USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1668 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 92 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 95 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Set 2.1: B 33 SER OG : rot 85:sc= 0.853 USER MOD Set 2.2: B 37 THR OG1 : rot -147:sc= -1.83! USER MOD Set 3.1: A 92 SER OG : rot -133:sc=0.000301 USER MOD Set 3.2: A 95 GLN : amide:sc= 0 K(o=0.0003,f=-0.58) USER MOD Set 4.1: A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 33 SER OG : rot 180:sc= 0.107 USER MOD Set 5.2: A 37 THR OG1 : rot -81:sc= -7.28! USER MOD Single : A 1 ALA N :NH3+ 176:sc= 0 (180deg=-0.0233) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -60:sc= 0.981 USER MOD Single : A 6 LYS NZ :NH3+ -125:sc= -1.03 (180deg=-2.84!) USER MOD Single : A 11 GLN : amide:sc= -0.0274 X(o=-0.027,f=-0.027) USER MOD Single : A 17 CYS SG : rot -27:sc= -1.49 USER MOD Single : A 18 LYS NZ :NH3+ -119:sc= -3.86! (180deg=-5.25!) USER MOD Single : A 19 SER OG : rot -16:sc= 0.751 USER MOD Single : A 21 SER OG : rot 111:sc= 0.353 USER MOD Single : A 23 LYS NZ :NH3+ -153:sc= -0.0054 (180deg=-0.15) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.253 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -176:sc= -0.946 (180deg=-0.985) USER MOD Single : A 43 MET CE :methyl 175:sc= 0 (180deg=-0.0168) USER MOD Single : A 45 MET CE :methyl -165:sc= -0.059 (180deg=-0.447) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= -1.26 F(o=-4.9!,f=-1.3) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl -163:sc= 0 (180deg=-0.309) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.536 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0656) USER MOD Single : A 74 ASN : amide:sc= -0.0834 X(o=-0.083,f=0) USER MOD Single : A 78 LYS NZ :NH3+ -147:sc= -0.0656 (180deg=-0.53) USER MOD Single : A 79 ASN : amide:sc= -0.218 X(o=-0.22,f=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.311 X(o=-0.31,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 157:sc= -0.146 (180deg=-0.913) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.8!) USER MOD Single : A 89 SER OG : rot -81:sc= 0.201! USER MOD Single : B 1 ALA N :NH3+ 175:sc= 0 (180deg=-0.027) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot 3:sc= 0.0854 USER MOD Single : B 6 LYS NZ :NH3+ -118:sc= -0.995 (180deg=-2.83!) USER MOD Single : B 11 GLN : amide:sc= -0.0997 X(o=-0.1,f=-0.1) USER MOD Single : B 17 CYS SG : rot -24:sc= -1.17 USER MOD Single : B 18 LYS NZ :NH3+ -109:sc= -3.35! (180deg=-4.9!) USER MOD Single : B 19 SER OG : rot -14:sc= 0.641 USER MOD Single : B 21 SER OG : rot 111:sc= 0.604 USER MOD Single : B 23 LYS NZ :NH3+ 161:sc=-0.00611 (180deg=-0.0586) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.149 USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN :FLIP amide:sc= 0.0264 F(o=-0.76,f=0.026) USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 40 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 176:sc= -0.896 (180deg=-0.962) USER MOD Single : B 43 MET CE :methyl 155:sc= 0 (180deg=-0.0036) USER MOD Single : B 45 MET CE :methyl 159:sc= -0.316 (180deg=-0.919) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=-0.08) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN : amide:sc= -0.736 X(o=-0.74,f=-0.65) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.479 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.118) USER MOD Single : B 74 ASN : amide:sc=-0.00402 X(o=-0.004,f=0) USER MOD Single : B 78 LYS NZ :NH3+ -140:sc= -0.352 (180deg=-1.24!) USER MOD Single : B 79 ASN : amide:sc= -0.0715 X(o=-0.072,f=0) USER MOD Single : B 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 84 LYS NZ :NH3+ 157:sc= -0.208 (180deg=-0.889) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.6) USER MOD Single : B 89 SER OG : rot -80:sc= 0.359 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -7.875 13.914 7.220 1.00 5.35 N ATOM 2 CA ALA A 1 -8.775 12.831 7.706 1.00 4.76 C ATOM 3 C ALA A 1 -9.827 12.526 6.637 1.00 4.12 C ATOM 4 O ALA A 1 -10.997 12.374 6.931 1.00 3.94 O ATOM 5 CB ALA A 1 -9.469 13.284 8.992 1.00 4.81 C ATOM 0 H1 ALA A 1 -7.202 14.169 7.971 1.00 5.35 H new ATOM 0 H2 ALA A 1 -7.352 13.582 6.385 1.00 5.35 H new ATOM 0 H3 ALA A 1 -8.442 14.748 6.965 1.00 5.35 H new ATOM 0 HA ALA A 1 -8.190 11.933 7.907 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -10.128 12.492 9.348 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -8.719 13.502 9.753 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -10.055 14.181 8.793 1.00 4.81 H new ATOM 13 N LYS A 2 -9.421 12.435 5.400 1.00 4.22 N ATOM 14 CA LYS A 2 -10.398 12.140 4.314 1.00 4.07 C ATOM 15 C LYS A 2 -10.454 10.631 4.073 1.00 3.66 C ATOM 16 O LYS A 2 -9.473 9.931 4.221 1.00 4.35 O ATOM 17 CB LYS A 2 -9.961 12.844 3.029 1.00 4.82 C ATOM 18 CG LYS A 2 -10.982 13.925 2.665 1.00 5.66 C ATOM 19 CD LYS A 2 -11.048 14.965 3.786 1.00 6.60 C ATOM 20 CE LYS A 2 -10.887 16.366 3.194 1.00 7.50 C ATOM 21 NZ LYS A 2 -11.138 17.384 4.253 1.00 7.90 N ATOM 0 H LYS A 2 -8.455 12.552 5.095 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.385 12.498 4.608 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -8.976 13.290 3.164 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -9.876 12.122 2.217 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -10.701 14.404 1.727 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -11.964 13.476 2.513 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -12.000 14.888 4.312 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -10.263 14.776 4.518 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -9.883 16.488 2.788 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -11.584 16.506 2.368 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -11.029 18.337 3.851 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -12.104 17.272 4.620 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -10.456 17.255 5.028 1.00 7.90 H new ATOM 35 N LYS A 3 -11.597 10.124 3.701 1.00 2.85 N ATOM 36 CA LYS A 3 -11.721 8.663 3.448 1.00 2.88 C ATOM 37 C LYS A 3 -13.005 8.401 2.660 1.00 2.35 C ATOM 38 O LYS A 3 -13.112 7.442 1.924 1.00 2.83 O ATOM 39 CB LYS A 3 -11.776 7.916 4.782 1.00 3.31 C ATOM 40 CG LYS A 3 -10.919 6.651 4.696 1.00 3.76 C ATOM 41 CD LYS A 3 -11.050 5.855 5.996 1.00 4.46 C ATOM 42 CE LYS A 3 -9.749 5.094 6.263 1.00 5.18 C ATOM 43 NZ LYS A 3 -9.959 4.126 7.376 1.00 5.69 N ATOM 0 H LYS A 3 -12.453 10.661 3.561 1.00 2.85 H new ATOM 0 HA LYS A 3 -10.861 8.313 2.877 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -11.415 8.558 5.585 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.807 7.654 5.022 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -11.236 6.041 3.850 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -9.876 6.917 4.524 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -11.267 6.527 6.826 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -11.884 5.157 5.925 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -9.432 4.567 5.363 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -8.953 5.793 6.520 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -9.075 3.609 7.558 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -10.242 4.640 8.235 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -10.707 3.452 7.114 1.00 5.69 H new ATOM 57 N LYS A 4 -13.981 9.256 2.808 1.00 1.83 N ATOM 58 CA LYS A 4 -15.260 9.070 2.070 1.00 1.71 C ATOM 59 C LYS A 4 -14.985 9.100 0.564 1.00 1.52 C ATOM 60 O LYS A 4 -14.288 8.259 0.031 1.00 2.02 O ATOM 61 CB LYS A 4 -16.221 10.204 2.434 1.00 2.12 C ATOM 62 CG LYS A 4 -16.531 10.148 3.931 1.00 2.54 C ATOM 63 CD LYS A 4 -17.755 11.015 4.233 1.00 3.17 C ATOM 64 CE LYS A 4 -17.521 11.797 5.528 1.00 3.65 C ATOM 65 NZ LYS A 4 -18.724 12.622 5.834 1.00 4.24 N ATOM 0 H LYS A 4 -13.946 10.078 3.411 1.00 1.83 H new ATOM 0 HA LYS A 4 -15.705 8.112 2.340 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -15.778 11.167 2.179 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -17.142 10.114 1.857 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -16.718 9.118 4.236 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -15.673 10.500 4.504 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -17.938 11.704 3.408 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -18.642 10.389 4.329 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -17.320 11.109 6.349 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -16.644 12.437 5.426 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -18.566 13.154 6.714 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -18.896 13.287 5.054 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -19.551 12.001 5.949 1.00 4.24 H new ATOM 79 N SER A 5 -15.526 10.069 -0.119 1.00 1.49 N ATOM 80 CA SER A 5 -15.301 10.174 -1.588 1.00 1.72 C ATOM 81 C SER A 5 -15.656 8.851 -2.269 1.00 1.51 C ATOM 82 O SER A 5 -14.892 8.304 -3.039 1.00 1.76 O ATOM 83 CB SER A 5 -13.836 10.524 -1.849 1.00 2.08 C ATOM 84 OG SER A 5 -13.485 10.164 -3.178 1.00 2.67 O ATOM 0 H SER A 5 -16.118 10.798 0.279 1.00 1.49 H new ATOM 0 HA SER A 5 -15.939 10.957 -1.998 1.00 1.72 H new ATOM 0 HB2 SER A 5 -13.675 11.591 -1.697 1.00 2.08 H new ATOM 0 HB3 SER A 5 -13.195 10.000 -1.139 1.00 2.08 H new ATOM 0 HG SER A 5 -13.610 9.200 -3.300 1.00 2.67 H new ATOM 90 N LYS A 6 -16.826 8.347 -2.004 1.00 1.38 N ATOM 91 CA LYS A 6 -17.260 7.079 -2.649 1.00 1.30 C ATOM 92 C LYS A 6 -16.518 5.876 -2.051 1.00 1.16 C ATOM 93 O LYS A 6 -16.788 4.743 -2.400 1.00 1.17 O ATOM 94 CB LYS A 6 -16.966 7.153 -4.148 1.00 1.59 C ATOM 95 CG LYS A 6 -18.072 6.427 -4.919 1.00 2.31 C ATOM 96 CD LYS A 6 -17.758 6.449 -6.420 1.00 2.60 C ATOM 97 CE LYS A 6 -16.468 5.669 -6.699 1.00 3.41 C ATOM 98 NZ LYS A 6 -15.306 6.601 -6.652 1.00 3.78 N ATOM 0 H LYS A 6 -17.505 8.761 -1.365 1.00 1.38 H new ATOM 0 HA LYS A 6 -18.328 6.950 -2.476 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.907 8.193 -4.467 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -15.999 6.699 -4.363 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -18.156 5.398 -4.571 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -19.033 6.906 -4.732 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -18.585 6.011 -6.979 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -17.651 7.478 -6.762 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -16.343 4.876 -5.961 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -16.524 5.189 -7.676 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -14.771 6.534 -7.542 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -15.647 7.575 -6.525 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -14.687 6.345 -5.856 1.00 3.78 H new ATOM 112 N LEU A 7 -15.573 6.104 -1.176 1.00 1.10 N ATOM 113 CA LEU A 7 -14.804 4.964 -0.589 1.00 1.09 C ATOM 114 C LEU A 7 -15.376 4.546 0.772 1.00 1.01 C ATOM 115 O LEU A 7 -15.843 3.436 0.948 1.00 0.97 O ATOM 116 CB LEU A 7 -13.345 5.385 -0.408 1.00 1.23 C ATOM 117 CG LEU A 7 -12.427 4.337 -1.041 1.00 1.37 C ATOM 118 CD1 LEU A 7 -12.557 4.395 -2.565 1.00 2.05 C ATOM 119 CD2 LEU A 7 -10.977 4.626 -0.644 1.00 1.67 C ATOM 0 H LEU A 7 -15.300 7.028 -0.842 1.00 1.10 H new ATOM 0 HA LEU A 7 -14.878 4.115 -1.269 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -13.176 6.358 -0.870 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.115 5.492 0.652 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.712 3.345 -0.690 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -11.903 3.648 -3.015 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -13.589 4.192 -2.850 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -12.272 5.386 -2.917 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -10.321 3.881 -1.094 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -10.694 5.618 -0.996 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -10.882 4.585 0.441 1.00 1.67 H new ATOM 131 N GLU A 8 -15.318 5.416 1.744 1.00 1.07 N ATOM 132 CA GLU A 8 -15.830 5.043 3.095 1.00 1.16 C ATOM 133 C GLU A 8 -17.356 4.961 3.086 1.00 1.10 C ATOM 134 O GLU A 8 -17.914 3.900 3.235 1.00 1.03 O ATOM 135 CB GLU A 8 -15.385 6.091 4.119 1.00 1.37 C ATOM 136 CG GLU A 8 -15.122 5.412 5.465 1.00 1.46 C ATOM 137 CD GLU A 8 -15.101 6.465 6.574 1.00 1.74 C ATOM 138 OE1 GLU A 8 -16.029 7.255 6.630 1.00 2.13 O ATOM 139 OE2 GLU A 8 -14.158 6.463 7.348 1.00 2.33 O ATOM 0 H GLU A 8 -14.942 6.361 1.663 1.00 1.07 H new ATOM 0 HA GLU A 8 -15.426 4.067 3.364 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -14.483 6.594 3.771 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -16.154 6.856 4.230 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -15.895 4.671 5.667 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -14.171 4.880 5.436 1.00 1.46 H new ATOM 146 N ILE A 9 -18.020 6.077 2.907 1.00 1.18 N ATOM 147 CA ILE A 9 -19.522 6.065 2.905 1.00 1.23 C ATOM 148 C ILE A 9 -19.985 4.724 2.330 1.00 1.11 C ATOM 149 O ILE A 9 -20.902 4.096 2.821 1.00 1.20 O ATOM 150 CB ILE A 9 -20.050 7.209 2.039 1.00 1.31 C ATOM 151 CG1 ILE A 9 -19.582 8.543 2.624 1.00 1.91 C ATOM 152 CG2 ILE A 9 -21.579 7.171 2.027 1.00 1.86 C ATOM 153 CD1 ILE A 9 -19.826 9.660 1.609 1.00 2.19 C ATOM 0 H ILE A 9 -17.593 6.992 2.763 1.00 1.18 H new ATOM 0 HA ILE A 9 -19.901 6.194 3.919 1.00 1.23 H new ATOM 0 HB ILE A 9 -19.673 7.102 1.022 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -20.118 8.754 3.549 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -18.523 8.490 2.875 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -21.958 7.986 1.410 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -21.916 6.219 1.618 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -21.954 7.282 3.045 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -19.492 10.610 2.026 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -19.270 9.450 0.696 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -20.890 9.718 1.380 1.00 2.19 H new ATOM 165 N ILE A 10 -19.321 4.281 1.303 1.00 0.96 N ATOM 166 CA ILE A 10 -19.661 2.971 0.675 1.00 0.91 C ATOM 167 C ILE A 10 -19.452 1.854 1.692 1.00 0.82 C ATOM 168 O ILE A 10 -20.362 1.113 2.006 1.00 0.85 O ATOM 169 CB ILE A 10 -18.769 2.742 -0.547 1.00 0.92 C ATOM 170 CG1 ILE A 10 -19.431 3.380 -1.769 1.00 1.11 C ATOM 171 CG2 ILE A 10 -18.584 1.242 -0.791 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.716 4.853 -1.478 1.00 1.39 C ATOM 0 H ILE A 10 -18.545 4.776 0.863 1.00 0.96 H new ATOM 0 HA ILE A 10 -20.704 2.976 0.357 1.00 0.91 H new ATOM 0 HB ILE A 10 -17.792 3.193 -0.372 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -18.780 3.289 -2.639 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -20.358 2.859 -2.008 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -17.948 1.091 -1.663 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -18.117 0.786 0.082 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -19.555 0.779 -0.966 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -20.188 5.311 -2.347 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -20.383 4.932 -0.619 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -18.781 5.368 -1.259 1.00 1.39 H new ATOM 184 N GLN A 11 -18.257 1.720 2.204 1.00 0.77 N ATOM 185 CA GLN A 11 -17.995 0.643 3.200 1.00 0.74 C ATOM 186 C GLN A 11 -19.134 0.612 4.223 1.00 0.80 C ATOM 187 O GLN A 11 -19.631 -0.437 4.583 1.00 0.78 O ATOM 188 CB GLN A 11 -16.672 0.920 3.916 1.00 0.77 C ATOM 189 CG GLN A 11 -15.724 -0.265 3.718 1.00 1.36 C ATOM 190 CD GLN A 11 -14.416 -0.003 4.467 1.00 1.62 C ATOM 191 OE1 GLN A 11 -14.037 -0.762 5.336 1.00 2.31 O ATOM 192 NE2 GLN A 11 -13.704 1.049 4.164 1.00 1.94 N ATOM 0 H GLN A 11 -17.455 2.308 1.976 1.00 0.77 H new ATOM 0 HA GLN A 11 -17.935 -0.319 2.691 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.219 1.831 3.525 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -16.849 1.083 4.979 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -16.188 -1.181 4.084 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -15.525 -0.411 2.656 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -14.022 1.687 3.434 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -12.830 1.233 4.657 1.00 1.94 H new ATOM 201 N ALA A 12 -19.564 1.757 4.678 1.00 0.90 N ATOM 202 CA ALA A 12 -20.685 1.803 5.659 1.00 0.98 C ATOM 203 C ALA A 12 -21.965 1.274 5.002 1.00 0.94 C ATOM 204 O ALA A 12 -22.793 0.653 5.640 1.00 0.94 O ATOM 205 CB ALA A 12 -20.905 3.248 6.115 1.00 1.11 C ATOM 0 H ALA A 12 -19.186 2.666 4.411 1.00 0.90 H new ATOM 0 HA ALA A 12 -20.438 1.183 6.521 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -21.725 3.282 6.833 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -19.996 3.624 6.584 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.151 3.868 5.253 1.00 1.11 H new ATOM 211 N ILE A 13 -22.126 1.509 3.727 1.00 0.90 N ATOM 212 CA ILE A 13 -23.346 1.013 3.026 1.00 0.86 C ATOM 213 C ILE A 13 -23.259 -0.505 2.880 1.00 0.75 C ATOM 214 O ILE A 13 -24.209 -1.222 3.120 1.00 0.72 O ATOM 215 CB ILE A 13 -23.450 1.651 1.642 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.042 3.053 1.773 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.357 0.796 0.757 1.00 0.85 C ATOM 218 CD1 ILE A 13 -23.628 3.892 0.565 1.00 1.06 C ATOM 0 H ILE A 13 -21.467 2.022 3.142 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.228 1.280 3.608 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.459 1.715 1.194 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.129 2.997 1.836 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -23.694 3.523 2.693 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.433 1.249 -0.231 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -23.937 -0.206 0.666 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.349 0.734 1.205 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.049 4.893 0.656 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -22.541 3.958 0.523 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -23.998 3.424 -0.347 1.00 1.06 H new ATOM 230 N LEU A 14 -22.117 -0.994 2.490 1.00 0.74 N ATOM 231 CA LEU A 14 -21.941 -2.461 2.325 1.00 0.65 C ATOM 232 C LEU A 14 -22.188 -3.156 3.662 1.00 0.67 C ATOM 233 O LEU A 14 -22.818 -4.193 3.734 1.00 0.64 O ATOM 234 CB LEU A 14 -20.502 -2.730 1.881 1.00 0.65 C ATOM 235 CG LEU A 14 -20.498 -3.552 0.592 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.053 -3.774 0.137 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.164 -4.904 0.852 1.00 1.04 C ATOM 0 H LEU A 14 -21.291 -0.435 2.277 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.644 -2.840 1.583 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -19.979 -1.787 1.722 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -19.965 -3.264 2.665 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.047 -3.019 -0.185 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.047 -4.360 -0.782 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.576 -2.811 -0.044 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.506 -4.310 0.912 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.163 -5.493 -0.065 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.613 -5.438 1.626 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.191 -4.746 1.181 1.00 1.04 H new ATOM 249 N GLU A 15 -21.685 -2.591 4.721 1.00 0.75 N ATOM 250 CA GLU A 15 -21.872 -3.206 6.061 1.00 0.80 C ATOM 251 C GLU A 15 -23.332 -3.097 6.501 1.00 0.83 C ATOM 252 O GLU A 15 -23.846 -3.949 7.196 1.00 0.85 O ATOM 253 CB GLU A 15 -20.979 -2.507 7.080 1.00 0.87 C ATOM 254 CG GLU A 15 -20.251 -3.568 7.901 1.00 0.89 C ATOM 255 CD GLU A 15 -19.618 -2.917 9.133 1.00 1.01 C ATOM 256 OE1 GLU A 15 -19.379 -1.721 9.089 1.00 1.43 O ATOM 257 OE2 GLU A 15 -19.382 -3.625 10.097 1.00 1.53 O ATOM 0 H GLU A 15 -21.149 -1.723 4.715 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.600 -4.260 6.000 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -20.261 -1.862 6.574 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.576 -1.869 7.731 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.948 -4.348 8.207 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.482 -4.048 7.295 1.00 0.89 H new ATOM 264 N ALA A 16 -24.006 -2.054 6.116 1.00 0.85 N ATOM 265 CA ALA A 16 -25.424 -1.911 6.522 1.00 0.88 C ATOM 266 C ALA A 16 -26.242 -2.957 5.782 1.00 0.83 C ATOM 267 O ALA A 16 -27.157 -3.546 6.320 1.00 0.86 O ATOM 268 CB ALA A 16 -25.925 -0.514 6.164 1.00 0.91 C ATOM 0 H ALA A 16 -23.637 -1.298 5.540 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.522 -2.052 7.598 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -26.968 -0.413 6.464 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.324 0.232 6.684 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -25.841 -0.362 5.088 1.00 0.91 H new ATOM 274 N CYS A 17 -25.916 -3.191 4.542 1.00 0.76 N ATOM 275 CA CYS A 17 -26.665 -4.187 3.759 1.00 0.72 C ATOM 276 C CYS A 17 -26.242 -5.595 4.193 1.00 0.71 C ATOM 277 O CYS A 17 -26.852 -6.575 3.836 1.00 0.71 O ATOM 278 CB CYS A 17 -26.367 -3.975 2.277 1.00 0.65 C ATOM 279 SG CYS A 17 -24.734 -4.648 1.880 1.00 0.81 S ATOM 0 H CYS A 17 -25.157 -2.728 4.042 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.736 -4.075 3.929 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.129 -4.463 1.670 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.401 -2.912 2.038 1.00 0.65 H new ATOM 0 HG CYS A 17 -23.981 -4.613 2.939 1.00 0.81 H new ATOM 285 N LYS A 18 -25.189 -5.701 4.957 1.00 0.72 N ATOM 286 CA LYS A 18 -24.720 -7.041 5.416 1.00 0.73 C ATOM 287 C LYS A 18 -25.882 -7.886 5.965 1.00 0.83 C ATOM 288 O LYS A 18 -25.696 -9.033 6.320 1.00 0.87 O ATOM 289 CB LYS A 18 -23.688 -6.851 6.529 1.00 0.78 C ATOM 290 CG LYS A 18 -22.751 -8.053 6.572 1.00 1.34 C ATOM 291 CD LYS A 18 -21.562 -7.780 5.645 1.00 1.96 C ATOM 292 CE LYS A 18 -20.845 -9.088 5.276 1.00 2.36 C ATOM 293 NZ LYS A 18 -20.082 -8.887 4.013 1.00 2.97 N ATOM 0 H LYS A 18 -24.630 -4.913 5.285 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.286 -7.561 4.562 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -23.117 -5.939 6.357 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -24.191 -6.736 7.489 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -22.404 -8.226 7.591 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -23.277 -8.954 6.257 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -21.908 -7.282 4.739 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -20.862 -7.102 6.134 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -20.171 -9.387 6.079 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.570 -9.892 5.153 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.439 -9.538 3.285 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.200 -7.906 3.688 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -19.074 -9.076 4.183 1.00 2.97 H new ATOM 307 N SER A 19 -27.075 -7.351 6.052 1.00 0.88 N ATOM 308 CA SER A 19 -28.200 -8.169 6.594 1.00 0.99 C ATOM 309 C SER A 19 -29.548 -7.574 6.175 1.00 1.05 C ATOM 310 O SER A 19 -30.503 -7.606 6.926 1.00 1.21 O ATOM 311 CB SER A 19 -28.115 -8.193 8.120 1.00 1.07 C ATOM 312 OG SER A 19 -26.893 -8.804 8.514 1.00 1.10 O ATOM 0 H SER A 19 -27.315 -6.399 5.776 1.00 0.88 H new ATOM 0 HA SER A 19 -28.122 -9.181 6.196 1.00 0.99 H new ATOM 0 HB2 SER A 19 -28.171 -7.178 8.515 1.00 1.07 H new ATOM 0 HB3 SER A 19 -28.960 -8.743 8.534 1.00 1.07 H new ATOM 0 HG SER A 19 -26.509 -9.287 7.753 1.00 1.10 H new ATOM 318 N GLY A 20 -29.648 -7.043 4.987 1.00 0.94 N ATOM 319 CA GLY A 20 -30.950 -6.466 4.545 1.00 1.01 C ATOM 320 C GLY A 20 -31.302 -5.283 5.441 1.00 1.07 C ATOM 321 O GLY A 20 -31.696 -5.450 6.578 1.00 1.15 O ATOM 0 H GLY A 20 -28.890 -6.984 4.307 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -30.885 -6.144 3.506 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.733 -7.222 4.596 1.00 1.01 H new ATOM 325 N SER A 21 -31.134 -4.088 4.954 1.00 1.06 N ATOM 326 CA SER A 21 -31.428 -2.901 5.796 1.00 1.14 C ATOM 327 C SER A 21 -31.865 -1.723 4.896 1.00 1.14 C ATOM 328 O SER A 21 -31.200 -1.430 3.923 1.00 1.07 O ATOM 329 CB SER A 21 -30.144 -2.538 6.530 1.00 1.14 C ATOM 330 OG SER A 21 -29.447 -3.731 6.863 1.00 1.09 O ATOM 0 H SER A 21 -30.806 -3.883 4.010 1.00 1.06 H new ATOM 0 HA SER A 21 -32.231 -3.114 6.502 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.520 -1.900 5.904 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.374 -1.972 7.433 1.00 1.14 H new ATOM 0 HG SER A 21 -28.631 -3.794 6.324 1.00 1.09 H new ATOM 336 N PRO A 22 -32.965 -1.041 5.196 1.00 1.23 N ATOM 337 CA PRO A 22 -33.422 0.112 4.360 1.00 1.26 C ATOM 338 C PRO A 22 -32.346 1.195 4.241 1.00 1.26 C ATOM 339 O PRO A 22 -31.381 1.203 4.977 1.00 1.25 O ATOM 340 CB PRO A 22 -34.633 0.686 5.100 1.00 1.35 C ATOM 341 CG PRO A 22 -35.066 -0.349 6.083 1.00 1.47 C ATOM 342 CD PRO A 22 -33.881 -1.281 6.331 1.00 1.34 C ATOM 0 HA PRO A 22 -33.650 -0.215 3.346 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -34.372 1.615 5.606 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.438 0.918 4.403 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -35.386 0.119 7.014 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -35.918 -0.909 5.698 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.397 -1.061 7.283 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.199 -2.323 6.369 1.00 1.34 H new ATOM 350 N LYS A 23 -32.511 2.121 3.333 1.00 1.27 N ATOM 351 CA LYS A 23 -31.500 3.208 3.194 1.00 1.28 C ATOM 352 C LYS A 23 -31.445 3.996 4.509 1.00 1.33 C ATOM 353 O LYS A 23 -30.436 4.576 4.851 1.00 1.35 O ATOM 354 CB LYS A 23 -31.902 4.140 2.036 1.00 1.31 C ATOM 355 CG LYS A 23 -30.801 5.181 1.779 1.00 1.27 C ATOM 356 CD LYS A 23 -31.381 6.584 1.975 1.00 1.83 C ATOM 357 CE LYS A 23 -32.461 6.841 0.921 1.00 1.76 C ATOM 358 NZ LYS A 23 -33.761 7.110 1.599 1.00 2.13 N ATOM 0 H LYS A 23 -33.298 2.171 2.686 1.00 1.27 H new ATOM 0 HA LYS A 23 -30.519 2.785 2.978 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -32.076 3.555 1.133 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -32.839 4.644 2.274 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -29.966 5.021 2.461 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -30.411 5.074 0.767 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -31.804 6.678 2.975 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -30.591 7.331 1.892 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -32.181 7.690 0.297 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -32.554 5.978 0.262 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -34.543 6.838 0.970 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -33.815 6.557 2.478 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -33.833 8.123 1.822 1.00 2.13 H new ATOM 372 N THR A 24 -32.525 4.017 5.253 1.00 1.35 N ATOM 373 CA THR A 24 -32.540 4.758 6.551 1.00 1.41 C ATOM 374 C THR A 24 -31.601 4.103 7.575 1.00 1.43 C ATOM 375 O THR A 24 -30.872 4.776 8.273 1.00 1.48 O ATOM 376 CB THR A 24 -33.964 4.762 7.113 1.00 1.40 C ATOM 377 OG1 THR A 24 -34.214 3.526 7.769 1.00 1.42 O ATOM 378 CG2 THR A 24 -34.965 4.950 5.973 1.00 1.42 C ATOM 0 H THR A 24 -33.400 3.550 5.015 1.00 1.35 H new ATOM 0 HA THR A 24 -32.198 5.777 6.368 1.00 1.41 H new ATOM 0 HB THR A 24 -34.073 5.580 7.825 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.125 3.526 8.131 1.00 1.42 H new ATOM 0 HG21 THR A 24 -35.978 4.953 6.375 1.00 1.42 H new ATOM 0 HG22 THR A 24 -34.771 5.898 5.471 1.00 1.42 H new ATOM 0 HG23 THR A 24 -34.860 4.134 5.259 1.00 1.42 H new ATOM 386 N ARG A 25 -31.615 2.798 7.680 1.00 1.40 N ATOM 387 CA ARG A 25 -30.724 2.117 8.669 1.00 1.43 C ATOM 388 C ARG A 25 -29.276 2.477 8.356 1.00 1.44 C ATOM 389 O ARG A 25 -28.378 2.293 9.153 1.00 1.47 O ATOM 390 CB ARG A 25 -30.911 0.598 8.552 1.00 1.39 C ATOM 391 CG ARG A 25 -30.210 -0.120 9.716 1.00 1.72 C ATOM 392 CD ARG A 25 -30.833 0.269 11.064 1.00 1.56 C ATOM 393 NE ARG A 25 -32.213 0.804 10.869 1.00 2.13 N ATOM 394 CZ ARG A 25 -32.696 1.699 11.690 1.00 2.45 C ATOM 395 NH1 ARG A 25 -31.999 2.091 12.724 1.00 2.53 N ATOM 396 NH2 ARG A 25 -33.886 2.191 11.486 1.00 3.15 N ATOM 0 H ARG A 25 -32.203 2.176 7.125 1.00 1.40 H new ATOM 0 HA ARG A 25 -30.973 2.437 9.681 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -31.974 0.355 8.554 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.505 0.247 7.603 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -30.281 -1.199 9.577 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -29.149 0.132 9.716 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -30.863 -0.600 11.721 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -30.212 1.019 11.555 1.00 1.56 H new ATOM 0 HE ARG A 25 -32.782 0.469 10.091 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -31.073 1.698 12.894 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -32.381 2.790 13.361 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -34.438 1.877 10.687 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -34.265 2.890 12.125 1.00 3.15 H new ATOM 410 N ILE A 26 -29.064 3.005 7.194 1.00 1.41 N ATOM 411 CA ILE A 26 -27.696 3.403 6.801 1.00 1.41 C ATOM 412 C ILE A 26 -27.423 4.808 7.335 1.00 1.49 C ATOM 413 O ILE A 26 -26.289 5.199 7.530 1.00 1.50 O ATOM 414 CB ILE A 26 -27.572 3.348 5.278 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.129 1.999 4.808 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.100 3.477 4.875 1.00 1.34 C ATOM 417 CD1 ILE A 26 -27.582 1.638 3.426 1.00 0.96 C ATOM 0 H ILE A 26 -29.785 3.180 6.494 1.00 1.41 H new ATOM 0 HA ILE A 26 -26.957 2.721 7.223 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.128 4.165 4.819 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -27.863 1.221 5.524 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.218 2.042 4.774 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.015 3.437 3.789 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -25.706 4.427 5.235 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -25.530 2.658 5.314 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -27.990 0.677 3.113 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -27.870 2.406 2.709 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -26.495 1.573 3.471 1.00 0.96 H new ATOM 429 N MET A 27 -28.455 5.578 7.576 1.00 1.55 N ATOM 430 CA MET A 27 -28.243 6.958 8.098 1.00 1.64 C ATOM 431 C MET A 27 -27.409 6.882 9.376 1.00 1.70 C ATOM 432 O MET A 27 -26.445 7.602 9.546 1.00 1.74 O ATOM 433 CB MET A 27 -29.595 7.619 8.403 1.00 1.72 C ATOM 434 CG MET A 27 -30.298 8.028 7.101 1.00 2.02 C ATOM 435 SD MET A 27 -31.994 8.533 7.474 1.00 2.29 S ATOM 436 CE MET A 27 -31.718 10.319 7.375 1.00 1.90 C ATOM 0 H MET A 27 -29.429 5.310 7.434 1.00 1.55 H new ATOM 0 HA MET A 27 -27.722 7.554 7.349 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.226 6.929 8.963 1.00 1.72 H new ATOM 0 HB3 MET A 27 -29.444 8.496 9.033 1.00 1.72 H new ATOM 0 HG2 MET A 27 -29.759 8.846 6.624 1.00 2.02 H new ATOM 0 HG3 MET A 27 -30.300 7.195 6.398 1.00 2.02 H new ATOM 0 HE1 MET A 27 -32.652 10.843 7.575 1.00 1.90 H new ATOM 0 HE2 MET A 27 -30.971 10.613 8.113 1.00 1.90 H new ATOM 0 HE3 MET A 27 -31.364 10.578 6.377 1.00 1.90 H new ATOM 446 N TYR A 28 -27.763 6.002 10.270 1.00 1.72 N ATOM 447 CA TYR A 28 -26.984 5.860 11.529 1.00 1.80 C ATOM 448 C TYR A 28 -25.552 5.452 11.182 1.00 1.78 C ATOM 449 O TYR A 28 -24.703 5.332 12.044 1.00 2.09 O ATOM 450 CB TYR A 28 -27.620 4.785 12.411 1.00 1.82 C ATOM 451 CG TYR A 28 -27.154 4.965 13.836 1.00 2.02 C ATOM 452 CD1 TYR A 28 -27.760 5.923 14.655 1.00 2.25 C ATOM 453 CD2 TYR A 28 -26.114 4.173 14.336 1.00 2.64 C ATOM 454 CE1 TYR A 28 -27.327 6.090 15.976 1.00 2.48 C ATOM 455 CE2 TYR A 28 -25.681 4.339 15.657 1.00 3.00 C ATOM 456 CZ TYR A 28 -26.288 5.298 16.477 1.00 2.69 C ATOM 457 OH TYR A 28 -25.861 5.462 17.779 1.00 3.10 O ATOM 0 H TYR A 28 -28.561 5.373 10.182 1.00 1.72 H new ATOM 0 HA TYR A 28 -26.981 6.808 12.067 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -28.707 4.854 12.361 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -27.346 3.794 12.050 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -28.562 6.534 14.268 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -25.646 3.434 13.703 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -27.795 6.830 16.608 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -24.879 3.728 16.043 1.00 3.00 H new ATOM 0 HH TYR A 28 -25.133 4.833 17.966 1.00 3.10 H new ATOM 467 N GLY A 29 -25.276 5.253 9.920 1.00 1.51 N ATOM 468 CA GLY A 29 -23.899 4.868 9.508 1.00 1.48 C ATOM 469 C GLY A 29 -23.141 6.124 9.089 1.00 1.54 C ATOM 470 O GLY A 29 -21.928 6.181 9.142 1.00 1.61 O ATOM 0 H GLY A 29 -25.948 5.341 9.157 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.383 4.373 10.331 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -23.937 4.157 8.682 1.00 1.48 H new ATOM 474 N ALA A 30 -23.853 7.135 8.672 1.00 1.57 N ATOM 475 CA ALA A 30 -23.186 8.395 8.247 1.00 1.67 C ATOM 476 C ALA A 30 -24.238 9.490 8.046 1.00 1.71 C ATOM 477 O ALA A 30 -25.424 9.252 8.165 1.00 1.72 O ATOM 478 CB ALA A 30 -22.433 8.152 6.936 1.00 1.66 C ATOM 0 H ALA A 30 -24.871 7.141 8.608 1.00 1.57 H new ATOM 0 HA ALA A 30 -22.481 8.713 9.015 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -21.943 9.074 6.622 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -21.683 7.375 7.086 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -23.136 7.834 6.166 1.00 1.66 H new ATOM 484 N ASN A 31 -23.815 10.690 7.737 1.00 1.82 N ATOM 485 CA ASN A 31 -24.793 11.799 7.524 1.00 1.87 C ATOM 486 C ASN A 31 -25.595 11.535 6.248 1.00 1.82 C ATOM 487 O ASN A 31 -26.298 12.390 5.751 1.00 2.17 O ATOM 488 CB ASN A 31 -24.041 13.122 7.387 1.00 2.00 C ATOM 489 CG ASN A 31 -23.707 13.661 8.778 1.00 2.22 C ATOM 490 OD1 ASN A 31 -24.315 14.607 9.237 1.00 2.79 O ATOM 491 ND2 ASN A 31 -22.761 13.093 9.472 1.00 2.38 N ATOM 0 H ASN A 31 -22.835 10.949 7.623 1.00 1.82 H new ATOM 0 HA ASN A 31 -25.472 11.852 8.375 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -23.127 12.976 6.812 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -24.649 13.844 6.841 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -22.530 13.443 10.402 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -22.251 12.299 9.085 1.00 2.38 H new ATOM 498 N LEU A 32 -25.514 10.336 5.751 1.00 1.81 N ATOM 499 CA LEU A 32 -26.274 9.929 4.541 1.00 1.70 C ATOM 500 C LEU A 32 -26.478 11.046 3.542 1.00 1.72 C ATOM 501 O LEU A 32 -27.383 11.854 3.625 1.00 1.84 O ATOM 502 CB LEU A 32 -27.620 9.353 4.948 1.00 1.75 C ATOM 503 CG LEU A 32 -27.764 7.912 4.420 1.00 1.74 C ATOM 504 CD1 LEU A 32 -27.774 7.906 2.889 1.00 1.67 C ATOM 505 CD2 LEU A 32 -26.601 7.043 4.912 1.00 1.69 C ATOM 0 H LEU A 32 -24.933 9.597 6.147 1.00 1.81 H new ATOM 0 HA LEU A 32 -25.668 9.175 4.039 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -27.714 9.361 6.034 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -28.424 9.975 4.554 1.00 1.75 H new ATOM 0 HG LEU A 32 -28.704 7.507 4.794 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -27.876 6.882 2.530 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -28.612 8.502 2.528 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -26.841 8.329 2.517 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -26.718 6.029 4.530 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -25.659 7.459 4.554 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -26.598 7.022 6.002 1.00 1.69 H new ATOM 517 N SER A 33 -25.673 11.005 2.546 1.00 1.63 N ATOM 518 CA SER A 33 -25.773 11.934 1.410 1.00 1.66 C ATOM 519 C SER A 33 -27.096 11.633 0.690 1.00 1.68 C ATOM 520 O SER A 33 -27.248 11.965 -0.448 1.00 1.69 O ATOM 521 CB SER A 33 -24.582 11.732 0.471 1.00 1.58 C ATOM 522 OG SER A 33 -23.492 11.191 1.207 1.00 1.75 O ATOM 0 H SER A 33 -24.910 10.333 2.466 1.00 1.63 H new ATOM 0 HA SER A 33 -25.757 12.971 1.745 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.855 11.061 -0.343 1.00 1.58 H new ATOM 0 HB3 SER A 33 -24.295 12.681 0.019 1.00 1.58 H new ATOM 0 HG SER A 33 -22.727 11.058 0.609 1.00 1.75 H new ATOM 528 N TYR A 34 -27.990 10.889 1.334 1.00 1.70 N ATOM 529 CA TYR A 34 -29.272 10.405 0.701 1.00 1.73 C ATOM 530 C TYR A 34 -29.636 11.172 -0.569 1.00 1.77 C ATOM 531 O TYR A 34 -29.936 10.565 -1.579 1.00 1.71 O ATOM 532 CB TYR A 34 -30.415 10.583 1.697 1.00 1.92 C ATOM 533 CG TYR A 34 -30.934 12.001 1.654 1.00 1.73 C ATOM 534 CD1 TYR A 34 -31.914 12.359 0.718 1.00 1.94 C ATOM 535 CD2 TYR A 34 -30.441 12.956 2.550 1.00 2.49 C ATOM 536 CE1 TYR A 34 -32.399 13.670 0.679 1.00 2.57 C ATOM 537 CE2 TYR A 34 -30.927 14.268 2.511 1.00 3.01 C ATOM 538 CZ TYR A 34 -31.906 14.625 1.575 1.00 2.95 C ATOM 539 OH TYR A 34 -32.384 15.919 1.538 1.00 3.85 O ATOM 0 H TYR A 34 -27.874 10.592 2.303 1.00 1.70 H new ATOM 0 HA TYR A 34 -29.119 9.360 0.433 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -31.221 9.887 1.464 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -30.070 10.346 2.703 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -32.295 11.622 0.027 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -29.686 12.681 3.271 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -33.154 13.945 -0.043 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -30.547 15.005 3.203 1.00 3.01 H new ATOM 0 HH TYR A 34 -31.937 16.453 2.228 1.00 3.85 H new ATOM 549 N ALA A 35 -29.584 12.463 -0.583 1.00 1.88 N ATOM 550 CA ALA A 35 -29.899 13.150 -1.859 1.00 1.95 C ATOM 551 C ALA A 35 -28.929 12.605 -2.913 1.00 1.82 C ATOM 552 O ALA A 35 -29.297 12.288 -4.026 1.00 1.78 O ATOM 553 CB ALA A 35 -29.701 14.659 -1.701 1.00 2.11 C ATOM 0 H ALA A 35 -29.345 13.063 0.207 1.00 1.88 H new ATOM 0 HA ALA A 35 -30.934 12.972 -2.152 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -29.934 15.157 -2.642 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -30.362 15.033 -0.919 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -28.665 14.864 -1.429 1.00 2.11 H new ATOM 559 N LEU A 36 -27.686 12.489 -2.536 1.00 1.76 N ATOM 560 CA LEU A 36 -26.632 11.956 -3.450 1.00 1.66 C ATOM 561 C LEU A 36 -26.368 10.456 -3.198 1.00 1.48 C ATOM 562 O LEU A 36 -26.212 9.689 -4.126 1.00 1.40 O ATOM 563 CB LEU A 36 -25.334 12.735 -3.227 1.00 1.73 C ATOM 564 CG LEU A 36 -24.891 13.381 -4.542 1.00 1.83 C ATOM 565 CD1 LEU A 36 -25.910 14.443 -4.959 1.00 2.23 C ATOM 566 CD2 LEU A 36 -23.522 14.036 -4.351 1.00 2.42 C ATOM 0 H LEU A 36 -27.347 12.748 -1.609 1.00 1.76 H new ATOM 0 HA LEU A 36 -26.981 12.074 -4.476 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -25.484 13.501 -2.466 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -24.556 12.067 -2.858 1.00 1.73 H new ATOM 0 HG LEU A 36 -24.825 12.618 -5.317 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -25.594 14.903 -5.895 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -26.886 13.977 -5.095 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -25.977 15.207 -4.184 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -23.205 14.496 -5.287 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -23.589 14.799 -3.575 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -22.795 13.280 -4.054 1.00 2.42 H new ATOM 578 N THR A 37 -26.259 10.055 -1.943 1.00 1.43 N ATOM 579 CA THR A 37 -25.937 8.620 -1.607 1.00 1.30 C ATOM 580 C THR A 37 -26.602 7.668 -2.589 1.00 1.23 C ATOM 581 O THR A 37 -26.018 6.679 -2.979 1.00 1.15 O ATOM 582 CB THR A 37 -26.407 8.271 -0.196 1.00 1.36 C ATOM 583 OG1 THR A 37 -25.986 9.274 0.714 1.00 1.49 O ATOM 584 CG2 THR A 37 -25.821 6.921 0.221 1.00 1.33 C ATOM 0 H THR A 37 -26.380 10.664 -1.134 1.00 1.43 H new ATOM 0 HA THR A 37 -24.854 8.511 -1.669 1.00 1.30 H new ATOM 0 HB THR A 37 -27.495 8.212 -0.186 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.051 9.119 0.962 1.00 1.49 H new ATOM 0 HG21 THR A 37 -26.157 6.674 1.228 1.00 1.33 H new ATOM 0 HG22 THR A 37 -26.155 6.149 -0.473 1.00 1.33 H new ATOM 0 HG23 THR A 37 -24.733 6.976 0.206 1.00 1.33 H new ATOM 592 N GLY A 38 -27.805 7.955 -2.995 1.00 1.26 N ATOM 593 CA GLY A 38 -28.487 7.053 -3.974 1.00 1.21 C ATOM 594 C GLY A 38 -27.474 6.690 -5.064 1.00 1.17 C ATOM 595 O GLY A 38 -27.578 5.681 -5.731 1.00 1.12 O ATOM 0 H GLY A 38 -28.346 8.767 -2.697 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -28.850 6.154 -3.476 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -29.355 7.549 -4.409 1.00 1.21 H new ATOM 599 N ARG A 39 -26.478 7.518 -5.214 1.00 1.22 N ATOM 600 CA ARG A 39 -25.403 7.276 -6.219 1.00 1.23 C ATOM 601 C ARG A 39 -24.548 6.082 -5.776 1.00 1.13 C ATOM 602 O ARG A 39 -24.116 5.280 -6.582 1.00 1.10 O ATOM 603 CB ARG A 39 -24.523 8.533 -6.302 1.00 1.33 C ATOM 604 CG ARG A 39 -23.479 8.397 -7.420 1.00 1.36 C ATOM 605 CD ARG A 39 -22.250 9.243 -7.070 1.00 1.39 C ATOM 606 NE ARG A 39 -22.657 10.670 -6.924 1.00 1.58 N ATOM 607 CZ ARG A 39 -21.761 11.581 -6.658 1.00 2.13 C ATOM 608 NH1 ARG A 39 -20.509 11.243 -6.519 1.00 2.75 N ATOM 609 NH2 ARG A 39 -22.118 12.831 -6.531 1.00 2.58 N ATOM 0 H ARG A 39 -26.361 8.373 -4.669 1.00 1.22 H new ATOM 0 HA ARG A 39 -25.842 7.060 -7.193 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -25.147 9.407 -6.486 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -24.021 8.694 -5.348 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -23.193 7.352 -7.541 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -23.902 8.724 -8.370 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -21.800 8.885 -6.144 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -21.494 9.147 -7.850 1.00 1.39 H new ATOM 0 HE ARG A 39 -23.636 10.934 -7.032 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -20.230 10.267 -6.618 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -19.809 11.955 -6.311 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -23.097 13.095 -6.640 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -21.418 13.543 -6.323 1.00 2.58 H new ATOM 623 N TYR A 40 -24.307 5.956 -4.497 1.00 1.10 N ATOM 624 CA TYR A 40 -23.484 4.815 -4.006 1.00 1.01 C ATOM 625 C TYR A 40 -24.327 3.544 -3.983 1.00 0.91 C ATOM 626 O TYR A 40 -23.860 2.479 -4.333 1.00 0.85 O ATOM 627 CB TYR A 40 -22.953 5.107 -2.594 1.00 1.04 C ATOM 628 CG TYR A 40 -22.360 6.506 -2.508 1.00 1.24 C ATOM 629 CD1 TYR A 40 -21.576 7.034 -3.552 1.00 1.92 C ATOM 630 CD2 TYR A 40 -22.596 7.279 -1.364 1.00 1.74 C ATOM 631 CE1 TYR A 40 -21.042 8.324 -3.443 1.00 2.17 C ATOM 632 CE2 TYR A 40 -22.060 8.567 -1.260 1.00 2.01 C ATOM 633 CZ TYR A 40 -21.285 9.090 -2.298 1.00 1.89 C ATOM 634 OH TYR A 40 -20.757 10.360 -2.192 1.00 2.27 O ATOM 0 H TYR A 40 -24.644 6.592 -3.775 1.00 1.10 H new ATOM 0 HA TYR A 40 -22.638 4.679 -4.680 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -23.762 5.007 -1.870 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -22.195 4.371 -2.328 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -21.387 6.444 -4.437 1.00 1.92 H new ATOM 0 HD2 TYR A 40 -23.194 6.879 -0.559 1.00 1.74 H new ATOM 0 HE1 TYR A 40 -20.441 8.728 -4.244 1.00 2.17 H new ATOM 0 HE2 TYR A 40 -22.246 9.158 -0.375 1.00 2.01 H new ATOM 0 HH TYR A 40 -21.022 10.754 -1.335 1.00 2.27 H new ATOM 644 N ILE A 41 -25.565 3.633 -3.589 1.00 0.89 N ATOM 645 CA ILE A 41 -26.419 2.415 -3.565 1.00 0.80 C ATOM 646 C ILE A 41 -26.654 1.934 -4.997 1.00 0.77 C ATOM 647 O ILE A 41 -26.288 0.837 -5.362 1.00 0.70 O ATOM 648 CB ILE A 41 -27.758 2.742 -2.899 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.521 3.068 -1.421 1.00 0.92 C ATOM 650 CG2 ILE A 41 -28.695 1.537 -3.009 1.00 0.77 C ATOM 651 CD1 ILE A 41 -28.789 3.669 -0.813 1.00 0.95 C ATOM 0 H ILE A 41 -26.021 4.493 -3.284 1.00 0.89 H new ATOM 0 HA ILE A 41 -25.921 1.629 -2.998 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.212 3.599 -3.397 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.241 2.164 -0.880 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -26.692 3.769 -1.322 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.648 1.772 -2.534 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -28.862 1.301 -4.060 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.244 0.679 -2.511 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.615 3.899 0.238 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.050 4.583 -1.346 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.607 2.954 -0.897 1.00 0.95 H new ATOM 663 N LYS A 42 -27.255 2.759 -5.814 1.00 0.85 N ATOM 664 CA LYS A 42 -27.518 2.362 -7.224 1.00 0.86 C ATOM 665 C LYS A 42 -26.222 1.845 -7.853 1.00 0.85 C ATOM 666 O LYS A 42 -26.202 0.826 -8.512 1.00 0.82 O ATOM 667 CB LYS A 42 -28.019 3.582 -7.998 1.00 0.98 C ATOM 668 CG LYS A 42 -28.987 3.143 -9.100 1.00 1.09 C ATOM 669 CD LYS A 42 -28.303 2.127 -10.014 1.00 1.05 C ATOM 670 CE LYS A 42 -29.027 2.082 -11.361 1.00 1.07 C ATOM 671 NZ LYS A 42 -28.346 1.108 -12.260 1.00 1.81 N ATOM 0 H LYS A 42 -27.575 3.694 -5.562 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.271 1.575 -7.257 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -28.518 4.274 -7.319 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -27.176 4.117 -8.435 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -29.881 2.704 -8.658 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -29.310 4.008 -9.679 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -27.258 2.400 -10.160 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -28.313 1.140 -9.551 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -30.068 1.793 -11.217 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -29.031 3.072 -11.817 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -28.796 1.127 -13.197 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -27.342 1.364 -12.353 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -28.423 0.152 -11.858 1.00 1.81 H new ATOM 685 N MET A 43 -25.137 2.535 -7.650 1.00 0.90 N ATOM 686 CA MET A 43 -23.845 2.071 -8.229 1.00 0.93 C ATOM 687 C MET A 43 -23.522 0.680 -7.679 1.00 0.80 C ATOM 688 O MET A 43 -23.168 -0.225 -8.404 1.00 0.79 O ATOM 689 CB MET A 43 -22.731 3.050 -7.832 1.00 1.02 C ATOM 690 CG MET A 43 -21.374 2.531 -8.321 1.00 1.13 C ATOM 691 SD MET A 43 -20.077 3.703 -7.853 1.00 2.14 S ATOM 692 CE MET A 43 -19.708 3.002 -6.224 1.00 2.36 C ATOM 0 H MET A 43 -25.087 3.399 -7.110 1.00 0.90 H new ATOM 0 HA MET A 43 -23.920 2.028 -9.316 1.00 0.93 H new ATOM 0 HB2 MET A 43 -22.929 4.032 -8.261 1.00 1.02 H new ATOM 0 HB3 MET A 43 -22.713 3.173 -6.749 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.169 1.552 -7.887 1.00 1.13 H new ATOM 0 HG3 MET A 43 -21.390 2.403 -9.403 1.00 1.13 H new ATOM 0 HE1 MET A 43 -18.859 3.527 -5.786 1.00 2.36 H new ATOM 0 HE2 MET A 43 -20.577 3.112 -5.575 1.00 2.36 H new ATOM 0 HE3 MET A 43 -19.465 1.945 -6.329 1.00 2.36 H new ATOM 702 N LEU A 44 -23.615 0.526 -6.392 1.00 0.73 N ATOM 703 CA LEU A 44 -23.287 -0.779 -5.752 1.00 0.61 C ATOM 704 C LEU A 44 -24.203 -1.900 -6.276 1.00 0.57 C ATOM 705 O LEU A 44 -23.731 -2.944 -6.687 1.00 0.54 O ATOM 706 CB LEU A 44 -23.433 -0.625 -4.231 1.00 0.57 C ATOM 707 CG LEU A 44 -22.197 0.092 -3.662 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.426 0.419 -2.186 1.00 1.14 C ATOM 709 CD2 LEU A 44 -20.953 -0.799 -3.784 1.00 0.67 C ATOM 0 H LEU A 44 -23.908 1.258 -5.745 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.263 -1.058 -6.000 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.334 -0.058 -3.998 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.544 -1.604 -3.765 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.040 1.009 -4.230 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.549 0.927 -1.785 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.297 1.067 -2.088 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.596 -0.504 -1.631 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.089 -0.275 -3.376 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.112 -1.724 -3.229 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.774 -1.032 -4.834 1.00 0.67 H new ATOM 721 N MET A 45 -25.499 -1.721 -6.282 1.00 0.60 N ATOM 722 CA MET A 45 -26.369 -2.821 -6.800 1.00 0.58 C ATOM 723 C MET A 45 -26.203 -2.918 -8.322 1.00 0.62 C ATOM 724 O MET A 45 -26.143 -3.994 -8.883 1.00 0.59 O ATOM 725 CB MET A 45 -27.841 -2.572 -6.440 1.00 0.64 C ATOM 726 CG MET A 45 -28.223 -1.118 -6.701 1.00 1.07 C ATOM 727 SD MET A 45 -29.961 -1.042 -7.203 1.00 1.19 S ATOM 728 CE MET A 45 -30.565 -0.092 -5.786 1.00 1.04 C ATOM 0 H MET A 45 -25.984 -0.883 -5.960 1.00 0.60 H new ATOM 0 HA MET A 45 -26.067 -3.760 -6.337 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.480 -3.232 -7.027 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.010 -2.815 -5.391 1.00 0.64 H new ATOM 0 HG2 MET A 45 -28.065 -0.521 -5.803 1.00 1.07 H new ATOM 0 HG3 MET A 45 -27.588 -0.697 -7.480 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.653 -0.151 -5.745 1.00 1.04 H new ATOM 0 HE2 MET A 45 -30.145 -0.502 -4.868 1.00 1.04 H new ATOM 0 HE3 MET A 45 -30.262 0.950 -5.891 1.00 1.04 H new ATOM 738 N ASP A 46 -26.107 -1.800 -8.986 1.00 0.69 N ATOM 739 CA ASP A 46 -25.922 -1.823 -10.465 1.00 0.76 C ATOM 740 C ASP A 46 -24.659 -2.617 -10.799 1.00 0.75 C ATOM 741 O ASP A 46 -24.545 -3.216 -11.851 1.00 0.81 O ATOM 742 CB ASP A 46 -25.758 -0.397 -10.985 1.00 0.85 C ATOM 743 CG ASP A 46 -25.443 -0.432 -12.482 1.00 1.03 C ATOM 744 OD1 ASP A 46 -26.159 -1.108 -13.202 1.00 1.71 O ATOM 745 OD2 ASP A 46 -24.492 0.218 -12.883 1.00 1.26 O ATOM 0 H ASP A 46 -26.149 -0.870 -8.569 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.792 -2.285 -10.931 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.670 0.173 -10.808 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -24.957 0.108 -10.446 1.00 0.85 H new ATOM 750 N LEU A 47 -23.710 -2.615 -9.906 1.00 0.69 N ATOM 751 CA LEU A 47 -22.443 -3.355 -10.156 1.00 0.70 C ATOM 752 C LEU A 47 -22.526 -4.748 -9.525 1.00 0.62 C ATOM 753 O LEU A 47 -21.601 -5.529 -9.615 1.00 0.63 O ATOM 754 CB LEU A 47 -21.269 -2.567 -9.566 1.00 0.72 C ATOM 755 CG LEU A 47 -20.660 -1.668 -10.655 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.757 -0.833 -11.326 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.631 -0.722 -10.030 1.00 0.89 C ATOM 0 H LEU A 47 -23.758 -2.130 -9.010 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.288 -3.468 -11.229 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.609 -1.961 -8.726 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.514 -3.252 -9.180 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.178 -2.302 -11.399 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.314 -0.201 -12.095 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.492 -1.497 -11.781 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.246 -0.207 -10.579 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.202 -0.087 -10.805 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.118 -0.099 -9.279 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -18.839 -1.305 -9.560 1.00 0.89 H new ATOM 769 N GLU A 48 -23.631 -5.057 -8.893 1.00 0.55 N ATOM 770 CA GLU A 48 -23.802 -6.400 -8.256 1.00 0.50 C ATOM 771 C GLU A 48 -23.102 -6.423 -6.894 1.00 0.44 C ATOM 772 O GLU A 48 -22.151 -7.145 -6.680 1.00 0.46 O ATOM 773 CB GLU A 48 -23.227 -7.496 -9.167 1.00 0.56 C ATOM 774 CG GLU A 48 -24.019 -8.789 -8.963 1.00 1.22 C ATOM 775 CD GLU A 48 -25.397 -8.652 -9.612 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.685 -7.583 -10.125 1.00 1.79 O ATOM 777 OE2 GLU A 48 -26.142 -9.617 -9.585 1.00 1.73 O ATOM 0 H GLU A 48 -24.429 -4.431 -8.790 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.865 -6.591 -8.111 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.281 -7.184 -10.210 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.174 -7.661 -8.938 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.481 -9.630 -9.401 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.126 -8.998 -7.899 1.00 1.22 H new ATOM 784 N ILE A 49 -23.581 -5.640 -5.967 1.00 0.40 N ATOM 785 CA ILE A 49 -22.969 -5.608 -4.611 1.00 0.37 C ATOM 786 C ILE A 49 -24.095 -5.530 -3.584 1.00 0.37 C ATOM 787 O ILE A 49 -24.069 -6.189 -2.564 1.00 0.40 O ATOM 788 CB ILE A 49 -22.091 -4.360 -4.479 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.936 -4.392 -5.499 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.544 -4.249 -3.053 1.00 0.37 C ATOM 791 CD1 ILE A 49 -19.973 -5.556 -5.235 1.00 0.82 C ATOM 0 H ILE A 49 -24.378 -5.016 -6.093 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.362 -6.499 -4.451 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.704 -3.483 -4.689 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -21.343 -4.479 -6.506 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.388 -3.451 -5.457 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -20.921 -3.358 -2.971 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.374 -4.178 -2.350 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -20.947 -5.132 -2.822 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.174 -5.542 -5.976 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -19.545 -5.455 -4.238 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -20.515 -6.499 -5.303 1.00 0.82 H new ATOM 803 N ILE A 50 -25.088 -4.725 -3.862 1.00 0.43 N ATOM 804 CA ILE A 50 -26.240 -4.591 -2.927 1.00 0.48 C ATOM 805 C ILE A 50 -27.463 -5.262 -3.549 1.00 0.43 C ATOM 806 O ILE A 50 -27.785 -5.014 -4.693 1.00 0.49 O ATOM 807 CB ILE A 50 -26.547 -3.110 -2.697 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.620 -2.559 -1.610 1.00 0.62 C ATOM 809 CG2 ILE A 50 -28.007 -2.958 -2.257 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.809 -1.045 -1.495 1.00 0.74 C ATOM 0 H ILE A 50 -25.149 -4.152 -4.703 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.995 -5.063 -1.976 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.387 -2.554 -3.621 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.838 -3.037 -0.655 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.582 -2.789 -1.852 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.229 -1.904 -2.092 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.664 -3.350 -3.033 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -28.168 -3.512 -1.332 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.149 -0.654 -0.721 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.569 -0.575 -2.449 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.844 -0.826 -1.233 1.00 0.74 H new ATOM 822 N ARG A 51 -28.155 -6.093 -2.812 1.00 0.58 N ATOM 823 CA ARG A 51 -29.363 -6.750 -3.384 1.00 0.56 C ATOM 824 C ARG A 51 -30.621 -6.078 -2.839 1.00 0.53 C ATOM 825 O ARG A 51 -30.581 -5.353 -1.865 1.00 0.53 O ATOM 826 CB ARG A 51 -29.375 -8.231 -3.029 1.00 0.60 C ATOM 827 CG ARG A 51 -29.458 -9.038 -4.320 1.00 0.83 C ATOM 828 CD ARG A 51 -29.619 -10.516 -3.995 1.00 0.87 C ATOM 829 NE ARG A 51 -30.926 -10.987 -4.526 1.00 1.02 N ATOM 830 CZ ARG A 51 -31.288 -12.228 -4.365 1.00 1.06 C ATOM 831 NH1 ARG A 51 -30.506 -13.058 -3.732 1.00 1.47 N ATOM 832 NH2 ARG A 51 -32.433 -12.638 -4.835 1.00 1.39 N ATOM 0 H ARG A 51 -27.936 -6.342 -1.847 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.340 -6.648 -4.469 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.474 -8.495 -2.475 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -30.224 -8.459 -2.385 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -30.300 -8.695 -4.921 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -28.558 -8.883 -4.915 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -28.804 -11.090 -4.436 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -29.572 -10.672 -2.917 1.00 0.87 H new ATOM 0 HE ARG A 51 -31.540 -10.337 -5.017 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -29.611 -12.735 -3.363 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -30.789 -14.030 -3.606 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -33.044 -11.987 -5.328 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -32.717 -13.609 -4.710 1.00 1.39 H new ATOM 846 N GLN A 52 -31.737 -6.321 -3.466 1.00 0.59 N ATOM 847 CA GLN A 52 -33.020 -5.709 -3.008 1.00 0.59 C ATOM 848 C GLN A 52 -33.847 -6.748 -2.256 1.00 0.56 C ATOM 849 O GLN A 52 -34.315 -7.708 -2.835 1.00 0.58 O ATOM 850 CB GLN A 52 -33.807 -5.223 -4.226 1.00 0.68 C ATOM 851 CG GLN A 52 -34.790 -4.132 -3.797 1.00 1.47 C ATOM 852 CD GLN A 52 -35.872 -3.973 -4.866 1.00 1.71 C ATOM 853 OE1 GLN A 52 -36.643 -4.881 -5.108 1.00 2.42 O ATOM 854 NE2 GLN A 52 -35.963 -2.848 -5.522 1.00 1.84 N ATOM 0 H GLN A 52 -31.818 -6.923 -4.285 1.00 0.59 H new ATOM 0 HA GLN A 52 -32.806 -4.870 -2.346 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -33.124 -4.835 -4.982 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -34.346 -6.055 -4.680 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -35.244 -4.392 -2.841 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -34.263 -3.188 -3.654 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -35.316 -2.086 -5.319 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -36.681 -2.731 -6.237 1.00 1.84 H new ATOM 863 N GLU A 53 -34.051 -6.552 -0.978 1.00 0.67 N ATOM 864 CA GLU A 53 -34.870 -7.514 -0.194 1.00 0.78 C ATOM 865 C GLU A 53 -36.160 -6.824 0.221 1.00 0.77 C ATOM 866 O GLU A 53 -36.185 -6.023 1.126 1.00 0.87 O ATOM 867 CB GLU A 53 -34.096 -7.943 1.050 1.00 1.04 C ATOM 868 CG GLU A 53 -33.886 -9.456 1.025 1.00 0.85 C ATOM 869 CD GLU A 53 -33.219 -9.902 2.329 1.00 1.59 C ATOM 870 OE1 GLU A 53 -32.262 -9.261 2.730 1.00 2.30 O ATOM 871 OE2 GLU A 53 -33.679 -10.874 2.903 1.00 2.25 O ATOM 0 H GLU A 53 -33.683 -5.764 -0.446 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.095 -8.394 -0.796 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -33.134 -7.432 1.086 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.643 -7.656 1.948 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -34.842 -9.964 0.901 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -33.265 -9.733 0.173 1.00 0.85 H new ATOM 878 N GLY A 54 -37.233 -7.127 -0.441 1.00 0.73 N ATOM 879 CA GLY A 54 -38.523 -6.483 -0.092 1.00 0.75 C ATOM 880 C GLY A 54 -38.367 -4.960 -0.142 1.00 0.83 C ATOM 881 O GLY A 54 -38.921 -4.250 0.673 1.00 1.15 O ATOM 0 H GLY A 54 -37.274 -7.795 -1.211 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.300 -6.802 -0.787 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.839 -6.794 0.904 1.00 0.75 H new ATOM 885 N LYS A 55 -37.588 -4.461 -1.075 1.00 0.86 N ATOM 886 CA LYS A 55 -37.352 -2.985 -1.178 1.00 1.03 C ATOM 887 C LYS A 55 -36.272 -2.590 -0.172 1.00 1.02 C ATOM 888 O LYS A 55 -35.994 -1.427 0.044 1.00 1.27 O ATOM 889 CB LYS A 55 -38.642 -2.216 -0.878 1.00 1.21 C ATOM 890 CG LYS A 55 -38.675 -0.930 -1.705 1.00 1.38 C ATOM 891 CD LYS A 55 -39.596 0.088 -1.028 1.00 1.67 C ATOM 892 CE LYS A 55 -39.624 1.378 -1.848 1.00 1.89 C ATOM 893 NZ LYS A 55 -38.471 2.237 -1.458 1.00 2.27 N ATOM 0 H LYS A 55 -37.101 -5.020 -1.776 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.031 -2.739 -2.190 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.509 -2.834 -1.113 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.698 -1.979 0.184 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -37.669 -0.520 -1.800 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.029 -1.143 -2.714 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.603 -0.320 -0.939 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.245 0.295 -0.017 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -39.576 1.147 -2.912 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -40.561 1.909 -1.679 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -38.488 3.115 -2.015 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -38.536 2.467 -0.446 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -37.582 1.729 -1.641 1.00 2.27 H new ATOM 907 N GLN A 56 -35.685 -3.568 0.456 1.00 0.87 N ATOM 908 CA GLN A 56 -34.640 -3.302 1.472 1.00 0.97 C ATOM 909 C GLN A 56 -33.270 -3.555 0.839 1.00 0.89 C ATOM 910 O GLN A 56 -33.178 -4.196 -0.184 1.00 0.86 O ATOM 911 CB GLN A 56 -34.882 -4.255 2.639 1.00 1.04 C ATOM 912 CG GLN A 56 -34.331 -3.681 3.942 1.00 1.44 C ATOM 913 CD GLN A 56 -34.887 -4.487 5.118 1.00 1.38 C ATOM 914 OE1 GLN A 56 -34.201 -5.487 5.594 1.00 1.49 O flip ATOM 915 NE2 GLN A 56 -35.963 -4.201 5.608 1.00 2.04 N flip ATOM 0 H GLN A 56 -35.891 -4.555 0.303 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.673 -2.272 1.828 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -35.951 -4.442 2.744 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.409 -5.215 2.432 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.242 -3.721 3.940 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -34.611 -2.632 4.039 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -36.501 -3.418 5.236 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -36.327 -4.744 6.391 1.00 2.04 H new ATOM 924 N TYR A 57 -32.210 -3.037 1.412 1.00 0.87 N ATOM 925 CA TYR A 57 -30.863 -3.230 0.799 1.00 0.80 C ATOM 926 C TYR A 57 -30.063 -4.286 1.561 1.00 0.79 C ATOM 927 O TYR A 57 -29.836 -4.174 2.750 1.00 0.95 O ATOM 928 CB TYR A 57 -30.118 -1.902 0.837 1.00 0.81 C ATOM 929 CG TYR A 57 -30.980 -0.833 0.201 1.00 0.85 C ATOM 930 CD1 TYR A 57 -30.969 -0.654 -1.189 1.00 1.49 C ATOM 931 CD2 TYR A 57 -31.801 -0.030 0.999 1.00 1.34 C ATOM 932 CE1 TYR A 57 -31.776 0.329 -1.776 1.00 1.56 C ATOM 933 CE2 TYR A 57 -32.609 0.951 0.412 1.00 1.35 C ATOM 934 CZ TYR A 57 -32.596 1.131 -0.974 1.00 0.98 C ATOM 935 OH TYR A 57 -33.393 2.098 -1.552 1.00 1.06 O ATOM 0 H TYR A 57 -32.221 -2.492 2.274 1.00 0.87 H new ATOM 0 HA TYR A 57 -30.984 -3.571 -0.229 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -29.883 -1.632 1.866 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.170 -1.987 0.305 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -30.338 -1.274 -1.808 1.00 1.49 H new ATOM 0 HD2 TYR A 57 -31.812 -0.167 2.070 1.00 1.34 H new ATOM 0 HE1 TYR A 57 -31.765 0.468 -2.847 1.00 1.56 H new ATOM 0 HE2 TYR A 57 -33.243 1.569 1.031 1.00 1.35 H new ATOM 0 HH TYR A 57 -33.900 2.564 -0.855 1.00 1.06 H new ATOM 945 N MET A 58 -29.650 -5.316 0.866 1.00 0.66 N ATOM 946 CA MET A 58 -28.875 -6.415 1.506 1.00 0.67 C ATOM 947 C MET A 58 -27.623 -6.708 0.678 1.00 0.57 C ATOM 948 O MET A 58 -27.407 -6.123 -0.364 1.00 0.51 O ATOM 949 CB MET A 58 -29.750 -7.669 1.682 1.00 0.73 C ATOM 950 CG MET A 58 -29.374 -8.766 0.679 1.00 0.90 C ATOM 951 SD MET A 58 -30.643 -10.057 0.701 1.00 1.22 S ATOM 952 CE MET A 58 -29.608 -11.426 0.119 1.00 1.60 C ATOM 0 H MET A 58 -29.821 -5.441 -0.132 1.00 0.66 H new ATOM 0 HA MET A 58 -28.561 -6.103 2.502 1.00 0.67 H new ATOM 0 HB2 MET A 58 -29.640 -8.050 2.697 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.799 -7.402 1.554 1.00 0.73 H new ATOM 0 HG2 MET A 58 -29.285 -8.344 -0.322 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.403 -9.190 0.934 1.00 0.90 H new ATOM 0 HE1 MET A 58 -30.244 -12.241 -0.227 1.00 1.60 H new ATOM 0 HE2 MET A 58 -28.979 -11.083 -0.702 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.978 -11.779 0.936 1.00 1.60 H new ATOM 962 N LEU A 59 -26.776 -7.565 1.165 1.00 0.59 N ATOM 963 CA LEU A 59 -25.506 -7.845 0.440 1.00 0.52 C ATOM 964 C LEU A 59 -25.647 -9.096 -0.439 1.00 0.46 C ATOM 965 O LEU A 59 -26.217 -10.093 -0.046 1.00 0.53 O ATOM 966 CB LEU A 59 -24.372 -8.059 1.466 1.00 0.63 C ATOM 967 CG LEU A 59 -24.445 -9.454 2.128 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.275 -9.609 3.096 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.755 -9.603 2.911 1.00 1.16 C ATOM 0 H LEU A 59 -26.906 -8.085 2.033 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.273 -6.996 -0.202 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.408 -7.943 0.970 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.429 -7.289 2.236 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.401 -10.217 1.351 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.320 -10.591 3.567 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.336 -9.511 2.551 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.332 -8.836 3.863 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.793 -10.590 3.372 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.805 -8.838 3.686 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.600 -9.487 2.232 1.00 1.16 H new ATOM 981 N THR A 60 -25.129 -9.031 -1.639 1.00 0.39 N ATOM 982 CA THR A 60 -25.222 -10.197 -2.563 1.00 0.41 C ATOM 983 C THR A 60 -23.901 -10.967 -2.503 1.00 0.46 C ATOM 984 O THR A 60 -22.921 -10.469 -1.985 1.00 0.43 O ATOM 985 CB THR A 60 -25.449 -9.716 -4.000 1.00 0.40 C ATOM 986 OG1 THR A 60 -24.695 -10.527 -4.889 1.00 1.12 O ATOM 987 CG2 THR A 60 -25.004 -8.262 -4.136 1.00 1.04 C ATOM 0 H THR A 60 -24.645 -8.217 -2.018 1.00 0.39 H new ATOM 0 HA THR A 60 -26.056 -10.833 -2.264 1.00 0.41 H new ATOM 0 HB THR A 60 -26.509 -9.790 -4.243 1.00 0.40 H new ATOM 0 HG1 THR A 60 -24.839 -10.224 -5.810 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.168 -7.926 -5.160 1.00 1.04 H new ATOM 0 HG22 THR A 60 -25.581 -7.639 -3.453 1.00 1.04 H new ATOM 0 HG23 THR A 60 -23.945 -8.181 -3.893 1.00 1.04 H new ATOM 995 N LYS A 61 -23.867 -12.170 -3.018 1.00 0.54 N ATOM 996 CA LYS A 61 -22.600 -12.967 -2.986 1.00 0.61 C ATOM 997 C LYS A 61 -21.412 -12.049 -3.309 1.00 0.57 C ATOM 998 O LYS A 61 -20.383 -12.082 -2.665 1.00 0.56 O ATOM 999 CB LYS A 61 -22.666 -14.101 -4.021 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.424 -13.645 -5.276 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.850 -14.203 -5.245 1.00 0.99 C ATOM 1002 CE LYS A 61 -25.721 -13.435 -6.240 1.00 1.84 C ATOM 1003 NZ LYS A 61 -26.779 -14.339 -6.772 1.00 2.26 N ATOM 0 H LYS A 61 -24.660 -12.636 -3.459 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.473 -13.397 -1.993 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.657 -14.412 -4.292 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -23.161 -14.969 -3.586 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.449 -12.556 -5.322 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -22.907 -13.990 -6.171 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -24.842 -15.264 -5.496 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -25.264 -14.116 -4.240 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -26.176 -12.573 -5.752 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -25.109 -13.053 -7.057 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -27.372 -13.818 -7.449 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -26.335 -15.148 -7.251 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -27.369 -14.682 -5.987 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.558 -11.238 -4.314 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.462 -10.306 -4.706 1.00 0.56 C ATOM 1019 C LYS A 62 -20.194 -9.300 -3.578 1.00 0.50 C ATOM 1020 O LYS A 62 -19.076 -8.871 -3.367 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.867 -9.553 -5.976 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.505 -10.381 -7.213 1.00 0.78 C ATOM 1023 CD LYS A 62 -21.295 -11.692 -7.200 1.00 1.25 C ATOM 1024 CE LYS A 62 -21.096 -12.423 -8.528 1.00 1.29 C ATOM 1025 NZ LYS A 62 -20.621 -13.810 -8.264 1.00 2.14 N ATOM 0 H LYS A 62 -22.398 -11.178 -4.889 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.554 -10.881 -4.891 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.938 -9.352 -5.964 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.362 -8.588 -6.013 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.730 -9.818 -8.119 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.435 -10.589 -7.224 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -20.963 -12.321 -6.374 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -22.354 -11.489 -7.040 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -22.032 -12.448 -9.086 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -20.372 -11.890 -9.144 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -20.485 -14.308 -9.167 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -19.718 -13.776 -7.748 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -21.327 -14.316 -7.692 1.00 2.14 H new ATOM 1039 N GLY A 63 -21.216 -8.906 -2.864 1.00 0.43 N ATOM 1040 CA GLY A 63 -21.022 -7.909 -1.770 1.00 0.38 C ATOM 1041 C GLY A 63 -20.247 -8.520 -0.601 1.00 0.40 C ATOM 1042 O GLY A 63 -19.362 -7.899 -0.045 1.00 0.39 O ATOM 0 H GLY A 63 -22.175 -9.231 -2.991 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.484 -7.043 -2.154 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.992 -7.553 -1.422 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.558 -9.727 -0.221 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.816 -10.358 0.917 1.00 0.51 C ATOM 1048 C GLU A 64 -18.354 -10.572 0.524 1.00 0.51 C ATOM 1049 O GLU A 64 -17.440 -10.176 1.224 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.446 -11.700 1.288 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.683 -11.925 0.434 1.00 0.65 C ATOM 1052 CD GLU A 64 -22.360 -13.236 0.838 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.790 -13.949 1.649 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -23.435 -13.506 0.330 1.00 1.40 O ATOM 0 H GLU A 64 -21.287 -10.304 -0.642 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.870 -9.693 1.779 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.730 -12.507 1.132 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.712 -11.710 2.345 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.377 -11.094 0.557 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.408 -11.957 -0.620 1.00 0.65 H new ATOM 1061 N GLU A 65 -18.132 -11.204 -0.594 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.736 -11.458 -1.045 1.00 0.58 C ATOM 1063 C GLU A 65 -15.993 -10.126 -1.157 1.00 0.52 C ATOM 1064 O GLU A 65 -14.800 -10.049 -0.937 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.760 -12.145 -2.414 1.00 0.64 C ATOM 1066 CG GLU A 65 -17.115 -13.630 -2.258 1.00 0.72 C ATOM 1067 CD GLU A 65 -17.991 -13.840 -1.022 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -19.201 -13.769 -1.159 1.00 1.69 O ATOM 1069 OE2 GLU A 65 -17.437 -14.075 0.039 1.00 1.82 O ATOM 0 H GLU A 65 -18.859 -11.556 -1.216 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.229 -12.101 -0.325 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.488 -11.656 -3.061 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.787 -12.045 -2.896 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -17.639 -13.981 -3.147 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -16.204 -14.221 -2.171 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.688 -9.075 -1.494 1.00 0.50 N ATOM 1077 CA LEU A 66 -16.013 -7.753 -1.615 1.00 0.48 C ATOM 1078 C LEU A 66 -15.704 -7.205 -0.219 1.00 0.44 C ATOM 1079 O LEU A 66 -14.662 -6.621 0.008 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.928 -6.777 -2.367 1.00 0.46 C ATOM 1081 CG LEU A 66 -16.323 -5.368 -2.365 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -14.904 -5.410 -2.931 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -17.178 -4.452 -3.236 1.00 1.54 C ATOM 0 H LEU A 66 -17.689 -9.074 -1.690 1.00 0.50 H new ATOM 0 HA LEU A 66 -15.081 -7.870 -2.168 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -17.069 -7.118 -3.393 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.912 -6.758 -1.899 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.294 -4.992 -1.342 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.481 -4.406 -2.926 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.287 -6.067 -2.318 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -14.931 -5.788 -3.953 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -16.751 -3.449 -3.237 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -17.202 -4.838 -4.255 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -18.192 -4.414 -2.838 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.590 -7.391 0.725 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.322 -6.884 2.099 1.00 0.43 C ATOM 1097 C LEU A 67 -15.028 -7.502 2.620 1.00 0.46 C ATOM 1098 O LEU A 67 -14.229 -6.849 3.261 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.476 -7.252 3.037 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.387 -6.397 4.308 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -18.425 -5.276 4.240 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -17.660 -7.263 5.542 1.00 1.39 C ATOM 0 H LEU A 67 -17.482 -7.870 0.603 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.228 -5.799 2.065 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.432 -7.086 2.539 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.429 -8.311 3.293 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.386 -5.971 4.382 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -18.363 -4.668 5.142 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -18.230 -4.652 3.368 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -19.423 -5.708 4.162 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -17.595 -6.648 6.440 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -18.658 -7.695 5.470 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -16.922 -8.063 5.596 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.810 -8.760 2.343 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.560 -9.414 2.816 1.00 0.55 C ATOM 1116 C GLU A 68 -12.377 -8.812 2.063 1.00 0.52 C ATOM 1117 O GLU A 68 -11.368 -8.463 2.643 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.633 -10.919 2.544 1.00 0.62 C ATOM 1119 CG GLU A 68 -14.872 -11.501 3.228 1.00 1.34 C ATOM 1120 CD GLU A 68 -15.040 -12.966 2.820 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -15.032 -13.234 1.629 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -15.174 -13.795 3.705 1.00 2.26 O ATOM 0 H GLU A 68 -15.442 -9.359 1.812 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.438 -9.253 3.887 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -13.676 -11.104 1.471 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -12.734 -11.411 2.916 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -14.773 -11.423 4.311 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -15.757 -10.930 2.947 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.501 -8.675 0.771 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.390 -8.079 -0.018 1.00 0.51 C ATOM 1131 C ASP A 69 -11.072 -6.692 0.546 1.00 0.46 C ATOM 1132 O ASP A 69 -9.926 -6.347 0.761 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.807 -7.956 -1.484 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.063 -9.351 -2.059 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -11.286 -10.244 -1.764 1.00 1.13 O ATOM 1136 OD2 ASP A 69 -13.032 -9.503 -2.785 1.00 1.34 O ATOM 0 H ASP A 69 -13.321 -8.950 0.231 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.508 -8.716 0.047 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.706 -7.346 -1.568 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -11.026 -7.453 -2.055 1.00 0.53 H new ATOM 1141 N ILE A 70 -12.079 -5.895 0.798 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.824 -4.535 1.358 1.00 0.43 C ATOM 1143 C ILE A 70 -11.066 -4.673 2.678 1.00 0.42 C ATOM 1144 O ILE A 70 -10.166 -3.912 2.971 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.156 -3.817 1.604 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.774 -3.420 0.264 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -12.917 -2.557 2.440 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -15.247 -3.059 0.469 1.00 1.29 C ATOM 0 H ILE A 70 -13.060 -6.126 0.641 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.232 -3.954 0.651 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.831 -4.485 2.138 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -13.236 -2.572 -0.160 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.685 -4.241 -0.447 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -13.866 -2.049 2.613 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.474 -2.834 3.397 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.240 -1.889 1.907 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.689 -2.776 -0.486 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.780 -3.920 0.874 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -15.323 -2.224 1.166 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.418 -5.642 3.474 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.711 -5.832 4.768 1.00 0.47 C ATOM 1162 C ARG A 71 -9.211 -5.977 4.505 1.00 0.48 C ATOM 1163 O ARG A 71 -8.415 -5.161 4.923 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.239 -7.095 5.453 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.637 -6.769 6.895 1.00 0.81 C ATOM 1166 CD ARG A 71 -12.181 -8.026 7.579 1.00 1.02 C ATOM 1167 NE ARG A 71 -13.268 -7.645 8.524 1.00 1.58 N ATOM 1168 CZ ARG A 71 -14.024 -8.567 9.056 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -13.828 -9.824 8.760 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -14.976 -8.234 9.884 1.00 3.04 N ATOM 0 H ARG A 71 -12.165 -6.310 3.284 1.00 0.43 H new ATOM 0 HA ARG A 71 -10.885 -4.972 5.414 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.098 -7.485 4.907 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.475 -7.873 5.443 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -10.775 -6.390 7.443 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -12.392 -5.983 6.905 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.561 -8.724 6.833 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -11.381 -8.537 8.115 1.00 1.02 H new ATOM 0 HE ARG A 71 -13.422 -6.664 8.755 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -13.084 -10.086 8.113 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -14.419 -10.544 9.176 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -15.130 -7.253 10.116 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -15.566 -8.955 10.299 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.824 -7.016 3.816 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.376 -7.238 3.523 1.00 0.52 C ATOM 1186 C LYS A 72 -6.723 -5.949 3.010 1.00 0.49 C ATOM 1187 O LYS A 72 -5.835 -5.406 3.638 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.238 -8.329 2.458 1.00 0.57 C ATOM 1189 CG LYS A 72 -8.109 -9.530 2.832 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.812 -10.691 1.881 1.00 0.93 C ATOM 1191 CE LYS A 72 -8.607 -11.923 2.315 1.00 1.44 C ATOM 1192 NZ LYS A 72 -7.948 -12.549 3.495 1.00 1.87 N ATOM 0 H LYS A 72 -9.452 -7.726 3.440 1.00 0.49 H new ATOM 0 HA LYS A 72 -6.876 -7.543 4.443 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.537 -7.940 1.485 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.196 -8.636 2.372 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -7.912 -9.829 3.861 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -9.163 -9.260 2.775 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -8.077 -10.415 0.860 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -6.745 -10.914 1.885 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -9.630 -11.640 2.564 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -8.665 -12.639 1.495 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -8.373 -13.481 3.676 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -6.932 -12.662 3.305 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -8.079 -11.941 4.329 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.140 -5.476 1.863 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.536 -4.237 1.280 1.00 0.47 C ATOM 1208 C PHE A 73 -6.290 -3.197 2.377 1.00 0.46 C ATOM 1209 O PHE A 73 -5.181 -2.767 2.599 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.490 -3.660 0.234 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.582 -2.161 0.396 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.587 -1.336 -0.144 1.00 1.20 C ATOM 1213 CD2 PHE A 73 -8.663 -1.595 1.083 1.00 1.35 C ATOM 1214 CE1 PHE A 73 -6.675 0.054 0.005 1.00 1.27 C ATOM 1215 CE2 PHE A 73 -8.750 -0.207 1.231 1.00 1.34 C ATOM 1216 CZ PHE A 73 -7.755 0.618 0.692 1.00 0.58 C ATOM 0 H PHE A 73 -7.879 -5.898 1.300 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.582 -4.489 0.816 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -7.137 -3.906 -0.768 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.478 -4.108 0.343 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.753 -1.771 -0.675 1.00 1.20 H new ATOM 0 HD2 PHE A 73 -9.430 -2.231 1.499 1.00 1.35 H new ATOM 0 HE1 PHE A 73 -5.908 0.691 -0.411 1.00 1.27 H new ATOM 0 HE2 PHE A 73 -9.584 0.228 1.761 1.00 1.34 H new ATOM 0 HZ PHE A 73 -7.822 1.690 0.807 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.318 -2.794 3.059 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.135 -1.784 4.140 1.00 0.48 C ATOM 1228 C ASN A 74 -6.196 -2.360 5.199 1.00 0.50 C ATOM 1229 O ASN A 74 -5.424 -1.652 5.814 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.488 -1.457 4.774 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.374 -0.166 5.587 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.758 0.892 5.127 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -7.861 -0.207 6.786 1.00 1.06 N ATOM 0 H ASN A 74 -8.276 -3.116 2.919 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.708 -0.871 3.725 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.247 -1.345 3.999 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.807 -2.277 5.417 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -7.782 0.648 7.337 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -7.539 -1.094 7.173 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.270 -3.640 5.422 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.404 -4.274 6.442 1.00 0.55 C ATOM 1242 C GLU A 75 -3.967 -4.367 5.923 1.00 0.55 C ATOM 1243 O GLU A 75 -3.026 -4.315 6.690 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.945 -5.671 6.741 1.00 0.59 C ATOM 1245 CG GLU A 75 -5.485 -6.129 8.126 1.00 0.87 C ATOM 1246 CD GLU A 75 -6.130 -7.477 8.455 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -7.280 -7.665 8.091 1.00 1.77 O ATOM 1248 OE2 GLU A 75 -5.465 -8.297 9.066 1.00 1.79 O ATOM 0 H GLU A 75 -6.900 -4.277 4.935 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.404 -3.675 7.353 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -7.034 -5.665 6.695 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -5.598 -6.374 5.983 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -4.399 -6.217 8.150 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -5.761 -5.388 8.877 1.00 0.87 H new ATOM 1255 N MET A 76 -3.773 -4.489 4.631 1.00 0.52 N ATOM 1256 CA MET A 76 -2.390 -4.568 4.085 1.00 0.51 C ATOM 1257 C MET A 76 -1.965 -3.174 3.631 1.00 0.51 C ATOM 1258 O MET A 76 -0.815 -2.795 3.737 1.00 0.52 O ATOM 1259 CB MET A 76 -2.377 -5.517 2.885 1.00 0.50 C ATOM 1260 CG MET A 76 -2.512 -6.962 3.371 1.00 0.52 C ATOM 1261 SD MET A 76 -0.936 -7.824 3.145 1.00 0.55 S ATOM 1262 CE MET A 76 -1.377 -9.339 4.032 1.00 0.65 C ATOM 0 H MET A 76 -4.516 -4.537 3.934 1.00 0.52 H new ATOM 0 HA MET A 76 -1.705 -4.937 4.848 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.195 -5.273 2.207 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.451 -5.397 2.324 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.800 -6.978 4.422 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.300 -7.471 2.817 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.533 -10.028 4.017 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.629 -9.096 5.064 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.235 -9.807 3.549 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.894 -2.402 3.128 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.563 -1.025 2.666 1.00 0.50 C ATOM 1274 C ARG A 77 -2.001 -0.217 3.838 1.00 0.51 C ATOM 1275 O ARG A 77 -0.983 0.438 3.731 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.833 -0.335 2.160 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.488 1.072 1.670 1.00 0.52 C ATOM 1278 CD ARG A 77 -4.069 2.106 2.635 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.624 3.468 2.230 1.00 0.85 N ATOM 1280 CZ ARG A 77 -4.246 4.101 1.272 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -5.259 3.540 0.671 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.855 5.294 0.916 1.00 1.84 N ATOM 0 H ARG A 77 -3.872 -2.670 3.018 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.827 -1.083 1.864 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.277 -0.915 1.351 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.574 -0.282 2.958 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.407 1.190 1.602 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.889 1.228 0.669 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.158 2.051 2.631 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.743 1.893 3.653 1.00 0.54 H new ATOM 0 HE ARG A 77 -2.833 3.907 2.701 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -5.565 2.608 0.950 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -5.745 4.034 -0.077 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -3.063 5.733 1.386 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -4.341 5.788 0.168 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.665 -0.269 4.962 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.183 0.480 6.156 1.00 0.52 C ATOM 1298 C LYS A 78 -0.850 -0.117 6.601 1.00 0.53 C ATOM 1299 O LYS A 78 0.050 0.585 7.019 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.218 0.367 7.282 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.521 0.433 8.646 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.540 0.785 9.738 1.00 1.04 C ATOM 1303 CE LYS A 78 -4.026 2.231 9.571 1.00 1.45 C ATOM 1304 NZ LYS A 78 -5.435 2.225 9.087 1.00 2.15 N ATOM 0 H LYS A 78 -3.524 -0.801 5.104 1.00 0.51 H new ATOM 0 HA LYS A 78 -2.046 1.534 5.912 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -3.948 1.173 7.198 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.766 -0.571 7.190 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -2.051 -0.524 8.870 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.728 1.180 8.623 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.388 0.102 9.687 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -3.087 0.658 10.721 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -3.958 2.761 10.521 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -3.389 2.761 8.863 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -5.593 3.046 8.468 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -5.615 1.350 8.555 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -6.082 2.275 9.900 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.712 -1.408 6.497 1.00 0.52 N ATOM 1319 CA ASN A 79 0.574 -2.047 6.893 1.00 0.53 C ATOM 1320 C ASN A 79 1.677 -1.506 5.986 1.00 0.54 C ATOM 1321 O ASN A 79 2.755 -1.165 6.429 1.00 0.54 O ATOM 1322 CB ASN A 79 0.471 -3.563 6.725 1.00 0.54 C ATOM 1323 CG ASN A 79 0.962 -4.254 7.999 1.00 0.60 C ATOM 1324 OD1 ASN A 79 0.238 -5.018 8.607 1.00 1.17 O ATOM 1325 ND2 ASN A 79 2.170 -4.019 8.432 1.00 1.14 N ATOM 0 H ASN A 79 -1.430 -2.047 6.156 1.00 0.52 H new ATOM 0 HA ASN A 79 0.798 -1.823 7.936 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.561 -3.847 6.519 1.00 0.54 H new ATOM 0 HB3 ASN A 79 1.067 -3.886 5.871 1.00 0.54 H new ATOM 0 HD21 ASN A 79 2.506 -4.476 9.280 1.00 1.14 H new ATOM 0 HD22 ASN A 79 2.779 -3.378 7.923 1.00 1.14 H new ATOM 1332 N MET A 80 1.402 -1.421 4.715 1.00 0.56 N ATOM 1333 CA MET A 80 2.414 -0.899 3.759 1.00 0.58 C ATOM 1334 C MET A 80 2.874 0.490 4.208 1.00 0.57 C ATOM 1335 O MET A 80 4.044 0.715 4.447 1.00 0.56 O ATOM 1336 CB MET A 80 1.787 -0.816 2.365 1.00 0.60 C ATOM 1337 CG MET A 80 2.615 0.111 1.468 1.00 0.64 C ATOM 1338 SD MET A 80 2.013 1.810 1.622 1.00 1.38 S ATOM 1339 CE MET A 80 2.199 2.280 -0.116 1.00 1.16 C ATOM 0 H MET A 80 0.513 -1.693 4.296 1.00 0.56 H new ATOM 0 HA MET A 80 3.276 -1.566 3.731 1.00 0.58 H new ATOM 0 HB2 MET A 80 1.734 -1.811 1.922 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.765 -0.445 2.439 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.667 0.061 1.750 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.547 -0.216 0.430 1.00 0.64 H new ATOM 0 HE1 MET A 80 1.878 3.313 -0.250 1.00 1.16 H new ATOM 0 HE2 MET A 80 3.244 2.184 -0.409 1.00 1.16 H new ATOM 0 HE3 MET A 80 1.587 1.626 -0.737 1.00 1.16 H new ATOM 1349 N ASP A 81 1.969 1.425 4.328 1.00 0.58 N ATOM 1350 CA ASP A 81 2.363 2.795 4.763 1.00 0.58 C ATOM 1351 C ASP A 81 3.079 2.721 6.108 1.00 0.56 C ATOM 1352 O ASP A 81 4.059 3.402 6.342 1.00 0.56 O ATOM 1353 CB ASP A 81 1.109 3.655 4.907 1.00 0.59 C ATOM 1354 CG ASP A 81 1.235 4.898 4.027 1.00 0.61 C ATOM 1355 OD1 ASP A 81 2.308 5.481 4.011 1.00 1.22 O ATOM 1356 OD2 ASP A 81 0.260 5.249 3.384 1.00 1.12 O ATOM 0 H ASP A 81 0.974 1.298 4.143 1.00 0.58 H new ATOM 0 HA ASP A 81 3.031 3.234 4.021 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.228 3.082 4.620 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.974 3.947 5.948 1.00 0.59 H new ATOM 1361 N GLN A 82 2.611 1.882 6.984 1.00 0.56 N ATOM 1362 CA GLN A 82 3.262 1.726 8.302 1.00 0.54 C ATOM 1363 C GLN A 82 4.680 1.205 8.057 1.00 0.53 C ATOM 1364 O GLN A 82 5.664 1.740 8.535 1.00 0.55 O ATOM 1365 CB GLN A 82 2.433 0.712 9.083 1.00 0.55 C ATOM 1366 CG GLN A 82 2.964 0.552 10.497 1.00 1.12 C ATOM 1367 CD GLN A 82 2.134 1.408 11.456 1.00 0.77 C ATOM 1368 OE1 GLN A 82 1.397 0.887 12.269 1.00 1.13 O ATOM 1369 NE2 GLN A 82 2.219 2.709 11.391 1.00 1.43 N ATOM 0 H GLN A 82 1.793 1.291 6.837 1.00 0.56 H new ATOM 0 HA GLN A 82 3.322 2.659 8.862 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.392 1.035 9.115 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.452 -0.251 8.572 1.00 0.55 H new ATOM 0 HG2 GLN A 82 2.920 -0.495 10.797 1.00 1.12 H new ATOM 0 HG3 GLN A 82 4.011 0.852 10.539 1.00 1.12 H new ATOM 0 HE21 GLN A 82 2.838 3.146 10.708 1.00 1.43 H new ATOM 0 HE22 GLN A 82 1.666 3.288 12.023 1.00 1.43 H new ATOM 1378 N LEU A 83 4.772 0.168 7.279 1.00 0.51 N ATOM 1379 CA LEU A 83 6.101 -0.407 6.949 1.00 0.51 C ATOM 1380 C LEU A 83 6.896 0.650 6.178 1.00 0.52 C ATOM 1381 O LEU A 83 8.047 0.909 6.466 1.00 0.53 O ATOM 1382 CB LEU A 83 5.916 -1.662 6.093 1.00 0.49 C ATOM 1383 CG LEU A 83 5.298 -2.775 6.953 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.806 -3.903 6.048 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.333 -3.334 7.942 1.00 0.48 C ATOM 0 H LEU A 83 3.977 -0.310 6.854 1.00 0.51 H new ATOM 0 HA LEU A 83 6.637 -0.685 7.857 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.271 -1.444 5.242 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.876 -1.987 5.691 1.00 0.49 H new ATOM 0 HG LEU A 83 4.464 -2.357 7.516 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.367 -4.693 6.657 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.055 -3.516 5.360 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.645 -4.306 5.480 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.875 -4.121 8.542 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.179 -3.744 7.390 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.680 -2.534 8.597 1.00 0.48 H new ATOM 1397 N LYS A 84 6.279 1.278 5.210 1.00 0.53 N ATOM 1398 CA LYS A 84 6.987 2.335 4.434 1.00 0.56 C ATOM 1399 C LYS A 84 7.631 3.328 5.407 1.00 0.56 C ATOM 1400 O LYS A 84 8.765 3.736 5.243 1.00 0.57 O ATOM 1401 CB LYS A 84 5.983 3.079 3.552 1.00 0.57 C ATOM 1402 CG LYS A 84 6.726 4.047 2.630 1.00 0.58 C ATOM 1403 CD LYS A 84 6.156 5.457 2.807 1.00 0.75 C ATOM 1404 CE LYS A 84 6.929 6.438 1.924 1.00 0.77 C ATOM 1405 NZ LYS A 84 7.074 5.869 0.554 1.00 1.42 N ATOM 0 H LYS A 84 5.315 1.103 4.925 1.00 0.53 H new ATOM 0 HA LYS A 84 7.754 1.877 3.810 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.407 2.368 2.960 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.273 3.625 4.173 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.791 4.042 2.861 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.624 3.729 1.592 1.00 0.58 H new ATOM 0 HD2 LYS A 84 5.099 5.469 2.542 1.00 0.75 H new ATOM 0 HD3 LYS A 84 6.226 5.760 3.852 1.00 0.75 H new ATOM 0 HE2 LYS A 84 6.405 7.393 1.879 1.00 0.77 H new ATOM 0 HE3 LYS A 84 7.912 6.633 2.354 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 7.231 6.639 -0.127 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 7.884 5.217 0.533 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 6.208 5.353 0.299 1.00 1.42 H new ATOM 1419 N GLU A 85 6.908 3.716 6.423 1.00 0.55 N ATOM 1420 CA GLU A 85 7.462 4.679 7.413 1.00 0.55 C ATOM 1421 C GLU A 85 8.653 4.045 8.127 1.00 0.57 C ATOM 1422 O GLU A 85 9.613 4.708 8.465 1.00 0.57 O ATOM 1423 CB GLU A 85 6.382 5.031 8.439 1.00 0.55 C ATOM 1424 CG GLU A 85 7.040 5.431 9.763 1.00 0.56 C ATOM 1425 CD GLU A 85 6.043 6.225 10.608 1.00 0.56 C ATOM 1426 OE1 GLU A 85 5.166 5.608 11.190 1.00 1.12 O ATOM 1427 OE2 GLU A 85 6.173 7.437 10.662 1.00 1.18 O ATOM 0 H GLU A 85 5.954 3.405 6.609 1.00 0.55 H new ATOM 0 HA GLU A 85 7.786 5.584 6.899 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.765 5.849 8.066 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.721 4.178 8.593 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.364 4.542 10.304 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.930 6.030 9.573 1.00 0.56 H new ATOM 1434 N LYS A 86 8.606 2.762 8.347 1.00 0.58 N ATOM 1435 CA LYS A 86 9.746 2.087 9.025 1.00 0.61 C ATOM 1436 C LYS A 86 10.990 2.223 8.148 1.00 0.62 C ATOM 1437 O LYS A 86 12.092 2.400 8.632 1.00 0.63 O ATOM 1438 CB LYS A 86 9.420 0.605 9.225 1.00 0.62 C ATOM 1439 CG LYS A 86 9.710 0.208 10.674 1.00 0.65 C ATOM 1440 CD LYS A 86 9.343 -1.262 10.884 1.00 0.83 C ATOM 1441 CE LYS A 86 8.238 -1.366 11.937 1.00 1.01 C ATOM 1442 NZ LYS A 86 7.944 -2.801 12.208 1.00 1.24 N ATOM 0 H LYS A 86 7.830 2.153 8.088 1.00 0.58 H new ATOM 0 HA LYS A 86 9.924 2.547 9.997 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.373 0.417 8.988 1.00 0.62 H new ATOM 0 HB3 LYS A 86 10.015 -0.004 8.544 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.764 0.367 10.902 1.00 0.65 H new ATOM 0 HG3 LYS A 86 9.138 0.837 11.356 1.00 0.65 H new ATOM 0 HD2 LYS A 86 9.008 -1.702 9.945 1.00 0.83 H new ATOM 0 HD3 LYS A 86 10.220 -1.825 11.205 1.00 0.83 H new ATOM 0 HE2 LYS A 86 8.548 -0.867 12.855 1.00 1.01 H new ATOM 0 HE3 LYS A 86 7.339 -0.859 11.587 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 7.193 -2.872 12.924 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.631 -3.263 11.330 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 8.803 -3.271 12.559 1.00 1.24 H new ATOM 1456 N ILE A 87 10.817 2.148 6.857 1.00 0.64 N ATOM 1457 CA ILE A 87 11.980 2.278 5.937 1.00 0.67 C ATOM 1458 C ILE A 87 12.563 3.681 6.051 1.00 0.65 C ATOM 1459 O ILE A 87 13.753 3.855 6.217 1.00 0.63 O ATOM 1460 CB ILE A 87 11.524 2.049 4.493 1.00 0.71 C ATOM 1461 CG1 ILE A 87 11.302 0.553 4.250 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.599 2.569 3.532 1.00 0.80 C ATOM 1463 CD1 ILE A 87 10.594 0.343 2.906 1.00 0.84 C ATOM 0 H ILE A 87 9.917 2.002 6.399 1.00 0.64 H new ATOM 0 HA ILE A 87 12.733 1.538 6.207 1.00 0.67 H new ATOM 0 HB ILE A 87 10.589 2.583 4.321 1.00 0.71 H new ATOM 0 HG12 ILE A 87 12.258 0.029 4.253 1.00 0.79 H new ATOM 0 HG13 ILE A 87 10.704 0.129 5.057 1.00 0.79 H new ATOM 0 HG21 ILE A 87 12.277 2.407 2.503 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.753 3.635 3.701 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.533 2.035 3.708 1.00 0.80 H new ATOM 0 HD11 ILE A 87 10.439 -0.723 2.739 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.630 0.852 2.919 1.00 0.84 H new ATOM 0 HD13 ILE A 87 11.209 0.750 2.103 1.00 0.84 H new ATOM 1475 N ASN A 88 11.738 4.689 5.974 1.00 0.66 N ATOM 1476 CA ASN A 88 12.257 6.076 6.089 1.00 0.65 C ATOM 1477 C ASN A 88 12.906 6.277 7.459 1.00 0.62 C ATOM 1478 O ASN A 88 13.829 7.047 7.605 1.00 0.62 O ATOM 1479 CB ASN A 88 11.103 7.067 5.922 1.00 0.69 C ATOM 1480 CG ASN A 88 10.113 6.526 4.887 1.00 1.66 C ATOM 1481 OD1 ASN A 88 10.502 5.867 3.944 1.00 2.38 O ATOM 1482 ND2 ASN A 88 8.840 6.780 5.024 1.00 2.46 N ATOM 0 H ASN A 88 10.730 4.610 5.837 1.00 0.66 H new ATOM 0 HA ASN A 88 13.002 6.246 5.311 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.600 7.221 6.877 1.00 0.69 H new ATOM 0 HB3 ASN A 88 11.485 8.037 5.603 1.00 0.69 H new ATOM 0 HD21 ASN A 88 8.173 6.425 4.339 1.00 2.46 H new ATOM 0 HD22 ASN A 88 8.513 7.333 5.816 1.00 2.46 H new ATOM 1489 N SER A 89 12.411 5.615 8.470 1.00 0.61 N ATOM 1490 CA SER A 89 12.980 5.795 9.838 1.00 0.61 C ATOM 1491 C SER A 89 14.422 5.275 9.928 1.00 0.63 C ATOM 1492 O SER A 89 15.329 6.009 10.266 1.00 0.71 O ATOM 1493 CB SER A 89 12.111 5.039 10.843 1.00 0.62 C ATOM 1494 OG SER A 89 12.536 3.683 10.904 1.00 1.29 O ATOM 0 H SER A 89 11.635 4.956 8.408 1.00 0.61 H new ATOM 0 HA SER A 89 12.992 6.862 10.062 1.00 0.61 H new ATOM 0 HB2 SER A 89 12.187 5.501 11.827 1.00 0.62 H new ATOM 0 HB3 SER A 89 11.063 5.091 10.547 1.00 0.62 H new ATOM 0 HG SER A 89 12.147 3.184 10.155 1.00 1.29 H new ATOM 1500 N VAL A 90 14.645 4.017 9.651 1.00 0.58 N ATOM 1501 CA VAL A 90 16.030 3.462 9.748 1.00 0.60 C ATOM 1502 C VAL A 90 16.879 3.994 8.603 1.00 0.59 C ATOM 1503 O VAL A 90 18.019 4.375 8.781 1.00 0.63 O ATOM 1504 CB VAL A 90 15.971 1.937 9.668 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.284 1.335 10.177 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.809 1.426 10.521 1.00 0.81 C ATOM 0 H VAL A 90 13.930 3.350 9.362 1.00 0.58 H new ATOM 0 HA VAL A 90 16.474 3.764 10.697 1.00 0.60 H new ATOM 0 HB VAL A 90 15.821 1.639 8.630 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.233 0.248 10.117 1.00 0.52 H new ATOM 0 HG12 VAL A 90 18.111 1.694 9.564 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.444 1.634 11.213 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.767 0.338 10.464 1.00 0.81 H new ATOM 0 HG22 VAL A 90 14.957 1.730 11.557 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.874 1.845 10.150 1.00 0.81 H new ATOM 1516 N LEU A 91 16.318 4.051 7.431 1.00 0.57 N ATOM 1517 CA LEU A 91 17.073 4.588 6.277 1.00 0.61 C ATOM 1518 C LEU A 91 17.109 6.099 6.438 1.00 0.67 C ATOM 1519 O LEU A 91 17.831 6.791 5.756 1.00 0.70 O ATOM 1520 CB LEU A 91 16.344 4.226 4.974 1.00 0.62 C ATOM 1521 CG LEU A 91 17.349 4.009 3.830 1.00 0.72 C ATOM 1522 CD1 LEU A 91 16.610 3.478 2.601 1.00 0.91 C ATOM 1523 CD2 LEU A 91 18.032 5.331 3.464 1.00 0.97 C ATOM 0 H LEU A 91 15.366 3.747 7.225 1.00 0.57 H new ATOM 0 HA LEU A 91 18.080 4.173 6.238 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.753 3.322 5.121 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.649 5.022 4.708 1.00 0.62 H new ATOM 0 HG LEU A 91 18.103 3.293 4.156 1.00 0.72 H new ATOM 0 HD11 LEU A 91 17.320 3.323 1.788 1.00 0.91 H new ATOM 0 HD12 LEU A 91 16.128 2.532 2.847 1.00 0.91 H new ATOM 0 HD13 LEU A 91 15.855 4.200 2.290 1.00 0.91 H new ATOM 0 HD21 LEU A 91 18.741 5.162 2.653 1.00 0.97 H new ATOM 0 HD22 LEU A 91 17.280 6.053 3.145 1.00 0.97 H new ATOM 0 HD23 LEU A 91 18.562 5.720 4.334 1.00 0.97 H new ATOM 1535 N SER A 92 16.336 6.605 7.366 1.00 0.71 N ATOM 1536 CA SER A 92 16.292 8.083 7.618 1.00 0.81 C ATOM 1537 C SER A 92 15.835 8.821 6.348 1.00 0.88 C ATOM 1538 O SER A 92 15.270 9.894 6.423 1.00 1.04 O ATOM 1539 CB SER A 92 17.677 8.588 8.033 1.00 0.85 C ATOM 1540 OG SER A 92 17.700 8.781 9.441 1.00 0.94 O ATOM 0 H SER A 92 15.726 6.052 7.968 1.00 0.71 H new ATOM 0 HA SER A 92 15.583 8.279 8.423 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.442 7.870 7.740 1.00 0.85 H new ATOM 0 HB3 SER A 92 17.905 9.523 7.522 1.00 0.85 H new ATOM 0 HG SER A 92 18.104 9.650 9.645 1.00 0.94 H new ATOM 1546 N ILE A 93 16.105 8.259 5.193 1.00 0.85 N ATOM 1547 CA ILE A 93 15.733 8.904 3.891 1.00 0.92 C ATOM 1548 C ILE A 93 16.466 10.247 3.754 1.00 1.05 C ATOM 1549 O ILE A 93 17.231 10.453 2.835 1.00 1.13 O ATOM 1550 CB ILE A 93 14.206 9.101 3.806 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.572 7.874 3.136 1.00 1.07 C ATOM 1552 CG2 ILE A 93 13.876 10.357 2.990 1.00 1.16 C ATOM 1553 CD1 ILE A 93 13.590 8.036 1.614 1.00 1.65 C ATOM 0 H ILE A 93 16.578 7.361 5.096 1.00 0.85 H new ATOM 0 HA ILE A 93 16.034 8.254 3.069 1.00 0.92 H new ATOM 0 HB ILE A 93 13.807 9.220 4.813 1.00 1.02 H new ATOM 0 HG12 ILE A 93 14.116 6.973 3.420 1.00 1.07 H new ATOM 0 HG13 ILE A 93 12.547 7.750 3.484 1.00 1.07 H new ATOM 0 HG21 ILE A 93 12.795 10.484 2.938 1.00 1.16 H new ATOM 0 HG22 ILE A 93 14.321 11.229 3.469 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.278 10.252 1.982 1.00 1.16 H new ATOM 0 HD11 ILE A 93 13.138 7.160 1.149 1.00 1.65 H new ATOM 0 HD12 ILE A 93 13.025 8.926 1.336 1.00 1.65 H new ATOM 0 HD13 ILE A 93 14.620 8.138 1.271 1.00 1.65 H new ATOM 1565 N ARG A 94 16.243 11.148 4.666 1.00 1.20 N ATOM 1566 CA ARG A 94 16.917 12.483 4.621 1.00 1.42 C ATOM 1567 C ARG A 94 16.938 13.080 6.027 1.00 1.49 C ATOM 1568 O ARG A 94 17.726 13.952 6.338 1.00 1.74 O ATOM 1569 CB ARG A 94 16.142 13.425 3.700 1.00 1.79 C ATOM 1570 CG ARG A 94 17.112 14.382 3.002 1.00 2.10 C ATOM 1571 CD ARG A 94 17.942 13.614 1.975 1.00 2.55 C ATOM 1572 NE ARG A 94 19.389 13.750 2.305 1.00 3.16 N ATOM 1573 CZ ARG A 94 20.247 12.880 1.849 1.00 3.74 C ATOM 1574 NH1 ARG A 94 19.840 11.890 1.103 1.00 3.85 N ATOM 1575 NH2 ARG A 94 21.515 12.999 2.139 1.00 4.56 N ATOM 0 H ARG A 94 15.612 11.018 5.457 1.00 1.20 H new ATOM 0 HA ARG A 94 17.933 12.359 4.246 1.00 1.42 H new ATOM 0 HB2 ARG A 94 15.588 12.849 2.959 1.00 1.79 H new ATOM 0 HB3 ARG A 94 15.410 13.991 4.276 1.00 1.79 H new ATOM 0 HG2 ARG A 94 16.558 15.183 2.511 1.00 2.10 H new ATOM 0 HG3 ARG A 94 17.767 14.851 3.736 1.00 2.10 H new ATOM 0 HD2 ARG A 94 17.656 12.562 1.973 1.00 2.55 H new ATOM 0 HD3 ARG A 94 17.748 13.999 0.974 1.00 2.55 H new ATOM 0 HE ARG A 94 19.708 14.524 2.888 1.00 3.16 H new ATOM 0 HH11 ARG A 94 18.850 11.796 0.876 1.00 3.85 H new ATOM 0 HH12 ARG A 94 20.512 11.210 0.747 1.00 3.85 H new ATOM 0 HH21 ARG A 94 21.834 13.772 2.722 1.00 4.56 H new ATOM 0 HH22 ARG A 94 22.186 12.318 1.782 1.00 4.56 H new ATOM 1589 N GLN A 95 16.072 12.602 6.871 1.00 1.46 N ATOM 1590 CA GLN A 95 16.003 13.111 8.273 1.00 1.61 C ATOM 1591 C GLN A 95 16.144 14.635 8.280 1.00 2.21 C ATOM 1592 O GLN A 95 15.884 15.240 7.254 1.00 2.75 O ATOM 1593 CB GLN A 95 17.130 12.489 9.099 1.00 1.83 C ATOM 1594 CG GLN A 95 16.630 12.219 10.521 1.00 2.35 C ATOM 1595 CD GLN A 95 17.823 11.946 11.439 1.00 2.88 C ATOM 1596 OE1 GLN A 95 18.854 11.483 10.995 1.00 3.43 O ATOM 1597 NE2 GLN A 95 17.726 12.215 12.713 1.00 3.20 N ATOM 1598 OXT GLN A 95 16.510 15.172 9.314 1.00 2.78 O ATOM 0 H GLN A 95 15.398 11.870 6.649 1.00 1.46 H new ATOM 0 HA GLN A 95 15.041 12.838 8.707 1.00 1.61 H new ATOM 0 HB2 GLN A 95 17.464 11.560 8.637 1.00 1.83 H new ATOM 0 HB3 GLN A 95 17.989 13.159 9.125 1.00 1.83 H new ATOM 0 HG2 GLN A 95 16.064 13.076 10.888 1.00 2.35 H new ATOM 0 HG3 GLN A 95 15.953 11.365 10.524 1.00 2.35 H new ATOM 0 HE21 GLN A 95 16.861 12.604 13.088 1.00 3.20 H new ATOM 0 HE22 GLN A 95 18.516 12.036 13.334 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 8.061 0.050 -15.966 1.00 5.31 N ATOM 1609 CA ALA B 1 8.972 -0.873 -15.233 1.00 4.73 C ATOM 1610 C ALA B 1 10.013 -0.056 -14.465 1.00 4.10 C ATOM 1611 O ALA B 1 11.188 -0.368 -14.469 1.00 3.94 O ATOM 1612 CB ALA B 1 9.680 -1.792 -16.231 1.00 4.76 C ATOM 0 H1 ALA B 1 7.407 -0.503 -16.555 1.00 5.31 H new ATOM 0 H2 ALA B 1 7.518 0.616 -15.283 1.00 5.31 H new ATOM 0 H3 ALA B 1 8.622 0.682 -16.572 1.00 5.31 H new ATOM 0 HA ALA B 1 8.393 -1.476 -14.533 1.00 4.73 H new ATOM 0 HB1 ALA B 1 10.346 -2.467 -15.694 1.00 4.76 H new ATOM 0 HB2 ALA B 1 8.939 -2.374 -16.779 1.00 4.76 H new ATOM 0 HB3 ALA B 1 10.260 -1.191 -16.931 1.00 4.76 H new ATOM 1620 N LYS B 2 9.592 0.990 -13.808 1.00 4.19 N ATOM 1621 CA LYS B 2 10.557 1.827 -13.042 1.00 4.06 C ATOM 1622 C LYS B 2 10.623 1.337 -11.595 1.00 3.61 C ATOM 1623 O LYS B 2 9.657 0.838 -11.053 1.00 4.29 O ATOM 1624 CB LYS B 2 10.097 3.287 -13.067 1.00 4.79 C ATOM 1625 CG LYS B 2 11.099 4.125 -13.862 1.00 5.69 C ATOM 1626 CD LYS B 2 11.165 3.612 -15.303 1.00 6.62 C ATOM 1627 CE LYS B 2 10.987 4.783 -16.271 1.00 7.56 C ATOM 1628 NZ LYS B 2 11.245 4.321 -17.664 1.00 7.96 N ATOM 0 H LYS B 2 8.621 1.301 -13.769 1.00 4.19 H new ATOM 0 HA LYS B 2 11.545 1.749 -13.496 1.00 4.06 H new ATOM 0 HB2 LYS B 2 9.107 3.360 -13.518 1.00 4.79 H new ATOM 0 HB3 LYS B 2 10.013 3.670 -12.050 1.00 4.79 H new ATOM 0 HG2 LYS B 2 10.801 5.174 -13.851 1.00 5.69 H new ATOM 0 HG3 LYS B 2 12.084 4.069 -13.399 1.00 5.69 H new ATOM 0 HD2 LYS B 2 12.122 3.121 -15.482 1.00 6.62 H new ATOM 0 HD3 LYS B 2 10.388 2.867 -15.471 1.00 6.62 H new ATOM 0 HE2 LYS B 2 9.977 5.184 -16.191 1.00 7.56 H new ATOM 0 HE3 LYS B 2 11.672 5.590 -16.012 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 11.124 5.117 -18.322 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 12.217 3.958 -17.735 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 10.574 3.565 -17.909 1.00 7.96 H new ATOM 1642 N LYS B 3 11.758 1.475 -10.964 1.00 2.84 N ATOM 1643 CA LYS B 3 11.889 1.018 -9.554 1.00 2.84 C ATOM 1644 C LYS B 3 13.169 1.606 -8.958 1.00 2.25 C ATOM 1645 O LYS B 3 13.273 1.815 -7.767 1.00 2.75 O ATOM 1646 CB LYS B 3 11.962 -0.510 -9.516 1.00 3.27 C ATOM 1647 CG LYS B 3 11.110 -1.037 -8.358 1.00 3.74 C ATOM 1648 CD LYS B 3 11.263 -2.556 -8.262 1.00 4.47 C ATOM 1649 CE LYS B 3 9.971 -3.167 -7.717 1.00 5.15 C ATOM 1650 NZ LYS B 3 10.202 -4.599 -7.379 1.00 5.62 N ATOM 0 H LYS B 3 12.601 1.885 -11.366 1.00 2.84 H new ATOM 0 HA LYS B 3 11.026 1.350 -8.977 1.00 2.84 H new ATOM 0 HB2 LYS B 3 11.607 -0.925 -10.460 1.00 3.27 H new ATOM 0 HB3 LYS B 3 12.996 -0.832 -9.395 1.00 3.27 H new ATOM 0 HG2 LYS B 3 11.419 -0.570 -7.423 1.00 3.74 H new ATOM 0 HG3 LYS B 3 10.063 -0.775 -8.514 1.00 3.74 H new ATOM 0 HD2 LYS B 3 11.488 -2.972 -9.244 1.00 4.47 H new ATOM 0 HD3 LYS B 3 12.100 -2.807 -7.610 1.00 4.47 H new ATOM 0 HE2 LYS B 3 9.644 -2.622 -6.832 1.00 5.15 H new ATOM 0 HE3 LYS B 3 9.175 -3.081 -8.457 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 9.323 -5.014 -7.008 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 10.495 -5.114 -8.233 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 10.949 -4.670 -6.659 1.00 5.62 H new ATOM 1664 N LYS B 4 14.143 1.875 -9.784 1.00 1.66 N ATOM 1665 CA LYS B 4 15.419 2.451 -9.275 1.00 1.45 C ATOM 1666 C LYS B 4 15.138 3.796 -8.600 1.00 1.21 C ATOM 1667 O LYS B 4 14.468 3.873 -7.589 1.00 1.74 O ATOM 1668 CB LYS B 4 16.378 2.667 -10.448 1.00 1.77 C ATOM 1669 CG LYS B 4 16.701 1.320 -11.100 1.00 2.27 C ATOM 1670 CD LYS B 4 17.923 1.474 -12.009 1.00 2.87 C ATOM 1671 CE LYS B 4 17.690 0.708 -13.312 1.00 3.35 C ATOM 1672 NZ LYS B 4 18.890 0.838 -14.186 1.00 3.94 N ATOM 0 H LYS B 4 14.109 1.720 -10.792 1.00 1.66 H new ATOM 0 HA LYS B 4 15.866 1.767 -8.554 1.00 1.45 H new ATOM 0 HB2 LYS B 4 15.929 3.338 -11.180 1.00 1.77 H new ATOM 0 HB3 LYS B 4 17.294 3.143 -10.099 1.00 1.77 H new ATOM 0 HG2 LYS B 4 16.897 0.570 -10.333 1.00 2.27 H new ATOM 0 HG3 LYS B 4 15.846 0.969 -11.678 1.00 2.27 H new ATOM 0 HD2 LYS B 4 18.101 2.528 -12.221 1.00 2.87 H new ATOM 0 HD3 LYS B 4 18.813 1.096 -11.507 1.00 2.87 H new ATOM 0 HE2 LYS B 4 17.494 -0.343 -13.099 1.00 3.35 H new ATOM 0 HE3 LYS B 4 16.810 1.098 -13.824 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 18.732 0.317 -15.072 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 19.057 1.842 -14.399 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 19.720 0.446 -13.697 1.00 3.94 H new ATOM 1686 N SER B 5 15.651 4.854 -9.160 1.00 1.06 N ATOM 1687 CA SER B 5 15.428 6.209 -8.575 1.00 1.29 C ATOM 1688 C SER B 5 15.782 6.209 -7.089 1.00 1.14 C ATOM 1689 O SER B 5 15.017 6.661 -6.259 1.00 1.52 O ATOM 1690 CB SER B 5 13.969 6.607 -8.754 1.00 1.71 C ATOM 1691 OG SER B 5 13.155 5.830 -7.888 1.00 2.58 O ATOM 0 H SER B 5 16.221 4.840 -10.006 1.00 1.06 H new ATOM 0 HA SER B 5 16.068 6.926 -9.089 1.00 1.29 H new ATOM 0 HB2 SER B 5 13.841 7.667 -8.536 1.00 1.71 H new ATOM 0 HB3 SER B 5 13.664 6.455 -9.790 1.00 1.71 H new ATOM 0 HG SER B 5 13.723 5.252 -7.336 1.00 2.58 H new ATOM 1697 N LYS B 6 16.947 5.730 -6.754 1.00 1.03 N ATOM 1698 CA LYS B 6 17.377 5.724 -5.329 1.00 1.04 C ATOM 1699 C LYS B 6 16.642 4.633 -4.537 1.00 0.96 C ATOM 1700 O LYS B 6 16.914 4.422 -3.372 1.00 1.02 O ATOM 1701 CB LYS B 6 17.069 7.087 -4.704 1.00 1.37 C ATOM 1702 CG LYS B 6 18.158 7.441 -3.686 1.00 2.21 C ATOM 1703 CD LYS B 6 17.826 8.780 -3.018 1.00 2.52 C ATOM 1704 CE LYS B 6 16.529 8.658 -2.211 1.00 3.33 C ATOM 1705 NZ LYS B 6 15.372 9.041 -3.070 1.00 3.75 N ATOM 0 H LYS B 6 17.624 5.340 -7.410 1.00 1.03 H new ATOM 0 HA LYS B 6 18.447 5.521 -5.292 1.00 1.04 H new ATOM 0 HB2 LYS B 6 17.019 7.851 -5.479 1.00 1.37 H new ATOM 0 HB3 LYS B 6 16.094 7.063 -4.216 1.00 1.37 H new ATOM 0 HG2 LYS B 6 18.234 6.657 -2.933 1.00 2.21 H new ATOM 0 HG3 LYS B 6 19.127 7.501 -4.182 1.00 2.21 H new ATOM 0 HD2 LYS B 6 18.644 9.082 -2.363 1.00 2.52 H new ATOM 0 HD3 LYS B 6 17.721 9.557 -3.775 1.00 2.52 H new ATOM 0 HE2 LYS B 6 16.406 7.636 -1.852 1.00 3.33 H new ATOM 0 HE3 LYS B 6 16.573 9.302 -1.333 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 14.898 9.872 -2.663 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 15.710 9.269 -4.027 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 14.700 8.249 -3.120 1.00 3.75 H new ATOM 1719 N LEU B 7 15.701 3.958 -5.144 1.00 0.91 N ATOM 1720 CA LEU B 7 14.938 2.905 -4.404 1.00 0.98 C ATOM 1721 C LEU B 7 15.519 1.509 -4.663 1.00 0.86 C ATOM 1722 O LEU B 7 15.972 0.835 -3.756 1.00 0.86 O ATOM 1723 CB LEU B 7 13.479 2.929 -4.862 1.00 1.15 C ATOM 1724 CG LEU B 7 12.557 2.993 -3.641 1.00 1.40 C ATOM 1725 CD1 LEU B 7 12.668 4.371 -2.985 1.00 2.06 C ATOM 1726 CD2 LEU B 7 11.112 2.756 -4.086 1.00 1.70 C ATOM 0 H LEU B 7 15.427 4.089 -6.118 1.00 0.91 H new ATOM 0 HA LEU B 7 15.010 3.116 -3.337 1.00 0.98 H new ATOM 0 HB2 LEU B 7 13.304 3.790 -5.507 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.258 2.039 -5.451 1.00 1.15 H new ATOM 0 HG LEU B 7 12.850 2.227 -2.923 1.00 1.40 H new ATOM 0 HD11 LEU B 7 12.011 4.414 -2.116 1.00 2.06 H new ATOM 0 HD12 LEU B 7 13.697 4.542 -2.670 1.00 2.06 H new ATOM 0 HD13 LEU B 7 12.375 5.139 -3.700 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.452 2.801 -3.219 1.00 1.70 H new ATOM 0 HD22 LEU B 7 10.822 3.524 -4.803 1.00 1.70 H new ATOM 0 HD23 LEU B 7 11.031 1.774 -4.553 1.00 1.70 H new ATOM 1738 N GLU B 8 15.490 1.059 -5.887 1.00 0.85 N ATOM 1739 CA GLU B 8 16.014 -0.306 -6.181 1.00 0.91 C ATOM 1740 C GLU B 8 17.540 -0.319 -6.107 1.00 0.79 C ATOM 1741 O GLU B 8 18.106 -0.942 -5.241 1.00 0.74 O ATOM 1742 CB GLU B 8 15.571 -0.736 -7.581 1.00 1.08 C ATOM 1743 CG GLU B 8 15.313 -2.245 -7.593 1.00 1.20 C ATOM 1744 CD GLU B 8 15.301 -2.751 -9.036 1.00 1.47 C ATOM 1745 OE1 GLU B 8 16.226 -2.425 -9.765 1.00 1.97 O ATOM 1746 OE2 GLU B 8 14.370 -3.455 -9.390 1.00 2.06 O ATOM 0 H GLU B 8 15.129 1.572 -6.691 1.00 0.85 H new ATOM 0 HA GLU B 8 15.617 -0.999 -5.439 1.00 0.91 H new ATOM 0 HB2 GLU B 8 14.667 -0.199 -7.869 1.00 1.08 H new ATOM 0 HB3 GLU B 8 16.339 -0.482 -8.311 1.00 1.08 H new ATOM 0 HG2 GLU B 8 16.085 -2.761 -7.022 1.00 1.20 H new ATOM 0 HG3 GLU B 8 14.360 -2.465 -7.112 1.00 1.20 H new ATOM 1753 N ILE B 9 18.193 0.367 -7.012 1.00 0.80 N ATOM 1754 CA ILE B 9 19.694 0.380 -7.007 1.00 0.81 C ATOM 1755 C ILE B 9 20.161 0.264 -5.553 1.00 0.71 C ATOM 1756 O ILE B 9 21.083 -0.458 -5.230 1.00 0.82 O ATOM 1757 CB ILE B 9 20.209 1.685 -7.614 1.00 0.85 C ATOM 1758 CG1 ILE B 9 19.764 1.776 -9.075 1.00 1.52 C ATOM 1759 CG2 ILE B 9 21.737 1.705 -7.548 1.00 1.50 C ATOM 1760 CD1 ILE B 9 19.969 3.204 -9.585 1.00 1.88 C ATOM 0 H ILE B 9 17.757 0.917 -7.752 1.00 0.80 H new ATOM 0 HA ILE B 9 20.080 -0.450 -7.599 1.00 0.81 H new ATOM 0 HB ILE B 9 19.807 2.531 -7.057 1.00 0.85 H new ATOM 0 HG12 ILE B 9 20.336 1.076 -9.684 1.00 1.52 H new ATOM 0 HG13 ILE B 9 18.715 1.494 -9.165 1.00 1.52 H new ATOM 0 HG21 ILE B 9 22.108 2.634 -7.980 1.00 1.50 H new ATOM 0 HG22 ILE B 9 22.057 1.635 -6.508 1.00 1.50 H new ATOM 0 HG23 ILE B 9 22.136 0.860 -8.108 1.00 1.50 H new ATOM 0 HD11 ILE B 9 19.652 3.268 -10.626 1.00 1.88 H new ATOM 0 HD12 ILE B 9 19.378 3.894 -8.983 1.00 1.88 H new ATOM 0 HD13 ILE B 9 21.024 3.469 -9.510 1.00 1.88 H new ATOM 1772 N ILE B 10 19.493 0.960 -4.680 1.00 0.59 N ATOM 1773 CA ILE B 10 19.833 0.906 -3.229 1.00 0.59 C ATOM 1774 C ILE B 10 19.635 -0.515 -2.716 1.00 0.51 C ATOM 1775 O ILE B 10 20.549 -1.130 -2.204 1.00 0.54 O ATOM 1776 CB ILE B 10 18.926 1.867 -2.456 1.00 0.67 C ATOM 1777 CG1 ILE B 10 19.578 3.248 -2.430 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.730 1.371 -1.020 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.854 3.700 -3.861 1.00 1.31 C ATOM 0 H ILE B 10 18.713 1.575 -4.912 1.00 0.59 H new ATOM 0 HA ILE B 10 20.873 1.200 -3.085 1.00 0.59 H new ATOM 0 HB ILE B 10 17.954 1.919 -2.946 1.00 0.67 H new ATOM 0 HG12 ILE B 10 18.924 3.963 -1.930 1.00 0.85 H new ATOM 0 HG13 ILE B 10 20.507 3.214 -1.861 1.00 0.85 H new ATOM 0 HG21 ILE B 10 18.083 2.063 -0.481 1.00 0.74 H new ATOM 0 HG22 ILE B 10 18.271 0.383 -1.036 1.00 0.74 H new ATOM 0 HG23 ILE B 10 19.697 1.314 -0.520 1.00 0.74 H new ATOM 0 HD11 ILE B 10 20.319 4.686 -3.848 1.00 1.31 H new ATOM 0 HD12 ILE B 10 20.524 2.989 -4.344 1.00 1.31 H new ATOM 0 HD13 ILE B 10 18.916 3.749 -4.414 1.00 1.31 H new ATOM 1791 N GLN B 11 18.444 -1.035 -2.836 1.00 0.50 N ATOM 1792 CA GLN B 11 18.188 -2.419 -2.343 1.00 0.50 C ATOM 1793 C GLN B 11 19.339 -3.332 -2.776 1.00 0.52 C ATOM 1794 O GLN B 11 19.831 -4.133 -2.007 1.00 0.52 O ATOM 1795 CB GLN B 11 16.874 -2.938 -2.930 1.00 0.55 C ATOM 1796 CG GLN B 11 15.918 -3.309 -1.794 1.00 1.24 C ATOM 1797 CD GLN B 11 14.622 -3.875 -2.380 1.00 1.53 C ATOM 1798 OE1 GLN B 11 14.262 -5.002 -2.110 1.00 2.22 O ATOM 1799 NE2 GLN B 11 13.902 -3.132 -3.175 1.00 1.91 N ATOM 0 H GLN B 11 17.640 -0.564 -3.252 1.00 0.50 H new ATOM 0 HA GLN B 11 18.118 -2.411 -1.255 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.422 -2.177 -3.566 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.063 -3.808 -3.559 1.00 0.55 H new ATOM 0 HG2 GLN B 11 16.384 -4.044 -1.138 1.00 1.24 H new ATOM 0 HG3 GLN B 11 15.701 -2.431 -1.186 1.00 1.24 H new ATOM 0 HE21 GLN B 11 14.205 -2.185 -3.401 1.00 1.91 H new ATOM 0 HE22 GLN B 11 13.036 -3.498 -3.570 1.00 1.91 H new ATOM 1808 N ALA B 12 19.786 -3.204 -3.998 1.00 0.57 N ATOM 1809 CA ALA B 12 20.919 -4.047 -4.472 1.00 0.62 C ATOM 1810 C ALA B 12 22.192 -3.683 -3.698 1.00 0.57 C ATOM 1811 O ALA B 12 23.024 -4.525 -3.422 1.00 0.57 O ATOM 1812 CB ALA B 12 21.144 -3.810 -5.968 1.00 0.71 C ATOM 0 H ALA B 12 19.414 -2.551 -4.688 1.00 0.57 H new ATOM 0 HA ALA B 12 20.682 -5.097 -4.303 1.00 0.62 H new ATOM 0 HB1 ALA B 12 21.973 -4.427 -6.314 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.241 -4.074 -6.518 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.378 -2.759 -6.139 1.00 0.71 H new ATOM 1818 N ILE B 13 22.344 -2.434 -3.337 1.00 0.55 N ATOM 1819 CA ILE B 13 23.559 -2.031 -2.571 1.00 0.51 C ATOM 1820 C ILE B 13 23.477 -2.642 -1.175 1.00 0.44 C ATOM 1821 O ILE B 13 24.446 -3.137 -0.635 1.00 0.45 O ATOM 1822 CB ILE B 13 23.634 -0.505 -2.467 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.238 0.062 -3.756 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.517 -0.115 -1.281 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.772 1.505 -3.952 1.00 0.84 C ATOM 0 H ILE B 13 21.684 -1.682 -3.538 1.00 0.55 H new ATOM 0 HA ILE B 13 24.453 -2.387 -3.083 1.00 0.51 H new ATOM 0 HB ILE B 13 22.632 -0.102 -2.322 1.00 0.52 H new ATOM 0 HG12 ILE B 13 25.326 0.025 -3.706 1.00 0.65 H new ATOM 0 HG13 ILE B 13 23.937 -0.547 -4.609 1.00 0.65 H new ATOM 0 HG21 ILE B 13 24.570 0.971 -1.208 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.092 -0.520 -0.363 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.519 -0.518 -1.426 1.00 0.52 H new ATOM 0 HD11 ILE B 13 24.203 1.905 -4.870 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.684 1.530 -4.021 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.095 2.110 -3.105 1.00 0.84 H new ATOM 1837 N LEU B 14 22.314 -2.606 -0.594 1.00 0.45 N ATOM 1838 CA LEU B 14 22.128 -3.177 0.766 1.00 0.41 C ATOM 1839 C LEU B 14 22.430 -4.681 0.747 1.00 0.42 C ATOM 1840 O LEU B 14 23.044 -5.215 1.650 1.00 0.41 O ATOM 1841 CB LEU B 14 20.678 -2.956 1.195 1.00 0.45 C ATOM 1842 CG LEU B 14 20.641 -2.113 2.471 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.186 -1.812 2.848 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.312 -2.888 3.607 1.00 1.01 C ATOM 0 H LEU B 14 21.474 -2.201 -1.008 1.00 0.45 H new ATOM 0 HA LEU B 14 22.806 -2.688 1.465 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.126 -2.455 0.400 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.189 -3.915 1.367 1.00 0.45 H new ATOM 0 HG LEU B 14 21.171 -1.175 2.303 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.163 -1.211 3.757 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.706 -1.263 2.038 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.653 -2.748 3.017 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.288 -2.291 4.519 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.780 -3.825 3.773 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.347 -3.101 3.340 1.00 1.01 H new ATOM 1856 N GLU B 15 21.996 -5.366 -0.276 1.00 0.47 N ATOM 1857 CA GLU B 15 22.245 -6.836 -0.364 1.00 0.52 C ATOM 1858 C GLU B 15 23.733 -7.115 -0.589 1.00 0.53 C ATOM 1859 O GLU B 15 24.261 -8.107 -0.129 1.00 0.60 O ATOM 1860 CB GLU B 15 21.447 -7.430 -1.531 1.00 0.59 C ATOM 1861 CG GLU B 15 19.973 -7.611 -1.144 1.00 0.80 C ATOM 1862 CD GLU B 15 19.352 -8.698 -2.024 1.00 0.73 C ATOM 1863 OE1 GLU B 15 18.987 -8.388 -3.145 1.00 1.29 O ATOM 1864 OE2 GLU B 15 19.253 -9.823 -1.561 1.00 1.28 O ATOM 0 H GLU B 15 21.477 -4.970 -1.059 1.00 0.47 H new ATOM 0 HA GLU B 15 21.930 -7.294 0.574 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.522 -6.776 -2.400 1.00 0.59 H new ATOM 0 HB3 GLU B 15 21.874 -8.391 -1.818 1.00 0.59 H new ATOM 0 HG2 GLU B 15 19.892 -7.887 -0.093 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.434 -6.672 -1.270 1.00 0.80 H new ATOM 1871 N ALA B 16 24.413 -6.269 -1.304 1.00 0.49 N ATOM 1872 CA ALA B 16 25.854 -6.518 -1.552 1.00 0.52 C ATOM 1873 C ALA B 16 26.637 -6.264 -0.272 1.00 0.50 C ATOM 1874 O ALA B 16 27.568 -6.976 0.049 1.00 0.54 O ATOM 1875 CB ALA B 16 26.350 -5.593 -2.656 1.00 0.53 C ATOM 0 H ALA B 16 24.035 -5.420 -1.725 1.00 0.49 H new ATOM 0 HA ALA B 16 25.998 -7.553 -1.863 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.409 -5.777 -2.837 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.787 -5.783 -3.570 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.209 -4.556 -2.352 1.00 0.53 H new ATOM 1881 N CYS B 17 26.279 -5.247 0.463 1.00 0.46 N ATOM 1882 CA CYS B 17 27.021 -4.956 1.706 1.00 0.46 C ATOM 1883 C CYS B 17 26.670 -6.013 2.754 1.00 0.47 C ATOM 1884 O CYS B 17 27.347 -6.176 3.749 1.00 0.49 O ATOM 1885 CB CYS B 17 26.638 -3.571 2.218 1.00 0.42 C ATOM 1886 SG CYS B 17 24.926 -3.591 2.801 1.00 0.42 S ATOM 0 H CYS B 17 25.509 -4.613 0.252 1.00 0.46 H new ATOM 0 HA CYS B 17 28.093 -4.977 1.511 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.305 -3.274 3.028 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.754 -2.834 1.423 1.00 0.42 H new ATOM 0 HG CYS B 17 24.279 -4.554 2.214 1.00 0.42 H new ATOM 1892 N LYS B 18 25.604 -6.727 2.518 1.00 0.49 N ATOM 1893 CA LYS B 18 25.153 -7.799 3.459 1.00 0.51 C ATOM 1894 C LYS B 18 26.324 -8.692 3.891 1.00 0.55 C ATOM 1895 O LYS B 18 26.166 -9.554 4.733 1.00 0.58 O ATOM 1896 CB LYS B 18 24.116 -8.668 2.745 1.00 0.56 C ATOM 1897 CG LYS B 18 23.177 -9.303 3.766 1.00 1.18 C ATOM 1898 CD LYS B 18 21.968 -8.383 3.957 1.00 1.89 C ATOM 1899 CE LYS B 18 21.267 -8.676 5.292 1.00 2.29 C ATOM 1900 NZ LYS B 18 20.437 -7.501 5.675 1.00 2.90 N ATOM 0 H LYS B 18 25.012 -6.612 1.695 1.00 0.49 H new ATOM 0 HA LYS B 18 24.732 -7.327 4.346 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.545 -8.063 2.040 1.00 0.56 H new ATOM 0 HB3 LYS B 18 24.616 -9.444 2.166 1.00 0.56 H new ATOM 0 HG2 LYS B 18 22.854 -10.286 3.423 1.00 1.18 H new ATOM 0 HG3 LYS B 18 23.694 -9.451 4.714 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.289 -7.342 3.930 1.00 1.89 H new ATOM 0 HD3 LYS B 18 21.266 -8.521 3.134 1.00 1.89 H new ATOM 0 HE2 LYS B 18 20.642 -9.564 5.201 1.00 2.29 H new ATOM 0 HE3 LYS B 18 22.005 -8.883 6.067 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.872 -7.019 6.487 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 20.377 -6.842 4.873 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 19.482 -7.820 5.933 1.00 2.90 H new ATOM 1914 N SER B 19 27.492 -8.515 3.333 1.00 0.57 N ATOM 1915 CA SER B 19 28.633 -9.382 3.744 1.00 0.63 C ATOM 1916 C SER B 19 29.967 -8.712 3.402 1.00 0.66 C ATOM 1917 O SER B 19 30.934 -9.371 3.077 1.00 0.84 O ATOM 1918 CB SER B 19 28.538 -10.723 3.016 1.00 0.70 C ATOM 1919 OG SER B 19 27.343 -11.386 3.407 1.00 0.93 O ATOM 0 H SER B 19 27.704 -7.817 2.620 1.00 0.57 H new ATOM 0 HA SER B 19 28.585 -9.539 4.822 1.00 0.63 H new ATOM 0 HB2 SER B 19 28.544 -10.566 1.937 1.00 0.70 H new ATOM 0 HB3 SER B 19 29.404 -11.341 3.253 1.00 0.70 H new ATOM 0 HG SER B 19 26.973 -10.951 4.204 1.00 0.93 H new ATOM 1925 N GLY B 20 30.036 -7.412 3.488 1.00 0.65 N ATOM 1926 CA GLY B 20 31.318 -6.713 3.185 1.00 0.66 C ATOM 1927 C GLY B 20 31.727 -6.979 1.738 1.00 0.70 C ATOM 1928 O GLY B 20 32.185 -8.051 1.396 1.00 0.77 O ATOM 0 H GLY B 20 29.262 -6.804 3.755 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.205 -5.641 3.349 1.00 0.66 H new ATOM 0 HA3 GLY B 20 32.099 -7.058 3.862 1.00 0.66 H new ATOM 1932 N SER B 21 31.550 -6.013 0.881 1.00 0.67 N ATOM 1933 CA SER B 21 31.910 -6.207 -0.550 1.00 0.74 C ATOM 1934 C SER B 21 32.276 -4.843 -1.162 1.00 0.72 C ATOM 1935 O SER B 21 31.542 -3.891 -0.993 1.00 0.63 O ATOM 1936 CB SER B 21 30.700 -6.773 -1.292 1.00 0.74 C ATOM 1937 OG SER B 21 29.855 -7.444 -0.367 1.00 0.72 O ATOM 0 H SER B 21 31.170 -5.095 1.111 1.00 0.67 H new ATOM 0 HA SER B 21 32.754 -6.892 -0.633 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.153 -5.970 -1.786 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.026 -7.462 -2.071 1.00 0.74 H new ATOM 0 HG SER B 21 29.025 -6.935 -0.254 1.00 0.72 H new ATOM 1943 N PRO B 22 33.388 -4.725 -1.867 1.00 0.82 N ATOM 1944 CA PRO B 22 33.780 -3.430 -2.491 1.00 0.83 C ATOM 1945 C PRO B 22 32.653 -2.836 -3.343 1.00 0.81 C ATOM 1946 O PRO B 22 31.683 -3.497 -3.655 1.00 0.80 O ATOM 1947 CB PRO B 22 34.971 -3.773 -3.388 1.00 0.93 C ATOM 1948 CG PRO B 22 35.504 -5.080 -2.904 1.00 1.08 C ATOM 1949 CD PRO B 22 34.382 -5.783 -2.137 1.00 0.95 C ATOM 0 HA PRO B 22 34.012 -2.686 -1.729 1.00 0.83 H new ATOM 0 HB2 PRO B 22 34.663 -3.842 -4.431 1.00 0.93 H new ATOM 0 HB3 PRO B 22 35.735 -2.998 -3.332 1.00 0.93 H new ATOM 0 HG2 PRO B 22 35.836 -5.692 -3.743 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.370 -4.925 -2.260 1.00 1.08 H new ATOM 0 HD2 PRO B 22 33.948 -6.592 -2.724 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.752 -6.224 -1.211 1.00 0.95 H new ATOM 1957 N LYS B 23 32.780 -1.596 -3.726 1.00 0.80 N ATOM 1958 CA LYS B 23 31.727 -0.958 -4.564 1.00 0.80 C ATOM 1959 C LYS B 23 31.616 -1.725 -5.884 1.00 0.79 C ATOM 1960 O LYS B 23 30.599 -1.696 -6.549 1.00 0.79 O ATOM 1961 CB LYS B 23 32.119 0.503 -4.834 1.00 0.82 C ATOM 1962 CG LYS B 23 31.012 1.219 -5.620 1.00 0.78 C ATOM 1963 CD LYS B 23 31.571 1.679 -6.967 1.00 1.42 C ATOM 1964 CE LYS B 23 32.664 2.727 -6.739 1.00 1.27 C ATOM 1965 NZ LYS B 23 33.939 2.255 -7.349 1.00 1.83 N ATOM 0 H LYS B 23 33.571 -0.995 -3.494 1.00 0.80 H new ATOM 0 HA LYS B 23 30.766 -0.981 -4.050 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.295 1.019 -3.890 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.053 0.538 -5.395 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.166 0.549 -5.773 1.00 0.78 H new ATOM 0 HG3 LYS B 23 30.643 2.074 -5.054 1.00 0.78 H new ATOM 0 HD2 LYS B 23 31.978 0.828 -7.513 1.00 1.42 H new ATOM 0 HD3 LYS B 23 30.773 2.099 -7.579 1.00 1.42 H new ATOM 0 HE2 LYS B 23 32.368 3.679 -7.180 1.00 1.27 H new ATOM 0 HE3 LYS B 23 32.801 2.899 -5.671 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 34.579 3.064 -7.485 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 34.389 1.560 -6.719 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 33.741 1.812 -8.269 1.00 1.83 H new ATOM 1979 N THR B 24 32.657 -2.423 -6.263 1.00 0.79 N ATOM 1980 CA THR B 24 32.630 -3.209 -7.530 1.00 0.79 C ATOM 1981 C THR B 24 31.645 -4.385 -7.432 1.00 0.82 C ATOM 1982 O THR B 24 30.940 -4.688 -8.373 1.00 0.84 O ATOM 1983 CB THR B 24 34.033 -3.749 -7.814 1.00 0.78 C ATOM 1984 OG1 THR B 24 34.260 -4.911 -7.028 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.074 -2.684 -7.465 1.00 0.82 C ATOM 0 H THR B 24 33.532 -2.481 -5.742 1.00 0.79 H new ATOM 0 HA THR B 24 32.303 -2.553 -8.337 1.00 0.79 H new ATOM 0 HB THR B 24 34.117 -4.002 -8.871 1.00 0.78 H new ATOM 0 HG1 THR B 24 35.158 -5.259 -7.210 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.073 -3.071 -7.668 1.00 0.82 H new ATOM 0 HG22 THR B 24 34.900 -1.793 -8.069 1.00 0.82 H new ATOM 0 HG23 THR B 24 34.992 -2.428 -6.409 1.00 0.82 H new ATOM 1993 N ARG B 25 31.606 -5.069 -6.313 1.00 0.84 N ATOM 1994 CA ARG B 25 30.684 -6.241 -6.182 1.00 0.89 C ATOM 1995 C ARG B 25 29.232 -5.800 -6.394 1.00 0.90 C ATOM 1996 O ARG B 25 28.340 -6.613 -6.537 1.00 0.96 O ATOM 1997 CB ARG B 25 30.824 -6.847 -4.775 1.00 0.90 C ATOM 1998 CG ARG B 25 30.369 -8.313 -4.791 1.00 1.33 C ATOM 1999 CD ARG B 25 31.587 -9.242 -4.832 1.00 1.07 C ATOM 2000 NE ARG B 25 32.652 -8.658 -5.702 1.00 1.67 N ATOM 2001 CZ ARG B 25 32.736 -8.980 -6.969 1.00 2.00 C ATOM 2002 NH1 ARG B 25 31.856 -9.777 -7.512 1.00 2.14 N ATOM 2003 NH2 ARG B 25 33.703 -8.490 -7.696 1.00 2.74 N ATOM 0 H ARG B 25 32.171 -4.867 -5.488 1.00 0.84 H new ATOM 0 HA ARG B 25 30.948 -6.982 -6.936 1.00 0.89 H new ATOM 0 HB2 ARG B 25 31.860 -6.782 -4.443 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.225 -6.279 -4.063 1.00 0.90 H new ATOM 0 HG2 ARG B 25 29.769 -8.525 -3.906 1.00 1.33 H new ATOM 0 HG3 ARG B 25 29.734 -8.495 -5.658 1.00 1.33 H new ATOM 0 HD2 ARG B 25 31.973 -9.393 -3.824 1.00 1.07 H new ATOM 0 HD3 ARG B 25 31.294 -10.221 -5.211 1.00 1.07 H new ATOM 0 HE ARG B 25 33.322 -8.000 -5.304 1.00 1.67 H new ATOM 0 HH11 ARG B 25 31.094 -10.155 -6.949 1.00 2.14 H new ATOM 0 HH12 ARG B 25 31.930 -10.022 -8.499 1.00 2.14 H new ATOM 0 HH21 ARG B 25 34.387 -7.860 -7.277 1.00 2.74 H new ATOM 0 HH22 ARG B 25 33.774 -8.737 -8.683 1.00 2.74 H new ATOM 2017 N ILE B 26 29.002 -4.519 -6.421 1.00 0.86 N ATOM 2018 CA ILE B 26 27.618 -4.024 -6.630 1.00 0.89 C ATOM 2019 C ILE B 26 27.379 -3.819 -8.132 1.00 0.93 C ATOM 2020 O ILE B 26 26.255 -3.762 -8.587 1.00 0.96 O ATOM 2021 CB ILE B 26 27.401 -2.756 -5.784 1.00 0.86 C ATOM 2022 CG1 ILE B 26 27.384 -3.193 -4.315 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.047 -2.103 -6.111 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.110 -2.189 -3.419 1.00 0.62 C ATOM 0 H ILE B 26 29.712 -3.795 -6.307 1.00 0.86 H new ATOM 0 HA ILE B 26 26.878 -4.750 -6.294 1.00 0.89 H new ATOM 0 HB ILE B 26 28.192 -2.035 -5.991 1.00 0.86 H new ATOM 0 HG12 ILE B 26 26.353 -3.301 -3.979 1.00 0.92 H new ATOM 0 HG13 ILE B 26 27.854 -4.172 -4.221 1.00 0.92 H new ATOM 0 HG21 ILE B 26 25.917 -1.209 -5.501 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.020 -1.829 -7.166 1.00 0.90 H new ATOM 0 HG23 ILE B 26 25.243 -2.807 -5.899 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.077 -2.533 -2.385 1.00 0.62 H new ATOM 0 HD12 ILE B 26 29.148 -2.100 -3.739 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.623 -1.217 -3.493 1.00 0.62 H new ATOM 2036 N MET B 27 28.428 -3.743 -8.914 1.00 0.94 N ATOM 2037 CA MET B 27 28.256 -3.575 -10.388 1.00 0.99 C ATOM 2038 C MET B 27 27.471 -4.762 -10.940 1.00 1.06 C ATOM 2039 O MET B 27 26.503 -4.600 -11.655 1.00 1.10 O ATOM 2040 CB MET B 27 29.637 -3.502 -11.045 1.00 0.98 C ATOM 2041 CG MET B 27 29.499 -3.174 -12.530 1.00 1.55 C ATOM 2042 SD MET B 27 31.123 -3.291 -13.321 1.00 1.89 S ATOM 2043 CE MET B 27 31.508 -1.523 -13.316 1.00 1.25 C ATOM 0 H MET B 27 29.395 -3.790 -8.594 1.00 0.94 H new ATOM 0 HA MET B 27 27.708 -2.657 -10.602 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.242 -2.741 -10.552 1.00 0.98 H new ATOM 0 HB3 MET B 27 30.157 -4.452 -10.922 1.00 0.98 H new ATOM 0 HG2 MET B 27 28.800 -3.864 -13.003 1.00 1.55 H new ATOM 0 HG3 MET B 27 29.091 -2.171 -12.656 1.00 1.55 H new ATOM 0 HE1 MET B 27 32.487 -1.362 -13.768 1.00 1.25 H new ATOM 0 HE2 MET B 27 30.752 -0.984 -13.887 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.518 -1.156 -12.290 1.00 1.25 H new ATOM 2053 N TYR B 28 27.864 -5.958 -10.603 1.00 1.07 N ATOM 2054 CA TYR B 28 27.118 -7.144 -11.101 1.00 1.14 C ATOM 2055 C TYR B 28 25.632 -6.942 -10.792 1.00 1.09 C ATOM 2056 O TYR B 28 24.811 -6.835 -11.681 1.00 1.20 O ATOM 2057 CB TYR B 28 27.627 -8.399 -10.388 1.00 1.17 C ATOM 2058 CG TYR B 28 27.269 -9.625 -11.195 1.00 1.43 C ATOM 2059 CD1 TYR B 28 27.934 -9.888 -12.399 1.00 1.71 C ATOM 2060 CD2 TYR B 28 26.272 -10.497 -10.740 1.00 2.20 C ATOM 2061 CE1 TYR B 28 27.603 -11.024 -13.147 1.00 1.98 C ATOM 2062 CE2 TYR B 28 25.942 -11.633 -11.488 1.00 2.58 C ATOM 2063 CZ TYR B 28 26.606 -11.897 -12.692 1.00 2.21 C ATOM 2064 OH TYR B 28 26.281 -13.016 -13.428 1.00 2.65 O ATOM 0 H TYR B 28 28.666 -6.164 -10.007 1.00 1.07 H new ATOM 0 HA TYR B 28 27.264 -7.261 -12.175 1.00 1.14 H new ATOM 0 HB2 TYR B 28 28.708 -8.341 -10.257 1.00 1.17 H new ATOM 0 HB3 TYR B 28 27.188 -8.466 -9.393 1.00 1.17 H new ATOM 0 HD1 TYR B 28 28.702 -9.215 -12.750 1.00 1.71 H new ATOM 0 HD2 TYR B 28 25.758 -10.293 -9.812 1.00 2.20 H new ATOM 0 HE1 TYR B 28 28.116 -11.228 -14.075 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.175 -12.306 -11.136 1.00 2.58 H new ATOM 0 HH TYR B 28 25.571 -13.514 -12.971 1.00 2.65 H new ATOM 2074 N GLY B 29 25.293 -6.900 -9.531 1.00 1.05 N ATOM 2075 CA GLY B 29 23.867 -6.714 -9.123 1.00 1.02 C ATOM 2076 C GLY B 29 23.183 -5.691 -10.034 1.00 1.05 C ATOM 2077 O GLY B 29 22.012 -5.805 -10.340 1.00 1.10 O ATOM 0 H GLY B 29 25.950 -6.988 -8.756 1.00 1.05 H new ATOM 0 HA2 GLY B 29 23.340 -7.667 -9.174 1.00 1.02 H new ATOM 0 HA3 GLY B 29 23.819 -6.378 -8.087 1.00 1.02 H new ATOM 2081 N ALA B 30 23.898 -4.692 -10.472 1.00 1.06 N ATOM 2082 CA ALA B 30 23.281 -3.668 -11.362 1.00 1.10 C ATOM 2083 C ALA B 30 24.368 -2.738 -11.895 1.00 1.16 C ATOM 2084 O ALA B 30 25.393 -2.552 -11.270 1.00 1.24 O ATOM 2085 CB ALA B 30 22.259 -2.847 -10.569 1.00 1.13 C ATOM 0 H ALA B 30 24.882 -4.540 -10.252 1.00 1.06 H new ATOM 0 HA ALA B 30 22.782 -4.166 -12.194 1.00 1.10 H new ATOM 0 HB1 ALA B 30 21.809 -2.099 -11.221 1.00 1.13 H new ATOM 0 HB2 ALA B 30 21.482 -3.507 -10.184 1.00 1.13 H new ATOM 0 HB3 ALA B 30 22.758 -2.350 -9.737 1.00 1.13 H new ATOM 2091 N ASN B 31 24.152 -2.141 -13.037 1.00 1.19 N ATOM 2092 CA ASN B 31 25.176 -1.213 -13.588 1.00 1.26 C ATOM 2093 C ASN B 31 25.604 -0.266 -12.468 1.00 1.28 C ATOM 2094 O ASN B 31 24.785 0.403 -11.872 1.00 1.73 O ATOM 2095 CB ASN B 31 24.572 -0.409 -14.744 1.00 1.34 C ATOM 2096 CG ASN B 31 24.286 -1.340 -15.924 1.00 1.68 C ATOM 2097 OD1 ASN B 31 23.205 -2.072 -15.915 1.00 2.40 O flip ATOM 2098 ND2 ASN B 31 25.052 -1.402 -16.865 1.00 1.85 N flip ATOM 0 H ASN B 31 23.315 -2.256 -13.608 1.00 1.19 H new ATOM 0 HA ASN B 31 26.035 -1.771 -13.962 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.652 0.077 -14.420 1.00 1.34 H new ATOM 0 HB3 ASN B 31 25.259 0.380 -15.049 1.00 1.34 H new ATOM 0 HD21 ASN B 31 25.897 -0.831 -16.873 1.00 1.85 H new ATOM 0 HD22 ASN B 31 24.850 -2.025 -17.647 1.00 1.85 H new ATOM 2105 N LEU B 32 26.869 -0.213 -12.154 1.00 1.11 N ATOM 2106 CA LEU B 32 27.295 0.681 -11.044 1.00 1.05 C ATOM 2107 C LEU B 32 27.305 2.125 -11.527 1.00 1.03 C ATOM 2108 O LEU B 32 28.163 2.558 -12.264 1.00 1.08 O ATOM 2109 CB LEU B 32 28.699 0.299 -10.560 1.00 1.08 C ATOM 2110 CG LEU B 32 28.826 0.372 -9.019 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.348 1.719 -8.468 1.00 1.07 C ATOM 2112 CD2 LEU B 32 28.038 -0.746 -8.343 1.00 1.16 C ATOM 0 H LEU B 32 27.614 -0.740 -12.609 1.00 1.11 H new ATOM 0 HA LEU B 32 26.592 0.572 -10.218 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.935 -0.711 -10.895 1.00 1.08 H new ATOM 0 HB3 LEU B 32 29.432 0.965 -11.015 1.00 1.08 H new ATOM 0 HG LEU B 32 29.886 0.256 -8.795 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.455 1.727 -7.383 1.00 1.07 H new ATOM 0 HD12 LEU B 32 28.948 2.521 -8.897 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.301 1.869 -8.731 1.00 1.07 H new ATOM 0 HD21 LEU B 32 28.148 -0.666 -7.262 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.984 -0.660 -8.608 1.00 1.16 H new ATOM 0 HD23 LEU B 32 28.418 -1.712 -8.676 1.00 1.16 H new ATOM 2124 N SER B 33 26.357 2.865 -11.059 1.00 0.99 N ATOM 2125 CA SER B 33 26.241 4.309 -11.381 1.00 1.01 C ATOM 2126 C SER B 33 27.430 5.048 -10.747 1.00 0.96 C ATOM 2127 O SER B 33 27.391 6.237 -10.583 1.00 0.96 O ATOM 2128 CB SER B 33 24.904 4.859 -10.873 1.00 0.99 C ATOM 2129 OG SER B 33 24.065 3.777 -10.491 1.00 1.33 O ATOM 0 H SER B 33 25.625 2.518 -10.440 1.00 0.99 H new ATOM 0 HA SER B 33 26.264 4.459 -12.460 1.00 1.01 H new ATOM 0 HB2 SER B 33 25.070 5.523 -10.024 1.00 0.99 H new ATOM 0 HB3 SER B 33 24.422 5.451 -11.651 1.00 0.99 H new ATOM 0 HG SER B 33 24.268 3.515 -9.569 1.00 1.33 H new ATOM 2135 N TYR B 34 28.434 4.310 -10.307 1.00 0.95 N ATOM 2136 CA TYR B 34 29.619 4.884 -9.566 1.00 0.94 C ATOM 2137 C TYR B 34 29.796 6.374 -9.790 1.00 0.96 C ATOM 2138 O TYR B 34 30.011 7.101 -8.841 1.00 0.89 O ATOM 2139 CB TYR B 34 30.892 4.192 -10.058 1.00 1.10 C ATOM 2140 CG TYR B 34 31.339 4.799 -11.369 1.00 1.01 C ATOM 2141 CD1 TYR B 34 32.155 5.937 -11.370 1.00 1.77 C ATOM 2142 CD2 TYR B 34 30.944 4.223 -12.583 1.00 1.81 C ATOM 2143 CE1 TYR B 34 32.572 6.500 -12.583 1.00 2.53 C ATOM 2144 CE2 TYR B 34 31.361 4.787 -13.795 1.00 2.56 C ATOM 2145 CZ TYR B 34 32.176 5.924 -13.795 1.00 2.75 C ATOM 2146 OH TYR B 34 32.587 6.478 -14.990 1.00 3.76 O ATOM 0 H TYR B 34 28.482 3.299 -10.436 1.00 0.95 H new ATOM 0 HA TYR B 34 29.437 4.718 -8.504 1.00 0.94 H new ATOM 0 HB2 TYR B 34 31.681 4.293 -9.313 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.709 3.125 -10.186 1.00 1.10 H new ATOM 0 HD1 TYR B 34 32.463 6.381 -10.435 1.00 1.77 H new ATOM 0 HD2 TYR B 34 30.317 3.343 -12.584 1.00 1.81 H new ATOM 0 HE1 TYR B 34 33.199 7.379 -12.583 1.00 2.53 H new ATOM 0 HE2 TYR B 34 31.053 4.344 -14.731 1.00 2.56 H new ATOM 0 HH TYR B 34 32.224 5.955 -15.735 1.00 3.76 H new ATOM 2156 N ALA B 35 29.686 6.868 -10.978 1.00 1.07 N ATOM 2157 CA ALA B 35 29.823 8.334 -11.118 1.00 1.15 C ATOM 2158 C ALA B 35 28.806 8.951 -10.156 1.00 1.05 C ATOM 2159 O ALA B 35 29.114 9.810 -9.354 1.00 1.03 O ATOM 2160 CB ALA B 35 29.514 8.757 -12.555 1.00 1.30 C ATOM 0 H ALA B 35 29.513 6.343 -11.835 1.00 1.07 H new ATOM 0 HA ALA B 35 30.837 8.663 -10.890 1.00 1.15 H new ATOM 0 HB1 ALA B 35 29.618 9.838 -12.646 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.210 8.267 -13.236 1.00 1.30 H new ATOM 0 HB3 ALA B 35 28.494 8.468 -12.808 1.00 1.30 H new ATOM 2166 N LEU B 36 27.593 8.477 -10.230 1.00 1.02 N ATOM 2167 CA LEU B 36 26.507 8.962 -9.330 1.00 0.96 C ATOM 2168 C LEU B 36 26.277 8.004 -8.138 1.00 0.83 C ATOM 2169 O LEU B 36 26.058 8.436 -7.023 1.00 0.79 O ATOM 2170 CB LEU B 36 25.210 9.085 -10.131 1.00 1.03 C ATOM 2171 CG LEU B 36 24.743 10.542 -10.125 1.00 1.16 C ATOM 2172 CD1 LEU B 36 25.772 11.414 -10.847 1.00 1.74 C ATOM 2173 CD2 LEU B 36 23.396 10.645 -10.844 1.00 1.99 C ATOM 0 H LEU B 36 27.302 7.757 -10.892 1.00 1.02 H new ATOM 0 HA LEU B 36 26.808 9.930 -8.931 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.369 8.747 -11.155 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.441 8.444 -9.700 1.00 1.03 H new ATOM 0 HG LEU B 36 24.637 10.885 -9.096 1.00 1.16 H new ATOM 0 HD11 LEU B 36 25.438 12.451 -10.842 1.00 1.74 H new ATOM 0 HD12 LEU B 36 26.733 11.340 -10.338 1.00 1.74 H new ATOM 0 HD13 LEU B 36 25.880 11.073 -11.877 1.00 1.74 H new ATOM 0 HD21 LEU B 36 23.061 11.682 -10.841 1.00 1.99 H new ATOM 0 HD22 LEU B 36 23.505 10.302 -11.873 1.00 1.99 H new ATOM 0 HD23 LEU B 36 22.661 10.025 -10.331 1.00 1.99 H new ATOM 2185 N THR B 37 26.252 6.708 -8.384 1.00 0.80 N ATOM 2186 CA THR B 37 25.950 5.722 -7.284 1.00 0.71 C ATOM 2187 C THR B 37 26.644 6.113 -5.986 1.00 0.66 C ATOM 2188 O THR B 37 26.077 5.974 -4.919 1.00 0.61 O ATOM 2189 CB THR B 37 26.366 4.298 -7.676 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.394 3.744 -8.550 1.00 0.93 O ATOM 2191 CG2 THR B 37 26.462 3.428 -6.417 1.00 0.81 C ATOM 0 H THR B 37 26.427 6.291 -9.298 1.00 0.80 H new ATOM 0 HA THR B 37 24.871 5.742 -7.130 1.00 0.71 H new ATOM 0 HB THR B 37 27.334 4.330 -8.176 1.00 0.80 H new ATOM 0 HG1 THR B 37 25.330 2.778 -8.398 1.00 0.93 H new ATOM 0 HG21 THR B 37 26.757 2.416 -6.695 1.00 0.81 H new ATOM 0 HG22 THR B 37 27.204 3.849 -5.739 1.00 0.81 H new ATOM 0 HG23 THR B 37 25.492 3.399 -5.920 1.00 0.81 H new ATOM 2199 N GLY B 38 27.849 6.602 -6.055 1.00 0.69 N ATOM 2200 CA GLY B 38 28.544 7.015 -4.795 1.00 0.68 C ATOM 2201 C GLY B 38 27.543 7.810 -3.947 1.00 0.65 C ATOM 2202 O GLY B 38 27.662 7.922 -2.744 1.00 0.64 O ATOM 0 H GLY B 38 28.381 6.734 -6.915 1.00 0.69 H new ATOM 0 HA2 GLY B 38 28.897 6.140 -4.249 1.00 0.68 H new ATOM 0 HA3 GLY B 38 29.419 7.623 -5.023 1.00 0.68 H new ATOM 2206 N ARG B 39 26.542 8.339 -4.597 1.00 0.67 N ATOM 2207 CA ARG B 39 25.476 9.118 -3.902 1.00 0.69 C ATOM 2208 C ARG B 39 24.630 8.174 -3.038 1.00 0.64 C ATOM 2209 O ARG B 39 24.185 8.531 -1.964 1.00 0.64 O ATOM 2210 CB ARG B 39 24.582 9.771 -4.967 1.00 0.76 C ATOM 2211 CG ARG B 39 23.538 10.692 -4.318 1.00 0.80 C ATOM 2212 CD ARG B 39 22.295 10.760 -5.213 1.00 0.82 C ATOM 2213 NE ARG B 39 22.678 11.289 -6.553 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.769 11.455 -7.475 1.00 1.79 C ATOM 2215 NH1 ARG B 39 20.523 11.162 -7.222 1.00 2.44 N ATOM 2216 NH2 ARG B 39 22.107 11.915 -8.648 1.00 2.34 N ATOM 0 H ARG B 39 26.416 8.262 -5.606 1.00 0.67 H new ATOM 0 HA ARG B 39 25.924 9.880 -3.265 1.00 0.69 H new ATOM 0 HB2 ARG B 39 25.196 10.344 -5.661 1.00 0.76 H new ATOM 0 HB3 ARG B 39 24.079 8.998 -5.549 1.00 0.76 H new ATOM 0 HG2 ARG B 39 23.269 10.317 -3.331 1.00 0.80 H new ATOM 0 HG3 ARG B 39 23.954 11.690 -4.177 1.00 0.80 H new ATOM 0 HD2 ARG B 39 21.851 9.769 -5.314 1.00 0.82 H new ATOM 0 HD3 ARG B 39 21.541 11.402 -4.758 1.00 0.82 H new ATOM 0 HE ARG B 39 23.651 11.522 -6.750 1.00 1.17 H new ATOM 0 HH11 ARG B 39 20.260 10.803 -6.304 1.00 2.44 H new ATOM 0 HH12 ARG B 39 19.812 11.292 -7.942 1.00 2.44 H new ATOM 0 HH21 ARG B 39 23.081 12.145 -8.844 1.00 2.34 H new ATOM 0 HH22 ARG B 39 21.397 12.045 -9.369 1.00 2.34 H new ATOM 2230 N TYR B 40 24.413 6.970 -3.496 1.00 0.60 N ATOM 2231 CA TYR B 40 23.603 6.008 -2.696 1.00 0.56 C ATOM 2232 C TYR B 40 24.461 5.432 -1.576 1.00 0.48 C ATOM 2233 O TYR B 40 24.018 5.290 -0.455 1.00 0.47 O ATOM 2234 CB TYR B 40 23.093 4.866 -3.586 1.00 0.58 C ATOM 2235 CG TYR B 40 22.485 5.404 -4.872 1.00 0.81 C ATOM 2236 CD1 TYR B 40 21.656 6.541 -4.870 1.00 1.61 C ATOM 2237 CD2 TYR B 40 22.755 4.748 -6.080 1.00 1.51 C ATOM 2238 CE1 TYR B 40 21.110 7.012 -6.070 1.00 1.88 C ATOM 2239 CE2 TYR B 40 22.207 5.223 -7.277 1.00 1.79 C ATOM 2240 CZ TYR B 40 21.385 6.355 -7.272 1.00 1.59 C ATOM 2241 OH TYR B 40 20.845 6.821 -8.453 1.00 2.01 O ATOM 0 H TYR B 40 24.760 6.613 -4.386 1.00 0.60 H new ATOM 0 HA TYR B 40 22.747 6.535 -2.274 1.00 0.56 H new ATOM 0 HB2 TYR B 40 23.915 4.191 -3.823 1.00 0.58 H new ATOM 0 HB3 TYR B 40 22.348 4.283 -3.044 1.00 0.58 H new ATOM 0 HD1 TYR B 40 21.441 7.051 -3.942 1.00 1.61 H new ATOM 0 HD2 TYR B 40 23.388 3.873 -6.088 1.00 1.51 H new ATOM 0 HE1 TYR B 40 20.475 7.885 -6.067 1.00 1.88 H new ATOM 0 HE2 TYR B 40 22.419 4.715 -8.206 1.00 1.79 H new ATOM 0 HH TYR B 40 21.137 6.250 -9.194 1.00 2.01 H new ATOM 2251 N ILE B 41 25.686 5.098 -1.863 1.00 0.44 N ATOM 2252 CA ILE B 41 26.564 4.532 -0.804 1.00 0.40 C ATOM 2253 C ILE B 41 26.796 5.582 0.284 1.00 0.41 C ATOM 2254 O ILE B 41 26.612 5.324 1.457 1.00 0.41 O ATOM 2255 CB ILE B 41 27.897 4.116 -1.426 1.00 0.41 C ATOM 2256 CG1 ILE B 41 27.658 2.939 -2.375 1.00 0.53 C ATOM 2257 CG2 ILE B 41 28.872 3.692 -0.326 1.00 0.47 C ATOM 2258 CD1 ILE B 41 28.912 2.687 -3.217 1.00 0.54 C ATOM 0 H ILE B 41 26.117 5.192 -2.783 1.00 0.44 H new ATOM 0 HA ILE B 41 26.088 3.659 -0.357 1.00 0.40 H new ATOM 0 HB ILE B 41 28.321 4.956 -1.975 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.407 2.045 -1.804 1.00 0.53 H new ATOM 0 HG13 ILE B 41 26.809 3.151 -3.025 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.820 3.396 -0.775 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.037 4.527 0.355 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.454 2.850 0.226 1.00 0.47 H new ATOM 0 HD11 ILE B 41 28.736 1.848 -3.890 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.144 3.578 -3.800 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.751 2.455 -2.560 1.00 0.54 H new ATOM 2270 N LYS B 42 27.200 6.763 -0.092 1.00 0.46 N ATOM 2271 CA LYS B 42 27.443 7.822 0.922 1.00 0.50 C ATOM 2272 C LYS B 42 26.165 8.056 1.732 1.00 0.51 C ATOM 2273 O LYS B 42 26.181 8.050 2.946 1.00 0.53 O ATOM 2274 CB LYS B 42 27.854 9.114 0.215 1.00 0.59 C ATOM 2275 CG LYS B 42 28.813 9.910 1.104 1.00 0.89 C ATOM 2276 CD LYS B 42 28.127 10.251 2.428 1.00 0.61 C ATOM 2277 CE LYS B 42 28.890 11.384 3.119 1.00 0.65 C ATOM 2278 NZ LYS B 42 28.244 11.696 4.424 1.00 1.61 N ATOM 0 H LYS B 42 27.372 7.039 -1.059 1.00 0.46 H new ATOM 0 HA LYS B 42 28.241 7.510 1.596 1.00 0.50 H new ATOM 0 HB2 LYS B 42 28.333 8.882 -0.736 1.00 0.59 H new ATOM 0 HB3 LYS B 42 26.971 9.712 -0.010 1.00 0.59 H new ATOM 0 HG2 LYS B 42 29.717 9.330 1.291 1.00 0.89 H new ATOM 0 HG3 LYS B 42 29.120 10.824 0.596 1.00 0.89 H new ATOM 0 HD2 LYS B 42 27.094 10.550 2.249 1.00 0.61 H new ATOM 0 HD3 LYS B 42 28.097 9.372 3.072 1.00 0.61 H new ATOM 0 HE2 LYS B 42 29.929 11.094 3.276 1.00 0.65 H new ATOM 0 HE3 LYS B 42 28.899 12.270 2.485 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 28.801 12.418 4.923 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 27.282 12.055 4.258 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 28.197 10.833 5.003 1.00 1.61 H new ATOM 2292 N MET B 43 25.054 8.263 1.073 1.00 0.55 N ATOM 2293 CA MET B 43 23.780 8.498 1.816 1.00 0.60 C ATOM 2294 C MET B 43 23.520 7.330 2.773 1.00 0.50 C ATOM 2295 O MET B 43 23.226 7.520 3.933 1.00 0.52 O ATOM 2296 CB MET B 43 22.622 8.627 0.820 1.00 0.68 C ATOM 2297 CG MET B 43 21.281 8.611 1.558 1.00 0.78 C ATOM 2298 SD MET B 43 20.750 6.900 1.817 1.00 1.39 S ATOM 2299 CE MET B 43 19.948 6.661 0.213 1.00 2.16 C ATOM 0 H MET B 43 24.974 8.279 0.056 1.00 0.55 H new ATOM 0 HA MET B 43 23.860 9.420 2.393 1.00 0.60 H new ATOM 0 HB2 MET B 43 22.722 9.553 0.254 1.00 0.68 H new ATOM 0 HB3 MET B 43 22.659 7.808 0.101 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.376 9.122 2.516 1.00 0.78 H new ATOM 0 HG3 MET B 43 20.531 9.152 0.981 1.00 0.78 H new ATOM 0 HE1 MET B 43 19.940 5.600 -0.035 1.00 2.16 H new ATOM 0 HE2 MET B 43 18.924 7.031 0.260 1.00 2.16 H new ATOM 0 HE3 MET B 43 20.497 7.208 -0.553 1.00 2.16 H new ATOM 2309 N LEU B 44 23.613 6.122 2.296 1.00 0.43 N ATOM 2310 CA LEU B 44 23.352 4.951 3.182 1.00 0.35 C ATOM 2311 C LEU B 44 24.341 4.947 4.359 1.00 0.32 C ATOM 2312 O LEU B 44 23.979 4.641 5.479 1.00 0.35 O ATOM 2313 CB LEU B 44 23.489 3.664 2.360 1.00 0.33 C ATOM 2314 CG LEU B 44 22.303 3.548 1.389 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.522 2.369 0.443 1.00 0.90 C ATOM 2316 CD2 LEU B 44 20.997 3.325 2.162 1.00 0.68 C ATOM 0 H LEU B 44 23.858 5.893 1.333 1.00 0.43 H new ATOM 0 HA LEU B 44 22.342 5.014 3.588 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.427 3.672 1.806 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.517 2.798 3.022 1.00 0.33 H new ATOM 0 HG LEU B 44 22.233 4.475 0.820 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.678 2.291 -0.243 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.439 2.524 -0.125 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.605 1.449 1.021 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.167 3.245 1.459 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.070 2.406 2.743 1.00 0.68 H new ATOM 0 HD23 LEU B 44 20.824 4.166 2.834 1.00 0.68 H new ATOM 2328 N MET B 45 25.576 5.305 4.135 1.00 0.40 N ATOM 2329 CA MET B 45 26.553 5.339 5.268 1.00 0.42 C ATOM 2330 C MET B 45 26.256 6.572 6.115 1.00 0.44 C ATOM 2331 O MET B 45 26.214 6.530 7.329 1.00 0.43 O ATOM 2332 CB MET B 45 27.982 5.480 4.724 1.00 0.52 C ATOM 2333 CG MET B 45 28.639 4.117 4.513 1.00 1.13 C ATOM 2334 SD MET B 45 30.431 4.336 4.387 1.00 0.80 S ATOM 2335 CE MET B 45 30.493 4.772 2.632 1.00 0.83 C ATOM 0 H MET B 45 25.952 5.574 3.226 1.00 0.40 H new ATOM 0 HA MET B 45 26.466 4.421 5.850 1.00 0.42 H new ATOM 0 HB2 MET B 45 27.961 6.025 3.780 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.580 6.070 5.419 1.00 0.52 H new ATOM 0 HG2 MET B 45 28.399 3.452 5.342 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.253 3.650 3.607 1.00 1.13 H new ATOM 0 HE1 MET B 45 31.422 5.302 2.421 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.449 3.865 2.030 1.00 0.83 H new ATOM 0 HE3 MET B 45 29.646 5.412 2.386 1.00 0.83 H new ATOM 2345 N ASP B 46 26.052 7.669 5.453 1.00 0.48 N ATOM 2346 CA ASP B 46 25.756 8.940 6.163 1.00 0.53 C ATOM 2347 C ASP B 46 24.497 8.781 7.018 1.00 0.51 C ATOM 2348 O ASP B 46 24.293 9.510 7.968 1.00 0.55 O ATOM 2349 CB ASP B 46 25.533 10.053 5.143 1.00 0.59 C ATOM 2350 CG ASP B 46 25.307 11.377 5.875 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.068 11.667 6.782 1.00 1.30 O ATOM 2352 OD2 ASP B 46 24.375 12.078 5.515 1.00 1.26 O ATOM 0 H ASP B 46 26.078 7.742 4.436 1.00 0.48 H new ATOM 0 HA ASP B 46 26.599 9.192 6.806 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.396 10.133 4.482 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.672 9.820 4.517 1.00 0.59 H new ATOM 2357 N LEU B 47 23.644 7.846 6.676 1.00 0.48 N ATOM 2358 CA LEU B 47 22.387 7.655 7.454 1.00 0.50 C ATOM 2359 C LEU B 47 22.499 6.423 8.362 1.00 0.46 C ATOM 2360 O LEU B 47 21.602 6.132 9.126 1.00 0.50 O ATOM 2361 CB LEU B 47 21.225 7.494 6.472 1.00 0.51 C ATOM 2362 CG LEU B 47 20.625 8.876 6.153 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.726 9.852 5.724 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.603 8.754 5.015 1.00 0.62 C ATOM 0 H LEU B 47 23.767 7.208 5.890 1.00 0.48 H new ATOM 0 HA LEU B 47 22.213 8.523 8.090 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.573 7.017 5.556 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.461 6.844 6.900 1.00 0.51 H new ATOM 0 HG LEU B 47 20.137 9.252 7.052 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.285 10.824 5.502 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.452 9.959 6.530 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.225 9.469 4.834 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.184 9.736 4.796 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.095 8.363 4.125 1.00 0.62 H new ATOM 0 HD23 LEU B 47 18.803 8.077 5.315 1.00 0.62 H new ATOM 2376 N GLU B 48 23.593 5.704 8.287 1.00 0.42 N ATOM 2377 CA GLU B 48 23.773 4.493 9.150 1.00 0.42 C ATOM 2378 C GLU B 48 23.015 3.306 8.538 1.00 0.39 C ATOM 2379 O GLU B 48 21.986 2.883 9.023 1.00 0.47 O ATOM 2380 CB GLU B 48 23.269 4.777 10.573 1.00 0.47 C ATOM 2381 CG GLU B 48 24.106 3.984 11.580 1.00 1.16 C ATOM 2382 CD GLU B 48 25.459 4.672 11.776 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.706 5.656 11.099 1.00 1.69 O ATOM 2384 OE2 GLU B 48 26.224 4.204 12.603 1.00 1.72 O ATOM 0 H GLU B 48 24.373 5.905 7.662 1.00 0.42 H new ATOM 0 HA GLU B 48 24.833 4.245 9.204 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.337 5.843 10.788 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.218 4.500 10.660 1.00 0.47 H new ATOM 0 HG2 GLU B 48 23.580 3.916 12.532 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.253 2.965 11.223 1.00 1.16 H new ATOM 2391 N ILE B 49 23.531 2.768 7.468 1.00 0.32 N ATOM 2392 CA ILE B 49 22.875 1.611 6.800 1.00 0.30 C ATOM 2393 C ILE B 49 23.979 0.747 6.210 1.00 0.30 C ATOM 2394 O ILE B 49 23.940 -0.469 6.268 1.00 0.31 O ATOM 2395 CB ILE B 49 21.965 2.114 5.670 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.667 2.714 6.244 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.609 0.952 4.739 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.846 4.203 6.575 1.00 0.51 C ATOM 0 H ILE B 49 24.392 3.086 7.023 1.00 0.32 H new ATOM 0 HA ILE B 49 22.271 1.046 7.510 1.00 0.30 H new ATOM 0 HB ILE B 49 22.499 2.886 5.116 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.857 2.593 5.524 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.378 2.170 7.143 1.00 0.35 H new ATOM 0 HG21 ILE B 49 20.963 1.312 3.938 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.521 0.537 4.311 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.089 0.179 5.305 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.915 4.601 6.978 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.640 4.319 7.313 1.00 0.51 H new ATOM 0 HD13 ILE B 49 21.111 4.748 5.669 1.00 0.51 H new ATOM 2410 N ILE B 50 24.988 1.382 5.682 1.00 0.30 N ATOM 2411 CA ILE B 50 26.136 0.639 5.114 1.00 0.31 C ATOM 2412 C ILE B 50 27.263 0.715 6.133 1.00 0.36 C ATOM 2413 O ILE B 50 27.174 1.453 7.095 1.00 0.57 O ATOM 2414 CB ILE B 50 26.546 1.251 3.768 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.680 0.624 2.667 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.020 0.948 3.474 1.00 0.36 C ATOM 2417 CD1 ILE B 50 25.998 1.267 1.315 1.00 0.70 C ATOM 0 H ILE B 50 25.062 2.397 5.621 1.00 0.30 H new ATOM 0 HA ILE B 50 25.881 -0.403 4.921 1.00 0.31 H new ATOM 0 HB ILE B 50 26.406 2.331 3.802 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.861 -0.450 2.619 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.624 0.759 2.903 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.298 1.388 2.516 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.643 1.371 4.262 1.00 0.36 H new ATOM 0 HG23 ILE B 50 28.169 -0.131 3.434 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.378 0.814 0.542 1.00 0.70 H new ATOM 0 HD12 ILE B 50 25.794 2.337 1.364 1.00 0.70 H new ATOM 0 HD13 ILE B 50 27.049 1.109 1.075 1.00 0.70 H new ATOM 2429 N ARG B 51 28.298 -0.055 5.970 1.00 0.42 N ATOM 2430 CA ARG B 51 29.386 -0.023 6.982 1.00 0.44 C ATOM 2431 C ARG B 51 30.723 -0.198 6.270 1.00 0.44 C ATOM 2432 O ARG B 51 30.809 -0.817 5.241 1.00 0.54 O ATOM 2433 CB ARG B 51 29.112 -1.156 7.989 1.00 0.52 C ATOM 2434 CG ARG B 51 30.223 -1.281 9.037 1.00 0.75 C ATOM 2435 CD ARG B 51 29.961 -0.295 10.175 1.00 0.89 C ATOM 2436 NE ARG B 51 31.189 -0.159 11.010 1.00 0.89 N ATOM 2437 CZ ARG B 51 31.423 -1.003 11.984 1.00 0.95 C ATOM 2438 NH1 ARG B 51 30.587 -1.977 12.228 1.00 1.50 N ATOM 2439 NH2 ARG B 51 32.499 -0.874 12.711 1.00 1.24 N ATOM 0 H ARG B 51 28.438 -0.698 5.190 1.00 0.42 H new ATOM 0 HA ARG B 51 29.422 0.925 7.519 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.161 -0.972 8.490 1.00 0.52 H new ATOM 0 HB3 ARG B 51 29.013 -2.100 7.453 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.260 -2.299 9.424 1.00 0.75 H new ATOM 0 HG3 ARG B 51 31.192 -1.078 8.581 1.00 0.75 H new ATOM 0 HD2 ARG B 51 29.675 0.676 9.770 1.00 0.89 H new ATOM 0 HD3 ARG B 51 29.129 -0.643 10.787 1.00 0.89 H new ATOM 0 HE ARG B 51 31.850 0.595 10.822 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.747 -2.083 11.659 1.00 1.50 H new ATOM 0 HH12 ARG B 51 30.774 -2.631 12.988 1.00 1.50 H new ATOM 0 HH21 ARG B 51 33.156 -0.117 12.520 1.00 1.24 H new ATOM 0 HH22 ARG B 51 32.683 -1.530 13.470 1.00 1.24 H new ATOM 2453 N GLN B 52 31.761 0.377 6.807 1.00 0.44 N ATOM 2454 CA GLN B 52 33.100 0.287 6.147 1.00 0.48 C ATOM 2455 C GLN B 52 33.939 -0.801 6.805 1.00 0.53 C ATOM 2456 O GLN B 52 34.360 -0.674 7.938 1.00 0.65 O ATOM 2457 CB GLN B 52 33.821 1.629 6.285 1.00 0.61 C ATOM 2458 CG GLN B 52 34.825 1.790 5.142 1.00 1.46 C ATOM 2459 CD GLN B 52 35.886 2.820 5.534 1.00 1.70 C ATOM 2460 OE1 GLN B 52 36.614 2.626 6.487 1.00 2.42 O ATOM 2461 NE2 GLN B 52 36.006 3.913 4.833 1.00 1.80 N ATOM 0 H GLN B 52 31.744 0.908 7.678 1.00 0.44 H new ATOM 0 HA GLN B 52 32.961 0.043 5.094 1.00 0.48 H new ATOM 0 HB2 GLN B 52 33.099 2.445 6.266 1.00 0.61 H new ATOM 0 HB3 GLN B 52 34.335 1.680 7.245 1.00 0.61 H new ATOM 0 HG2 GLN B 52 35.297 0.833 4.921 1.00 1.46 H new ATOM 0 HG3 GLN B 52 34.311 2.109 4.235 1.00 1.46 H new ATOM 0 HE21 GLN B 52 35.395 4.075 4.033 1.00 1.80 H new ATOM 0 HE22 GLN B 52 36.711 4.605 5.085 1.00 1.80 H new ATOM 2470 N GLU B 53 34.188 -1.867 6.090 1.00 0.57 N ATOM 2471 CA GLU B 53 35.003 -2.972 6.642 1.00 0.74 C ATOM 2472 C GLU B 53 36.220 -3.182 5.746 1.00 0.75 C ATOM 2473 O GLU B 53 36.137 -3.781 4.698 1.00 0.76 O ATOM 2474 CB GLU B 53 34.147 -4.232 6.645 1.00 0.90 C ATOM 2475 CG GLU B 53 34.723 -5.252 7.625 1.00 1.02 C ATOM 2476 CD GLU B 53 33.983 -6.582 7.466 1.00 1.37 C ATOM 2477 OE1 GLU B 53 33.024 -6.617 6.714 1.00 2.11 O ATOM 2478 OE2 GLU B 53 34.389 -7.544 8.099 1.00 1.95 O ATOM 0 H GLU B 53 33.855 -2.014 5.137 1.00 0.57 H new ATOM 0 HA GLU B 53 35.336 -2.742 7.654 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.123 -3.985 6.924 1.00 0.90 H new ATOM 0 HB3 GLU B 53 34.110 -4.659 5.643 1.00 0.90 H new ATOM 0 HG2 GLU B 53 35.788 -5.391 7.439 1.00 1.02 H new ATOM 0 HG3 GLU B 53 34.623 -4.887 8.647 1.00 1.02 H new ATOM 2485 N GLY B 54 37.346 -2.691 6.164 1.00 0.80 N ATOM 2486 CA GLY B 54 38.583 -2.851 5.354 1.00 0.85 C ATOM 2487 C GLY B 54 38.456 -2.073 4.036 1.00 0.74 C ATOM 2488 O GLY B 54 39.006 -2.462 3.024 1.00 0.88 O ATOM 0 H GLY B 54 37.466 -2.181 7.039 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.444 -2.490 5.916 1.00 0.85 H new ATOM 0 HA3 GLY B 54 38.757 -3.907 5.147 1.00 0.85 H new ATOM 2492 N LYS B 55 37.719 -0.991 4.045 1.00 0.78 N ATOM 2493 CA LYS B 55 37.519 -0.171 2.804 1.00 0.78 C ATOM 2494 C LYS B 55 36.381 -0.763 1.964 1.00 0.69 C ATOM 2495 O LYS B 55 36.014 -0.229 0.936 1.00 0.70 O ATOM 2496 CB LYS B 55 38.807 -0.114 1.976 1.00 0.91 C ATOM 2497 CG LYS B 55 38.891 1.244 1.274 1.00 1.13 C ATOM 2498 CD LYS B 55 39.811 1.140 0.056 1.00 1.34 C ATOM 2499 CE LYS B 55 39.858 2.489 -0.664 1.00 1.60 C ATOM 2500 NZ LYS B 55 38.676 2.614 -1.563 1.00 2.11 N ATOM 0 H LYS B 55 37.239 -0.633 4.871 1.00 0.78 H new ATOM 0 HA LYS B 55 37.256 0.844 3.100 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.675 -0.259 2.620 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.817 -0.919 1.241 1.00 0.91 H new ATOM 0 HG2 LYS B 55 37.897 1.566 0.964 1.00 1.13 H new ATOM 0 HG3 LYS B 55 39.270 1.998 1.964 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.813 0.847 0.368 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.449 0.366 -0.621 1.00 1.34 H new ATOM 0 HE2 LYS B 55 39.863 3.301 0.063 1.00 1.60 H new ATOM 0 HE3 LYS B 55 40.778 2.573 -1.242 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 38.708 3.531 -2.053 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 38.691 1.846 -2.264 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 37.804 2.552 -1.000 1.00 2.11 H new ATOM 2514 N GLN B 56 35.814 -1.852 2.407 1.00 0.70 N ATOM 2515 CA GLN B 56 34.688 -2.473 1.650 1.00 0.70 C ATOM 2516 C GLN B 56 33.397 -2.022 2.307 1.00 0.60 C ATOM 2517 O GLN B 56 33.420 -1.469 3.387 1.00 0.60 O ATOM 2518 CB GLN B 56 34.760 -4.002 1.702 1.00 0.85 C ATOM 2519 CG GLN B 56 36.211 -4.461 1.603 1.00 1.17 C ATOM 2520 CD GLN B 56 36.265 -5.815 0.894 1.00 1.15 C ATOM 2521 OE1 GLN B 56 37.095 -6.033 0.035 1.00 1.54 O ATOM 2522 NE2 GLN B 56 35.404 -6.742 1.221 1.00 1.66 N ATOM 0 H GLN B 56 36.082 -2.340 3.262 1.00 0.70 H new ATOM 0 HA GLN B 56 34.741 -2.167 0.605 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.318 -4.363 2.631 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.178 -4.429 0.885 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.800 -3.726 1.054 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.648 -4.541 2.598 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.707 -6.559 1.943 1.00 1.66 H new ATOM 0 HE22 GLN B 56 35.429 -7.649 0.755 1.00 1.66 H new ATOM 2531 N TYR B 57 32.275 -2.221 1.669 1.00 0.56 N ATOM 2532 CA TYR B 57 31.005 -1.757 2.277 1.00 0.48 C ATOM 2533 C TYR B 57 30.282 -2.937 2.918 1.00 0.47 C ATOM 2534 O TYR B 57 29.972 -3.924 2.285 1.00 0.53 O ATOM 2535 CB TYR B 57 30.150 -1.116 1.199 1.00 0.46 C ATOM 2536 CG TYR B 57 31.013 -0.129 0.433 1.00 0.49 C ATOM 2537 CD1 TYR B 57 31.858 -0.565 -0.597 1.00 1.27 C ATOM 2538 CD2 TYR B 57 30.988 1.230 0.778 1.00 1.18 C ATOM 2539 CE1 TYR B 57 32.669 0.354 -1.276 1.00 1.30 C ATOM 2540 CE2 TYR B 57 31.796 2.146 0.095 1.00 1.18 C ATOM 2541 CZ TYR B 57 32.636 1.709 -0.932 1.00 0.57 C ATOM 2542 OH TYR B 57 33.436 2.612 -1.602 1.00 0.63 O ATOM 0 H TYR B 57 32.187 -2.680 0.763 1.00 0.56 H new ATOM 0 HA TYR B 57 31.206 -1.019 3.054 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.754 -1.876 0.526 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.295 -0.607 1.644 1.00 0.46 H new ATOM 0 HD1 TYR B 57 31.884 -1.610 -0.867 1.00 1.27 H new ATOM 0 HD2 TYR B 57 30.343 1.571 1.574 1.00 1.18 H new ATOM 0 HE1 TYR B 57 33.321 0.015 -2.067 1.00 1.30 H new ATOM 0 HE2 TYR B 57 31.770 3.192 0.362 1.00 1.18 H new ATOM 0 HH TYR B 57 33.290 3.511 -1.239 1.00 0.63 H new ATOM 2552 N MET B 58 30.059 -2.830 4.196 1.00 0.44 N ATOM 2553 CA MET B 58 29.400 -3.904 4.979 1.00 0.45 C ATOM 2554 C MET B 58 28.032 -3.401 5.447 1.00 0.42 C ATOM 2555 O MET B 58 27.708 -2.245 5.280 1.00 0.40 O ATOM 2556 CB MET B 58 30.312 -4.255 6.169 1.00 0.50 C ATOM 2557 CG MET B 58 29.549 -5.045 7.231 1.00 1.04 C ATOM 2558 SD MET B 58 30.728 -5.730 8.422 1.00 1.10 S ATOM 2559 CE MET B 58 29.723 -5.524 9.913 1.00 1.52 C ATOM 0 H MET B 58 30.317 -2.011 4.747 1.00 0.44 H new ATOM 0 HA MET B 58 29.245 -4.801 4.380 1.00 0.45 H new ATOM 0 HB2 MET B 58 31.164 -4.838 5.819 1.00 0.50 H new ATOM 0 HB3 MET B 58 30.711 -3.340 6.608 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.834 -4.398 7.739 1.00 1.04 H new ATOM 0 HG3 MET B 58 28.977 -5.847 6.764 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.276 -5.891 10.778 1.00 1.52 H new ATOM 0 HE2 MET B 58 29.491 -4.468 10.052 1.00 1.52 H new ATOM 0 HE3 MET B 58 28.796 -6.088 9.808 1.00 1.52 H new ATOM 2569 N LEU B 59 27.225 -4.254 6.012 1.00 0.44 N ATOM 2570 CA LEU B 59 25.875 -3.804 6.468 1.00 0.43 C ATOM 2571 C LEU B 59 25.920 -3.533 7.974 1.00 0.41 C ATOM 2572 O LEU B 59 26.494 -4.290 8.731 1.00 0.47 O ATOM 2573 CB LEU B 59 24.813 -4.877 6.150 1.00 0.51 C ATOM 2574 CG LEU B 59 24.876 -6.070 7.128 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.754 -7.052 6.793 1.00 1.05 C ATOM 2576 CD2 LEU B 59 26.220 -6.790 7.000 1.00 1.25 C ATOM 0 H LEU B 59 27.437 -5.238 6.178 1.00 0.44 H new ATOM 0 HA LEU B 59 25.602 -2.890 5.941 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.821 -4.427 6.192 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.957 -5.237 5.131 1.00 0.51 H new ATOM 0 HG LEU B 59 24.763 -5.700 8.147 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.793 -7.897 7.480 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.791 -6.551 6.889 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.877 -7.410 5.771 1.00 1.05 H new ATOM 0 HD21 LEU B 59 26.251 -7.629 7.695 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.340 -7.158 5.981 1.00 1.25 H new ATOM 0 HD23 LEU B 59 27.028 -6.096 7.232 1.00 1.25 H new ATOM 2588 N THR B 60 25.340 -2.444 8.413 1.00 0.38 N ATOM 2589 CA THR B 60 25.378 -2.120 9.871 1.00 0.41 C ATOM 2590 C THR B 60 24.073 -2.587 10.518 1.00 0.44 C ATOM 2591 O THR B 60 23.110 -2.878 9.838 1.00 0.43 O ATOM 2592 CB THR B 60 25.511 -0.609 10.071 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.744 -0.215 11.200 1.00 1.04 O ATOM 2594 CG2 THR B 60 25.003 0.121 8.833 1.00 1.01 C ATOM 0 H THR B 60 24.845 -1.770 7.829 1.00 0.38 H new ATOM 0 HA THR B 60 26.232 -2.622 10.326 1.00 0.41 H new ATOM 0 HB THR B 60 26.559 -0.356 10.233 1.00 0.40 H new ATOM 0 HG1 THR B 60 24.829 0.752 11.332 1.00 1.04 H new ATOM 0 HG21 THR B 60 25.100 1.197 8.980 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.590 -0.181 7.966 1.00 1.01 H new ATOM 0 HG23 THR B 60 23.955 -0.130 8.667 1.00 1.01 H new ATOM 2602 N LYS B 61 24.036 -2.664 11.824 1.00 0.51 N ATOM 2603 CA LYS B 61 22.789 -3.113 12.513 1.00 0.54 C ATOM 2604 C LYS B 61 21.580 -2.423 11.868 1.00 0.51 C ATOM 2605 O LYS B 61 20.560 -3.027 11.608 1.00 0.50 O ATOM 2606 CB LYS B 61 22.852 -2.749 14.005 1.00 0.61 C ATOM 2607 CG LYS B 61 23.581 -1.415 14.205 1.00 1.28 C ATOM 2608 CD LYS B 61 25.018 -1.682 14.662 1.00 1.04 C ATOM 2609 CE LYS B 61 25.862 -0.422 14.457 1.00 1.73 C ATOM 2610 NZ LYS B 61 26.928 -0.364 15.498 1.00 2.19 N ATOM 0 H LYS B 61 24.815 -2.436 12.442 1.00 0.51 H new ATOM 0 HA LYS B 61 22.693 -4.194 12.415 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.843 -2.683 14.412 1.00 0.61 H new ATOM 0 HB3 LYS B 61 23.366 -3.537 14.556 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.584 -0.847 13.275 1.00 1.28 H new ATOM 0 HG3 LYS B 61 23.059 -0.810 14.946 1.00 1.28 H new ATOM 0 HD2 LYS B 61 25.029 -1.973 15.713 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.442 -2.512 14.097 1.00 1.04 H new ATOM 0 HE2 LYS B 61 26.309 -0.429 13.463 1.00 1.73 H new ATOM 0 HE3 LYS B 61 25.231 0.465 14.517 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 27.502 0.492 15.360 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 26.491 -0.339 16.441 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 27.535 -1.205 15.420 1.00 2.19 H new ATOM 2624 N LYS B 62 21.700 -1.157 11.609 1.00 0.51 N ATOM 2625 CA LYS B 62 20.578 -0.405 10.977 1.00 0.49 C ATOM 2626 C LYS B 62 20.311 -0.948 9.567 1.00 0.45 C ATOM 2627 O LYS B 62 19.190 -0.963 9.093 1.00 0.53 O ATOM 2628 CB LYS B 62 20.940 1.079 10.888 1.00 0.54 C ATOM 2629 CG LYS B 62 20.591 1.782 12.203 1.00 0.75 C ATOM 2630 CD LYS B 62 21.413 1.179 13.345 1.00 1.16 C ATOM 2631 CE LYS B 62 21.221 2.015 14.611 1.00 1.17 C ATOM 2632 NZ LYS B 62 20.793 1.130 15.731 1.00 2.08 N ATOM 0 H LYS B 62 22.532 -0.602 11.808 1.00 0.51 H new ATOM 0 HA LYS B 62 19.682 -0.528 11.585 1.00 0.49 H new ATOM 0 HB2 LYS B 62 22.004 1.191 10.677 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.401 1.545 10.063 1.00 0.54 H new ATOM 0 HG2 LYS B 62 20.794 2.850 12.121 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.527 1.675 12.412 1.00 0.75 H new ATOM 0 HD2 LYS B 62 21.103 0.150 13.526 1.00 1.16 H new ATOM 0 HD3 LYS B 62 22.468 1.151 13.072 1.00 1.16 H new ATOM 0 HE2 LYS B 62 22.151 2.522 14.869 1.00 1.17 H new ATOM 0 HE3 LYS B 62 20.473 2.789 14.439 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 20.662 1.698 16.592 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 19.896 0.666 15.483 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 21.522 0.407 15.900 1.00 2.08 H new ATOM 2646 N GLY B 63 21.341 -1.374 8.885 1.00 0.41 N ATOM 2647 CA GLY B 63 21.163 -1.889 7.496 1.00 0.39 C ATOM 2648 C GLY B 63 20.437 -3.237 7.493 1.00 0.38 C ATOM 2649 O GLY B 63 19.557 -3.470 6.688 1.00 0.39 O ATOM 0 H GLY B 63 22.300 -1.387 9.231 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.597 -1.167 6.908 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.137 -1.996 7.018 1.00 0.39 H new ATOM 2653 N GLU B 64 20.787 -4.127 8.376 1.00 0.40 N ATOM 2654 CA GLU B 64 20.094 -5.452 8.400 1.00 0.43 C ATOM 2655 C GLU B 64 18.627 -5.261 8.781 1.00 0.43 C ATOM 2656 O GLU B 64 17.726 -5.703 8.093 1.00 0.42 O ATOM 2657 CB GLU B 64 20.766 -6.392 9.399 1.00 0.52 C ATOM 2658 CG GLU B 64 21.935 -5.676 10.050 1.00 0.63 C ATOM 2659 CD GLU B 64 22.614 -6.604 11.059 1.00 0.88 C ATOM 2660 OE1 GLU B 64 22.060 -7.655 11.332 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.676 -6.246 11.541 1.00 1.45 O ATOM 0 H GLU B 64 21.516 -4.001 9.078 1.00 0.40 H new ATOM 0 HA GLU B 64 20.158 -5.895 7.406 1.00 0.43 H new ATOM 0 HB2 GLU B 64 20.050 -6.708 10.157 1.00 0.52 H new ATOM 0 HB3 GLU B 64 21.112 -7.293 8.892 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.651 -5.364 9.290 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.587 -4.772 10.550 1.00 0.63 H new ATOM 2668 N GLU B 65 18.383 -4.607 9.881 1.00 0.46 N ATOM 2669 CA GLU B 65 16.976 -4.389 10.313 1.00 0.49 C ATOM 2670 C GLU B 65 16.222 -3.658 9.202 1.00 0.45 C ATOM 2671 O GLU B 65 15.033 -3.839 9.021 1.00 0.48 O ATOM 2672 CB GLU B 65 16.949 -3.560 11.599 1.00 0.54 C ATOM 2673 CG GLU B 65 17.786 -4.253 12.672 1.00 0.62 C ATOM 2674 CD GLU B 65 17.201 -5.631 12.982 1.00 1.07 C ATOM 2675 OE1 GLU B 65 16.020 -5.818 12.751 1.00 1.68 O ATOM 2676 OE2 GLU B 65 17.950 -6.477 13.443 1.00 1.66 O ATOM 0 H GLU B 65 19.095 -4.215 10.498 1.00 0.46 H new ATOM 0 HA GLU B 65 16.498 -5.349 10.507 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.340 -2.561 11.408 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.922 -3.440 11.945 1.00 0.54 H new ATOM 0 HG2 GLU B 65 18.817 -4.354 12.332 1.00 0.62 H new ATOM 0 HG3 GLU B 65 17.807 -3.646 13.577 1.00 0.62 H new ATOM 2683 N LEU B 66 16.906 -2.845 8.445 1.00 0.44 N ATOM 2684 CA LEU B 66 16.229 -2.117 7.337 1.00 0.45 C ATOM 2685 C LEU B 66 15.934 -3.096 6.194 1.00 0.43 C ATOM 2686 O LEU B 66 14.892 -3.038 5.572 1.00 0.45 O ATOM 2687 CB LEU B 66 17.143 -0.988 6.841 1.00 0.46 C ATOM 2688 CG LEU B 66 16.576 -0.362 5.562 1.00 0.64 C ATOM 2689 CD1 LEU B 66 15.136 0.099 5.802 1.00 0.72 C ATOM 2690 CD2 LEU B 66 17.434 0.842 5.172 1.00 1.57 C ATOM 0 H LEU B 66 17.903 -2.654 8.546 1.00 0.44 H new ATOM 0 HA LEU B 66 15.291 -1.689 7.691 1.00 0.45 H new ATOM 0 HB2 LEU B 66 17.241 -0.225 7.614 1.00 0.46 H new ATOM 0 HB3 LEU B 66 18.142 -1.379 6.650 1.00 0.46 H new ATOM 0 HG LEU B 66 16.586 -1.102 4.761 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.739 0.543 4.889 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.523 -0.756 6.086 1.00 0.72 H new ATOM 0 HD13 LEU B 66 15.119 0.839 6.602 1.00 0.72 H new ATOM 0 HD21 LEU B 66 17.037 1.293 4.263 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.418 1.576 5.978 1.00 1.57 H new ATOM 0 HD23 LEU B 66 18.460 0.517 4.997 1.00 1.57 H new ATOM 2702 N LEU B 67 16.830 -4.009 5.918 1.00 0.42 N ATOM 2703 CA LEU B 67 16.570 -4.991 4.827 1.00 0.43 C ATOM 2704 C LEU B 67 15.289 -5.758 5.139 1.00 0.45 C ATOM 2705 O LEU B 67 14.496 -6.048 4.264 1.00 0.48 O ATOM 2706 CB LEU B 67 17.733 -5.978 4.702 1.00 0.45 C ATOM 2707 CG LEU B 67 17.648 -6.677 3.342 1.00 0.51 C ATOM 2708 CD1 LEU B 67 18.592 -5.990 2.355 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.045 -8.149 3.483 1.00 1.26 C ATOM 0 H LEU B 67 17.724 -4.115 6.398 1.00 0.42 H new ATOM 0 HA LEU B 67 16.466 -4.452 3.885 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.684 -5.454 4.797 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.692 -6.712 5.506 1.00 0.45 H new ATOM 0 HG LEU B 67 16.624 -6.616 2.974 1.00 0.51 H new ATOM 0 HD11 LEU B 67 18.531 -6.488 1.387 1.00 0.90 H new ATOM 0 HD12 LEU B 67 18.304 -4.944 2.244 1.00 0.90 H new ATOM 0 HD13 LEU B 67 19.614 -6.047 2.729 1.00 0.90 H new ATOM 0 HD21 LEU B 67 17.981 -8.638 2.511 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.067 -8.216 3.857 1.00 1.26 H new ATOM 0 HD23 LEU B 67 17.370 -8.643 4.182 1.00 1.26 H new ATOM 2721 N GLU B 68 15.075 -6.085 6.386 1.00 0.44 N ATOM 2722 CA GLU B 68 13.840 -6.828 6.755 1.00 0.48 C ATOM 2723 C GLU B 68 12.636 -5.910 6.561 1.00 0.46 C ATOM 2724 O GLU B 68 11.627 -6.298 6.004 1.00 0.47 O ATOM 2725 CB GLU B 68 13.924 -7.264 8.220 1.00 0.52 C ATOM 2726 CG GLU B 68 15.171 -8.126 8.424 1.00 1.26 C ATOM 2727 CD GLU B 68 15.341 -8.438 9.911 1.00 1.77 C ATOM 2728 OE1 GLU B 68 15.317 -7.506 10.698 1.00 2.23 O ATOM 2729 OE2 GLU B 68 15.492 -9.603 10.239 1.00 2.25 O ATOM 0 H GLU B 68 15.702 -5.869 7.161 1.00 0.44 H new ATOM 0 HA GLU B 68 13.736 -7.711 6.125 1.00 0.48 H new ATOM 0 HB2 GLU B 68 13.963 -6.389 8.869 1.00 0.52 H new ATOM 0 HB3 GLU B 68 13.031 -7.826 8.495 1.00 0.52 H new ATOM 0 HG2 GLU B 68 15.082 -9.052 7.856 1.00 1.26 H new ATOM 0 HG3 GLU B 68 16.051 -7.604 8.049 1.00 1.26 H new ATOM 2736 N ASP B 69 12.739 -4.688 7.004 1.00 0.44 N ATOM 2737 CA ASP B 69 11.606 -3.740 6.831 1.00 0.45 C ATOM 2738 C ASP B 69 11.269 -3.639 5.342 1.00 0.45 C ATOM 2739 O ASP B 69 10.123 -3.723 4.949 1.00 0.46 O ATOM 2740 CB ASP B 69 12.003 -2.361 7.365 1.00 0.46 C ATOM 2741 CG ASP B 69 12.337 -2.469 8.854 1.00 0.51 C ATOM 2742 OD1 ASP B 69 11.609 -3.150 9.557 1.00 1.12 O ATOM 2743 OD2 ASP B 69 13.316 -1.867 9.267 1.00 1.25 O ATOM 0 H ASP B 69 13.558 -4.306 7.477 1.00 0.44 H new ATOM 0 HA ASP B 69 10.737 -4.098 7.383 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.863 -1.980 6.815 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.189 -1.652 7.214 1.00 0.46 H new ATOM 2748 N ILE B 70 12.262 -3.466 4.510 1.00 0.45 N ATOM 2749 CA ILE B 70 11.997 -3.368 3.046 1.00 0.49 C ATOM 2750 C ILE B 70 11.274 -4.631 2.578 1.00 0.48 C ATOM 2751 O ILE B 70 10.375 -4.580 1.762 1.00 0.50 O ATOM 2752 CB ILE B 70 13.322 -3.225 2.290 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.922 -1.848 2.574 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.078 -3.367 0.785 1.00 0.85 C ATOM 2755 CD1 ILE B 70 15.399 -1.837 2.172 1.00 1.29 C ATOM 0 H ILE B 70 13.242 -3.389 4.781 1.00 0.45 H new ATOM 0 HA ILE B 70 11.375 -2.496 2.847 1.00 0.49 H new ATOM 0 HB ILE B 70 14.010 -4.003 2.621 1.00 0.56 H new ATOM 0 HG12 ILE B 70 13.379 -1.082 2.020 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.821 -1.608 3.632 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.023 -3.265 0.252 1.00 0.85 H new ATOM 0 HG22 ILE B 70 12.648 -4.347 0.577 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.388 -2.591 0.453 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.824 -0.854 2.376 1.00 1.29 H new ATOM 0 HD12 ILE B 70 15.938 -2.591 2.745 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.488 -2.058 1.108 1.00 1.29 H new ATOM 2767 N ARG B 71 11.657 -5.764 3.094 1.00 0.47 N ATOM 2768 CA ARG B 71 10.993 -7.033 2.689 1.00 0.50 C ATOM 2769 C ARG B 71 9.493 -6.946 2.979 1.00 0.50 C ATOM 2770 O ARG B 71 8.667 -7.202 2.126 1.00 0.54 O ATOM 2771 CB ARG B 71 11.600 -8.192 3.480 1.00 0.52 C ATOM 2772 CG ARG B 71 11.961 -9.329 2.523 1.00 0.82 C ATOM 2773 CD ARG B 71 12.554 -10.497 3.315 1.00 1.02 C ATOM 2774 NE ARG B 71 13.657 -11.118 2.530 1.00 1.57 N ATOM 2775 CZ ARG B 71 14.441 -11.997 3.092 1.00 2.17 C ATOM 2776 NH1 ARG B 71 14.258 -12.332 4.340 1.00 2.58 N ATOM 2777 NH2 ARG B 71 15.408 -12.542 2.406 1.00 2.98 N ATOM 0 H ARG B 71 12.404 -5.866 3.781 1.00 0.47 H new ATOM 0 HA ARG B 71 11.142 -7.198 1.622 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.489 -7.856 4.014 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.892 -8.545 4.230 1.00 0.52 H new ATOM 0 HG2 ARG B 71 11.074 -9.657 1.981 1.00 0.82 H new ATOM 0 HG3 ARG B 71 12.678 -8.979 1.780 1.00 0.82 H new ATOM 0 HD2 ARG B 71 12.930 -10.146 4.276 1.00 1.02 H new ATOM 0 HD3 ARG B 71 11.782 -11.237 3.526 1.00 1.02 H new ATOM 0 HE ARG B 71 13.799 -10.857 1.554 1.00 1.57 H new ATOM 0 HH11 ARG B 71 13.502 -11.907 4.877 1.00 2.58 H new ATOM 0 HH12 ARG B 71 14.871 -13.019 4.779 1.00 2.58 H new ATOM 0 HH21 ARG B 71 15.551 -12.281 1.430 1.00 2.98 H new ATOM 0 HH22 ARG B 71 16.021 -13.229 2.845 1.00 2.98 H new ATOM 2791 N LYS B 72 9.139 -6.594 4.185 1.00 0.48 N ATOM 2792 CA LYS B 72 7.697 -6.498 4.549 1.00 0.49 C ATOM 2793 C LYS B 72 6.986 -5.496 3.632 1.00 0.48 C ATOM 2794 O LYS B 72 6.104 -5.852 2.877 1.00 0.51 O ATOM 2795 CB LYS B 72 7.577 -6.028 5.998 1.00 0.49 C ATOM 2796 CG LYS B 72 8.383 -6.960 6.904 1.00 0.65 C ATOM 2797 CD LYS B 72 8.084 -6.635 8.370 1.00 0.91 C ATOM 2798 CE LYS B 72 8.875 -7.582 9.273 1.00 1.46 C ATOM 2799 NZ LYS B 72 8.255 -8.937 9.236 1.00 1.81 N ATOM 0 H LYS B 72 9.790 -6.368 4.937 1.00 0.48 H new ATOM 0 HA LYS B 72 7.233 -7.477 4.433 1.00 0.49 H new ATOM 0 HB2 LYS B 72 7.943 -5.006 6.092 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.531 -6.021 6.304 1.00 0.49 H new ATOM 0 HG2 LYS B 72 8.129 -7.999 6.692 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.449 -6.845 6.705 1.00 0.65 H new ATOM 0 HD2 LYS B 72 8.352 -5.601 8.586 1.00 0.91 H new ATOM 0 HD3 LYS B 72 7.016 -6.736 8.566 1.00 0.91 H new ATOM 0 HE2 LYS B 72 9.912 -7.636 8.942 1.00 1.46 H new ATOM 0 HE3 LYS B 72 8.886 -7.203 10.295 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 8.646 -9.519 10.004 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 7.226 -8.851 9.356 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 8.460 -9.388 8.322 1.00 1.81 H new ATOM 2813 N PHE B 73 7.360 -4.246 3.710 1.00 0.47 N ATOM 2814 CA PHE B 73 6.715 -3.195 2.866 1.00 0.48 C ATOM 2815 C PHE B 73 6.475 -3.720 1.446 1.00 0.51 C ATOM 2816 O PHE B 73 5.368 -3.720 0.955 1.00 0.52 O ATOM 2817 CB PHE B 73 7.636 -1.973 2.816 1.00 0.48 C ATOM 2818 CG PHE B 73 7.740 -1.457 1.400 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.762 -0.591 0.899 1.00 1.25 C ATOM 2820 CD2 PHE B 73 8.816 -1.839 0.590 1.00 1.37 C ATOM 2821 CE1 PHE B 73 6.860 -0.107 -0.411 1.00 1.29 C ATOM 2822 CE2 PHE B 73 8.913 -1.357 -0.721 1.00 1.40 C ATOM 2823 CZ PHE B 73 7.934 -0.489 -1.221 1.00 0.67 C ATOM 0 H PHE B 73 8.094 -3.904 4.330 1.00 0.47 H new ATOM 0 HA PHE B 73 5.752 -2.923 3.299 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.250 -1.190 3.469 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.626 -2.239 3.188 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.931 -0.296 1.523 1.00 1.25 H new ATOM 0 HD2 PHE B 73 9.572 -2.506 0.977 1.00 1.37 H new ATOM 0 HE1 PHE B 73 6.105 0.562 -0.797 1.00 1.29 H new ATOM 0 HE2 PHE B 73 9.742 -1.654 -1.346 1.00 1.40 H new ATOM 0 HZ PHE B 73 8.009 -0.115 -2.231 1.00 0.67 H new ATOM 2833 N ASN B 74 7.506 -4.160 0.787 1.00 0.52 N ATOM 2834 CA ASN B 74 7.331 -4.677 -0.601 1.00 0.55 C ATOM 2835 C ASN B 74 6.384 -5.877 -0.581 1.00 0.57 C ATOM 2836 O ASN B 74 5.604 -6.077 -1.491 1.00 0.60 O ATOM 2837 CB ASN B 74 8.688 -5.100 -1.167 1.00 0.57 C ATOM 2838 CG ASN B 74 8.611 -5.145 -2.694 1.00 0.79 C ATOM 2839 OD1 ASN B 74 9.007 -4.210 -3.361 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.115 -6.199 -3.279 1.00 0.99 N ATOM 0 H ASN B 74 8.461 -4.185 1.145 1.00 0.52 H new ATOM 0 HA ASN B 74 6.909 -3.893 -1.230 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.460 -4.399 -0.852 1.00 0.57 H new ATOM 0 HB3 ASN B 74 8.968 -6.079 -0.777 1.00 0.57 H new ATOM 0 HD21 ASN B 74 8.059 -6.239 -4.297 1.00 0.99 H new ATOM 0 HD22 ASN B 74 7.783 -6.984 -2.719 1.00 0.99 H new ATOM 2847 N GLU B 75 6.445 -6.676 0.445 1.00 0.55 N ATOM 2848 CA GLU B 75 5.552 -7.860 0.521 1.00 0.59 C ATOM 2849 C GLU B 75 4.123 -7.419 0.821 1.00 0.57 C ATOM 2850 O GLU B 75 3.177 -8.068 0.421 1.00 0.68 O ATOM 2851 CB GLU B 75 6.031 -8.784 1.636 1.00 0.62 C ATOM 2852 CG GLU B 75 6.980 -9.830 1.063 1.00 1.10 C ATOM 2853 CD GLU B 75 7.473 -10.742 2.187 1.00 1.46 C ATOM 2854 OE1 GLU B 75 6.720 -11.615 2.587 1.00 1.88 O ATOM 2855 OE2 GLU B 75 8.594 -10.552 2.628 1.00 2.12 O ATOM 0 H GLU B 75 7.078 -6.559 1.237 1.00 0.55 H new ATOM 0 HA GLU B 75 5.575 -8.384 -0.435 1.00 0.59 H new ATOM 0 HB2 GLU B 75 6.536 -8.205 2.409 1.00 0.62 H new ATOM 0 HB3 GLU B 75 5.179 -9.272 2.109 1.00 0.62 H new ATOM 0 HG2 GLU B 75 6.471 -10.419 0.300 1.00 1.10 H new ATOM 0 HG3 GLU B 75 7.826 -9.342 0.579 1.00 1.10 H new ATOM 2862 N MET B 76 3.940 -6.326 1.519 1.00 0.53 N ATOM 2863 CA MET B 76 2.563 -5.866 1.828 1.00 0.51 C ATOM 2864 C MET B 76 2.145 -4.836 0.785 1.00 0.52 C ATOM 2865 O MET B 76 0.989 -4.724 0.430 1.00 0.53 O ATOM 2866 CB MET B 76 2.553 -5.219 3.215 1.00 0.48 C ATOM 2867 CG MET B 76 2.739 -6.299 4.283 1.00 0.48 C ATOM 2868 SD MET B 76 1.194 -6.516 5.201 1.00 0.51 S ATOM 2869 CE MET B 76 1.671 -8.014 6.097 1.00 0.60 C ATOM 0 H MET B 76 4.688 -5.737 1.885 1.00 0.53 H new ATOM 0 HA MET B 76 1.872 -6.709 1.813 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.350 -4.479 3.288 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.612 -4.692 3.375 1.00 0.48 H new ATOM 0 HG2 MET B 76 3.032 -7.240 3.817 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.542 -6.017 4.964 1.00 0.48 H new ATOM 0 HE1 MET B 76 0.849 -8.332 6.738 1.00 0.60 H new ATOM 0 HE2 MET B 76 1.903 -8.806 5.385 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.549 -7.808 6.709 1.00 0.60 H new ATOM 2879 N ARG B 77 3.087 -4.074 0.296 1.00 0.52 N ATOM 2880 CA ARG B 77 2.763 -3.039 -0.723 1.00 0.54 C ATOM 2881 C ARG B 77 2.179 -3.689 -1.976 1.00 0.57 C ATOM 2882 O ARG B 77 1.157 -3.274 -2.484 1.00 0.57 O ATOM 2883 CB ARG B 77 4.034 -2.269 -1.092 1.00 0.54 C ATOM 2884 CG ARG B 77 3.688 -1.153 -2.083 1.00 0.57 C ATOM 2885 CD ARG B 77 4.287 -1.481 -3.451 1.00 0.62 C ATOM 2886 NE ARG B 77 3.821 -0.480 -4.451 1.00 0.86 N ATOM 2887 CZ ARG B 77 4.415 0.678 -4.542 1.00 1.32 C ATOM 2888 NH1 ARG B 77 5.418 0.961 -3.756 1.00 1.81 N ATOM 2889 NH2 ARG B 77 4.007 1.554 -5.419 1.00 1.80 N ATOM 0 H ARG B 77 4.071 -4.126 0.561 1.00 0.52 H new ATOM 0 HA ARG B 77 2.025 -2.354 -0.306 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.488 -1.846 -0.196 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.767 -2.946 -1.532 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.606 -1.047 -2.164 1.00 0.57 H new ATOM 0 HG3 ARG B 77 4.076 -0.200 -1.724 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.375 -1.474 -3.394 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.990 -2.484 -3.759 1.00 0.62 H new ATOM 0 HE ARG B 77 3.037 -0.700 -5.065 1.00 0.86 H new ATOM 0 HH11 ARG B 77 5.738 0.277 -3.070 1.00 1.81 H new ATOM 0 HH12 ARG B 77 5.882 1.866 -3.827 1.00 1.81 H new ATOM 0 HH21 ARG B 77 3.223 1.333 -6.034 1.00 1.80 H new ATOM 0 HH22 ARG B 77 4.472 2.459 -5.490 1.00 1.80 H new ATOM 2903 N LYS B 78 2.810 -4.717 -2.469 1.00 0.58 N ATOM 2904 CA LYS B 78 2.280 -5.401 -3.671 1.00 0.61 C ATOM 2905 C LYS B 78 0.986 -6.101 -3.286 1.00 0.60 C ATOM 2906 O LYS B 78 0.075 -6.227 -4.076 1.00 0.62 O ATOM 2907 CB LYS B 78 3.301 -6.429 -4.170 1.00 0.63 C ATOM 2908 CG LYS B 78 2.569 -7.556 -4.910 1.00 1.17 C ATOM 2909 CD LYS B 78 3.540 -8.338 -5.800 1.00 1.22 C ATOM 2910 CE LYS B 78 4.086 -7.442 -6.919 1.00 1.57 C ATOM 2911 NZ LYS B 78 5.475 -7.017 -6.580 1.00 2.26 N ATOM 0 H LYS B 78 3.671 -5.111 -2.088 1.00 0.58 H new ATOM 0 HA LYS B 78 2.093 -4.680 -4.467 1.00 0.61 H new ATOM 0 HB2 LYS B 78 4.021 -5.950 -4.834 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.864 -6.836 -3.330 1.00 0.63 H new ATOM 0 HG2 LYS B 78 2.105 -8.230 -4.190 1.00 1.17 H new ATOM 0 HG3 LYS B 78 1.767 -7.138 -5.518 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.364 -8.722 -5.199 1.00 1.22 H new ATOM 0 HD3 LYS B 78 3.032 -9.200 -6.232 1.00 1.22 H new ATOM 0 HE2 LYS B 78 4.080 -7.980 -7.867 1.00 1.57 H new ATOM 0 HE3 LYS B 78 3.447 -6.568 -7.045 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 5.608 -6.020 -6.846 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 5.632 -7.126 -5.558 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 6.155 -7.608 -7.099 1.00 2.26 H new ATOM 2925 N ASN B 79 0.892 -6.542 -2.063 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.352 -7.221 -1.618 1.00 0.58 C ATOM 2927 C ASN B 79 -1.499 -6.221 -1.638 1.00 0.57 C ATOM 2928 O ASN B 79 -2.516 -6.441 -2.265 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.175 -7.767 -0.203 1.00 0.57 C ATOM 2930 CG ASN B 79 -0.658 -9.217 -0.149 1.00 0.62 C ATOM 2931 OD1 ASN B 79 0.055 -10.090 0.302 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -1.849 -9.512 -0.595 1.00 1.16 N ATOM 0 H ASN B 79 1.622 -6.461 -1.355 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.571 -8.050 -2.291 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.873 -7.711 0.091 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.738 -7.159 0.505 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -2.181 -10.476 -0.565 1.00 1.16 H new ATOM 0 HD22 ASN B 79 -2.448 -8.778 -0.974 1.00 1.16 H new ATOM 2939 N MET B 80 -1.356 -5.118 -0.953 1.00 0.57 N ATOM 2940 CA MET B 80 -2.459 -4.130 -0.949 1.00 0.57 C ATOM 2941 C MET B 80 -2.820 -3.796 -2.399 1.00 0.58 C ATOM 2942 O MET B 80 -3.976 -3.822 -2.768 1.00 0.57 O ATOM 2943 CB MET B 80 -2.070 -2.886 -0.118 1.00 0.60 C ATOM 2944 CG MET B 80 -1.561 -1.725 -0.982 1.00 0.69 C ATOM 2945 SD MET B 80 -2.931 -0.944 -1.875 1.00 1.27 S ATOM 2946 CE MET B 80 -2.198 0.705 -2.026 1.00 1.05 C ATOM 0 H MET B 80 -0.533 -4.866 -0.405 1.00 0.57 H new ATOM 0 HA MET B 80 -3.345 -4.544 -0.469 1.00 0.57 H new ATOM 0 HB2 MET B 80 -2.935 -2.553 0.455 1.00 0.60 H new ATOM 0 HB3 MET B 80 -1.299 -3.162 0.601 1.00 0.60 H new ATOM 0 HG2 MET B 80 -1.063 -0.988 -0.352 1.00 0.69 H new ATOM 0 HG3 MET B 80 -0.819 -2.091 -1.692 1.00 0.69 H new ATOM 0 HE1 MET B 80 -2.887 1.362 -2.556 1.00 1.05 H new ATOM 0 HE2 MET B 80 -2.003 1.109 -1.033 1.00 1.05 H new ATOM 0 HE3 MET B 80 -1.262 0.638 -2.581 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.859 -3.511 -3.242 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.187 -3.216 -4.666 1.00 0.62 C ATOM 2958 C ASP B 81 -2.881 -4.429 -5.290 1.00 0.63 C ATOM 2959 O ASP B 81 -3.859 -4.297 -6.000 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.893 -2.912 -5.425 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.162 -1.858 -6.500 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -2.263 -1.840 -7.024 1.00 1.23 O ATOM 2963 OD2 ASP B 81 -0.260 -1.084 -6.782 1.00 1.19 O ATOM 0 H ASP B 81 -0.868 -3.471 -3.005 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.853 -2.355 -4.722 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.130 -2.554 -4.734 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.506 -3.822 -5.883 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.407 -5.617 -5.004 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.070 -6.832 -5.555 1.00 0.66 C ATOM 2970 C GLN B 82 -4.504 -6.838 -5.030 1.00 0.63 C ATOM 2971 O GLN B 82 -5.465 -7.001 -5.758 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.342 -8.085 -5.047 1.00 0.68 C ATOM 2973 CG GLN B 82 -0.933 -8.161 -5.635 1.00 1.09 C ATOM 2974 CD GLN B 82 -0.891 -9.245 -6.713 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -0.300 -10.289 -6.518 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -1.499 -9.041 -7.850 1.00 1.41 N ATOM 0 H GLN B 82 -1.593 -5.794 -4.415 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.049 -6.827 -6.645 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.288 -8.065 -3.959 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.906 -8.977 -5.322 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.652 -7.198 -6.061 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.211 -8.385 -4.850 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -1.995 -8.165 -8.013 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -1.478 -9.758 -8.575 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.625 -6.634 -3.753 1.00 0.59 N ATOM 2986 CA LEU B 83 -5.967 -6.595 -3.121 1.00 0.56 C ATOM 2987 C LEU B 83 -6.735 -5.413 -3.718 1.00 0.55 C ATOM 2988 O LEU B 83 -7.887 -5.528 -4.083 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.818 -6.428 -1.608 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.114 -7.666 -1.032 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.658 -7.382 0.398 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.064 -8.874 -1.026 1.00 0.56 C ATOM 0 H LEU B 83 -3.843 -6.491 -3.113 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.509 -7.522 -3.309 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.242 -5.530 -1.384 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.797 -6.303 -1.145 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.252 -7.894 -1.658 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.159 -8.263 0.803 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -3.965 -6.540 0.399 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.524 -7.140 1.015 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.547 -9.741 -0.615 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -6.937 -8.647 -0.414 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.383 -9.091 -2.045 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.094 -4.280 -3.839 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.776 -3.097 -4.434 1.00 0.55 C ATOM 3006 C LYS B 84 -7.415 -3.501 -5.767 1.00 0.58 C ATOM 3007 O LYS B 84 -8.548 -3.166 -6.059 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.755 -1.984 -4.680 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.482 -0.708 -5.112 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.920 -0.226 -6.451 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.701 1.004 -6.919 1.00 0.80 C ATOM 3012 NZ LYS B 84 -6.889 1.939 -5.774 1.00 1.40 N ATOM 0 H LYS B 84 -5.128 -4.125 -3.551 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.544 -2.738 -3.749 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.179 -1.798 -3.773 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.047 -2.290 -5.450 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.551 -0.899 -5.203 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.360 0.066 -4.355 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -4.863 0.019 -6.347 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -5.991 -1.020 -7.194 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -6.164 1.503 -7.726 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -7.669 0.703 -7.319 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -7.052 2.901 -6.134 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -7.709 1.637 -5.210 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -6.037 1.933 -5.177 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.691 -4.222 -6.580 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.241 -4.654 -7.894 1.00 0.63 C ATOM 3028 C GLU B 85 -8.416 -5.606 -7.668 1.00 0.63 C ATOM 3029 O GLU B 85 -9.374 -5.615 -8.415 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.148 -5.377 -8.689 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.788 -6.383 -9.651 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.785 -6.751 -10.745 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.896 -7.540 -10.465 1.00 1.28 O ATOM 3034 OE2 GLU B 85 -5.922 -6.240 -11.844 1.00 1.21 O ATOM 0 H GLU B 85 -5.738 -4.531 -6.388 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.582 -3.781 -8.450 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.552 -4.654 -9.247 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.470 -5.891 -8.008 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.095 -7.277 -9.108 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.687 -5.956 -10.096 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.357 -6.395 -6.635 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.478 -7.332 -6.355 1.00 0.63 C ATOM 3043 C LYS B 86 -10.733 -6.515 -6.051 1.00 0.61 C ATOM 3044 O LYS B 86 -11.834 -6.885 -6.407 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.129 -8.206 -5.150 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.456 -9.667 -5.462 1.00 0.70 C ATOM 3047 CD LYS B 86 -9.076 -10.543 -4.266 1.00 0.89 C ATOM 3048 CE LYS B 86 -7.935 -11.482 -4.661 1.00 1.09 C ATOM 3049 NZ LYS B 86 -7.598 -12.365 -3.509 1.00 0.99 N ATOM 0 H LYS B 86 -7.582 -6.432 -5.973 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.652 -7.973 -7.219 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.071 -8.104 -4.908 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.689 -7.877 -4.275 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.518 -9.774 -5.681 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.913 -9.990 -6.350 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -8.772 -9.918 -3.426 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.939 -11.121 -3.937 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -8.226 -12.084 -5.522 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -7.060 -10.904 -4.958 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -6.822 -13.004 -3.777 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -7.303 -11.782 -2.700 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -8.433 -12.926 -3.246 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.567 -5.397 -5.399 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.738 -4.539 -5.074 1.00 0.57 C ATOM 3065 C ILE B 87 -12.336 -3.997 -6.366 1.00 0.57 C ATOM 3066 O ILE B 87 -13.527 -4.077 -6.589 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.289 -3.367 -4.196 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -11.105 -3.852 -2.753 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.349 -2.260 -4.236 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -10.442 -2.755 -1.912 1.00 0.70 C ATOM 0 H ILE B 87 -9.667 -5.041 -5.077 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.483 -5.128 -4.540 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.344 -2.974 -4.570 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -12.071 -4.117 -2.324 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -10.492 -4.753 -2.739 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -12.028 -1.427 -3.611 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.477 -1.916 -5.262 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.296 -2.650 -3.863 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -10.315 -3.108 -0.889 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -9.468 -2.511 -2.335 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -11.071 -1.865 -1.914 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.522 -3.455 -7.231 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.054 -2.923 -8.512 1.00 0.63 C ATOM 3084 C ASN B 88 -12.689 -4.054 -9.322 1.00 0.63 C ATOM 3085 O ASN B 88 -13.612 -3.841 -10.078 1.00 0.64 O ATOM 3086 CB ASN B 88 -10.913 -2.300 -9.318 1.00 0.70 C ATOM 3087 CG ASN B 88 -9.943 -1.594 -8.368 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -10.348 -1.060 -7.354 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -8.671 -1.568 -8.654 1.00 2.62 N ATOM 0 H ASN B 88 -10.515 -3.359 -7.104 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.809 -2.166 -8.299 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.389 -3.071 -9.883 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -11.311 -1.589 -10.042 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -8.017 -1.100 -8.027 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -8.330 -2.016 -9.505 1.00 2.62 H new ATOM 3096 N SER B 89 -12.185 -5.251 -9.190 1.00 0.64 N ATOM 3097 CA SER B 89 -12.742 -6.390 -9.975 1.00 0.68 C ATOM 3098 C SER B 89 -14.176 -6.728 -9.542 1.00 0.67 C ATOM 3099 O SER B 89 -15.081 -6.760 -10.353 1.00 0.74 O ATOM 3100 CB SER B 89 -11.855 -7.619 -9.774 1.00 0.70 C ATOM 3101 OG SER B 89 -12.268 -8.309 -8.602 1.00 1.23 O ATOM 0 H SER B 89 -11.410 -5.490 -8.571 1.00 0.64 H new ATOM 0 HA SER B 89 -12.764 -6.099 -11.025 1.00 0.68 H new ATOM 0 HB2 SER B 89 -11.923 -8.277 -10.640 1.00 0.70 H new ATOM 0 HB3 SER B 89 -10.811 -7.318 -9.684 1.00 0.70 H new ATOM 0 HG SER B 89 -11.895 -7.864 -7.812 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.396 -6.996 -8.282 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.771 -7.347 -7.818 1.00 0.64 C ATOM 3109 C VAL B 90 -16.638 -6.095 -7.766 1.00 0.57 C ATOM 3110 O VAL B 90 -17.777 -6.093 -8.188 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.698 -7.975 -6.428 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -16.976 -8.775 -6.158 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.489 -8.908 -6.355 1.00 0.89 C ATOM 0 H VAL B 90 -13.682 -6.987 -7.553 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.212 -8.058 -8.516 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.598 -7.189 -5.680 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -16.922 -9.223 -5.166 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.839 -8.111 -6.210 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.078 -9.562 -6.906 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.435 -9.357 -5.363 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -14.590 -9.693 -7.104 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.579 -8.340 -6.545 1.00 0.89 H new ATOM 3123 N LEU B 91 -16.092 -5.022 -7.273 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.866 -3.759 -7.219 1.00 0.49 C ATOM 3125 C LEU B 91 -16.919 -3.215 -8.634 1.00 0.57 C ATOM 3126 O LEU B 91 -17.654 -2.300 -8.936 1.00 0.61 O ATOM 3127 CB LEU B 91 -16.150 -2.757 -6.302 1.00 0.47 C ATOM 3128 CG LEU B 91 -17.170 -1.927 -5.510 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -16.434 -1.048 -4.499 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -17.973 -1.032 -6.460 1.00 0.84 C ATOM 0 H LEU B 91 -15.142 -4.967 -6.905 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.869 -3.926 -6.828 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.494 -3.290 -5.614 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.519 -2.097 -6.897 1.00 0.47 H new ATOM 0 HG LEU B 91 -17.850 -2.603 -4.991 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -17.157 -0.458 -3.936 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -15.867 -1.678 -3.814 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -15.752 -0.380 -5.026 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -18.693 -0.448 -5.888 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -17.296 -0.359 -6.985 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -18.502 -1.652 -7.184 1.00 0.84 H new ATOM 3142 N SER B 92 -16.146 -3.804 -9.510 1.00 0.63 N ATOM 3143 CA SER B 92 -16.126 -3.360 -10.937 1.00 0.76 C ATOM 3144 C SER B 92 -15.668 -1.897 -11.028 1.00 0.83 C ATOM 3145 O SER B 92 -15.134 -1.476 -12.032 1.00 1.11 O ATOM 3146 CB SER B 92 -17.528 -3.488 -11.541 1.00 0.72 C ATOM 3147 OG SER B 92 -17.501 -4.458 -12.580 1.00 0.89 O ATOM 0 H SER B 92 -15.521 -4.581 -9.296 1.00 0.63 H new ATOM 0 HA SER B 92 -15.430 -3.991 -11.490 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.243 -3.781 -10.772 1.00 0.72 H new ATOM 0 HB3 SER B 92 -17.857 -2.526 -11.933 1.00 0.72 H new ATOM 0 HG SER B 92 -18.396 -4.545 -12.969 1.00 0.89 H new ATOM 3153 N ILE B 93 -15.902 -1.127 -9.992 1.00 0.74 N ATOM 3154 CA ILE B 93 -15.527 0.323 -9.989 1.00 0.82 C ATOM 3155 C ILE B 93 -16.272 1.045 -11.122 1.00 1.03 C ATOM 3156 O ILE B 93 -17.073 1.923 -10.883 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.005 0.484 -10.146 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.354 0.515 -8.755 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -13.681 1.785 -10.890 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -13.364 1.942 -8.202 1.00 1.43 C ATOM 0 H ILE B 93 -16.346 -1.449 -9.132 1.00 0.74 H new ATOM 0 HA ILE B 93 -15.814 0.768 -9.037 1.00 0.82 H new ATOM 0 HB ILE B 93 -13.615 -0.356 -10.721 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.891 -0.149 -8.078 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -12.330 0.147 -8.816 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -12.601 1.885 -10.994 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -14.140 1.763 -11.878 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.072 2.633 -10.327 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -12.900 1.953 -7.216 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -12.806 2.596 -8.873 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -14.392 2.295 -8.123 1.00 1.43 H new ATOM 3172 N ARG B 94 -16.021 0.670 -12.344 1.00 1.25 N ATOM 3173 CA ARG B 94 -16.711 1.311 -13.507 1.00 1.52 C ATOM 3174 C ARG B 94 -16.712 0.338 -14.686 1.00 1.60 C ATOM 3175 O ARG B 94 -17.483 0.467 -15.615 1.00 1.76 O ATOM 3176 CB ARG B 94 -15.965 2.582 -13.914 1.00 1.97 C ATOM 3177 CG ARG B 94 -16.961 3.625 -14.430 1.00 2.23 C ATOM 3178 CD ARG B 94 -17.802 4.153 -13.268 1.00 2.52 C ATOM 3179 NE ARG B 94 -19.243 3.893 -13.541 1.00 3.12 N ATOM 3180 CZ ARG B 94 -20.102 3.879 -12.558 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -19.698 4.095 -11.335 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -21.364 3.652 -12.796 1.00 4.55 N ATOM 0 H ARG B 94 -15.358 -0.064 -12.594 1.00 1.25 H new ATOM 0 HA ARG B 94 -17.734 1.563 -13.226 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -15.415 2.981 -13.061 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -15.231 2.353 -14.687 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -16.427 4.446 -14.908 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -17.607 3.181 -15.187 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -17.503 3.668 -12.339 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -17.632 5.222 -13.138 1.00 2.52 H new ATOM 0 HE ARG B 94 -19.559 3.726 -14.496 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -18.712 4.275 -11.148 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -20.369 4.084 -10.567 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -21.681 3.485 -13.751 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -22.034 3.641 -12.027 1.00 4.55 H new ATOM 3196 N GLN B 95 -15.848 -0.632 -14.637 1.00 1.55 N ATOM 3197 CA GLN B 95 -15.761 -1.642 -15.734 1.00 1.73 C ATOM 3198 C GLN B 95 -15.886 -0.949 -17.093 1.00 2.40 C ATOM 3199 O GLN B 95 -15.634 0.244 -17.152 1.00 2.92 O ATOM 3200 CB GLN B 95 -16.889 -2.666 -15.579 1.00 1.94 C ATOM 3201 CG GLN B 95 -16.384 -4.047 -15.999 1.00 2.44 C ATOM 3202 CD GLN B 95 -17.572 -4.992 -16.184 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -18.605 -4.817 -15.569 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -17.469 -5.996 -17.011 1.00 3.31 N ATOM 3205 OXT GLN B 95 -16.230 -1.621 -18.050 1.00 3.00 O ATOM 0 H GLN B 95 -15.186 -0.774 -13.874 1.00 1.55 H new ATOM 0 HA GLN B 95 -14.797 -2.148 -15.677 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -17.232 -2.691 -14.545 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -17.743 -2.378 -16.191 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -15.818 -3.972 -16.927 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -15.706 -4.443 -15.243 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -16.602 -6.144 -17.528 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -18.255 -6.633 -17.141 1.00 3.31 H new TER 3214 GLN B 95