 HH11 ARG A 96 -14.946 -4.916 19.063 1.00 14.47 H new ATOM 0 HH12 ARG A 96 -14.420 -4.974 20.749 1.00 14.47 H new ATOM 0 HH21 ARG A 96 -13.433 -1.576 20.863 1.00 15.87 H new ATOM 0 HH22 ARG A 96 -13.566 -3.090 21.764 1.00 15.87 H new ATOM 1596 N LYS A 97 -14.240 -7.429 16.469 1.00 10.28 N ATOM 1597 CA LYS A 97 -13.741 -8.462 17.379 1.00 11.45 C ATOM 1598 C LYS A 97 -12.636 -9.353 16.793 1.00 11.80 C ATOM 1599 O LYS A 97 -11.641 -9.564 17.482 1.00 12.70 O ATOM 1600 CB LYS A 97 -14.912 -9.352 17.862 1.00 11.83 C ATOM 1601 CG LYS A 97 -14.553 -10.133 19.137 1.00 13.32 C ATOM 1602 CD LYS A 97 -15.727 -10.971 19.673 1.00 13.93 C ATOM 1603 CE LYS A 97 -16.870 -10.104 20.233 1.00 14.10 C ATOM 1604 NZ LYS A 97 -17.922 -10.911 20.889 1.00 14.63 N ATOM 0 H LYS A 97 -13.878 -7.484 15.517 1.00 10.28 H new ATOM 0 HA LYS A 97 -13.287 -7.922 18.210 1.00 11.45 H new ATOM 0 HB2 LYS A 97 -15.786 -8.729 18.052 1.00 11.83 H new ATOM 0 HB3 LYS A 97 -15.185 -10.052 17.073 1.00 11.83 H new ATOM 0 HG2 LYS A 97 -13.708 -10.790 18.929 1.00 13.32 H new ATOM 0 HG3 LYS A 97 -14.230 -9.433 19.908 1.00 13.32 H new ATOM 0 HD2 LYS A 97 -16.114 -11.601 18.872 1.00 13.93 H new ATOM 0 HD3 LYS A 97 -15.365 -11.637 20.456 1.00 13.93 H new ATOM 0 HE2 LYS A 97 -16.463 -9.391 20.950 1.00 14.10 H new ATOM 0 HE3 LYS A 97 -17.313 -9.524 19.423 1.00 14.10 H new ATOM 0 HZ1 LYS A 97 -18.668 -10.282 21.249 1.00 14.63 H new ATOM 0 HZ2 LYS A 97 -18.331 -11.574 20.200 1.00 14.63 H new ATOM 0 HZ3 LYS A 97 -17.508 -11.445 21.680 1.00 14.63 H new ATOM 1618 N LYS A 98 -12.815 -9.935 15.603 1.00 11.40 N ATOM 1619 CA LYS A 98 -11.945 -11.018 15.135 1.00 12.04 C ATOM 1620 C LYS A 98 -10.776 -10.550 14.261 1.00 12.20 C ATOM 1621 O LYS A 98 -10.741 -9.377 13.823 1.00 11.87 O ATOM 1622 CB LYS A 98 -12.773 -12.122 14.450 1.00 12.04 C ATOM 1623 CG LYS A 98 -12.919 -13.353 15.356 1.00 13.05 C ATOM 1624 CD LYS A 98 -11.604 -14.156 15.402 1.00 14.08 C ATOM 1625 CE LYS A 98 -11.568 -15.185 16.542 1.00 15.12 C ATOM 1626 NZ LYS A 98 -12.596 -16.236 16.396 1.00 15.01 N ATOM 1627 OXT LYS A 98 -9.852 -11.369 14.050 1.00 12.98 O ATOM 0 H LYS A 98 -13.552 -9.675 14.948 1.00 11.40 H new ATOM 0 HA LYS A 98 -11.474 -11.437 16.024 1.00 12.04 H new ATOM 0 HB2 LYS A 98 -13.760 -11.735 14.197 1.00 12.04 H new ATOM 0 HB3 LYS A 98 -12.294 -12.411 13.514 1.00 12.04 H new ATOM 0 HG2 LYS A 98 -13.194 -13.039 16.363 1.00 13.05 H new ATOM 0 HG3 LYS A 98 -13.725 -13.987 14.988 1.00 13.05 H new ATOM 0 HD2 LYS A 98 -11.466 -14.671 14.451 1.00 14.08 H new ATOM 0 HD3 LYS A 98 -10.768 -13.466 15.516 1.00 14.08 H new ATOM 0 HE2 LYS A 98 -10.582 -15.649 16.576 1.00 15.12 H new ATOM 0 HE3 LYS A 98 -11.711 -14.672 17.493 1.00 15.12 H new ATOM 0 HZ1 LYS A 98 -12.526 -16.903 17.191 1.00 15.01 H new ATOM 0 HZ2 LYS A 98 -13.540 -15.800 16.391 1.00 15.01 H new ATOM 0 HZ3 LYS A 98 -12.446 -16.747 15.502 1.00 15.01 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -12.607 -5.611 12.659 1.00 4.54 N ATOM 1643 CA MET B 1 -11.412 -6.327 12.187 1.00 5.26 C ATOM 1644 C MET B 1 -11.424 -6.383 10.644 1.00 5.00 C ATOM 1645 O MET B 1 -10.363 -6.368 10.021 1.00 5.93 O ATOM 1646 CB MET B 1 -10.099 -5.673 12.686 1.00 6.31 C ATOM 1647 CG MET B 1 -10.116 -4.965 14.053 1.00 6.54 C ATOM 1648 SD MET B 1 -10.970 -5.774 15.430 1.00 6.20 S ATOM 1649 CE MET B 1 -9.735 -7.015 15.854 1.00 7.57 C ATOM 0 H1 MET B 1 -12.354 -5.011 13.470 1.00 4.54 H new ATOM 0 H2 MET B 1 -12.982 -5.017 11.892 1.00 4.54 H new ATOM 0 H3 MET B 1 -13.331 -6.298 12.950 1.00 4.54 H new ATOM 0 HA MET B 1 -11.443 -7.336 12.599 1.00 5.26 H new ATOM 0 HB2 MET B 1 -9.333 -6.448 12.721 1.00 6.31 H new ATOM 0 HB3 MET B 1 -9.783 -4.946 11.938 1.00 6.31 H new ATOM 0 HG2 MET B 1 -9.082 -4.800 14.355 1.00 6.54 H new ATOM 0 HG3 MET B 1 -10.568 -3.983 13.913 1.00 6.54 H new ATOM 0 HE1 MET B 1 -10.210 -7.994 15.919 1.00 7.57 H new ATOM 0 HE2 MET B 1 -8.963 -7.037 15.085 1.00 7.57 H new ATOM 0 HE3 MET B 1 -9.284 -6.766 16.814 1.00 7.57 H new ATOM 1661 N ALA B 2 -12.619 -6.364 10.035 1.00 4.17 N ATOM 1662 CA ALA B 2 -12.835 -6.000 8.634 1.00 4.01 C ATOM 1663 C ALA B 2 -13.027 -7.226 7.742 1.00 3.68 C ATOM 1664 O ALA B 2 -13.018 -8.349 8.242 1.00 4.38 O ATOM 1665 CB ALA B 2 -14.051 -5.064 8.562 1.00 4.50 C ATOM 0 H ALA B 2 -13.482 -6.609 10.520 1.00 4.17 H new ATOM 0 HA ALA B 2 -11.948 -5.491 8.257 1.00 4.01 H new ATOM 0 HB1 ALA B 2 -14.230 -4.780 7.525 1.00 4.50 H new ATOM 0 HB2 ALA B 2 -14.929 -5.577 8.955 1.00 4.50 H new ATOM 0 HB3 ALA B 2 -13.858 -4.170 9.155 1.00 4.50 H new ATOM 1671 N ALA B 3 -13.199 -6.974 6.438 1.00 3.46 N ATOM 1672 CA ALA B 3 -13.456 -7.937 5.365 1.00 3.42 C ATOM 1673 C ALA B 3 -14.960 -8.200 5.186 1.00 2.50 C ATOM 1674 O ALA B 3 -15.528 -9.052 5.867 1.00 2.93 O ATOM 1675 CB ALA B 3 -12.649 -9.235 5.519 1.00 4.61 C ATOM 0 H ALA B 3 -13.159 -6.019 6.081 1.00 3.46 H new ATOM 0 HA ALA B 3 -13.099 -7.476 4.444 1.00 3.42 H new ATOM 0 HB1 ALA B 3 -12.882 -9.908 4.694 1.00 4.61 H new ATOM 0 HB2 ALA B 3 -11.584 -9.004 5.509 1.00 4.61 H new ATOM 0 HB3 ALA B 3 -12.908 -9.714 6.463 1.00 4.61 H new ATOM 1681 N GLU B 4 -15.591 -7.478 4.251 1.00 2.25 N ATOM 1682 CA GLU B 4 -16.915 -7.747 3.693 1.00 2.36 C ATOM 1683 C GLU B 4 -16.733 -7.624 2.162 1.00 2.21 C ATOM 1684 O GLU B 4 -15.844 -6.878 1.751 1.00 2.30 O ATOM 1685 CB GLU B 4 -17.963 -6.759 4.269 1.00 3.40 C ATOM 1686 CG GLU B 4 -18.187 -6.929 5.790 1.00 4.69 C ATOM 1687 CD GLU B 4 -19.362 -6.119 6.364 1.00 5.91 C ATOM 1688 OE1 GLU B 4 -20.487 -6.237 5.829 1.00 6.27 O ATOM 1689 OE2 GLU B 4 -19.155 -5.414 7.379 1.00 6.82 O ATOM 0 H GLU B 4 -15.165 -6.646 3.844 1.00 2.25 H new ATOM 0 HA GLU B 4 -17.296 -8.735 3.953 1.00 2.36 H new ATOM 0 HB2 GLU B 4 -17.640 -5.738 4.068 1.00 3.40 H new ATOM 0 HB3 GLU B 4 -18.911 -6.901 3.750 1.00 3.40 H new ATOM 0 HG2 GLU B 4 -18.354 -7.985 6.003 1.00 4.69 H new ATOM 0 HG3 GLU B 4 -17.275 -6.639 6.312 1.00 4.69 H new ATOM 1696 N PRO B 5 -17.476 -8.377 1.325 1.00 2.22 N ATOM 1697 CA PRO B 5 -17.204 -8.512 -0.110 1.00 2.15 C ATOM 1698 C PRO B 5 -17.287 -7.184 -0.879 1.00 1.99 C ATOM 1699 O PRO B 5 -17.908 -6.229 -0.413 1.00 2.23 O ATOM 1700 CB PRO B 5 -18.188 -9.565 -0.635 1.00 2.53 C ATOM 1701 CG PRO B 5 -19.303 -9.572 0.410 1.00 2.78 C ATOM 1702 CD PRO B 5 -18.562 -9.259 1.710 1.00 2.51 C ATOM 0 HA PRO B 5 -16.173 -8.828 -0.269 1.00 2.15 H new ATOM 0 HB2 PRO B 5 -18.567 -9.302 -1.623 1.00 2.53 H new ATOM 0 HB3 PRO B 5 -17.717 -10.544 -0.724 1.00 2.53 H new ATOM 0 HG2 PRO B 5 -20.066 -8.825 0.191 1.00 2.78 H new ATOM 0 HG3 PRO B 5 -19.807 -10.538 0.456 1.00 2.78 H new ATOM 0 HD2 PRO B 5 -19.221 -8.779 2.434 1.00 2.51 H new ATOM 0 HD3 PRO B 5 -18.184 -10.169 2.177 1.00 2.51 H new ATOM 1710 N LEU B 6 -16.615 -7.114 -2.038 1.00 1.81 N ATOM 1711 CA LEU B 6 -16.040 -5.869 -2.541 1.00 1.67 C ATOM 1712 C LEU B 6 -15.576 -6.011 -4.012 1.00 1.44 C ATOM 1713 O LEU B 6 -15.655 -7.113 -4.553 1.00 1.59 O ATOM 1714 CB LEU B 6 -14.927 -5.462 -1.558 1.00 1.83 C ATOM 1715 CG LEU B 6 -13.991 -6.590 -1.073 1.00 1.44 C ATOM 1716 CD1 LEU B 6 -13.275 -7.307 -2.220 1.00 2.66 C ATOM 1717 CD2 LEU B 6 -12.961 -6.035 -0.087 1.00 2.52 C ATOM 0 H LEU B 6 -16.458 -7.918 -2.646 1.00 1.81 H new ATOM 0 HA LEU B 6 -16.780 -5.069 -2.580 1.00 1.67 H new ATOM 0 HB2 LEU B 6 -14.317 -4.693 -2.032 1.00 1.83 H new ATOM 0 HB3 LEU B 6 -15.393 -5.006 -0.685 1.00 1.83 H new ATOM 0 HG LEU B 6 -14.622 -7.328 -0.578 1.00 1.44 H new ATOM 0 HD11 LEU B 6 -12.632 -8.089 -1.815 1.00 2.66 H new ATOM 0 HD12 LEU B 6 -14.013 -7.753 -2.887 1.00 2.66 H new ATOM 0 HD13 LEU B 6 -12.670 -6.591 -2.775 1.00 2.66 H new ATOM 0 HD21 LEU B 6 -12.307 -6.840 0.248 1.00 2.52 H new ATOM 0 HD22 LEU B 6 -12.366 -5.264 -0.577 1.00 2.52 H new ATOM 0 HD23 LEU B 6 -13.475 -5.604 0.772 1.00 2.52 H new ATOM 1729 N THR B 7 -15.160 -4.919 -4.682 1.00 1.44 N ATOM 1730 CA THR B 7 -14.823 -4.902 -6.120 1.00 1.31 C ATOM 1731 C THR B 7 -13.345 -5.201 -6.408 1.00 1.38 C ATOM 1732 O THR B 7 -12.580 -5.440 -5.489 1.00 2.19 O ATOM 1733 CB THR B 7 -15.220 -3.562 -6.762 1.00 1.33 C ATOM 1734 OG1 THR B 7 -15.268 -3.700 -8.170 1.00 1.43 O ATOM 1735 CG2 THR B 7 -14.238 -2.430 -6.437 1.00 1.39 C ATOM 0 H THR B 7 -15.047 -4.010 -4.233 1.00 1.44 H new ATOM 0 HA THR B 7 -15.402 -5.710 -6.568 1.00 1.31 H new ATOM 0 HB THR B 7 -16.195 -3.302 -6.350 1.00 1.33 H new ATOM 0 HG1 THR B 7 -15.523 -2.844 -8.574 1.00 1.43 H new ATOM 0 HG21 THR B 7 -14.571 -1.510 -6.918 1.00 1.39 H new ATOM 0 HG22 THR B 7 -14.198 -2.282 -5.358 1.00 1.39 H new ATOM 0 HG23 THR B 7 -13.246 -2.692 -6.804 1.00 1.39 H new ATOM 1743 N GLU B 8 -12.930 -5.104 -7.681 1.00 1.27 N ATOM 1744 CA GLU B 8 -11.621 -5.476 -8.217 1.00 1.22 C ATOM 1745 C GLU B 8 -10.461 -4.949 -7.363 1.00 1.10 C ATOM 1746 O GLU B 8 -9.788 -5.706 -6.664 1.00 1.15 O ATOM 1747 CB GLU B 8 -11.531 -4.984 -9.669 1.00 1.34 C ATOM 1748 CG GLU B 8 -10.197 -5.354 -10.326 1.00 1.46 C ATOM 1749 CD GLU B 8 -10.119 -4.793 -11.740 1.00 1.75 C ATOM 1750 OE1 GLU B 8 -9.757 -3.599 -11.850 1.00 3.22 O ATOM 1751 OE2 GLU B 8 -10.461 -5.547 -12.675 1.00 2.03 O ATOM 0 H GLU B 8 -13.545 -4.738 -8.408 1.00 1.27 H new ATOM 0 HA GLU B 8 -11.526 -6.562 -8.191 1.00 1.22 H new ATOM 0 HB2 GLU B 8 -12.350 -5.413 -10.247 1.00 1.34 H new ATOM 0 HB3 GLU B 8 -11.657 -3.902 -9.692 1.00 1.34 H new ATOM 0 HG2 GLU B 8 -9.372 -4.965 -9.729 1.00 1.46 H new ATOM 0 HG3 GLU B 8 -10.088 -6.438 -10.353 1.00 1.46 H new ATOM 1758 N LEU B 9 -10.190 -3.644 -7.429 1.00 0.97 N ATOM 1759 CA LEU B 9 -9.120 -3.042 -6.649 1.00 0.89 C ATOM 1760 C LEU B 9 -9.288 -3.335 -5.155 1.00 0.89 C ATOM 1761 O LEU B 9 -8.299 -3.604 -4.472 1.00 0.91 O ATOM 1762 CB LEU B 9 -9.031 -1.542 -6.961 1.00 0.83 C ATOM 1763 CG LEU B 9 -8.273 -1.323 -8.283 1.00 0.97 C ATOM 1764 CD1 LEU B 9 -8.507 0.087 -8.826 1.00 1.06 C ATOM 1765 CD2 LEU B 9 -6.754 -1.463 -8.098 1.00 1.22 C ATOM 0 H LEU B 9 -10.701 -2.987 -8.018 1.00 0.97 H new ATOM 0 HA LEU B 9 -8.169 -3.492 -6.934 1.00 0.89 H new ATOM 0 HB2 LEU B 9 -10.032 -1.117 -7.032 1.00 0.83 H new ATOM 0 HB3 LEU B 9 -8.521 -1.023 -6.149 1.00 0.83 H new ATOM 0 HG LEU B 9 -8.651 -2.081 -8.969 1.00 0.97 H new ATOM 0 HD11 LEU B 9 -7.959 0.213 -9.760 1.00 1.06 H new ATOM 0 HD12 LEU B 9 -9.572 0.235 -9.007 1.00 1.06 H new ATOM 0 HD13 LEU B 9 -8.157 0.820 -8.099 1.00 1.06 H new ATOM 0 HD21 LEU B 9 -6.255 -1.302 -9.053 1.00 1.22 H new ATOM 0 HD22 LEU B 9 -6.406 -0.724 -7.377 1.00 1.22 H new ATOM 0 HD23 LEU B 9 -6.523 -2.463 -7.732 1.00 1.22 H new ATOM 1777 N GLU B 10 -10.530 -3.336 -4.663 1.00 0.90 N ATOM 1778 CA GLU B 10 -10.835 -3.731 -3.300 1.00 0.93 C ATOM 1779 C GLU B 10 -10.390 -5.201 -3.031 1.00 1.05 C ATOM 1780 O GLU B 10 -9.867 -5.490 -1.954 1.00 1.38 O ATOM 1781 CB GLU B 10 -12.309 -3.410 -2.970 1.00 1.10 C ATOM 1782 CG GLU B 10 -12.757 -1.940 -3.183 1.00 1.90 C ATOM 1783 CD GLU B 10 -14.268 -1.699 -2.969 1.00 2.58 C ATOM 1784 OE1 GLU B 10 -15.032 -2.673 -3.142 1.00 2.87 O ATOM 1785 OE2 GLU B 10 -14.672 -0.535 -2.724 1.00 3.69 O ATOM 0 H GLU B 10 -11.349 -3.061 -5.206 1.00 0.90 H new ATOM 0 HA GLU B 10 -10.250 -3.141 -2.595 1.00 0.93 H new ATOM 0 HB2 GLU B 10 -12.944 -4.053 -3.580 1.00 1.10 H new ATOM 0 HB3 GLU B 10 -12.492 -3.676 -1.929 1.00 1.10 H new ATOM 0 HG2 GLU B 10 -12.198 -1.300 -2.500 1.00 1.90 H new ATOM 0 HG3 GLU B 10 -12.492 -1.635 -4.195 1.00 1.90 H new ATOM 1792 N GLU B 11 -10.500 -6.128 -3.998 1.00 0.96 N ATOM 1793 CA GLU B 11 -9.954 -7.483 -3.886 1.00 0.95 C ATOM 1794 C GLU B 11 -8.434 -7.407 -3.841 1.00 0.95 C ATOM 1795 O GLU B 11 -7.787 -8.074 -3.038 1.00 0.98 O ATOM 1796 CB GLU B 11 -10.309 -8.410 -5.069 1.00 0.98 C ATOM 1797 CG GLU B 11 -11.767 -8.469 -5.530 1.00 2.05 C ATOM 1798 CD GLU B 11 -12.030 -9.739 -6.330 1.00 3.01 C ATOM 1799 OE1 GLU B 11 -11.276 -9.955 -7.304 1.00 3.69 O ATOM 1800 OE2 GLU B 11 -12.964 -10.477 -5.952 1.00 3.99 O ATOM 0 H GLU B 11 -10.974 -5.952 -4.884 1.00 0.96 H new ATOM 0 HA GLU B 11 -10.395 -7.900 -2.981 1.00 0.95 H new ATOM 0 HB2 GLU B 11 -9.702 -8.108 -5.922 1.00 0.98 H new ATOM 0 HB3 GLU B 11 -10.003 -9.422 -4.803 1.00 0.98 H new ATOM 0 HG2 GLU B 11 -12.429 -8.435 -4.664 1.00 2.05 H new ATOM 0 HG3 GLU B 11 -11.996 -7.595 -6.140 1.00 2.05 H new ATOM 1807 N SER B 12 -7.858 -6.623 -4.756 1.00 0.98 N ATOM 1808 CA SER B 12 -6.417 -6.508 -4.909 1.00 1.03 C ATOM 1809 C SER B 12 -5.775 -6.080 -3.586 1.00 0.93 C ATOM 1810 O SER B 12 -4.760 -6.635 -3.166 1.00 1.00 O ATOM 1811 CB SER B 12 -6.088 -5.548 -6.056 1.00 1.20 C ATOM 1812 OG SER B 12 -4.733 -5.681 -6.424 1.00 1.34 O ATOM 0 H SER B 12 -8.387 -6.049 -5.413 1.00 0.98 H new ATOM 0 HA SER B 12 -5.997 -7.480 -5.168 1.00 1.03 H new ATOM 0 HB2 SER B 12 -6.728 -5.759 -6.913 1.00 1.20 H new ATOM 0 HB3 SER B 12 -6.291 -4.521 -5.751 1.00 1.20 H new ATOM 0 HG SER B 12 -4.163 -5.469 -5.655 1.00 1.34 H new ATOM 1818 N ILE B 13 -6.386 -5.119 -2.890 1.00 0.85 N ATOM 1819 CA ILE B 13 -5.948 -4.778 -1.546 1.00 0.83 C ATOM 1820 C ILE B 13 -6.297 -5.892 -0.555 1.00 0.90 C ATOM 1821 O ILE B 13 -5.443 -6.266 0.250 1.00 0.97 O ATOM 1822 CB ILE B 13 -6.352 -3.347 -1.143 1.00 0.81 C ATOM 1823 CG1 ILE B 13 -7.853 -3.070 -1.307 1.00 0.77 C ATOM 1824 CG2 ILE B 13 -5.515 -2.414 -2.042 1.00 0.83 C ATOM 1825 CD1 ILE B 13 -8.625 -3.266 -0.010 1.00 0.83 C ATOM 0 H ILE B 13 -7.175 -4.572 -3.234 1.00 0.85 H new ATOM 0 HA ILE B 13 -4.859 -4.732 -1.525 1.00 0.83 H new ATOM 0 HB ILE B 13 -6.159 -3.187 -0.082 1.00 0.81 H new ATOM 0 HG12 ILE B 13 -7.995 -2.048 -1.660 1.00 0.77 H new ATOM 0 HG13 ILE B 13 -8.260 -3.731 -2.072 1.00 0.77 H new ATOM 0 HG21 ILE B 13 -5.752 -1.376 -1.809 1.00 0.83 H new ATOM 0 HG22 ILE B 13 -4.455 -2.593 -1.865 1.00 0.83 H new ATOM 0 HG23 ILE B 13 -5.746 -2.613 -3.088 1.00 0.83 H new ATOM 0 HD11 ILE B 13 -9.681 -3.058 -0.180 1.00 0.83 H new ATOM 0 HD12 ILE B 13 -8.508 -4.295 0.331 1.00 0.83 H new ATOM 0 HD13 ILE B 13 -8.239 -2.586 0.750 1.00 0.83 H new ATOM 1837 N GLU B 14 -7.495 -6.484 -0.621 1.00 0.95 N ATOM 1838 CA GLU B 14 -7.837 -7.559 0.302 1.00 1.02 C ATOM 1839 C GLU B 14 -6.805 -8.698 0.270 1.00 1.05 C ATOM 1840 O GLU B 14 -6.400 -9.184 1.324 1.00 1.16 O ATOM 1841 CB GLU B 14 -9.274 -8.061 0.116 1.00 1.16 C ATOM 1842 CG GLU B 14 -9.704 -8.845 1.368 1.00 1.16 C ATOM 1843 CD GLU B 14 -11.174 -9.237 1.335 1.00 3.01 C ATOM 1844 OE1 GLU B 14 -11.544 -9.963 0.388 1.00 4.12 O ATOM 1845 OE2 GLU B 14 -11.895 -8.813 2.264 1.00 4.34 O ATOM 0 H GLU B 14 -8.226 -6.241 -1.290 1.00 0.95 H new ATOM 0 HA GLU B 14 -7.797 -7.132 1.304 1.00 1.02 H new ATOM 0 HB2 GLU B 14 -9.947 -7.220 -0.049 1.00 1.16 H new ATOM 0 HB3 GLU B 14 -9.338 -8.698 -0.766 1.00 1.16 H new ATOM 0 HG2 GLU B 14 -9.094 -9.744 1.457 1.00 1.16 H new ATOM 0 HG3 GLU B 14 -9.512 -8.241 2.255 1.00 1.16 H new ATOM 1852 N THR B 15 -6.327 -9.110 -0.910 1.00 1.00 N ATOM 1853 CA THR B 15 -5.380 -10.217 -0.999 1.00 1.03 C ATOM 1854 C THR B 15 -4.051 -9.901 -0.288 1.00 1.00 C ATOM 1855 O THR B 15 -3.425 -10.801 0.274 1.00 1.04 O ATOM 1856 CB THR B 15 -5.221 -10.760 -2.430 1.00 1.07 C ATOM 1857 OG1 THR B 15 -4.592 -12.027 -2.390 1.00 1.23 O ATOM 1858 CG2 THR B 15 -4.443 -9.855 -3.382 1.00 1.14 C ATOM 0 H THR B 15 -6.580 -8.695 -1.807 1.00 1.00 H new ATOM 0 HA THR B 15 -5.813 -11.049 -0.444 1.00 1.03 H new ATOM 0 HB THR B 15 -6.234 -10.820 -2.828 1.00 1.07 H new ATOM 0 HG1 THR B 15 -4.493 -12.372 -3.302 1.00 1.23 H new ATOM 0 HG21 THR B 15 -4.385 -10.324 -4.364 1.00 1.14 H new ATOM 0 HG22 THR B 15 -4.951 -8.895 -3.468 1.00 1.14 H new ATOM 0 HG23 THR B 15 -3.436 -9.699 -2.994 1.00 1.14 H new ATOM 1866 N VAL B 16 -3.614 -8.636 -0.256 1.00 0.95 N ATOM 1867 CA VAL B 16 -2.429 -8.275 0.521 1.00 0.91 C ATOM 1868 C VAL B 16 -2.799 -8.127 1.996 1.00 0.94 C ATOM 1869 O VAL B 16 -2.022 -8.526 2.860 1.00 0.96 O ATOM 1870 CB VAL B 16 -1.648 -7.069 -0.036 1.00 0.83 C ATOM 1871 CG1 VAL B 16 -1.232 -7.327 -1.485 1.00 0.94 C ATOM 1872 CG2 VAL B 16 -2.386 -5.733 0.031 1.00 0.80 C ATOM 0 H VAL B 16 -4.055 -7.861 -0.750 1.00 0.95 H new ATOM 0 HA VAL B 16 -1.720 -9.097 0.427 1.00 0.91 H new ATOM 0 HB VAL B 16 -0.781 -6.976 0.618 1.00 0.83 H new ATOM 0 HG11 VAL B 16 -0.681 -6.466 -1.864 1.00 0.94 H new ATOM 0 HG12 VAL B 16 -0.597 -8.212 -1.529 1.00 0.94 H new ATOM 0 HG13 VAL B 16 -2.121 -7.487 -2.096 1.00 0.94 H new ATOM 0 HG21 VAL B 16 -1.755 -4.947 -0.384 1.00 0.80 H new ATOM 0 HG22 VAL B 16 -3.310 -5.798 -0.544 1.00 0.80 H new ATOM 0 HG23 VAL B 16 -2.621 -5.499 1.069 1.00 0.80 H new ATOM 1882 N VAL B 17 -3.987 -7.598 2.300 1.00 0.97 N ATOM 1883 CA VAL B 17 -4.477 -7.483 3.669 1.00 1.02 C ATOM 1884 C VAL B 17 -4.523 -8.860 4.335 1.00 1.04 C ATOM 1885 O VAL B 17 -4.087 -8.998 5.474 1.00 1.11 O ATOM 1886 CB VAL B 17 -5.840 -6.777 3.696 1.00 1.07 C ATOM 1887 CG1 VAL B 17 -6.510 -6.822 5.077 1.00 1.14 C ATOM 1888 CG2 VAL B 17 -5.670 -5.308 3.288 1.00 1.12 C ATOM 0 H VAL B 17 -4.635 -7.238 1.599 1.00 0.97 H new ATOM 0 HA VAL B 17 -3.786 -6.867 4.245 1.00 1.02 H new ATOM 0 HB VAL B 17 -6.481 -7.311 2.994 1.00 1.07 H new ATOM 0 HG11 VAL B 17 -7.470 -6.307 5.033 1.00 1.14 H new ATOM 0 HG12 VAL B 17 -6.668 -7.860 5.371 1.00 1.14 H new ATOM 0 HG13 VAL B 17 -5.868 -6.332 5.809 1.00 1.14 H new ATOM 0 HG21 VAL B 17 -6.639 -4.810 3.308 1.00 1.12 H new ATOM 0 HG22 VAL B 17 -4.993 -4.813 3.984 1.00 1.12 H new ATOM 0 HG23 VAL B 17 -5.256 -5.256 2.281 1.00 1.12 H new ATOM 1898 N THR B 18 -5.030 -9.885 3.651 1.00 1.03 N ATOM 1899 CA THR B 18 -5.067 -11.234 4.204 1.00 1.08 C ATOM 1900 C THR B 18 -3.648 -11.803 4.344 1.00 1.06 C ATOM 1901 O THR B 18 -3.342 -12.410 5.372 1.00 1.10 O ATOM 1902 CB THR B 18 -6.038 -12.133 3.424 1.00 1.17 C ATOM 1903 OG1 THR B 18 -6.227 -13.354 4.107 1.00 1.27 O ATOM 1904 CG2 THR B 18 -5.559 -12.419 2.005 1.00 1.19 C ATOM 0 H THR B 18 -5.421 -9.805 2.712 1.00 1.03 H new ATOM 0 HA THR B 18 -5.471 -11.195 5.216 1.00 1.08 H new ATOM 0 HB THR B 18 -6.981 -11.591 3.353 1.00 1.17 H new ATOM 0 HG1 THR B 18 -6.849 -13.919 3.602 1.00 1.27 H new ATOM 0 HG21 THR B 18 -6.282 -13.058 1.499 1.00 1.19 H new ATOM 0 HG22 THR B 18 -5.459 -11.481 1.459 1.00 1.19 H new ATOM 0 HG23 THR B 18 -4.593 -12.922 2.042 1.00 1.19 H new ATOM 1912 N THR B 19 -2.754 -11.573 3.368 1.00 1.03 N ATOM 1913 CA THR B 19 -1.359 -11.978 3.504 1.00 1.03 C ATOM 1914 C THR B 19 -0.785 -11.358 4.781 1.00 1.05 C ATOM 1915 O THR B 19 -0.285 -12.071 5.643 1.00 1.13 O ATOM 1916 CB THR B 19 -0.563 -11.612 2.238 1.00 1.01 C ATOM 1917 OG1 THR B 19 -1.187 -12.180 1.107 1.00 1.04 O ATOM 1918 CG2 THR B 19 0.865 -12.167 2.282 1.00 1.02 C ATOM 0 H THR B 19 -2.977 -11.112 2.486 1.00 1.03 H new ATOM 0 HA THR B 19 -1.283 -13.061 3.600 1.00 1.03 H new ATOM 0 HB THR B 19 -0.533 -10.524 2.184 1.00 1.01 H new ATOM 0 HG1 THR B 19 -2.007 -11.685 0.903 1.00 1.04 H new ATOM 0 HG21 THR B 19 1.393 -11.887 1.370 1.00 1.02 H new ATOM 0 HG22 THR B 19 1.389 -11.756 3.145 1.00 1.02 H new ATOM 0 HG23 THR B 19 0.831 -13.254 2.362 1.00 1.02 H new ATOM 1926 N PHE B 20 -0.930 -10.038 4.938 1.00 1.02 N ATOM 1927 CA PHE B 20 -0.605 -9.294 6.150 1.00 1.10 C ATOM 1928 C PHE B 20 -1.199 -9.965 7.391 1.00 1.14 C ATOM 1929 O PHE B 20 -0.465 -10.265 8.328 1.00 1.18 O ATOM 1930 CB PHE B 20 -1.068 -7.834 5.992 1.00 1.20 C ATOM 1931 CG PHE B 20 -1.448 -7.096 7.269 1.00 2.01 C ATOM 1932 CD1 PHE B 20 -0.552 -7.025 8.352 1.00 2.50 C ATOM 1933 CD2 PHE B 20 -2.743 -6.558 7.404 1.00 3.52 C ATOM 1934 CE1 PHE B 20 -0.958 -6.437 9.563 1.00 3.59 C ATOM 1935 CE2 PHE B 20 -3.142 -5.959 8.611 1.00 4.52 C ATOM 1936 CZ PHE B 20 -2.252 -5.907 9.695 1.00 4.33 C ATOM 0 H PHE B 20 -1.291 -9.440 4.194 1.00 1.02 H new ATOM 0 HA PHE B 20 0.475 -9.294 6.295 1.00 1.10 H new ATOM 0 HB2 PHE B 20 -0.272 -7.276 5.500 1.00 1.20 H new ATOM 0 HB3 PHE B 20 -1.928 -7.820 5.322 1.00 1.20 H new ATOM 0 HD1 PHE B 20 0.447 -7.422 8.253 1.00 2.50 H new ATOM 0 HD2 PHE B 20 -3.433 -6.606 6.575 1.00 3.52 H new ATOM 0 HE1 PHE B 20 -0.272 -6.393 10.396 1.00 3.59 H new ATOM 0 HE2 PHE B 20 -4.133 -5.539 8.704 1.00 4.52 H new ATOM 0 HZ PHE B 20 -2.561 -5.461 10.628 1.00 4.33 H new ATOM 1946 N PHE B 21 -2.513 -10.192 7.411 1.00 1.16 N ATOM 1947 CA PHE B 21 -3.231 -10.730 8.560 1.00 1.24 C ATOM 1948 C PHE B 21 -2.612 -12.069 8.970 1.00 1.21 C ATOM 1949 O PHE B 21 -2.203 -12.248 10.115 1.00 1.17 O ATOM 1950 CB PHE B 21 -4.727 -10.853 8.215 1.00 1.35 C ATOM 1951 CG PHE B 21 -5.722 -10.996 9.364 1.00 1.45 C ATOM 1952 CD1 PHE B 21 -5.619 -12.059 10.285 1.00 2.00 C ATOM 1953 CD2 PHE B 21 -6.904 -10.226 9.339 1.00 2.79 C ATOM 1954 CE1 PHE B 21 -6.690 -12.362 11.146 1.00 2.38 C ATOM 1955 CE2 PHE B 21 -7.993 -10.559 10.165 1.00 3.09 C ATOM 1956 CZ PHE B 21 -7.893 -11.641 11.056 1.00 2.37 C ATOM 0 H PHE B 21 -3.117 -10.002 6.611 1.00 1.16 H new ATOM 0 HA PHE B 21 -3.146 -10.058 9.414 1.00 1.24 H new ATOM 0 HB2 PHE B 21 -5.009 -9.973 7.638 1.00 1.35 H new ATOM 0 HB3 PHE B 21 -4.848 -11.716 7.560 1.00 1.35 H new ATOM 0 HD1 PHE B 21 -4.712 -12.644 10.330 1.00 2.00 H new ATOM 0 HD2 PHE B 21 -6.973 -9.373 8.680 1.00 2.79 H new ATOM 0 HE1 PHE B 21 -6.587 -13.150 11.877 1.00 2.38 H new ATOM 0 HE2 PHE B 21 -8.905 -9.983 10.114 1.00 3.09 H new ATOM 0 HZ PHE B 21 -8.738 -11.918 11.670 1.00 2.37 H new ATOM 1966 N THR B 22 -2.556 -13.017 8.034 1.00 1.28 N ATOM 1967 CA THR B 22 -2.044 -14.356 8.284 1.00 1.35 C ATOM 1968 C THR B 22 -0.572 -14.303 8.707 1.00 1.31 C ATOM 1969 O THR B 22 -0.178 -14.956 9.670 1.00 1.33 O ATOM 1970 CB THR B 22 -2.257 -15.240 7.045 1.00 1.51 C ATOM 1971 OG1 THR B 22 -1.728 -14.628 5.889 1.00 2.29 O ATOM 1972 CG2 THR B 22 -3.745 -15.524 6.816 1.00 2.32 C ATOM 0 H THR B 22 -2.869 -12.871 7.074 1.00 1.28 H new ATOM 0 HA THR B 22 -2.597 -14.803 9.110 1.00 1.35 H new ATOM 0 HB THR B 22 -1.735 -16.179 7.230 1.00 1.51 H new ATOM 0 HG1 THR B 22 -2.341 -13.929 5.579 1.00 2.29 H new ATOM 0 HG21 THR B 22 -3.864 -16.151 5.933 1.00 2.32 H new ATOM 0 HG22 THR B 22 -4.155 -16.039 7.685 1.00 2.32 H new ATOM 0 HG23 THR B 22 -4.276 -14.584 6.667 1.00 2.32 H new ATOM 1980 N PHE B 23 0.230 -13.503 8.006 1.00 1.34 N ATOM 1981 CA PHE B 23 1.639 -13.286 8.298 1.00 1.41 C ATOM 1982 C PHE B 23 1.830 -12.758 9.727 1.00 1.21 C ATOM 1983 O PHE B 23 2.446 -13.420 10.561 1.00 1.40 O ATOM 1984 CB PHE B 23 2.177 -12.316 7.239 1.00 1.70 C ATOM 1985 CG PHE B 23 3.495 -11.654 7.543 1.00 1.91 C ATOM 1986 CD1 PHE B 23 4.517 -12.373 8.186 1.00 2.38 C ATOM 1987 CD2 PHE B 23 3.635 -10.272 7.316 1.00 3.85 C ATOM 1988 CE1 PHE B 23 5.628 -11.690 8.693 1.00 4.15 C ATOM 1989 CE2 PHE B 23 4.776 -9.603 7.775 1.00 5.40 C ATOM 1990 CZ PHE B 23 5.767 -10.311 8.470 1.00 5.43 C ATOM 0 H PHE B 23 -0.096 -12.974 7.197 1.00 1.34 H new ATOM 0 HA PHE B 23 2.197 -14.222 8.253 1.00 1.41 H new ATOM 0 HB2 PHE B 23 2.276 -12.858 6.299 1.00 1.70 H new ATOM 0 HB3 PHE B 23 1.432 -11.536 7.080 1.00 1.70 H new ATOM 0 HD1 PHE B 23 4.445 -13.446 8.288 1.00 2.38 H new ATOM 0 HD2 PHE B 23 2.864 -9.729 6.789 1.00 3.85 H new ATOM 0 HE1 PHE B 23 6.379 -12.224 9.256 1.00 4.15 H new ATOM 0 HE2 PHE B 23 4.893 -8.545 7.594 1.00 5.40 H new ATOM 0 HZ PHE B 23 6.641 -9.793 8.835 1.00 5.43 H new ATOM 2000 N ALA B 24 1.265 -11.585 10.025 1.00 0.95 N ATOM 2001 CA ALA B 24 1.257 -10.932 11.319 1.00 0.88 C ATOM 2002 C ALA B 24 0.582 -11.796 12.383 1.00 1.12 C ATOM 2003 O ALA B 24 0.786 -11.571 13.577 1.00 1.22 O ATOM 2004 CB ALA B 24 0.546 -9.588 11.192 1.00 0.84 C ATOM 0 H ALA B 24 0.772 -11.039 9.318 1.00 0.95 H new ATOM 0 HA ALA B 24 2.288 -10.778 11.638 1.00 0.88 H new ATOM 0 HB1 ALA B 24 0.535 -9.089 12.161 1.00 0.84 H new ATOM 0 HB2 ALA B 24 1.072 -8.965 10.469 1.00 0.84 H new ATOM 0 HB3 ALA B 24 -0.478 -9.749 10.855 1.00 0.84 H new ATOM 2010 N ARG B 25 -0.225 -12.763 11.945 1.00 1.32 N ATOM 2011 CA ARG B 25 -0.705 -13.923 12.673 1.00 1.70 C ATOM 2012 C ARG B 25 0.398 -14.661 13.443 1.00 1.80 C ATOM 2013 O ARG B 25 0.072 -15.457 14.322 1.00 2.24 O ATOM 2014 CB ARG B 25 -1.929 -13.554 13.524 1.00 1.87 C ATOM 2015 CG ARG B 25 -2.795 -14.779 13.867 1.00 3.14 C ATOM 2016 CD ARG B 25 -2.818 -15.080 15.371 1.00 4.14 C ATOM 2017 NE ARG B 25 -3.333 -16.432 15.643 1.00 5.01 N ATOM 2018 CZ ARG B 25 -2.606 -17.566 15.625 1.00 4.88 C ATOM 2019 NH1 ARG B 25 -1.310 -17.544 15.298 1.00 4.88 N ATOM 2020 NH2 ARG B 25 -3.189 -18.730 15.935 1.00 5.24 N ATOM 0 H ARG B 25 -0.586 -12.747 10.991 1.00 1.32 H new ATOM 0 HA ARG B 25 -1.038 -14.660 11.942 1.00 1.70 H new ATOM 0 HB2 ARG B 25 -1.597 -13.077 14.446 1.00 1.87 H new ATOM 0 HB3 ARG B 25 -2.534 -12.823 12.988 1.00 1.87 H new ATOM 0 HG2 ARG B 25 -3.814 -14.609 13.518 1.00 3.14 H new ATOM 0 HG3 ARG B 25 -2.416 -15.649 13.331 1.00 3.14 H new ATOM 0 HD2 ARG B 25 -1.811 -14.984 15.778 1.00 4.14 H new ATOM 0 HD3 ARG B 25 -3.439 -14.344 15.881 1.00 4.14 H new ATOM 0 HE ARG B 25 -4.325 -16.517 15.864 1.00 5.01 H new ATOM 0 HH11 ARG B 25 -0.859 -16.661 15.058 1.00 4.88 H new ATOM 0 HH12 ARG B 25 -0.772 -18.410 15.289 1.00 4.88 H new ATOM 0 HH21 ARG B 25 -4.178 -18.755 16.183 1.00 5.24 H new ATOM 0 HH22 ARG B 25 -2.644 -19.592 15.923 1.00 5.24 H new ATOM 2034 N GLN B 26 1.676 -14.464 13.103 1.00 1.45 N ATOM 2035 CA GLN B 26 2.785 -15.186 13.717 1.00 1.29 C ATOM 2036 C GLN B 26 2.790 -15.140 15.252 1.00 1.54 C ATOM 2037 O GLN B 26 2.673 -16.175 15.907 1.00 1.56 O ATOM 2038 CB GLN B 26 4.075 -14.522 13.228 1.00 1.15 C ATOM 2039 CG GLN B 26 5.189 -15.439 12.804 1.00 1.22 C ATOM 2040 CD GLN B 26 4.836 -16.301 11.593 1.00 1.29 C ATOM 2041 OE1 GLN B 26 5.206 -17.469 11.528 1.00 1.96 O ATOM 2042 NE2 GLN B 26 4.051 -15.778 10.650 1.00 2.19 N ATOM 0 H GLN B 26 1.967 -13.795 12.390 1.00 1.45 H new ATOM 0 HA GLN B 26 2.691 -16.234 13.433 1.00 1.29 H new ATOM 0 HB2 GLN B 26 3.827 -13.876 12.386 1.00 1.15 H new ATOM 0 HB3 GLN B 26 4.449 -13.878 14.024 1.00 1.15 H new ATOM 0 HG2 GLN B 26 6.072 -14.843 12.572 1.00 1.22 H new ATOM 0 HG3 GLN B 26 5.453 -16.088 13.639 1.00 1.22 H new ATOM 0 HE21 GLN B 26 3.751 -14.805 10.718 1.00 2.19 H new ATOM 0 HE22 GLN B 26 3.750 -16.351 9.861 1.00 2.19 H new ATOM 2051 N GLU B 27 2.954 -13.943 15.826 1.00 1.85 N ATOM 2052 CA GLU B 27 3.511 -13.835 17.170 1.00 1.92 C ATOM 2053 C GLU B 27 2.592 -14.246 18.327 1.00 2.00 C ATOM 2054 O GLU B 27 3.112 -14.681 19.350 1.00 1.29 O ATOM 2055 CB GLU B 27 4.035 -12.427 17.439 1.00 2.63 C ATOM 2056 CG GLU B 27 5.148 -11.952 16.492 1.00 3.03 C ATOM 2057 CD GLU B 27 5.063 -10.432 16.284 1.00 4.30 C ATOM 2058 OE1 GLU B 27 3.911 -9.926 16.220 1.00 5.35 O ATOM 2059 OE2 GLU B 27 6.117 -9.773 16.169 1.00 4.59 O ATOM 0 H GLU B 27 2.713 -13.054 15.388 1.00 1.85 H new ATOM 0 HA GLU B 27 4.317 -14.569 17.158 1.00 1.92 H new ATOM 0 HB2 GLU B 27 3.201 -11.728 17.374 1.00 2.63 H new ATOM 0 HB3 GLU B 27 4.408 -12.384 18.462 1.00 2.63 H new ATOM 0 HG2 GLU B 27 6.122 -12.215 16.905 1.00 3.03 H new ATOM 0 HG3 GLU B 27 5.060 -12.462 15.533 1.00 3.03 H new ATOM 2066 N GLY B 28 1.260 -14.103 18.307 1.00 3.35 N ATOM 2067 CA GLY B 28 0.327 -13.744 17.248 1.00 3.98 C ATOM 2068 C GLY B 28 0.174 -12.248 16.965 1.00 2.60 C ATOM 2069 O GLY B 28 1.062 -11.590 16.419 1.00 1.93 O ATOM 0 H GLY B 28 0.742 -14.263 19.171 1.00 3.35 H new ATOM 0 HA2 GLY B 28 0.645 -14.236 16.329 1.00 3.98 H new ATOM 0 HA3 GLY B 28 -0.653 -14.147 17.503 1.00 3.98 H new ATOM 2073 N ARG B 29 -1.012 -11.726 17.299 1.00 2.64 N ATOM 2074 CA ARG B 29 -1.454 -10.358 17.064 1.00 2.17 C ATOM 2075 C ARG B 29 -1.317 -9.949 15.596 1.00 1.86 C ATOM 2076 O ARG B 29 -0.228 -9.561 15.157 1.00 1.48 O ATOM 2077 CB ARG B 29 -0.733 -9.393 18.010 1.00 1.94 C ATOM 2078 CG ARG B 29 -1.436 -8.031 18.037 1.00 2.43 C ATOM 2079 CD ARG B 29 -0.860 -7.161 19.157 1.00 1.80 C ATOM 2080 NE ARG B 29 -1.404 -5.797 19.086 1.00 2.76 N ATOM 2081 CZ ARG B 29 -2.548 -5.378 19.648 1.00 3.15 C ATOM 2082 NH1 ARG B 29 -3.323 -6.246 20.313 1.00 3.43 N ATOM 2083 NH2 ARG B 29 -2.915 -4.098 19.536 1.00 4.29 N ATOM 0 H ARG B 29 -1.726 -12.284 17.767 1.00 2.64 H new ATOM 0 HA ARG B 29 -2.520 -10.306 17.287 1.00 2.17 H new ATOM 0 HB2 ARG B 29 -0.707 -9.814 19.015 1.00 1.94 H new ATOM 0 HB3 ARG B 29 0.301 -9.267 17.690 1.00 1.94 H new ATOM 0 HG2 ARG B 29 -1.311 -7.530 17.077 1.00 2.43 H new ATOM 0 HG3 ARG B 29 -2.507 -8.169 18.188 1.00 2.43 H new ATOM 0 HD2 ARG B 29 -1.096 -7.602 20.125 1.00 1.80 H new ATOM 0 HD3 ARG B 29 0.227 -7.129 19.078 1.00 1.80 H new ATOM 0 HE ARG B 29 -0.864 -5.108 18.563 1.00 2.76 H new ATOM 0 HH11 ARG B 29 -3.043 -7.224 20.391 1.00 3.43 H new ATOM 0 HH12 ARG B 29 -4.193 -5.929 20.741 1.00 3.43 H new ATOM 0 HH21 ARG B 29 -2.326 -3.441 19.024 1.00 4.29 H new ATOM 0 HH22 ARG B 29 -3.784 -3.778 19.963 1.00 4.29 H new ATOM 2097 N LYS B 30 -2.426 -10.020 14.849 1.00 2.16 N ATOM 2098 CA LYS B 30 -2.435 -9.604 13.457 1.00 2.18 C ATOM 2099 C LYS B 30 -2.157 -8.104 13.328 1.00 1.90 C ATOM 2100 O LYS B 30 -1.434 -7.669 12.439 1.00 2.89 O ATOM 2101 CB LYS B 30 -3.697 -10.066 12.696 1.00 2.98 C ATOM 2102 CG LYS B 30 -5.031 -9.327 12.918 1.00 3.55 C ATOM 2103 CD LYS B 30 -5.794 -9.790 14.169 1.00 3.26 C ATOM 2104 CE LYS B 30 -7.156 -9.085 14.306 1.00 4.04 C ATOM 2105 NZ LYS B 30 -8.168 -9.584 13.354 1.00 5.09 N ATOM 0 H LYS B 30 -3.323 -10.362 15.193 1.00 2.16 H new ATOM 0 HA LYS B 30 -1.613 -10.119 12.959 1.00 2.18 H new ATOM 0 HB2 LYS B 30 -3.471 -10.019 11.631 1.00 2.98 H new ATOM 0 HB3 LYS B 30 -3.860 -11.115 12.941 1.00 2.98 H new ATOM 0 HG2 LYS B 30 -4.835 -8.258 12.998 1.00 3.55 H new ATOM 0 HG3 LYS B 30 -5.665 -9.470 12.043 1.00 3.55 H new ATOM 0 HD2 LYS B 30 -5.947 -10.868 14.122 1.00 3.26 H new ATOM 0 HD3 LYS B 30 -5.192 -9.591 15.056 1.00 3.26 H new ATOM 0 HE2 LYS B 30 -7.526 -9.218 15.323 1.00 4.04 H new ATOM 0 HE3 LYS B 30 -7.020 -8.014 14.154 1.00 4.04 H new ATOM 0 HZ1 LYS B 30 -9.028 -9.004 13.426 1.00 5.09 H new ATOM 0 HZ2 LYS B 30 -7.792 -9.527 12.386 1.00 5.09 H new ATOM 0 HZ3 LYS B 30 -8.398 -10.573 13.579 1.00 5.09 H new ATOM 2119 N ASP B 31 -2.711 -7.303 14.236 1.00 1.78 N ATOM 2120 CA ASP B 31 -2.695 -5.848 14.136 1.00 1.69 C ATOM 2121 C ASP B 31 -1.329 -5.237 14.469 1.00 1.63 C ATOM 2122 O ASP B 31 -1.210 -4.008 14.512 1.00 2.62 O ATOM 2123 CB ASP B 31 -3.789 -5.281 15.053 1.00 1.91 C ATOM 2124 CG ASP B 31 -5.085 -6.054 14.904 1.00 2.78 C ATOM 2125 OD1 ASP B 31 -5.155 -7.125 15.545 1.00 3.43 O ATOM 2126 OD2 ASP B 31 -5.934 -5.625 14.090 1.00 3.93 O ATOM 0 H ASP B 31 -3.187 -7.650 15.068 1.00 1.78 H new ATOM 0 HA ASP B 31 -2.892 -5.578 13.099 1.00 1.69 H new ATOM 0 HB2 ASP B 31 -3.455 -5.322 16.090 1.00 1.91 H new ATOM 0 HB3 ASP B 31 -3.959 -4.231 14.814 1.00 1.91 H new ATOM 2131 N SER B 32 -0.307 -6.053 14.760 1.00 1.13 N ATOM 2132 CA SER B 32 1.011 -5.562 15.144 1.00 1.12 C ATOM 2133 C SER B 32 2.090 -6.599 14.818 1.00 1.16 C ATOM 2134 O SER B 32 1.857 -7.812 14.929 1.00 1.19 O ATOM 2135 CB SER B 32 1.026 -5.174 16.632 1.00 1.50 C ATOM 2136 OG SER B 32 -0.190 -4.548 17.016 1.00 2.81 O ATOM 0 H SER B 32 -0.377 -7.070 14.734 1.00 1.13 H new ATOM 0 HA SER B 32 1.234 -4.666 14.566 1.00 1.12 H new ATOM 0 HB2 SER B 32 1.187 -6.064 17.240 1.00 1.50 H new ATOM 0 HB3 SER B 32 1.861 -4.501 16.826 1.00 1.50 H new ATOM 0 HG SER B 32 -0.016 -3.914 17.743 1.00 2.81 H new ATOM 2142 N LEU B 33 3.267 -6.124 14.408 1.00 1.36 N ATOM 2143 CA LEU B 33 4.415 -6.956 14.082 1.00 1.40 C ATOM 2144 C LEU B 33 5.643 -6.398 14.782 1.00 1.23 C ATOM 2145 O LEU B 33 5.789 -5.183 14.846 1.00 1.22 O ATOM 2146 CB LEU B 33 4.647 -6.972 12.563 1.00 1.40 C ATOM 2147 CG LEU B 33 3.477 -7.507 11.716 1.00 1.60 C ATOM 2148 CD1 LEU B 33 2.523 -6.435 11.203 1.00 2.78 C ATOM 2149 CD2 LEU B 33 4.057 -8.265 10.520 1.00 1.69 C ATOM 0 H LEU B 33 3.448 -5.127 14.292 1.00 1.36 H new ATOM 0 HA LEU B 33 4.228 -7.977 14.416 1.00 1.40 H new ATOM 0 HB2 LEU B 33 4.873 -5.957 12.237 1.00 1.40 H new ATOM 0 HB3 LEU B 33 5.529 -7.577 12.355 1.00 1.40 H new ATOM 0 HG LEU B 33 2.886 -8.147 12.371 1.00 1.60 H new ATOM 0 HD11 LEU B 33 1.731 -6.902 10.617 1.00 2.78 H new ATOM 0 HD12 LEU B 33 2.084 -5.904 12.048 1.00 2.78 H new ATOM 0 HD13 LEU B 33 3.070 -5.731 10.576 1.00 2.78 H new ATOM 0 HD21 LEU B 33 3.244 -8.653 9.906 1.00 1.69 H new ATOM 0 HD22 LEU B 33 4.671 -7.590 9.924 1.00 1.69 H new ATOM 0 HD23 LEU B 33 4.669 -9.093 10.876 1.00 1.69 H new ATOM 2161 N SER B 34 6.526 -7.254 15.296 1.00 1.40 N ATOM 2162 CA SER B 34 7.840 -6.846 15.769 1.00 1.25 C ATOM 2163 C SER B 34 8.914 -7.352 14.810 1.00 1.05 C ATOM 2164 O SER B 34 8.635 -8.071 13.845 1.00 1.26 O ATOM 2165 CB SER B 34 8.076 -7.342 17.197 1.00 1.80 C ATOM 2166 OG SER B 34 9.188 -6.651 17.740 1.00 3.02 O ATOM 0 H SER B 34 6.345 -8.253 15.395 1.00 1.40 H new ATOM 0 HA SER B 34 7.893 -5.758 15.792 1.00 1.25 H new ATOM 0 HB2 SER B 34 7.190 -7.171 17.808 1.00 1.80 H new ATOM 0 HB3 SER B 34 8.261 -8.416 17.198 1.00 1.80 H new ATOM 0 HG SER B 34 8.998 -5.690 17.759 1.00 3.02 H new ATOM 2172 N VAL B 35 10.174 -7.005 15.084 1.00 1.09 N ATOM 2173 CA VAL B 35 11.303 -7.472 14.287 1.00 1.01 C ATOM 2174 C VAL B 35 11.747 -8.851 14.773 1.00 1.32 C ATOM 2175 O VAL B 35 12.928 -9.137 14.943 1.00 2.40 O ATOM 2176 CB VAL B 35 12.407 -6.403 14.273 1.00 1.65 C ATOM 2177 CG1 VAL B 35 13.101 -6.162 15.620 1.00 1.90 C ATOM 2178 CG2 VAL B 35 13.438 -6.632 13.158 1.00 2.51 C ATOM 0 H VAL B 35 10.436 -6.397 15.860 1.00 1.09 H new ATOM 0 HA VAL B 35 11.017 -7.610 13.244 1.00 1.01 H new ATOM 0 HB VAL B 35 11.864 -5.482 14.057 1.00 1.65 H new ATOM 0 HG11 VAL B 35 13.863 -5.391 15.504 1.00 1.90 H new ATOM 0 HG12 VAL B 35 12.365 -5.838 16.356 1.00 1.90 H new ATOM 0 HG13 VAL B 35 13.569 -7.086 15.959 1.00 1.90 H new ATOM 0 HG21 VAL B 35 14.194 -5.848 13.195 1.00 2.51 H new ATOM 0 HG22 VAL B 35 13.915 -7.602 13.297 1.00 2.51 H new ATOM 0 HG23 VAL B 35 12.938 -6.608 12.190 1.00 2.51 H new ATOM 2188 N ASN B 36 10.772 -9.756 14.816 1.00 1.25 N ATOM 2189 CA ASN B 36 10.952 -11.178 14.615 1.00 1.41 C ATOM 2190 C ASN B 36 9.588 -11.683 14.156 1.00 1.31 C ATOM 2191 O ASN B 36 9.001 -12.602 14.720 1.00 1.77 O ATOM 2192 CB ASN B 36 11.455 -11.826 15.905 1.00 2.03 C ATOM 2193 CG ASN B 36 12.043 -13.212 15.644 1.00 2.37 C ATOM 2194 OD1 ASN B 36 13.202 -13.464 15.957 1.00 3.15 O ATOM 2195 ND2 ASN B 36 11.275 -14.125 15.055 1.00 2.15 N ATOM 0 H ASN B 36 9.801 -9.502 14.999 1.00 1.25 H new ATOM 0 HA ASN B 36 11.707 -11.427 13.869 1.00 1.41 H new ATOM 0 HB2 ASN B 36 12.212 -11.189 16.362 1.00 2.03 H new ATOM 0 HB3 ASN B 36 10.634 -11.906 16.617 1.00 2.03 H new ATOM 0 HD21 ASN B 36 11.648 -15.053 14.856 1.00 2.15 H new ATOM 0 HD22 ASN B 36 10.314 -13.896 14.802 1.00 2.15 H new ATOM 2202 N GLU B 37 9.131 -11.017 13.098 1.00 1.02 N ATOM 2203 CA GLU B 37 7.933 -11.243 12.327 1.00 0.93 C ATOM 2204 C GLU B 37 8.208 -10.449 11.054 1.00 0.91 C ATOM 2205 O GLU B 37 8.365 -11.019 9.984 1.00 1.06 O ATOM 2206 CB GLU B 37 6.681 -10.771 13.097 1.00 0.95 C ATOM 2207 CG GLU B 37 5.433 -11.548 12.659 1.00 1.06 C ATOM 2208 CD GLU B 37 4.161 -11.117 13.380 1.00 1.30 C ATOM 2209 OE1 GLU B 37 3.789 -9.936 13.337 1.00 2.33 O ATOM 2210 OE2 GLU B 37 3.432 -11.890 14.037 1.00 2.23 O ATOM 0 H GLU B 37 9.655 -10.223 12.729 1.00 1.02 H new ATOM 0 HA GLU B 37 7.720 -12.291 12.115 1.00 0.93 H new ATOM 0 HB2 GLU B 37 6.838 -10.904 14.167 1.00 0.95 H new ATOM 0 HB3 GLU B 37 6.527 -9.705 12.927 1.00 0.95 H new ATOM 0 HG2 GLU B 37 5.293 -11.419 11.586 1.00 1.06 H new ATOM 0 HG3 GLU B 37 5.597 -12.611 12.834 1.00 1.06 H new ATOM 2217 N PHE B 38 8.407 -9.130 11.195 1.00 0.87 N ATOM 2218 CA PHE B 38 8.665 -8.208 10.090 1.00 0.91 C ATOM 2219 C PHE B 38 9.630 -8.775 9.023 1.00 0.89 C ATOM 2220 O PHE B 38 9.254 -8.908 7.856 1.00 1.02 O ATOM 2221 CB PHE B 38 9.127 -6.862 10.670 1.00 0.96 C ATOM 2222 CG PHE B 38 9.377 -5.776 9.645 1.00 0.97 C ATOM 2223 CD1 PHE B 38 8.398 -5.465 8.684 1.00 1.55 C ATOM 2224 CD2 PHE B 38 10.609 -5.098 9.627 1.00 2.44 C ATOM 2225 CE1 PHE B 38 8.693 -4.564 7.646 1.00 1.57 C ATOM 2226 CE2 PHE B 38 10.928 -4.253 8.553 1.00 2.94 C ATOM 2227 CZ PHE B 38 9.974 -3.993 7.558 1.00 1.94 C ATOM 0 H PHE B 38 8.392 -8.668 12.104 1.00 0.87 H new ATOM 0 HA PHE B 38 7.736 -8.057 9.540 1.00 0.91 H new ATOM 0 HB2 PHE B 38 8.374 -6.509 11.375 1.00 0.96 H new ATOM 0 HB3 PHE B 38 10.044 -7.023 11.237 1.00 0.96 H new ATOM 0 HD1 PHE B 38 7.420 -5.918 8.744 1.00 1.55 H new ATOM 0 HD2 PHE B 38 11.309 -5.228 10.439 1.00 2.44 H new ATOM 0 HE1 PHE B 38 7.937 -4.311 6.918 1.00 1.57 H new ATOM 0 HE2 PHE B 38 11.908 -3.803 8.493 1.00 2.94 H new ATOM 0 HZ PHE B 38 10.224 -3.354 6.724 1.00 1.94 H new ATOM 2237 N LYS B 39 10.854 -9.153 9.420 1.00 0.84 N ATOM 2238 CA LYS B 39 11.870 -9.692 8.508 1.00 0.92 C ATOM 2239 C LYS B 39 11.359 -10.904 7.711 1.00 0.96 C ATOM 2240 O LYS B 39 11.801 -11.151 6.585 1.00 0.93 O ATOM 2241 CB LYS B 39 13.162 -10.032 9.280 1.00 0.91 C ATOM 2242 CG LYS B 39 14.290 -10.587 8.381 1.00 0.84 C ATOM 2243 CD LYS B 39 15.587 -10.858 9.171 1.00 1.02 C ATOM 2244 CE LYS B 39 16.456 -9.610 9.423 1.00 1.62 C ATOM 2245 NZ LYS B 39 17.550 -9.460 8.433 1.00 2.57 N ATOM 0 H LYS B 39 11.167 -9.092 10.389 1.00 0.84 H new ATOM 0 HA LYS B 39 12.097 -8.916 7.777 1.00 0.92 H new ATOM 0 HB2 LYS B 39 13.520 -9.135 9.786 1.00 0.91 H new ATOM 0 HB3 LYS B 39 12.931 -10.764 10.054 1.00 0.91 H new ATOM 0 HG2 LYS B 39 13.955 -11.511 7.909 1.00 0.84 H new ATOM 0 HG3 LYS B 39 14.496 -9.877 7.580 1.00 0.84 H new ATOM 0 HD2 LYS B 39 15.326 -11.303 10.131 1.00 1.02 H new ATOM 0 HD3 LYS B 39 16.180 -11.595 8.629 1.00 1.02 H new ATOM 0 HE2 LYS B 39 15.824 -8.722 9.396 1.00 1.62 H new ATOM 0 HE3 LYS B 39 16.884 -9.667 10.424 1.00 1.62 H new ATOM 0 HZ1 LYS B 39 18.037 -8.555 8.589 1.00 2.57 H new ATOM 0 HZ2 LYS B 39 18.228 -10.241 8.543 1.00 2.57 H new ATOM 0 HZ3 LYS B 39 17.153 -9.479 7.472 1.00 2.57 H new ATOM 2259 N GLU B 40 10.449 -11.690 8.279 1.00 0.99 N ATOM 2260 CA GLU B 40 10.009 -12.925 7.662 1.00 0.91 C ATOM 2261 C GLU B 40 9.274 -12.647 6.345 1.00 0.86 C ATOM 2262 O GLU B 40 9.301 -13.489 5.453 1.00 0.84 O ATOM 2263 CB GLU B 40 9.178 -13.745 8.651 1.00 0.89 C ATOM 2264 CG GLU B 40 9.945 -13.987 9.966 1.00 1.16 C ATOM 2265 CD GLU B 40 9.070 -14.575 11.068 1.00 2.09 C ATOM 2266 OE1 GLU B 40 7.895 -14.881 10.774 1.00 3.02 O ATOM 2267 OE2 GLU B 40 9.600 -14.676 12.195 1.00 3.04 O ATOM 0 H GLU B 40 10.002 -11.486 9.173 1.00 0.99 H new ATOM 0 HA GLU B 40 10.880 -13.528 7.403 1.00 0.91 H new ATOM 0 HB2 GLU B 40 8.244 -13.224 8.863 1.00 0.89 H new ATOM 0 HB3 GLU B 40 8.914 -14.702 8.201 1.00 0.89 H new ATOM 0 HG2 GLU B 40 10.780 -14.661 9.774 1.00 1.16 H new ATOM 0 HG3 GLU B 40 10.369 -13.044 10.311 1.00 1.16 H new ATOM 2274 N LEU B 41 8.674 -11.462 6.167 1.00 0.89 N ATOM 2275 CA LEU B 41 7.974 -11.140 4.926 1.00 0.87 C ATOM 2276 C LEU B 41 8.996 -11.029 3.795 1.00 0.80 C ATOM 2277 O LEU B 41 8.844 -11.635 2.732 1.00 0.77 O ATOM 2278 CB LEU B 41 7.171 -9.836 5.108 1.00 0.96 C ATOM 2279 CG LEU B 41 6.127 -9.488 4.025 1.00 0.95 C ATOM 2280 CD1 LEU B 41 6.771 -8.975 2.739 1.00 2.62 C ATOM 2281 CD2 LEU B 41 5.167 -10.646 3.734 1.00 2.20 C ATOM 0 H LEU B 41 8.662 -10.718 6.865 1.00 0.89 H new ATOM 0 HA LEU B 41 7.266 -11.928 4.669 1.00 0.87 H new ATOM 0 HB2 LEU B 41 6.656 -9.888 6.067 1.00 0.96 H new ATOM 0 HB3 LEU B 41 7.879 -9.010 5.171 1.00 0.96 H new ATOM 0 HG LEU B 41 5.533 -8.675 4.442 1.00 0.95 H new ATOM 0 HD11 LEU B 41 5.994 -8.745 2.010 1.00 2.62 H new ATOM 0 HD12 LEU B 41 7.345 -8.074 2.954 1.00 2.62 H new ATOM 0 HD13 LEU B 41 7.434 -9.740 2.334 1.00 2.62 H new ATOM 0 HD21 LEU B 41 4.456 -10.344 2.965 1.00 2.20 H new ATOM 0 HD22 LEU B 41 5.734 -11.509 3.385 1.00 2.20 H new ATOM 0 HD23 LEU B 41 4.628 -10.909 4.644 1.00 2.20 H new ATOM 2293 N VAL B 42 10.054 -10.254 4.054 1.00 0.80 N ATOM 2294 CA VAL B 42 11.078 -9.961 3.064 1.00 0.75 C ATOM 2295 C VAL B 42 11.835 -11.243 2.733 1.00 0.71 C ATOM 2296 O VAL B 42 12.170 -11.502 1.579 1.00 0.70 O ATOM 2297 CB VAL B 42 11.992 -8.799 3.504 1.00 0.74 C ATOM 2298 CG1 VAL B 42 11.227 -7.471 3.464 1.00 0.74 C ATOM 2299 CG2 VAL B 42 12.647 -8.949 4.873 1.00 0.74 C ATOM 0 H VAL B 42 10.219 -9.815 4.960 1.00 0.80 H new ATOM 0 HA VAL B 42 10.607 -9.607 2.147 1.00 0.75 H new ATOM 0 HB VAL B 42 12.808 -8.817 2.781 1.00 0.74 H new ATOM 0 HG11 VAL B 42 11.886 -6.662 3.777 1.00 0.74 H new ATOM 0 HG12 VAL B 42 10.878 -7.282 2.449 1.00 0.74 H new ATOM 0 HG13 VAL B 42 10.372 -7.523 4.138 1.00 0.74 H new ATOM 0 HG21 VAL B 42 13.266 -8.075 5.078 1.00 0.74 H new ATOM 0 HG22 VAL B 42 11.875 -9.035 5.638 1.00 0.74 H new ATOM 0 HG23 VAL B 42 13.269 -9.844 4.883 1.00 0.74 H new ATOM 2309 N THR B 43 12.062 -12.056 3.761 1.00 0.76 N ATOM 2310 CA THR B 43 12.680 -13.360 3.635 1.00 0.81 C ATOM 2311 C THR B 43 11.816 -14.308 2.792 1.00 0.86 C ATOM 2312 O THR B 43 12.319 -14.922 1.855 1.00 0.88 O ATOM 2313 CB THR B 43 12.913 -13.896 5.049 1.00 0.89 C ATOM 2314 OG1 THR B 43 13.702 -12.975 5.776 1.00 0.90 O ATOM 2315 CG2 THR B 43 13.621 -15.253 5.057 1.00 0.97 C ATOM 0 H THR B 43 11.814 -11.816 4.721 1.00 0.76 H new ATOM 0 HA THR B 43 13.632 -13.283 3.110 1.00 0.81 H new ATOM 0 HB THR B 43 11.932 -14.026 5.506 1.00 0.89 H new ATOM 0 HG1 THR B 43 13.137 -12.242 6.097 1.00 0.90 H new ATOM 0 HG21 THR B 43 13.760 -15.585 6.086 1.00 0.97 H new ATOM 0 HG22 THR B 43 13.015 -15.983 4.519 1.00 0.97 H new ATOM 0 HG23 THR B 43 14.592 -15.159 4.571 1.00 0.97 H new ATOM 2323 N GLN B 44 10.541 -14.488 3.159 1.00 0.91 N ATOM 2324 CA GLN B 44 9.730 -15.588 2.658 1.00 0.94 C ATOM 2325 C GLN B 44 9.163 -15.301 1.266 1.00 0.94 C ATOM 2326 O GLN B 44 9.452 -16.032 0.323 1.00 0.91 O ATOM 2327 CB GLN B 44 8.620 -15.877 3.678 1.00 1.05 C ATOM 2328 CG GLN B 44 7.824 -17.146 3.351 1.00 1.17 C ATOM 2329 CD GLN B 44 6.757 -17.381 4.413 1.00 1.30 C ATOM 2330 OE1 GLN B 44 6.876 -18.281 5.237 1.00 1.88 O ATOM 2331 NE2 GLN B 44 5.712 -16.562 4.411 1.00 2.25 N ATOM 0 H GLN B 44 10.051 -13.874 3.809 1.00 0.91 H new ATOM 0 HA GLN B 44 10.358 -16.471 2.542 1.00 0.94 H new ATOM 0 HB2 GLN B 44 9.062 -15.977 4.669 1.00 1.05 H new ATOM 0 HB3 GLN B 44 7.939 -15.027 3.717 1.00 1.05 H new ATOM 0 HG2 GLN B 44 7.358 -17.050 2.370 1.00 1.17 H new ATOM 0 HG3 GLN B 44 8.495 -18.004 3.302 1.00 1.17 H new ATOM 0 HE21 GLN B 44 5.644 -15.823 3.711 1.00 2.25 H new ATOM 0 HE22 GLN B 44 4.977 -16.671 5.110 1.00 2.25 H new ATOM 2340 N GLN B 45 8.328 -14.264 1.133 1.00 1.02 N ATOM 2341 CA GLN B 45 7.591 -14.047 -0.109 1.00 1.08 C ATOM 2342 C GLN B 45 8.475 -13.359 -1.148 1.00 1.01 C ATOM 2343 O GLN B 45 8.427 -13.696 -2.326 1.00 1.12 O ATOM 2344 CB GLN B 45 6.297 -13.245 0.125 1.00 1.34 C ATOM 2345 CG GLN B 45 5.013 -14.069 -0.083 1.00 1.95 C ATOM 2346 CD GLN B 45 4.691 -15.018 1.063 1.00 1.67 C ATOM 2347 OE1 GLN B 45 5.447 -15.136 2.025 1.00 2.48 O ATOM 2348 NE2 GLN B 45 3.550 -15.693 0.982 1.00 2.15 N ATOM 0 H GLN B 45 8.150 -13.573 1.861 1.00 1.02 H new ATOM 0 HA GLN B 45 7.302 -15.025 -0.492 1.00 1.08 H new ATOM 0 HB2 GLN B 45 6.304 -12.849 1.141 1.00 1.34 H new ATOM 0 HB3 GLN B 45 6.283 -12.390 -0.550 1.00 1.34 H new ATOM 0 HG2 GLN B 45 4.175 -13.386 -0.222 1.00 1.95 H new ATOM 0 HG3 GLN B 45 5.110 -14.646 -1.002 1.00 1.95 H new ATOM 0 HE21 GLN B 45 2.943 -15.574 0.171 1.00 2.15 H new ATOM 0 HE22 GLN B 45 3.280 -16.331 1.731 1.00 2.15 H new ATOM 2357 N LEU B 46 9.231 -12.344 -0.734 1.00 0.90 N ATOM 2358 CA LEU B 46 9.809 -11.361 -1.647 1.00 0.85 C ATOM 2359 C LEU B 46 11.108 -11.704 -2.392 1.00 1.09 C ATOM 2360 O LEU B 46 11.391 -10.941 -3.315 1.00 1.51 O ATOM 2361 CB LEU B 46 9.967 -10.021 -0.914 1.00 1.03 C ATOM 2362 CG LEU B 46 8.713 -9.136 -0.991 1.00 1.47 C ATOM 2363 CD1 LEU B 46 7.428 -9.899 -0.677 1.00 2.48 C ATOM 2364 CD2 LEU B 46 8.866 -7.959 -0.029 1.00 1.49 C ATOM 0 H LEU B 46 9.460 -12.180 0.246 1.00 0.90 H new ATOM 0 HA LEU B 46 9.082 -11.330 -2.459 1.00 0.85 H new ATOM 0 HB2 LEU B 46 10.205 -10.213 0.132 1.00 1.03 H new ATOM 0 HB3 LEU B 46 10.812 -9.480 -1.339 1.00 1.03 H new ATOM 0 HG LEU B 46 8.626 -8.782 -2.018 1.00 1.47 H new ATOM 0 HD11 LEU B 46 6.577 -9.222 -0.747 1.00 2.48 H new ATOM 0 HD12 LEU B 46 7.304 -10.713 -1.391 1.00 2.48 H new ATOM 0 HD13 LEU B 46 7.485 -10.307 0.332 1.00 2.48 H new ATOM 0 HD21 LEU B 46 7.978 -7.329 -0.081 1.00 1.49 H new ATOM 0 HD22 LEU B 46 8.986 -8.333 0.988 1.00 1.49 H new ATOM 0 HD23 LEU B 46 9.743 -7.374 -0.306 1.00 1.49 H new ATOM 2376 N PRO B 47 11.946 -12.688 -1.994 1.00 1.31 N ATOM 2377 CA PRO B 47 13.400 -12.617 -2.143 1.00 1.30 C ATOM 2378 C PRO B 47 13.868 -12.279 -3.563 1.00 1.39 C ATOM 2379 O PRO B 47 14.122 -13.155 -4.384 1.00 3.12 O ATOM 2380 CB PRO B 47 13.972 -13.934 -1.597 1.00 1.67 C ATOM 2381 CG PRO B 47 12.774 -14.876 -1.589 1.00 2.22 C ATOM 2382 CD PRO B 47 11.597 -13.938 -1.339 1.00 2.27 C ATOM 0 HA PRO B 47 13.788 -11.776 -1.568 1.00 1.30 H new ATOM 0 HB2 PRO B 47 14.775 -14.314 -2.229 1.00 1.67 H new ATOM 0 HB3 PRO B 47 14.387 -13.806 -0.597 1.00 1.67 H new ATOM 0 HG2 PRO B 47 12.672 -15.407 -2.536 1.00 2.22 H new ATOM 0 HG3 PRO B 47 12.860 -15.631 -0.808 1.00 2.22 H new ATOM 0 HD2 PRO B 47 10.674 -14.350 -1.747 1.00 2.27 H new ATOM 0 HD3 PRO B 47 11.435 -13.789 -0.272 1.00 2.27 H new ATOM 2390 N HIS B 48 13.996 -10.971 -3.800 1.00 1.40 N ATOM 2391 CA HIS B 48 14.318 -10.282 -5.033 1.00 1.18 C ATOM 2392 C HIS B 48 13.721 -8.885 -4.919 1.00 1.12 C ATOM 2393 O HIS B 48 14.479 -7.921 -4.959 1.00 1.80 O ATOM 2394 CB HIS B 48 13.813 -10.950 -6.329 1.00 1.19 C ATOM 2395 CG HIS B 48 13.843 -9.963 -7.482 1.00 1.82 C ATOM 2396 ND1 HIS B 48 12.727 -9.326 -7.983 1.00 3.30 N ATOM 2397 CD2 HIS B 48 14.914 -9.146 -7.750 1.00 2.23 C ATOM 2398 CE1 HIS B 48 13.119 -8.155 -8.513 1.00 3.95 C ATOM 2399 NE2 HIS B 48 14.443 -7.970 -8.349 1.00 3.24 N ATOM 0 H HIS B 48 13.859 -10.303 -3.041 1.00 1.40 H new ATOM 0 HA HIS B 48 15.403 -10.292 -5.132 1.00 1.18 H new ATOM 0 HB2 HIS B 48 14.434 -11.814 -6.566 1.00 1.19 H new ATOM 0 HB3 HIS B 48 12.797 -11.318 -6.184 1.00 1.19 H new ATOM 0 HD1 HIS B 48 11.771 -9.682 -7.956 1.00 3.30 H new ATOM 0 HD2 HIS B 48 15.948 -9.372 -7.535 1.00 2.23 H new ATOM 0 HE1 HIS B 48 12.460 -7.455 -9.005 1.00 3.95 H new ATOM 2407 N LEU B 49 12.388 -8.764 -4.854 1.00 0.82 N ATOM 2408 CA LEU B 49 11.677 -7.502 -5.064 1.00 0.81 C ATOM 2409 C LEU B 49 12.321 -6.411 -4.220 1.00 0.97 C ATOM 2410 O LEU B 49 13.109 -5.610 -4.732 1.00 1.07 O ATOM 2411 CB LEU B 49 10.184 -7.682 -4.764 1.00 0.75 C ATOM 2412 CG LEU B 49 9.383 -6.378 -4.925 1.00 0.76 C ATOM 2413 CD1 LEU B 49 9.313 -5.927 -6.383 1.00 0.79 C ATOM 2414 CD2 LEU B 49 7.958 -6.593 -4.427 1.00 0.83 C ATOM 0 H LEU B 49 11.770 -9.550 -4.652 1.00 0.82 H new ATOM 0 HA LEU B 49 11.753 -7.195 -6.107 1.00 0.81 H new ATOM 0 HB2 LEU B 49 9.773 -8.440 -5.430 1.00 0.75 H new ATOM 0 HB3 LEU B 49 10.065 -8.053 -3.746 1.00 0.75 H new ATOM 0 HG LEU B 49 9.893 -5.609 -4.345 1.00 0.76 H new ATOM 0 HD11 LEU B 49 8.739 -5.003 -6.451 1.00 0.79 H new ATOM 0 HD12 LEU B 49 10.321 -5.756 -6.760 1.00 0.79 H new ATOM 0 HD13 LEU B 49 8.829 -6.700 -6.980 1.00 0.79 H new ATOM 0 HD21 LEU B 49 7.390 -5.670 -4.541 1.00 0.83 H new ATOM 0 HD22 LEU B 49 7.485 -7.384 -5.008 1.00 0.83 H new ATOM 0 HD23 LEU B 49 7.979 -6.879 -3.375 1.00 0.83 H new ATOM 2426 N LEU B 50 12.086 -6.477 -2.909 1.00 1.09 N ATOM 2427 CA LEU B 50 13.099 -6.039 -1.978 1.00 1.08 C ATOM 2428 C LEU B 50 14.174 -7.123 -1.985 1.00 1.20 C ATOM 2429 O LEU B 50 13.880 -8.318 -1.909 1.00 2.02 O ATOM 2430 CB LEU B 50 12.516 -5.821 -0.578 1.00 1.26 C ATOM 2431 CG LEU B 50 11.580 -4.600 -0.510 1.00 0.94 C ATOM 2432 CD1 LEU B 50 10.914 -4.557 0.866 1.00 1.32 C ATOM 2433 CD2 LEU B 50 12.334 -3.280 -0.722 1.00 0.93 C ATOM 0 H LEU B 50 11.224 -6.821 -2.486 1.00 1.09 H new ATOM 0 HA LEU B 50 13.517 -5.076 -2.270 1.00 1.08 H new ATOM 0 HB2 LEU B 50 11.967 -6.712 -0.274 1.00 1.26 H new ATOM 0 HB3 LEU B 50 13.330 -5.690 0.134 1.00 1.26 H new ATOM 0 HG LEU B 50 10.843 -4.706 -1.306 1.00 0.94 H new ATOM 0 HD11 LEU B 50 10.249 -3.695 0.922 1.00 1.32 H new ATOM 0 HD12 LEU B 50 10.338 -5.470 1.020 1.00 1.32 H new ATOM 0 HD13 LEU B 50 11.679 -4.476 1.638 1.00 1.32 H new ATOM 0 HD21 LEU B 50 11.633 -2.447 -0.665 1.00 0.93 H new ATOM 0 HD22 LEU B 50 13.094 -3.167 0.051 1.00 0.93 H new ATOM 0 HD23 LEU B 50 12.811 -3.287 -1.702 1.00 0.93 H new ATOM 2445 N LYS B 51 15.415 -6.671 -2.112 1.00 1.06 N ATOM 2446 CA LYS B 51 16.624 -7.434 -1.905 1.00 1.21 C ATOM 2447 C LYS B 51 17.387 -6.651 -0.847 1.00 1.16 C ATOM 2448 O LYS B 51 16.995 -5.529 -0.521 1.00 1.87 O ATOM 2449 CB LYS B 51 17.423 -7.651 -3.208 1.00 1.60 C ATOM 2450 CG LYS B 51 18.004 -6.394 -3.886 1.00 1.85 C ATOM 2451 CD LYS B 51 16.979 -5.564 -4.672 1.00 3.11 C ATOM 2452 CE LYS B 51 16.622 -6.199 -6.036 1.00 4.72 C ATOM 2453 NZ LYS B 51 15.218 -5.962 -6.449 1.00 6.56 N ATOM 0 H LYS B 51 15.608 -5.705 -2.378 1.00 1.06 H new ATOM 0 HA LYS B 51 16.418 -8.452 -1.576 1.00 1.21 H new ATOM 0 HB2 LYS B 51 18.247 -8.332 -2.992 1.00 1.60 H new ATOM 0 HB3 LYS B 51 16.774 -8.154 -3.925 1.00 1.60 H new ATOM 0 HG2 LYS B 51 18.457 -5.761 -3.123 1.00 1.85 H new ATOM 0 HG3 LYS B 51 18.803 -6.698 -4.563 1.00 1.85 H new ATOM 0 HD2 LYS B 51 16.072 -5.455 -4.077 1.00 3.11 H new ATOM 0 HD3 LYS B 51 17.376 -4.562 -4.834 1.00 3.11 H new ATOM 0 HE2 LYS B 51 17.289 -5.800 -6.800 1.00 4.72 H new ATOM 0 HE3 LYS B 51 16.801 -7.273 -5.986 1.00 4.72 H new ATOM 0 HZ1 LYS B 51 15.046 -6.414 -7.370 1.00 6.56 H new ATOM 0 HZ2 LYS B 51 14.574 -6.367 -5.739 1.00 6.56 H new ATOM 0 HZ3 LYS B 51 15.047 -4.939 -6.528 1.00 6.56 H new ATOM 2467 N ASP B 52 18.431 -7.270 -0.306 1.00 1.11 N ATOM 2468 CA ASP B 52 18.921 -6.999 1.033 1.00 1.21 C ATOM 2469 C ASP B 52 17.811 -7.330 2.027 1.00 1.16 C ATOM 2470 O ASP B 52 17.056 -6.471 2.484 1.00 1.72 O ATOM 2471 CB ASP B 52 19.489 -5.592 1.248 1.00 1.55 C ATOM 2472 CG ASP B 52 19.723 -5.396 2.745 1.00 2.49 C ATOM 2473 OD1 ASP B 52 20.171 -6.372 3.393 1.00 3.56 O ATOM 2474 OD2 ASP B 52 19.363 -4.308 3.243 1.00 3.01 O ATOM 0 H ASP B 52 18.967 -7.986 -0.797 1.00 1.11 H new ATOM 0 HA ASP B 52 19.787 -7.641 1.196 1.00 1.21 H new ATOM 0 HB2 ASP B 52 20.422 -5.471 0.698 1.00 1.55 H new ATOM 0 HB3 ASP B 52 18.796 -4.840 0.870 1.00 1.55 H new ATOM 2479 N VAL B 53 17.753 -8.614 2.367 1.00 0.94 N ATOM 2480 CA VAL B 53 16.997 -9.105 3.499 1.00 1.01 C ATOM 2481 C VAL B 53 17.878 -9.088 4.757 1.00 1.36 C ATOM 2482 O VAL B 53 17.447 -9.562 5.809 1.00 1.63 O ATOM 2483 CB VAL B 53 16.459 -10.510 3.176 1.00 1.07 C ATOM 2484 CG1 VAL B 53 15.576 -10.489 1.921 1.00 1.34 C ATOM 2485 CG2 VAL B 53 17.567 -11.561 3.001 1.00 1.62 C ATOM 0 H VAL B 53 18.239 -9.348 1.852 1.00 0.94 H new ATOM 0 HA VAL B 53 16.141 -8.460 3.697 1.00 1.01 H new ATOM 0 HB VAL B 53 15.865 -10.802 4.042 1.00 1.07 H new ATOM 0 HG11 VAL B 53 15.210 -11.495 1.717 1.00 1.34 H new ATOM 0 HG12 VAL B 53 14.730 -9.821 2.082 1.00 1.34 H new ATOM 0 HG13 VAL B 53 16.160 -10.136 1.071 1.00 1.34 H new ATOM 0 HG21 VAL B 53 17.118 -12.528 2.775 1.00 1.62 H new ATOM 0 HG22 VAL B 53 18.223 -11.265 2.182 1.00 1.62 H new ATOM 0 HG23 VAL B 53 18.146 -11.636 3.921 1.00 1.62 H new ATOM 2495 N GLY B 54 19.114 -8.574 4.671 1.00 1.69 N ATOM 2496 CA GLY B 54 20.082 -8.625 5.749 1.00 2.28 C ATOM 2497 C GLY B 54 19.889 -7.395 6.619 1.00 2.01 C ATOM 2498 O GLY B 54 19.338 -7.508 7.723 1.00 2.35 O ATOM 0 H GLY B 54 19.463 -8.107 3.834 1.00 1.69 H new ATOM 0 HA2 GLY B 54 19.947 -9.532 6.338 1.00 2.28 H new ATOM 0 HA3 GLY B 54 21.096 -8.652 5.349 1.00 2.28 H new ATOM 2502 N SER B 55 20.279 -6.236 6.078 1.00 1.57 N ATOM 2503 CA SER B 55 20.147 -4.924 6.700 1.00 1.41 C ATOM 2504 C SER B 55 18.688 -4.492 6.566 1.00 1.10 C ATOM 2505 O SER B 55 18.328 -3.545 5.872 1.00 1.28 O ATOM 2506 CB SER B 55 21.131 -3.924 6.070 1.00 1.61 C ATOM 2507 OG SER B 55 21.477 -2.905 6.990 1.00 2.61 O ATOM 0 H SER B 55 20.713 -6.190 5.156 1.00 1.57 H new ATOM 0 HA SER B 55 20.404 -4.962 7.758 1.00 1.41 H new ATOM 0 HB2 SER B 55 22.031 -4.448 5.747 1.00 1.61 H new ATOM 0 HB3 SER B 55 20.684 -3.480 5.181 1.00 1.61 H new ATOM 0 HG SER B 55 20.696 -2.679 7.537 1.00 2.61 H new ATOM 2513 N LEU B 56 17.824 -5.260 7.219 1.00 0.99 N ATOM 2514 CA LEU B 56 16.399 -5.067 7.296 1.00 0.82 C ATOM 2515 C LEU B 56 16.107 -3.911 8.261 1.00 0.88 C ATOM 2516 O LEU B 56 15.125 -3.196 8.083 1.00 0.89 O ATOM 2517 CB LEU B 56 15.850 -6.433 7.724 1.00 0.82 C ATOM 2518 CG LEU B 56 14.334 -6.636 7.744 1.00 0.79 C ATOM 2519 CD1 LEU B 56 13.762 -6.308 9.121 1.00 0.93 C ATOM 2520 CD2 LEU B 56 13.621 -5.860 6.641 1.00 0.78 C ATOM 0 H LEU B 56 18.129 -6.083 7.738 1.00 0.99 H new ATOM 0 HA LEU B 56 15.918 -4.771 6.364 1.00 0.82 H new ATOM 0 HB2 LEU B 56 16.276 -7.185 7.060 1.00 0.82 H new ATOM 0 HB3 LEU B 56 16.226 -6.642 8.725 1.00 0.82 H new ATOM 0 HG LEU B 56 14.150 -7.691 7.540 1.00 0.79 H new ATOM 0 HD11 LEU B 56 12.683 -6.459 9.112 1.00 0.93 H new ATOM 0 HD12 LEU B 56 14.214 -6.961 9.868 1.00 0.93 H new ATOM 0 HD13 LEU B 56 13.981 -5.269 9.368 1.00 0.93 H new ATOM 0 HD21 LEU B 56 12.548 -6.042 6.704 1.00 0.78 H new ATOM 0 HD22 LEU B 56 13.816 -4.794 6.761 1.00 0.78 H new ATOM 0 HD23 LEU B 56 13.989 -6.189 5.669 1.00 0.78 H new ATOM 2532 N ASP B 57 16.998 -3.688 9.233 1.00 1.10 N ATOM 2533 CA ASP B 57 17.027 -2.538 10.129 1.00 1.35 C ATOM 2534 C ASP B 57 16.742 -1.222 9.391 1.00 1.37 C ATOM 2535 O ASP B 57 15.894 -0.442 9.822 1.00 1.49 O ATOM 2536 CB ASP B 57 18.380 -2.497 10.854 1.00 1.77 C ATOM 2537 CG ASP B 57 19.550 -2.151 9.939 1.00 3.15 C ATOM 2538 OD1 ASP B 57 19.526 -2.628 8.778 1.00 3.80 O ATOM 2539 OD2 ASP B 57 20.420 -1.390 10.402 1.00 4.33 O ATOM 0 H ASP B 57 17.757 -4.343 9.422 1.00 1.10 H new ATOM 0 HA ASP B 57 16.230 -2.650 10.864 1.00 1.35 H new ATOM 0 HB2 ASP B 57 18.330 -1.764 11.659 1.00 1.77 H new ATOM 0 HB3 ASP B 57 18.565 -3.467 11.316 1.00 1.77 H new ATOM 2544 N GLU B 58 17.428 -0.994 8.270 1.00 1.36 N ATOM 2545 CA GLU B 58 17.228 0.138 7.374 1.00 1.53 C ATOM 2546 C GLU B 58 15.735 0.356 7.100 1.00 1.36 C ATOM 2547 O GLU B 58 15.192 1.448 7.294 1.00 1.52 O ATOM 2548 CB GLU B 58 18.019 -0.145 6.084 1.00 1.70 C ATOM 2549 CG GLU B 58 17.642 0.754 4.904 1.00 2.17 C ATOM 2550 CD GLU B 58 18.510 0.487 3.688 1.00 2.14 C ATOM 2551 OE1 GLU B 58 18.356 -0.600 3.083 1.00 3.26 O ATOM 2552 OE2 GLU B 58 19.324 1.357 3.309 1.00 2.22 O ATOM 0 H GLU B 58 18.167 -1.620 7.952 1.00 1.36 H new ATOM 0 HA GLU B 58 17.592 1.060 7.827 1.00 1.53 H new ATOM 0 HB2 GLU B 58 19.083 -0.027 6.291 1.00 1.70 H new ATOM 0 HB3 GLU B 58 17.864 -1.185 5.797 1.00 1.70 H new ATOM 0 HG2 GLU B 58 16.595 0.593 4.645 1.00 2.17 H new ATOM 0 HG3 GLU B 58 17.741 1.799 5.198 1.00 2.17 H new ATOM 2559 N LYS B 59 15.069 -0.702 6.640 1.00 1.10 N ATOM 2560 CA LYS B 59 13.664 -0.661 6.287 1.00 1.02 C ATOM 2561 C LYS B 59 12.874 -0.462 7.581 1.00 0.89 C ATOM 2562 O LYS B 59 12.120 0.500 7.694 1.00 0.89 O ATOM 2563 CB LYS B 59 13.259 -1.950 5.548 1.00 0.94 C ATOM 2564 CG LYS B 59 13.506 -1.967 4.028 1.00 1.36 C ATOM 2565 CD LYS B 59 14.959 -1.844 3.534 1.00 1.33 C ATOM 2566 CE LYS B 59 15.927 -2.852 4.176 1.00 2.95 C ATOM 2567 NZ LYS B 59 17.228 -2.952 3.481 1.00 3.93 N ATOM 0 H LYS B 59 15.500 -1.616 6.503 1.00 1.10 H new ATOM 0 HA LYS B 59 13.452 0.162 5.604 1.00 1.02 H new ATOM 0 HB2 LYS B 59 13.801 -2.785 5.993 1.00 0.94 H new ATOM 0 HB3 LYS B 59 12.198 -2.128 5.725 1.00 0.94 H new ATOM 0 HG2 LYS B 59 13.096 -2.896 3.633 1.00 1.36 H new ATOM 0 HG3 LYS B 59 12.932 -1.152 3.587 1.00 1.36 H new ATOM 0 HD2 LYS B 59 14.976 -1.978 2.452 1.00 1.33 H new ATOM 0 HD3 LYS B 59 15.316 -0.834 3.736 1.00 1.33 H new ATOM 0 HE2 LYS B 59 16.100 -2.566 5.213 1.00 2.95 H new ATOM 0 HE3 LYS B 59 15.457 -3.835 4.191 1.00 2.95 H new ATOM 0 HZ1 LYS B 59 17.870 -3.557 4.032 1.00 3.93 H new ATOM 0 HZ2 LYS B 59 17.087 -3.366 2.538 1.00 3.93 H new ATOM 0 HZ3 LYS B 59 17.644 -2.004 3.384 1.00 3.93 H new ATOM 2581 N MET B 60 13.076 -1.346 8.562 1.00 0.85 N ATOM 2582 CA MET B 60 12.418 -1.323 9.863 1.00 0.81 C ATOM 2583 C MET B 60 12.316 0.102 10.398 1.00 0.94 C ATOM 2584 O MET B 60 11.217 0.577 10.659 1.00 0.93 O ATOM 2585 CB MET B 60 13.165 -2.262 10.823 1.00 0.97 C ATOM 2586 CG MET B 60 12.550 -2.343 12.223 1.00 1.06 C ATOM 2587 SD MET B 60 13.040 -1.026 13.367 1.00 2.02 S ATOM 2588 CE MET B 60 12.161 -1.578 14.839 1.00 1.73 C ATOM 0 H MET B 60 13.727 -2.125 8.464 1.00 0.85 H new ATOM 0 HA MET B 60 11.394 -1.684 9.765 1.00 0.81 H new ATOM 0 HB2 MET B 60 13.189 -3.262 10.390 1.00 0.97 H new ATOM 0 HB3 MET B 60 14.199 -1.927 10.911 1.00 0.97 H new ATOM 0 HG2 MET B 60 11.464 -2.330 12.125 1.00 1.06 H new ATOM 0 HG3 MET B 60 12.819 -3.303 12.664 1.00 1.06 H new ATOM 0 HE1 MET B 60 12.303 -0.854 15.641 1.00 1.73 H new ATOM 0 HE2 MET B 60 11.098 -1.668 14.616 1.00 1.73 H new ATOM 0 HE3 MET B 60 12.549 -2.547 15.152 1.00 1.73 H new ATOM 2598 N LYS B 61 13.443 0.803 10.518 1.00 1.13 N ATOM 2599 CA LYS B 61 13.455 2.170 11.018 1.00 1.32 C ATOM 2600 C LYS B 61 12.636 3.102 10.118 1.00 1.34 C ATOM 2601 O LYS B 61 11.886 3.936 10.621 1.00 1.42 O ATOM 2602 CB LYS B 61 14.899 2.653 11.181 1.00 1.56 C ATOM 2603 CG LYS B 61 15.593 1.841 12.282 1.00 1.69 C ATOM 2604 CD LYS B 61 17.008 2.377 12.527 1.00 1.90 C ATOM 2605 CE LYS B 61 17.799 1.491 13.499 1.00 1.99 C ATOM 2606 NZ LYS B 61 17.067 1.249 14.759 1.00 2.77 N ATOM 0 H LYS B 61 14.364 0.440 10.273 1.00 1.13 H new ATOM 0 HA LYS B 61 12.979 2.189 11.998 1.00 1.32 H new ATOM 0 HB2 LYS B 61 15.438 2.543 10.240 1.00 1.56 H new ATOM 0 HB3 LYS B 61 14.912 3.713 11.434 1.00 1.56 H new ATOM 0 HG2 LYS B 61 15.012 1.894 13.203 1.00 1.69 H new ATOM 0 HG3 LYS B 61 15.639 0.791 11.994 1.00 1.69 H new ATOM 0 HD2 LYS B 61 17.541 2.440 11.578 1.00 1.90 H new ATOM 0 HD3 LYS B 61 16.948 3.389 12.926 1.00 1.90 H new ATOM 0 HE2 LYS B 61 18.019 0.537 13.020 1.00 1.99 H new ATOM 0 HE3 LYS B 61 18.755 1.964 13.722 1.00 1.99 H new ATOM 0 HZ1 LYS B 61 17.710 0.824 15.458 1.00 2.77 H new ATOM 0 HZ2 LYS B 61 16.702 2.151 15.127 1.00 2.77 H new ATOM 0 HZ3 LYS B 61 16.273 0.601 14.580 1.00 2.77 H new ATOM 2620 N SER B 62 12.760 2.954 8.796 1.00 1.32 N ATOM 2621 CA SER B 62 11.981 3.738 7.844 1.00 1.42 C ATOM 2622 C SER B 62 10.471 3.535 8.029 1.00 1.29 C ATOM 2623 O SER B 62 9.701 4.461 7.780 1.00 1.45 O ATOM 2624 CB SER B 62 12.408 3.425 6.405 1.00 1.51 C ATOM 2625 OG SER B 62 13.803 3.614 6.247 1.00 1.51 O ATOM 0 H SER B 62 13.401 2.290 8.361 1.00 1.32 H new ATOM 0 HA SER B 62 12.187 4.790 8.043 1.00 1.42 H new ATOM 0 HB2 SER B 62 12.144 2.397 6.157 1.00 1.51 H new ATOM 0 HB3 SER B 62 11.867 4.069 5.711 1.00 1.51 H new ATOM 0 HG SER B 62 14.282 2.845 6.621 1.00 1.51 H new ATOM 2631 N LEU B 63 10.035 2.343 8.452 1.00 1.05 N ATOM 2632 CA LEU B 63 8.640 2.118 8.814 1.00 0.97 C ATOM 2633 C LEU B 63 8.326 2.710 10.191 1.00 0.86 C ATOM 2634 O LEU B 63 7.399 3.502 10.338 1.00 0.91 O ATOM 2635 CB LEU B 63 8.299 0.626 8.859 1.00 1.05 C ATOM 2636 CG LEU B 63 8.149 -0.069 7.505 1.00 1.43 C ATOM 2637 CD1 LEU B 63 9.473 -0.538 6.920 1.00 1.30 C ATOM 2638 CD2 LEU B 63 7.214 -1.265 7.685 1.00 2.12 C ATOM 0 H LEU B 63 10.632 1.522 8.550 1.00 1.05 H new ATOM 0 HA LEU B 63 8.043 2.608 8.045 1.00 0.97 H new ATOM 0 HB2 LEU B 63 9.077 0.113 9.424 1.00 1.05 H new ATOM 0 HB3 LEU B 63 7.369 0.503 9.413 1.00 1.05 H new ATOM 0 HG LEU B 63 7.743 0.656 6.800 1.00 1.43 H new ATOM 0 HD11 LEU B 63 9.295 -1.022 5.960 1.00 1.30 H new ATOM 0 HD12 LEU B 63 10.132 0.319 6.778 1.00 1.30 H new ATOM 0 HD13 LEU B 63 9.942 -1.247 7.603 1.00 1.30 H new ATOM 0 HD21 LEU B 63 7.091 -1.778 6.731 1.00 2.12 H new ATOM 0 HD22 LEU B 63 7.640 -1.953 8.415 1.00 2.12 H new ATOM 0 HD23 LEU B 63 6.243 -0.918 8.038 1.00 2.12 H new ATOM 2650 N ASP B 64 9.073 2.268 11.207 1.00 0.82 N ATOM 2651 CA ASP B 64 8.758 2.386 12.629 1.00 0.89 C ATOM 2652 C ASP B 64 8.597 3.836 13.103 1.00 1.03 C ATOM 2653 O ASP B 64 8.033 4.052 14.167 1.00 1.20 O ATOM 2654 CB ASP B 64 9.772 1.575 13.468 1.00 0.98 C ATOM 2655 CG ASP B 64 9.348 1.245 14.904 1.00 1.22 C ATOM 2656 OD1 ASP B 64 8.295 1.720 15.378 1.00 1.74 O ATOM 2657 OD2 ASP B 64 10.106 0.538 15.595 1.00 1.65 O ATOM 0 H ASP B 64 9.961 1.793 11.048 1.00 0.82 H new ATOM 0 HA ASP B 64 7.772 1.949 12.785 1.00 0.89 H new ATOM 0 HB2 ASP B 64 9.978 0.640 12.947 1.00 0.98 H new ATOM 0 HB3 ASP B 64 10.709 2.131 13.506 1.00 0.98 H new ATOM 2662 N VAL B 65 9.055 4.839 12.343 1.00 1.03 N ATOM 2663 CA VAL B 65 9.865 6.007 12.714 1.00 1.16 C ATOM 2664 C VAL B 65 9.698 6.616 14.119 1.00 1.34 C ATOM 2665 O VAL B 65 10.659 7.188 14.627 1.00 1.51 O ATOM 2666 CB VAL B 65 9.605 7.114 11.668 1.00 1.18 C ATOM 2667 CG1 VAL B 65 9.997 6.681 10.250 1.00 1.36 C ATOM 2668 CG2 VAL B 65 8.133 7.564 11.642 1.00 1.50 C ATOM 0 H VAL B 65 8.844 4.853 11.345 1.00 1.03 H new ATOM 0 HA VAL B 65 10.883 5.618 12.735 1.00 1.16 H new ATOM 0 HB VAL B 65 10.233 7.948 11.980 1.00 1.18 H new ATOM 0 HG11 VAL B 65 9.795 7.494 9.552 1.00 1.36 H new ATOM 0 HG12 VAL B 65 11.059 6.437 10.225 1.00 1.36 H new ATOM 0 HG13 VAL B 65 9.416 5.804 9.964 1.00 1.36 H new ATOM 0 HG21 VAL B 65 8.004 8.343 10.890 1.00 1.50 H new ATOM 0 HG22 VAL B 65 7.497 6.714 11.396 1.00 1.50 H new ATOM 0 HG23 VAL B 65 7.855 7.955 12.621 1.00 1.50 H new ATOM 2678 N ASN B 66 8.548 6.482 14.783 1.00 1.42 N ATOM 2679 CA ASN B 66 8.487 6.630 16.238 1.00 1.59 C ATOM 2680 C ASN B 66 9.490 5.698 16.937 1.00 1.58 C ATOM 2681 O ASN B 66 10.035 6.068 17.972 1.00 1.91 O ATOM 2682 CB ASN B 66 7.059 6.461 16.781 1.00 1.74 C ATOM 2683 CG ASN B 66 6.354 5.184 16.327 1.00 1.71 C ATOM 2684 OD1 ASN B 66 6.769 4.065 16.625 1.00 1.74 O ATOM 2685 ND2 ASN B 66 5.260 5.326 15.587 1.00 2.51 N ATOM 0 H ASN B 66 7.653 6.273 14.340 1.00 1.42 H new ATOM 0 HA ASN B 66 8.781 7.653 16.471 1.00 1.59 H new ATOM 0 HB2 ASN B 66 7.095 6.473 17.870 1.00 1.74 H new ATOM 0 HB3 ASN B 66 6.463 7.319 16.472 1.00 1.74 H new ATOM 0 HD21 ASN B 66 4.755 4.502 15.260 1.00 2.51 H new ATOM 0 HD22 ASN B 66 4.925 6.259 15.346 1.00 2.51 H new ATOM 2692 N GLN B 67 9.772 4.530 16.349 1.00 1.35 N ATOM 2693 CA GLN B 67 10.889 3.662 16.712 1.00 1.53 C ATOM 2694 C GLN B 67 10.656 3.006 18.076 1.00 1.55 C ATOM 2695 O GLN B 67 11.349 3.312 19.045 1.00 1.71 O ATOM 2696 CB GLN B 67 12.234 4.396 16.573 1.00 2.03 C ATOM 2697 CG GLN B 67 13.412 3.408 16.636 1.00 2.30 C ATOM 2698 CD GLN B 67 14.737 4.010 16.174 1.00 2.32 C ATOM 2699 OE1 GLN B 67 15.585 3.302 15.630 1.00 2.65 O ATOM 2700 NE2 GLN B 67 14.944 5.307 16.378 1.00 2.95 N ATOM 0 H GLN B 67 9.210 4.155 15.585 1.00 1.35 H new ATOM 0 HA GLN B 67 10.944 2.836 16.003 1.00 1.53 H new ATOM 0 HB2 GLN B 67 12.260 4.938 15.628 1.00 2.03 H new ATOM 0 HB3 GLN B 67 12.332 5.135 17.368 1.00 2.03 H new ATOM 0 HG2 GLN B 67 13.522 3.051 17.660 1.00 2.30 H new ATOM 0 HG3 GLN B 67 13.181 2.540 16.018 1.00 2.30 H new ATOM 0 HE21 GLN B 67 14.226 5.873 16.831 1.00 2.95 H new ATOM 0 HE22 GLN B 67 15.821 5.736 16.082 1.00 2.95 H new ATOM 2709 N ASP B 68 9.679 2.094 18.134 1.00 1.58 N ATOM 2710 CA ASP B 68 9.266 1.386 19.348 1.00 1.61 C ATOM 2711 C ASP B 68 9.397 -0.144 19.212 1.00 1.43 C ATOM 2712 O ASP B 68 9.188 -0.850 20.197 1.00 1.89 O ATOM 2713 CB ASP B 68 7.831 1.808 19.737 1.00 1.71 C ATOM 2714 CG ASP B 68 6.834 1.477 18.646 1.00 1.49 C ATOM 2715 OD1 ASP B 68 7.158 0.637 17.790 1.00 1.52 O ATOM 2716 OD2 ASP B 68 5.840 2.187 18.389 1.00 1.66 O ATOM 0 H ASP B 68 9.139 1.821 17.313 1.00 1.58 H new ATOM 0 HA ASP B 68 9.945 1.671 20.152 1.00 1.61 H new ATOM 0 HB2 ASP B 68 7.541 1.305 20.659 1.00 1.71 H new ATOM 0 HB3 ASP B 68 7.809 2.879 19.938 1.00 1.71 H new ATOM 2721 N SER B 69 9.710 -0.670 18.018 1.00 1.32 N ATOM 2722 CA SER B 69 9.798 -2.098 17.723 1.00 1.11 C ATOM 2723 C SER B 69 8.425 -2.781 17.677 1.00 0.99 C ATOM 2724 O SER B 69 8.355 -4.011 17.667 1.00 1.10 O ATOM 2725 CB SER B 69 10.796 -2.822 18.640 1.00 1.29 C ATOM 2726 OG SER B 69 12.054 -2.172 18.598 1.00 2.14 O ATOM 0 H SER B 69 9.915 -0.087 17.206 1.00 1.32 H new ATOM 0 HA SER B 69 10.200 -2.178 16.713 1.00 1.11 H new ATOM 0 HB2 SER B 69 10.419 -2.836 19.663 1.00 1.29 H new ATOM 0 HB3 SER B 69 10.903 -3.860 18.326 1.00 1.29 H new ATOM 0 HG SER B 69 12.683 -2.639 19.187 1.00 2.14 H new ATOM 2732 N GLU B 70 7.355 -1.989 17.585 1.00 1.05 N ATOM 2733 CA GLU B 70 6.007 -2.378 17.224 1.00 1.13 C ATOM 2734 C GLU B 70 5.665 -1.675 15.908 1.00 1.02 C ATOM 2735 O GLU B 70 5.396 -0.467 15.883 1.00 1.07 O ATOM 2736 CB GLU B 70 5.009 -1.961 18.313 1.00 1.46 C ATOM 2737 CG GLU B 70 3.630 -2.562 17.999 1.00 2.14 C ATOM 2738 CD GLU B 70 2.482 -1.876 18.733 1.00 3.02 C ATOM 2739 OE1 GLU B 70 2.456 -0.626 18.715 1.00 3.94 O ATOM 2740 OE2 GLU B 70 1.613 -2.618 19.241 1.00 3.40 O ATOM 0 H GLU B 70 7.422 -0.989 17.776 1.00 1.05 H new ATOM 0 HA GLU B 70 5.945 -3.461 17.117 1.00 1.13 H new ATOM 0 HB2 GLU B 70 5.354 -2.304 19.288 1.00 1.46 H new ATOM 0 HB3 GLU B 70 4.941 -0.874 18.363 1.00 1.46 H new ATOM 0 HG2 GLU B 70 3.452 -2.500 16.925 1.00 2.14 H new ATOM 0 HG3 GLU B 70 3.636 -3.620 18.260 1.00 2.14 H new ATOM 2747 N LEU B 71 5.649 -2.446 14.824 1.00 0.97 N ATOM 2748 CA LEU B 71 5.104 -2.078 13.533 1.00 0.88 C ATOM 2749 C LEU B 71 3.596 -2.350 13.603 1.00 0.97 C ATOM 2750 O LEU B 71 3.149 -3.465 13.329 1.00 0.98 O ATOM 2751 CB LEU B 71 5.769 -2.914 12.424 1.00 0.86 C ATOM 2752 CG LEU B 71 7.269 -2.677 12.154 1.00 0.83 C ATOM 2753 CD1 LEU B 71 7.523 -1.286 11.575 1.00 0.91 C ATOM 2754 CD2 LEU B 71 8.189 -2.915 13.359 1.00 0.92 C ATOM 0 H LEU B 71 6.036 -3.390 14.829 1.00 0.97 H new ATOM 0 HA LEU B 71 5.292 -1.030 13.300 1.00 0.88 H new ATOM 0 HB2 LEU B 71 5.634 -3.967 12.671 1.00 0.86 H new ATOM 0 HB3 LEU B 71 5.228 -2.732 11.496 1.00 0.86 H new ATOM 0 HG LEU B 71 7.531 -3.438 11.419 1.00 0.83 H new ATOM 0 HD11 LEU B 71 8.590 -1.155 11.398 1.00 0.91 H new ATOM 0 HD12 LEU B 71 6.983 -1.179 10.634 1.00 0.91 H new ATOM 0 HD13 LEU B 71 7.177 -0.530 12.280 1.00 0.91 H new ATOM 0 HD21 LEU B 71 9.223 -2.723 13.071 1.00 0.92 H new ATOM 0 HD22 LEU B 71 7.908 -2.243 14.170 1.00 0.92 H new ATOM 0 HD23 LEU B 71 8.091 -3.948 13.693 1.00 0.92 H new ATOM 2766 N LYS B 72 2.815 -1.349 14.021 1.00 1.11 N ATOM 2767 CA LYS B 72 1.355 -1.436 14.127 1.00 1.19 C ATOM 2768 C LYS B 72 0.679 -1.131 12.787 1.00 1.19 C ATOM 2769 O LYS B 72 1.359 -0.738 11.835 1.00 1.17 O ATOM 2770 CB LYS B 72 0.860 -0.543 15.271 1.00 1.53 C ATOM 2771 CG LYS B 72 1.162 0.957 15.109 1.00 1.76 C ATOM 2772 CD LYS B 72 1.058 1.605 16.497 1.00 2.43 C ATOM 2773 CE LYS B 72 1.454 3.086 16.495 1.00 3.46 C ATOM 2774 NZ LYS B 72 1.842 3.535 17.851 1.00 4.23 N ATOM 0 H LYS B 72 3.186 -0.441 14.300 1.00 1.11 H new ATOM 0 HA LYS B 72 1.073 -2.460 14.372 1.00 1.19 H new ATOM 0 HB2 LYS B 72 -0.218 -0.672 15.371 1.00 1.53 H new ATOM 0 HB3 LYS B 72 1.310 -0.889 16.202 1.00 1.53 H new ATOM 0 HG2 LYS B 72 2.158 1.104 14.692 1.00 1.76 H new ATOM 0 HG3 LYS B 72 0.456 1.417 14.418 1.00 1.76 H new ATOM 0 HD2 LYS B 72 0.036 1.508 16.862 1.00 2.43 H new ATOM 0 HD3 LYS B 72 1.698 1.064 17.194 1.00 2.43 H new ATOM 0 HE2 LYS B 72 2.283 3.243 15.805 1.00 3.46 H new ATOM 0 HE3 LYS B 72 0.620 3.688 16.134 1.00 3.46 H new ATOM 0 HZ1 LYS B 72 2.105 4.541 17.822 1.00 4.23 H new ATOM 0 HZ2 LYS B 72 1.041 3.406 18.502 1.00 4.23 H new ATOM 0 HZ3 LYS B 72 2.652 2.975 18.184 1.00 4.23 H new ATOM 2788 N PHE B 73 -0.652 -1.283 12.683 1.00 1.28 N ATOM 2789 CA PHE B 73 -1.320 -1.252 11.376 1.00 1.28 C ATOM 2790 C PHE B 73 -1.655 0.171 10.883 1.00 1.26 C ATOM 2791 O PHE B 73 -2.673 0.403 10.234 1.00 1.30 O ATOM 2792 CB PHE B 73 -2.576 -2.150 11.431 1.00 1.47 C ATOM 2793 CG PHE B 73 -3.763 -1.613 12.227 1.00 2.29 C ATOM 2794 CD1 PHE B 73 -3.764 -1.661 13.635 1.00 3.65 C ATOM 2795 CD2 PHE B 73 -4.840 -0.995 11.559 1.00 3.20 C ATOM 2796 CE1 PHE B 73 -4.769 -1.000 14.364 1.00 5.10 C ATOM 2797 CE2 PHE B 73 -5.821 -0.300 12.287 1.00 4.75 C ATOM 2798 CZ PHE B 73 -5.776 -0.286 13.691 1.00 5.51 C ATOM 0 H PHE B 73 -1.277 -1.426 13.477 1.00 1.28 H new ATOM 0 HA PHE B 73 -0.619 -1.642 10.637 1.00 1.28 H new ATOM 0 HB2 PHE B 73 -2.907 -2.337 10.409 1.00 1.47 H new ATOM 0 HB3 PHE B 73 -2.289 -3.113 11.854 1.00 1.47 H new ATOM 0 HD1 PHE B 73 -2.991 -2.207 14.156 1.00 3.65 H new ATOM 0 HD2 PHE B 73 -4.911 -1.056 10.483 1.00 3.20 H new ATOM 0 HE1 PHE B 73 -4.767 -1.041 15.443 1.00 5.10 H new ATOM 0 HE2 PHE B 73 -6.610 0.223 11.767 1.00 4.75 H new ATOM 0 HZ PHE B 73 -6.512 0.271 14.251 1.00 5.51 H new ATOM 2808 N ASN B 74 -0.654 1.046 10.938 1.00 1.36 N ATOM 2809 CA ASN B 74 -0.049 1.712 9.794 1.00 1.14 C ATOM 2810 C ASN B 74 1.188 2.478 10.265 1.00 1.20 C ATOM 2811 O ASN B 74 1.311 3.692 10.130 1.00 1.55 O ATOM 2812 CB ASN B 74 -0.995 2.622 9.017 1.00 1.08 C ATOM 2813 CG ASN B 74 -0.178 3.283 7.911 1.00 1.59 C ATOM 2814 OD1 ASN B 74 0.528 2.609 7.169 1.00 2.95 O ATOM 2815 ND2 ASN B 74 -0.161 4.607 7.872 1.00 1.86 N ATOM 0 H ASN B 74 -0.225 1.320 11.822 1.00 1.36 H new ATOM 0 HA ASN B 74 0.227 0.934 9.083 1.00 1.14 H new ATOM 0 HB2 ASN B 74 -1.821 2.049 8.595 1.00 1.08 H new ATOM 0 HB3 ASN B 74 -1.432 3.374 9.674 1.00 1.08 H new ATOM 0 HD21 ASN B 74 0.450 5.090 7.213 1.00 1.86 H new ATOM 0 HD22 ASN B 74 -0.759 5.143 8.501 1.00 1.86 H new ATOM 2822 N GLU B 75 2.121 1.751 10.852 1.00 1.14 N ATOM 2823 CA GLU B 75 3.481 1.736 10.382 1.00 0.99 C ATOM 2824 C GLU B 75 3.562 0.657 9.300 1.00 1.05 C ATOM 2825 O GLU B 75 3.874 0.951 8.151 1.00 1.09 O ATOM 2826 CB GLU B 75 4.388 1.496 11.582 1.00 0.95 C ATOM 2827 CG GLU B 75 4.190 2.630 12.601 1.00 1.04 C ATOM 2828 CD GLU B 75 4.856 2.283 13.902 1.00 1.04 C ATOM 2829 OE1 GLU B 75 5.738 1.412 13.928 1.00 1.75 O ATOM 2830 OE2 GLU B 75 4.527 2.837 14.972 1.00 2.05 O ATOM 0 H GLU B 75 1.951 1.159 11.665 1.00 1.14 H new ATOM 0 HA GLU B 75 3.808 2.674 9.934 1.00 0.99 H new ATOM 0 HB2 GLU B 75 4.157 0.535 12.041 1.00 0.95 H new ATOM 0 HB3 GLU B 75 5.430 1.455 11.263 1.00 0.95 H new ATOM 0 HG2 GLU B 75 4.605 3.558 12.208 1.00 1.04 H new ATOM 0 HG3 GLU B 75 3.126 2.801 12.763 1.00 1.04 H new ATOM 2837 N TYR B 76 3.235 -0.590 9.674 1.00 1.14 N ATOM 2838 CA TYR B 76 3.467 -1.798 8.890 1.00 1.22 C ATOM 2839 C TYR B 76 3.158 -1.671 7.401 1.00 1.19 C ATOM 2840 O TYR B 76 4.001 -2.062 6.589 1.00 1.22 O ATOM 2841 CB TYR B 76 2.701 -2.985 9.482 1.00 1.36 C ATOM 2842 CG TYR B 76 2.832 -4.221 8.612 1.00 1.23 C ATOM 2843 CD1 TYR B 76 4.101 -4.805 8.425 1.00 2.38 C ATOM 2844 CD2 TYR B 76 1.767 -4.591 7.771 1.00 2.23 C ATOM 2845 CE1 TYR B 76 4.305 -5.745 7.400 1.00 2.90 C ATOM 2846 CE2 TYR B 76 1.980 -5.510 6.731 1.00 2.51 C ATOM 2847 CZ TYR B 76 3.241 -6.098 6.554 1.00 2.38 C ATOM 2848 OH TYR B 76 3.425 -7.008 5.556 1.00 3.22 O ATOM 0 H TYR B 76 2.784 -0.784 10.568 1.00 1.14 H new ATOM 0 HA TYR B 76 4.542 -1.968 8.955 1.00 1.22 H new ATOM 0 HB2 TYR B 76 3.078 -3.201 10.482 1.00 1.36 H new ATOM 0 HB3 TYR B 76 1.648 -2.723 9.588 1.00 1.36 H new ATOM 0 HD1 TYR B 76 4.920 -4.529 9.072 1.00 2.38 H new ATOM 0 HD2 TYR B 76 0.785 -4.168 7.925 1.00 2.23 H new ATOM 0 HE1 TYR B 76 5.277 -6.195 7.263 1.00 2.90 H new ATOM 0 HE2 TYR B 76 1.169 -5.765 6.065 1.00 2.51 H new ATOM 0 HH TYR B 76 3.816 -7.826 5.927 1.00 3.22 H new ATOM 2858 N TRP B 77 1.960 -1.174 7.044 1.00 1.14 N ATOM 2859 CA TRP B 77 1.560 -1.060 5.642 1.00 1.11 C ATOM 2860 C TRP B 77 2.708 -0.456 4.827 1.00 1.08 C ATOM 2861 O TRP B 77 2.915 -0.907 3.703 1.00 1.12 O ATOM 2862 CB TRP B 77 0.194 -0.349 5.427 1.00 1.17 C ATOM 2863 CG TRP B 77 0.153 0.708 4.349 1.00 0.94 C ATOM 2864 CD1 TRP B 77 0.636 0.603 3.092 1.00 1.47 C ATOM 2865 CD2 TRP B 77 -0.380 2.063 4.383 1.00 2.02 C ATOM 2866 NE1 TRP B 77 0.952 1.872 2.660 1.00 1.56 N ATOM 2867 CE2 TRP B 77 0.297 2.833 3.395 1.00 1.96 C ATOM 2868 CE3 TRP B 77 -1.422 2.722 5.058 1.00 3.65 C ATOM 2869 CZ2 TRP B 77 0.133 4.230 3.291 1.00 3.21 C ATOM 2870 CZ3 TRP B 77 -1.830 3.967 4.554 1.00 4.64 C ATOM 2871 CH2 TRP B 77 -0.832 4.828 4.103 1.00 4.56 C ATOM 0 H TRP B 77 1.259 -0.848 7.709 1.00 1.14 H new ATOM 0 HA TRP B 77 1.372 -2.066 5.267 1.00 1.11 H new ATOM 0 HB2 TRP B 77 -0.553 -1.107 5.192 1.00 1.17 H new ATOM 0 HB3 TRP B 77 -0.104 0.111 6.369 1.00 1.17 H new ATOM 0 HD1 TRP B 77 0.753 -0.310 2.528 1.00 1.47 H new ATOM 0 HE1 TRP B 77 1.591 2.074 1.891 1.00 1.56 H new ATOM 0 HE3 TRP B 77 -1.890 2.288 5.929 1.00 3.65 H new ATOM 0 HZ2 TRP B 77 0.732 4.815 2.609 1.00 3.21 H new ATOM 0 HZ3 TRP B 77 -2.873 4.245 4.517 1.00 4.64 H new ATOM 0 HH2 TRP B 77 -0.807 5.876 4.361 1.00 4.56 H new ATOM 2882 N ARG B 78 3.490 0.480 5.388 1.00 1.05 N ATOM 2883 CA ARG B 78 4.584 1.148 4.692 1.00 1.04 C ATOM 2884 C ARG B 78 5.290 0.194 3.738 1.00 1.00 C ATOM 2885 O ARG B 78 5.313 0.490 2.556 1.00 1.19 O ATOM 2886 CB ARG B 78 5.621 1.663 5.692 1.00 1.08 C ATOM 2887 CG ARG B 78 5.414 3.110 6.149 1.00 1.01 C ATOM 2888 CD ARG B 78 6.348 4.012 5.330 1.00 1.55 C ATOM 2889 NE ARG B 78 6.256 5.417 5.742 1.00 2.11 N ATOM 2890 CZ ARG B 78 7.023 6.400 5.243 1.00 2.94 C ATOM 2891 NH1 ARG B 78 7.864 6.163 4.231 1.00 3.66 N ATOM 2892 NH2 ARG B 78 6.938 7.631 5.760 1.00 3.89 N ATOM 0 H ARG B 78 3.373 0.793 6.352 1.00 1.05 H new ATOM 0 HA ARG B 78 4.150 1.977 4.133 1.00 1.04 H new ATOM 0 HB2 ARG B 78 5.611 1.016 6.569 1.00 1.08 H new ATOM 0 HB3 ARG B 78 6.611 1.577 5.243 1.00 1.08 H new ATOM 0 HG2 ARG B 78 4.376 3.409 6.006 1.00 1.01 H new ATOM 0 HG3 ARG B 78 5.629 3.207 7.213 1.00 1.01 H new ATOM 0 HD2 ARG B 78 7.376 3.668 5.443 1.00 1.55 H new ATOM 0 HD3 ARG B 78 6.098 3.927 4.272 1.00 1.55 H new ATOM 0 HE ARG B 78 5.566 5.663 6.452 1.00 2.11 H new ATOM 0 HH11 ARG B 78 7.928 5.228 3.830 1.00 3.66 H new ATOM 0 HH12 ARG B 78 8.441 6.918 3.860 1.00 3.66 H new ATOM 0 HH21 ARG B 78 6.294 7.818 6.528 1.00 3.89 H new ATOM 0 HH22 ARG B 78 7.518 8.382 5.386 1.00 3.89 H new ATOM 2906 N LEU B 79 5.787 -0.963 4.187 1.00 0.84 N ATOM 2907 CA LEU B 79 6.520 -1.871 3.301 1.00 0.73 C ATOM 2908 C LEU B 79 5.778 -2.117 1.980 1.00 0.80 C ATOM 2909 O LEU B 79 6.354 -2.021 0.900 1.00 0.84 O ATOM 2910 CB LEU B 79 6.778 -3.213 4.000 1.00 0.70 C ATOM 2911 CG LEU B 79 7.905 -4.005 3.318 1.00 0.62 C ATOM 2912 CD1 LEU B 79 9.274 -3.395 3.647 1.00 0.56 C ATOM 2913 CD2 LEU B 79 7.862 -5.465 3.780 1.00 0.77 C ATOM 0 H LEU B 79 5.696 -1.290 5.149 1.00 0.84 H new ATOM 0 HA LEU B 79 7.469 -1.388 3.069 1.00 0.73 H new ATOM 0 HB2 LEU B 79 7.039 -3.035 5.043 1.00 0.70 H new ATOM 0 HB3 LEU B 79 5.864 -3.806 3.997 1.00 0.70 H new ATOM 0 HG LEU B 79 7.758 -3.960 2.239 1.00 0.62 H new ATOM 0 HD11 LEU B 79 10.057 -3.971 3.154 1.00 0.56 H new ATOM 0 HD12 LEU B 79 9.307 -2.364 3.296 1.00 0.56 H new ATOM 0 HD13 LEU B 79 9.432 -3.416 4.725 1.00 0.56 H new ATOM 0 HD21 LEU B 79 8.662 -6.024 3.295 1.00 0.77 H new ATOM 0 HD22 LEU B 79 7.993 -5.508 4.861 1.00 0.77 H new ATOM 0 HD23 LEU B 79 6.900 -5.903 3.513 1.00 0.77 H new ATOM 2925 N ILE B 80 4.481 -2.401 2.078 1.00 0.93 N ATOM 2926 CA ILE B 80 3.607 -2.729 0.959 1.00 1.11 C ATOM 2927 C ILE B 80 3.347 -1.444 0.171 1.00 1.44 C ATOM 2928 O ILE B 80 3.349 -1.435 -1.061 1.00 1.52 O ATOM 2929 CB ILE B 80 2.304 -3.378 1.473 1.00 1.29 C ATOM 2930 CG1 ILE B 80 2.624 -4.628 2.318 1.00 1.49 C ATOM 2931 CG2 ILE B 80 1.391 -3.747 0.293 1.00 1.56 C ATOM 2932 CD1 ILE B 80 1.380 -5.291 2.921 1.00 1.87 C ATOM 0 H ILE B 80 3.994 -2.409 2.974 1.00 0.93 H new ATOM 0 HA ILE B 80 4.075 -3.458 0.297 1.00 1.11 H new ATOM 0 HB ILE B 80 1.782 -2.659 2.104 1.00 1.29 H new ATOM 0 HG12 ILE B 80 3.148 -5.354 1.696 1.00 1.49 H new ATOM 0 HG13 ILE B 80 3.304 -4.349 3.123 1.00 1.49 H new ATOM 0 HG21 ILE B 80 0.476 -4.204 0.670 1.00 1.56 H new ATOM 0 HG22 ILE B 80 1.142 -2.847 -0.270 1.00 1.56 H new ATOM 0 HG23 ILE B 80 1.906 -4.452 -0.359 1.00 1.56 H new ATOM 0 HD11 ILE B 80 1.678 -6.163 3.502 1.00 1.87 H new ATOM 0 HD12 ILE B 80 0.867 -4.581 3.570 1.00 1.87 H new ATOM 0 HD13 ILE B 80 0.709 -5.601 2.120 1.00 1.87 H new ATOM 2944 N GLY B 81 3.166 -0.346 0.906 1.00 1.74 N ATOM 2945 CA GLY B 81 3.108 0.997 0.372 1.00 2.08 C ATOM 2946 C GLY B 81 4.234 1.233 -0.626 1.00 2.02 C ATOM 2947 O GLY B 81 4.050 1.726 -1.734 1.00 2.33 O ATOM 0 H GLY B 81 3.053 -0.378 1.919 1.00 1.74 H new ATOM 0 HA2 GLY B 81 2.146 1.158 -0.114 1.00 2.08 H new ATOM 0 HA3 GLY B 81 3.180 1.720 1.185 1.00 2.08 H new ATOM 2951 N GLU B 82 5.436 0.942 -0.134 1.00 1.71 N ATOM 2952 CA GLU B 82 6.708 1.294 -0.706 1.00 1.78 C ATOM 2953 C GLU B 82 6.940 0.368 -1.892 1.00 1.64 C ATOM 2954 O GLU B 82 7.234 0.851 -2.983 1.00 1.72 O ATOM 2955 CB GLU B 82 7.776 1.175 0.392 1.00 1.68 C ATOM 2956 CG GLU B 82 7.465 2.082 1.608 1.00 1.82 C ATOM 2957 CD GLU B 82 8.193 3.412 1.667 1.00 2.41 C ATOM 2958 OE1 GLU B 82 8.649 3.867 0.597 1.00 2.64 O ATOM 2959 OE2 GLU B 82 8.220 3.996 2.773 1.00 3.47 O ATOM 0 H GLU B 82 5.540 0.418 0.735 1.00 1.71 H new ATOM 0 HA GLU B 82 6.749 2.319 -1.073 1.00 1.78 H new ATOM 0 HB2 GLU B 82 7.843 0.138 0.721 1.00 1.68 H new ATOM 0 HB3 GLU B 82 8.749 1.442 -0.019 1.00 1.68 H new ATOM 0 HG2 GLU B 82 6.393 2.279 1.620 1.00 1.82 H new ATOM 0 HG3 GLU B 82 7.697 1.526 2.516 1.00 1.82 H new ATOM 2966 N LEU B 83 6.728 -0.940 -1.693 1.00 1.47 N ATOM 2967 CA LEU B 83 6.752 -1.967 -2.732 1.00 1.52 C ATOM 2968 C LEU B 83 6.115 -1.459 -4.023 1.00 1.55 C ATOM 2969 O LEU B 83 6.681 -1.634 -5.103 1.00 1.58 O ATOM 2970 CB LEU B 83 5.963 -3.201 -2.270 1.00 1.85 C ATOM 2971 CG LEU B 83 6.813 -4.434 -1.957 1.00 0.64 C ATOM 2972 CD1 LEU B 83 7.537 -4.316 -0.619 1.00 2.09 C ATOM 2973 CD2 LEU B 83 5.873 -5.648 -1.949 1.00 1.89 C ATOM 0 H LEU B 83 6.528 -1.321 -0.768 1.00 1.47 H new ATOM 0 HA LEU B 83 7.796 -2.223 -2.915 1.00 1.52 H new ATOM 0 HB2 LEU B 83 5.393 -2.936 -1.380 1.00 1.85 H new ATOM 0 HB3 LEU B 83 5.242 -3.463 -3.044 1.00 1.85 H new ATOM 0 HG LEU B 83 7.589 -4.538 -2.715 1.00 0.64 H new ATOM 0 HD11 LEU B 83 8.126 -5.216 -0.444 1.00 2.09 H new ATOM 0 HD12 LEU B 83 8.197 -3.448 -0.637 1.00 2.09 H new ATOM 0 HD13 LEU B 83 6.806 -4.199 0.181 1.00 2.09 H new ATOM 0 HD21 LEU B 83 6.445 -6.549 -1.729 1.00 1.89 H new ATOM 0 HD22 LEU B 83 5.106 -5.509 -1.187 1.00 1.89 H new ATOM 0 HD23 LEU B 83 5.400 -5.748 -2.926 1.00 1.89 H new ATOM 2985 N ALA B 84 4.937 -0.835 -3.891 1.00 1.59 N ATOM 2986 CA ALA B 84 4.212 -0.265 -5.013 1.00 1.69 C ATOM 2987 C ALA B 84 5.139 0.539 -5.925 1.00 1.50 C ATOM 2988 O ALA B 84 5.054 0.373 -7.137 1.00 1.72 O ATOM 2989 CB ALA B 84 3.034 0.586 -4.533 1.00 1.76 C ATOM 0 H ALA B 84 4.465 -0.716 -2.994 1.00 1.59 H new ATOM 0 HA ALA B 84 3.810 -1.091 -5.600 1.00 1.69 H new ATOM 0 HB1 ALA B 84 2.509 1.000 -5.394 1.00 1.76 H new ATOM 0 HB2 ALA B 84 2.349 -0.034 -3.955 1.00 1.76 H new ATOM 0 HB3 ALA B 84 3.403 1.399 -3.908 1.00 1.76 H new ATOM 2995 N LYS B 85 6.007 1.404 -5.370 1.00 1.19 N ATOM 2996 CA LYS B 85 7.105 1.955 -6.173 1.00 0.90 C ATOM 2997 C LYS B 85 8.369 1.085 -6.287 1.00 0.93 C ATOM 2998 O LYS B 85 9.013 1.137 -7.331 1.00 0.90 O ATOM 2999 CB LYS B 85 7.382 3.450 -6.029 1.00 1.34 C ATOM 3000 CG LYS B 85 8.098 3.850 -4.757 1.00 1.09 C ATOM 3001 CD LYS B 85 7.066 4.116 -3.666 1.00 2.01 C ATOM 3002 CE LYS B 85 7.734 4.866 -2.528 1.00 0.85 C ATOM 3003 NZ LYS B 85 8.824 4.099 -1.887 1.00 1.42 N ATOM 0 H LYS B 85 5.971 1.726 -4.403 1.00 1.19 H new ATOM 0 HA LYS B 85 6.659 1.888 -7.166 1.00 0.90 H new ATOM 0 HB2 LYS B 85 7.978 3.777 -6.881 1.00 1.34 H new ATOM 0 HB3 LYS B 85 6.434 3.986 -6.078 1.00 1.34 H new ATOM 0 HG2 LYS B 85 8.780 3.059 -4.445 1.00 1.09 H new ATOM 0 HG3 LYS B 85 8.701 4.741 -4.929 1.00 1.09 H new ATOM 0 HD2 LYS B 85 6.237 4.699 -4.066 1.00 2.01 H new ATOM 0 HD3 LYS B 85 6.649 3.176 -3.304 1.00 2.01 H new ATOM 0 HE2 LYS B 85 8.134 5.807 -2.906 1.00 0.85 H new ATOM 0 HE3 LYS B 85 6.985 5.117 -1.777 1.00 0.85 H new ATOM 0 HZ1 LYS B 85 8.544 3.840 -0.920 1.00 1.42 H new ATOM 0 HZ2 LYS B 85 9.011 3.236 -2.436 1.00 1.42 H new ATOM 0 HZ3 LYS B 85 9.685 4.681 -1.854 1.00 1.42 H new ATOM 3017 N GLU B 86 8.781 0.322 -5.266 1.00 1.17 N ATOM 3018 CA GLU B 86 10.027 -0.451 -5.348 1.00 1.33 C ATOM 3019 C GLU B 86 10.032 -1.460 -6.500 1.00 1.52 C ATOM 3020 O GLU B 86 11.097 -1.900 -6.921 1.00 1.89 O ATOM 3021 CB GLU B 86 10.436 -1.127 -4.036 1.00 1.48 C ATOM 3022 CG GLU B 86 10.436 -0.219 -2.797 1.00 1.61 C ATOM 3023 CD GLU B 86 11.032 1.176 -3.006 1.00 2.20 C ATOM 3024 OE1 GLU B 86 12.239 1.270 -3.306 1.00 2.06 O ATOM 3025 OE2 GLU B 86 10.269 2.156 -2.842 1.00 3.85 O ATOM 0 H GLU B 86 8.277 0.224 -4.384 1.00 1.17 H new ATOM 0 HA GLU B 86 10.786 0.302 -5.558 1.00 1.33 H new ATOM 0 HB2 GLU B 86 9.761 -1.963 -3.852 1.00 1.48 H new ATOM 0 HB3 GLU B 86 11.435 -1.545 -4.159 1.00 1.48 H new ATOM 0 HG2 GLU B 86 9.409 -0.109 -2.448 1.00 1.61 H new ATOM 0 HG3 GLU B 86 10.991 -0.717 -2.002 1.00 1.61 H new ATOM 3032 N ILE B 87 8.860 -1.817 -7.034 1.00 1.40 N ATOM 3033 CA ILE B 87 8.771 -2.477 -8.334 1.00 1.42 C ATOM 3034 C ILE B 87 9.752 -1.834 -9.343 1.00 1.35 C ATOM 3035 O ILE B 87 10.522 -2.538 -9.992 1.00 1.76 O ATOM 3036 CB ILE B 87 7.298 -2.489 -8.811 1.00 1.33 C ATOM 3037 CG1 ILE B 87 7.066 -3.436 -10.002 1.00 1.56 C ATOM 3038 CG2 ILE B 87 6.816 -1.091 -9.219 1.00 1.18 C ATOM 3039 CD1 ILE B 87 7.019 -4.911 -9.593 1.00 0.94 C ATOM 0 H ILE B 87 7.959 -1.658 -6.582 1.00 1.40 H new ATOM 0 HA ILE B 87 9.082 -3.518 -8.249 1.00 1.42 H new ATOM 0 HB ILE B 87 6.728 -2.845 -7.953 1.00 1.33 H new ATOM 0 HG12 ILE B 87 6.130 -3.171 -10.493 1.00 1.56 H new ATOM 0 HG13 ILE B 87 7.861 -3.293 -10.733 1.00 1.56 H new ATOM 0 HG21 ILE B 87 5.778 -1.145 -9.547 1.00 1.18 H new ATOM 0 HG22 ILE B 87 6.892 -0.417 -8.366 1.00 1.18 H new ATOM 0 HG23 ILE B 87 7.435 -0.716 -10.034 1.00 1.18 H new ATOM 0 HD11 ILE B 87 6.853 -5.528 -10.476 1.00 0.94 H new ATOM 0 HD12 ILE B 87 7.964 -5.190 -9.128 1.00 0.94 H new ATOM 0 HD13 ILE B 87 6.206 -5.066 -8.884 1.00 0.94 H new ATOM 3051 N ARG B 88 9.709 -0.501 -9.486 1.00 1.08 N ATOM 3052 CA ARG B 88 10.665 0.307 -10.242 1.00 1.48 C ATOM 3053 C ARG B 88 11.902 0.718 -9.423 1.00 1.78 C ATOM 3054 O ARG B 88 13.023 0.658 -9.922 1.00 2.39 O ATOM 3055 CB ARG B 88 9.960 1.484 -10.952 1.00 1.50 C ATOM 3056 CG ARG B 88 9.030 2.326 -10.065 1.00 2.40 C ATOM 3057 CD ARG B 88 8.160 3.318 -10.847 1.00 2.33 C ATOM 3058 NE ARG B 88 8.921 4.434 -11.434 1.00 2.47 N ATOM 3059 CZ ARG B 88 8.332 5.511 -11.984 1.00 3.25 C ATOM 3060 NH1 ARG B 88 7.007 5.566 -12.107 1.00 4.40 N ATOM 3061 NH2 ARG B 88 9.034 6.559 -12.418 1.00 3.68 N ATOM 0 H ARG B 88 8.974 0.063 -9.058 1.00 1.08 H new ATOM 0 HA ARG B 88 11.074 -0.328 -11.028 1.00 1.48 H new ATOM 0 HB2 ARG B 88 10.721 2.139 -11.376 1.00 1.50 H new ATOM 0 HB3 ARG B 88 9.380 1.088 -11.785 1.00 1.50 H new ATOM 0 HG2 ARG B 88 8.382 1.658 -9.497 1.00 2.40 H new ATOM 0 HG3 ARG B 88 9.633 2.876 -9.342 1.00 2.40 H new ATOM 0 HD2 ARG B 88 7.641 2.784 -11.643 1.00 2.33 H new ATOM 0 HD3 ARG B 88 7.395 3.720 -10.182 1.00 2.33 H new ATOM 0 HE ARG B 88 9.940 4.388 -11.423 1.00 2.47 H new ATOM 0 HH11 ARG B 88 6.432 4.788 -11.783 1.00 4.40 H new ATOM 0 HH12 ARG B 88 6.567 6.386 -12.525 1.00 4.40 H new ATOM 0 HH21 ARG B 88 10.051 6.560 -12.338 1.00 3.68 H new ATOM 0 HH22 ARG B 88 8.554 7.359 -12.830 1.00 3.68 H new ATOM 3075 N LYS B 89 11.689 1.242 -8.213 1.00 1.49 N ATOM 3076 CA LYS B 89 12.687 1.987 -7.446 1.00 1.75 C ATOM 3077 C LYS B 89 13.680 1.054 -6.734 1.00 2.11 C ATOM 3078 O LYS B 89 13.291 0.006 -6.227 1.00 2.36 O ATOM 3079 CB LYS B 89 11.920 2.897 -6.477 1.00 1.65 C ATOM 3080 CG LYS B 89 12.767 4.007 -5.860 1.00 2.36 C ATOM 3081 CD LYS B 89 11.826 4.869 -5.005 1.00 2.53 C ATOM 3082 CE LYS B 89 12.511 6.129 -4.472 1.00 3.59 C ATOM 3083 NZ LYS B 89 12.747 7.128 -5.537 1.00 4.32 N ATOM 0 H LYS B 89 10.795 1.157 -7.729 1.00 1.49 H new ATOM 0 HA LYS B 89 13.308 2.593 -8.106 1.00 1.75 H new ATOM 0 HB2 LYS B 89 11.080 3.347 -7.006 1.00 1.65 H new ATOM 0 HB3 LYS B 89 11.502 2.287 -5.677 1.00 1.65 H new ATOM 0 HG2 LYS B 89 13.567 3.588 -5.249 1.00 2.36 H new ATOM 0 HG3 LYS B 89 13.241 4.607 -6.637 1.00 2.36 H new ATOM 0 HD2 LYS B 89 10.959 5.155 -5.600 1.00 2.53 H new ATOM 0 HD3 LYS B 89 11.457 4.277 -4.167 1.00 2.53 H new ATOM 0 HE2 LYS B 89 11.895 6.573 -3.690 1.00 3.59 H new ATOM 0 HE3 LYS B 89 13.462 5.858 -4.013 1.00 3.59 H new ATOM 0 HZ1 LYS B 89 13.665 7.591 -5.382 1.00 4.32 H new ATOM 0 HZ2 LYS B 89 12.750 6.654 -6.463 1.00 4.32 H new ATOM 0 HZ3 LYS B 89 11.992 7.842 -5.516 1.00 4.32 H new ATOM 3097 N LYS B 90 14.977 1.396 -6.738 1.00 2.52 N ATOM 3098 CA LYS B 90 16.008 0.637 -6.037 1.00 2.93 C ATOM 3099 C LYS B 90 16.117 1.055 -4.566 1.00 3.15 C ATOM 3100 O LYS B 90 15.996 0.225 -3.668 1.00 3.50 O ATOM 3101 CB LYS B 90 17.343 0.770 -6.788 1.00 3.36 C ATOM 3102 CG LYS B 90 18.406 -0.180 -6.218 1.00 4.52 C ATOM 3103 CD LYS B 90 19.673 -0.134 -7.082 1.00 4.45 C ATOM 3104 CE LYS B 90 20.730 -1.108 -6.541 1.00 5.89 C ATOM 3105 NZ LYS B 90 21.951 -1.124 -7.374 1.00 6.46 N ATOM 0 H LYS B 90 15.336 2.213 -7.232 1.00 2.52 H new ATOM 0 HA LYS B 90 15.729 -0.417 -6.026 1.00 2.93 H new ATOM 0 HB2 LYS B 90 17.190 0.554 -7.845 1.00 3.36 H new ATOM 0 HB3 LYS B 90 17.699 1.798 -6.721 1.00 3.36 H new ATOM 0 HG2 LYS B 90 18.645 0.103 -5.193 1.00 4.52 H new ATOM 0 HG3 LYS B 90 18.016 -1.197 -6.185 1.00 4.52 H new ATOM 0 HD2 LYS B 90 19.427 -0.391 -8.112 1.00 4.45 H new ATOM 0 HD3 LYS B 90 20.076 0.879 -7.094 1.00 4.45 H new ATOM 0 HE2 LYS B 90 20.992 -0.828 -5.521 1.00 5.89 H new ATOM 0 HE3 LYS B 90 20.308 -2.112 -6.498 1.00 5.89 H new ATOM 0 HZ1 LYS B 90 22.637 -1.795 -6.972 1.00 6.46 H new ATOM 0 HZ2 LYS B 90 21.707 -1.416 -8.342 1.00 6.46 H new ATOM 0 HZ3 LYS B 90 22.369 -0.172 -7.395 1.00 6.46 H new ATOM 3119 N LYS B 91 16.438 2.335 -4.344 1.00 3.12 N ATOM 3120 CA LYS B 91 16.655 2.960 -3.031 1.00 3.40 C ATOM 3121 C LYS B 91 16.829 4.474 -3.214 1.00 2.92 C ATOM 3122 O LYS B 91 17.573 5.146 -2.492 1.00 3.03 O ATOM 3123 CB LYS B 91 17.865 2.329 -2.302 1.00 4.44 C ATOM 3124 CG LYS B 91 17.822 2.603 -0.789 1.00 5.71 C ATOM 3125 CD LYS B 91 19.042 2.048 -0.040 1.00 6.37 C ATOM 3126 CE LYS B 91 18.973 0.523 0.131 1.00 7.36 C ATOM 3127 NZ LYS B 91 19.917 0.051 1.164 1.00 8.65 N ATOM 0 H LYS B 91 16.560 2.996 -5.111 1.00 3.12 H new ATOM 0 HA LYS B 91 15.784 2.781 -2.401 1.00 3.40 H new ATOM 0 HB2 LYS B 91 17.875 1.253 -2.477 1.00 4.44 H new ATOM 0 HB3 LYS B 91 18.790 2.728 -2.718 1.00 4.44 H new ATOM 0 HG2 LYS B 91 17.760 3.678 -0.622 1.00 5.71 H new ATOM 0 HG3 LYS B 91 16.916 2.163 -0.372 1.00 5.71 H new ATOM 0 HD2 LYS B 91 19.950 2.310 -0.583 1.00 6.37 H new ATOM 0 HD3 LYS B 91 19.110 2.519 0.941 1.00 6.37 H new ATOM 0 HE2 LYS B 91 17.959 0.232 0.403 1.00 7.36 H new ATOM 0 HE3 LYS B 91 19.199 0.039 -0.819 1.00 7.36 H new ATOM 0 HZ1 LYS B 91 19.493 -0.743 1.685 1.00 8.65 H new ATOM 0 HZ2 LYS B 91 20.799 -0.264 0.711 1.00 8.65 H new ATOM 0 HZ3 LYS B 91 20.125 0.827 1.825 1.00 8.65 H new ATOM 3141 N ASP B 92 16.147 5.036 -4.206 1.00 2.59 N ATOM 3142 CA ASP B 92 16.479 6.322 -4.794 1.00 2.49 C ATOM 3143 C ASP B 92 15.682 7.413 -4.076 1.00 2.41 C ATOM 3144 O ASP B 92 14.992 8.213 -4.707 1.00 2.92 O ATOM 3145 CB ASP B 92 16.202 6.231 -6.307 1.00 2.75 C ATOM 3146 CG ASP B 92 16.623 4.881 -6.885 1.00 4.06 C ATOM 3147 OD1 ASP B 92 15.899 3.903 -6.571 1.00 5.10 O ATOM 3148 OD2 ASP B 92 17.677 4.827 -7.545 1.00 4.75 O ATOM 0 H ASP B 92 15.330 4.597 -4.631 1.00 2.59 H new ATOM 0 HA ASP B 92 17.530 6.584 -4.672 1.00 2.49 H new ATOM 0 HB2 ASP B 92 15.139 6.389 -6.491 1.00 2.75 H new ATOM 0 HB3 ASP B 92 16.737 7.029 -6.822 1.00 2.75 H new ATOM 3153 N LEU B 93 15.689 7.357 -2.742 1.00 2.48 N ATOM 3154 CA LEU B 93 14.905 8.206 -1.851 1.00 2.72 C ATOM 3155 C LEU B 93 15.828 9.230 -1.192 1.00 2.58 C ATOM 3156 O LEU B 93 16.142 10.248 -1.801 1.00 2.97 O ATOM 3157 CB LEU B 93 14.126 7.353 -0.830 1.00 3.43 C ATOM 3158 CG LEU B 93 14.958 6.229 -0.173 1.00 3.87 C ATOM 3159 CD1 LEU B 93 14.691 6.163 1.339 1.00 5.19 C ATOM 3160 CD2 LEU B 93 14.550 4.876 -0.767 1.00 4.44 C ATOM 0 H LEU B 93 16.268 6.688 -2.234 1.00 2.48 H new ATOM 0 HA LEU B 93 14.155 8.754 -2.421 1.00 2.72 H new ATOM 0 HB2 LEU B 93 13.739 8.007 -0.048 1.00 3.43 H new ATOM 0 HB3 LEU B 93 13.265 6.908 -1.328 1.00 3.43 H new ATOM 0 HG LEU B 93 16.011 6.442 -0.357 1.00 3.87 H new ATOM 0 HD11 LEU B 93 15.288 5.364 1.779 1.00 5.19 H new ATOM 0 HD12 LEU B 93 14.962 7.114 1.798 1.00 5.19 H new ATOM 0 HD13 LEU B 93 13.634 5.964 1.513 1.00 5.19 H new ATOM 0 HD21 LEU B 93 15.137 4.083 -0.303 1.00 4.44 H new ATOM 0 HD22 LEU B 93 13.491 4.701 -0.579 1.00 4.44 H new ATOM 0 HD23 LEU B 93 14.732 4.881 -1.842 1.00 4.44 H new ATOM 3172 N LYS B 94 16.292 8.933 0.026 1.00 2.65 N ATOM 3173 CA LYS B 94 17.121 9.801 0.837 1.00 2.78 C ATOM 3174 C LYS B 94 16.338 11.092 1.133 1.00 2.83 C ATOM 3175 O LYS B 94 15.118 11.028 1.260 1.00 3.58 O ATOM 3176 CB LYS B 94 18.480 10.007 0.151 1.00 3.19 C ATOM 3177 CG LYS B 94 19.212 8.720 -0.273 1.00 3.90 C ATOM 3178 CD LYS B 94 19.272 8.610 -1.808 1.00 4.83 C ATOM 3179 CE LYS B 94 20.275 7.561 -2.311 1.00 6.45 C ATOM 3180 NZ LYS B 94 19.960 6.197 -1.846 1.00 7.14 N ATOM 0 H LYS B 94 16.087 8.044 0.483 1.00 2.65 H new ATOM 0 HA LYS B 94 17.355 9.357 1.804 1.00 2.78 H new ATOM 0 HB2 LYS B 94 18.331 10.627 -0.733 1.00 3.19 H new ATOM 0 HB3 LYS B 94 19.127 10.566 0.827 1.00 3.19 H new ATOM 0 HG2 LYS B 94 20.222 8.718 0.137 1.00 3.90 H new ATOM 0 HG3 LYS B 94 18.699 7.851 0.139 1.00 3.90 H new ATOM 0 HD2 LYS B 94 18.280 8.362 -2.185 1.00 4.83 H new ATOM 0 HD3 LYS B 94 19.537 9.582 -2.223 1.00 4.83 H new ATOM 0 HE2 LYS B 94 20.290 7.573 -3.401 1.00 6.45 H new ATOM 0 HE3 LYS B 94 21.276 7.832 -1.975 1.00 6.45 H new ATOM 0 HZ1 LYS B 94 20.796 5.589 -1.961 1.00 7.14 H new ATOM 0 HZ2 LYS B 94 19.689 6.226 -0.842 1.00 7.14 H new ATOM 0 HZ3 LYS B 94 19.173 5.812 -2.406 1.00 7.14 H new ATOM 3194 N ILE B 95 17.019 12.239 1.251 1.00 3.30 N ATOM 3195 CA ILE B 95 16.409 13.558 1.418 1.00 4.28 C ATOM 3196 C ILE B 95 15.350 13.544 2.533 1.00 4.10 C ATOM 3197 O ILE B 95 14.157 13.692 2.279 1.00 5.34 O ATOM 3198 CB ILE B 95 15.870 14.093 0.069 1.00 5.68 C ATOM 3199 CG1 ILE B 95 16.904 13.898 -1.058 1.00 6.50 C ATOM 3200 CG2 ILE B 95 15.517 15.586 0.198 1.00 7.34 C ATOM 3201 CD1 ILE B 95 16.439 14.452 -2.409 1.00 7.86 C ATOM 0 H ILE B 95 18.038 12.272 1.232 1.00 3.30 H new ATOM 0 HA ILE B 95 17.178 14.259 1.741 1.00 4.28 H new ATOM 0 HB ILE B 95 14.973 13.528 -0.186 1.00 5.68 H new ATOM 0 HG12 ILE B 95 17.837 14.386 -0.775 1.00 6.50 H new ATOM 0 HG13 ILE B 95 17.120 12.835 -1.164 1.00 6.50 H new ATOM 0 HG21 ILE B 95 15.139 15.954 -0.756 1.00 7.34 H new ATOM 0 HG22 ILE B 95 14.753 15.714 0.965 1.00 7.34 H new ATOM 0 HG23 ILE B 95 16.409 16.148 0.476 1.00 7.34 H new ATOM 0 HD11 ILE B 95 17.213 14.282 -3.158 1.00 7.86 H new ATOM 0 HD12 ILE B 95 15.522 13.947 -2.713 1.00 7.86 H new ATOM 0 HD13 ILE B 95 16.250 15.522 -2.318 1.00 7.86 H new ATOM 3213 N ARG B 96 15.799 13.374 3.781 1.00 3.46 N ATOM 3214 CA ARG B 96 14.942 13.383 4.959 1.00 3.72 C ATOM 3215 C ARG B 96 15.474 14.415 5.952 1.00 3.58 C ATOM 3216 O ARG B 96 16.673 14.437 6.228 1.00 4.29 O ATOM 3217 CB ARG B 96 14.832 11.964 5.549 1.00 4.83 C ATOM 3218 CG ARG B 96 16.144 11.388 6.110 1.00 5.53 C ATOM 3219 CD ARG B 96 16.267 11.594 7.628 1.00 6.43 C ATOM 3220 NE ARG B 96 17.616 11.246 8.102 1.00 7.01 N ATOM 3221 CZ ARG B 96 18.059 11.431 9.357 1.00 7.96 C ATOM 3222 NH1 ARG B 96 17.227 11.899 10.294 1.00 8.51 N ATOM 3223 NH2 ARG B 96 19.329 11.147 9.668 1.00 8.76 N ATOM 0 H ARG B 96 16.784 13.224 3.999 1.00 3.46 H new ATOM 0 HA ARG B 96 13.926 13.678 4.696 1.00 3.72 H new ATOM 0 HB2 ARG B 96 14.088 11.975 6.346 1.00 4.83 H new ATOM 0 HB3 ARG B 96 14.460 11.293 4.775 1.00 4.83 H new ATOM 0 HG2 ARG B 96 16.197 10.323 5.884 1.00 5.53 H new ATOM 0 HG3 ARG B 96 16.989 11.862 5.611 1.00 5.53 H new ATOM 0 HD2 ARG B 96 16.048 12.632 7.876 1.00 6.43 H new ATOM 0 HD3 ARG B 96 15.528 10.980 8.143 1.00 6.43 H new ATOM 0 HE ARG B 96 18.262 10.834 7.429 1.00 7.01 H new ATOM 0 HH11 ARG B 96 16.259 12.114 10.055 1.00 8.51 H new ATOM 0 HH12 ARG B 96 17.560 12.040 11.248 1.00 8.51 H new ATOM 0 HH21 ARG B 96 19.962 10.790 8.952 1.00 8.76 H new ATOM 0 HH22 ARG B 96 19.664 11.288 10.621 1.00 8.76 H new ATOM 3237 N LYS B 97 14.586 15.258 6.484 1.00 3.62 N ATOM 3238 CA LYS B 97 14.881 16.337 7.414 1.00 3.83 C ATOM 3239 C LYS B 97 13.549 17.007 7.765 1.00 4.01 C ATOM 3240 O LYS B 97 12.718 17.199 6.881 1.00 4.78 O ATOM 3241 CB LYS B 97 15.880 17.363 6.831 1.00 4.87 C ATOM 3242 CG LYS B 97 15.960 18.575 7.771 1.00 5.83 C ATOM 3243 CD LYS B 97 17.042 19.613 7.465 1.00 6.95 C ATOM 3244 CE LYS B 97 16.680 20.946 8.151 1.00 7.81 C ATOM 3245 NZ LYS B 97 16.377 20.813 9.596 1.00 7.82 N ATOM 0 H LYS B 97 13.592 15.199 6.263 1.00 3.62 H new ATOM 0 HA LYS B 97 15.363 15.931 8.304 1.00 3.83 H new ATOM 0 HB2 LYS B 97 16.864 16.908 6.719 1.00 4.87 H new ATOM 0 HB3 LYS B 97 15.560 17.678 5.838 1.00 4.87 H new ATOM 0 HG2 LYS B 97 14.993 19.078 7.760 1.00 5.83 H new ATOM 0 HG3 LYS B 97 16.117 18.209 8.786 1.00 5.83 H new ATOM 0 HD2 LYS B 97 18.011 19.260 7.819 1.00 6.95 H new ATOM 0 HD3 LYS B 97 17.129 19.757 6.388 1.00 6.95 H new ATOM 0 HE2 LYS B 97 17.507 21.645 8.026 1.00 7.81 H new ATOM 0 HE3 LYS B 97 15.817 21.380 7.647 1.00 7.81 H new ATOM 0 HZ1 LYS B 97 15.630 21.488 9.858 1.00 7.82 H new ATOM 0 HZ2 LYS B 97 16.054 19.845 9.795 1.00 7.82 H new ATOM 0 HZ3 LYS B 97 17.234 21.013 10.150 1.00 7.82 H new ATOM 3259 N LYS B 98 13.362 17.355 9.041 1.00 4.15 N ATOM 3260 CA LYS B 98 12.585 18.520 9.425 1.00 4.52 C ATOM 3261 C LYS B 98 13.631 19.484 9.979 1.00 4.57 C ATOM 3262 O LYS B 98 14.654 18.984 10.500 1.00 4.96 O ATOM 3263 CB LYS B 98 11.508 18.130 10.449 1.00 5.48 C ATOM 3264 CG LYS B 98 10.592 19.312 10.802 1.00 6.13 C ATOM 3265 CD LYS B 98 11.092 20.083 12.037 1.00 6.29 C ATOM 3266 CE LYS B 98 10.469 21.482 12.138 1.00 6.34 C ATOM 3267 NZ LYS B 98 8.993 21.449 12.187 1.00 6.80 N ATOM 3268 OXT LYS B 98 13.527 20.708 9.765 1.00 5.22 O ATOM 0 H LYS B 98 13.747 16.834 9.829 1.00 4.15 H new ATOM 0 HA LYS B 98 12.029 18.975 8.606 1.00 4.52 H new ATOM 0 HB2 LYS B 98 10.907 17.313 10.049 1.00 5.48 H new ATOM 0 HB3 LYS B 98 11.987 17.760 11.355 1.00 5.48 H new ATOM 0 HG2 LYS B 98 10.532 19.991 9.951 1.00 6.13 H new ATOM 0 HG3 LYS B 98 9.583 18.945 10.988 1.00 6.13 H new ATOM 0 HD2 LYS B 98 10.856 19.516 12.937 1.00 6.29 H new ATOM 0 HD3 LYS B 98 12.177 20.173 11.992 1.00 6.29 H new ATOM 0 HE2 LYS B 98 10.847 21.979 13.031 1.00 6.34 H new ATOM 0 HE3 LYS B 98 10.786 22.079 11.283 1.00 6.34 H new ATOM 0 HZ1 LYS B 98 8.630 22.409 12.357 1.00 6.80 H new ATOM 0 HZ2 LYS B 98 8.623 21.094 11.282 1.00 6.80 H new ATOM 0 HZ3 LYS B 98 8.685 20.821 12.957 1.00 6.80 H new TER 3282 LYS B 98 HETATM 3283 CA CA A 197 -1.333 11.559 -15.204 1.00 0.86 CA HETATM 3284 CA CA A 198 2.644 16.736 -5.510 1.00 1.37 CA HETATM 3285 CA CA B 199 2.158 -10.172 14.900 1.00 1.19 CA HETATM 3286 CA CA B 200 6.220 1.769 16.107 1.00 1.15 CA