USER MOD reduce.3.24.130724 H: found=0, std=0, add=1443, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1445 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 55 SER OG : rot 87:sc= 2.28 USER MOD Set 1.2: B 85 LYS NZ :NH3+ -172:sc= 1.24 (180deg=0) USER MOD Set 2.1: B 48 HIS : no HE2:sc= 0.738 K(o=-0.14,f=-18!) USER MOD Set 2.2: B 89 LYS NZ :NH3+ -171:sc= -0.873! (180deg=-2.17!) USER MOD Set 3.1: A 85 LYS NZ :NH3+ -173:sc= -1.85! (180deg=0.51) USER MOD Set 3.2: B 74 ASN : amide:sc= -6.43! C(o=-8.3!,f=-18!) USER MOD Set 4.1: A 36 ASN : amide:sc= 1.79 K(o=4.6,f=-9.4!) USER MOD Set 4.2: A 39 LYS NZ :NH3+ -135:sc= 2.41 (180deg=0.00209) USER MOD Set 4.3: A 67 GLN : amide:sc= 0.404 K(o=4.6,f=-9!) USER MOD Single : A 7 THR OG1 : rot 89:sc= 1.21 USER MOD Single : A 12 SER OG : rot 99:sc= 0.982 USER MOD Single : A 15 THR OG1 : rot 168:sc= 1.26 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 75:sc= 1.21 USER MOD Single : A 22 THR OG1 : rot 76:sc= 1.18 USER MOD Single : A 32 SER OG : rot 87:sc= 0.884 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0.31 X(o=0.31,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.732 K(o=-0.73,f=-1.3) USER MOD Single : A 48 HIS : no HD1:sc= -0.154 K(o=-0.15,f=-1.5) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -68:sc= 1.26 USER MOD Single : A 59 LYS NZ :NH3+ -171:sc= -0.144 (180deg=-1.3) USER MOD Single : A 60 MET CE :methyl 177:sc= -0.465 (180deg=-0.527) USER MOD Single : A 61 LYS NZ :NH3+ -174:sc= 1.1 (180deg=0.618) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.29) USER MOD Single : A 69 SER OG : rot -46:sc= 0.895 USER MOD Single : A 72 LYS NZ :NH3+ -174:sc= 0.353 (180deg=0.341) USER MOD Single : A 74 ASN : amide:sc= 0.263 K(o=0.26,f=-6.9!) USER MOD Single : A 76 TYR OH : rot 165:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -160:sc= 0.692 (180deg=-1.78!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 146:sc= 1.09 (180deg=0.327) USER MOD Single : B 7 THR OG1 : rot -170:sc= 0 USER MOD Single : B 12 SER OG : rot 69:sc= 0.255 USER MOD Single : B 15 THR OG1 : rot -152:sc= 1.33 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 76:sc= 1.29 USER MOD Single : B 22 THR OG1 : rot -50:sc= 0.386 USER MOD Single : B 30 LYS NZ :NH3+ -109:sc= 2.3 (180deg=-1.27) USER MOD Single : B 32 SER OG : rot -93:sc= 0.931 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= -0.0227 K(o=-0.023,f=-0.72) USER MOD Single : B 45 GLN : amide:sc= -0.0476 X(o=-0.048,f=-0.25) USER MOD Single : B 51 LYS NZ :NH3+ 178:sc= 2.51 (180deg=2.35) USER MOD Single : B 59 LYS NZ :NH3+ 169:sc= 0.489 (180deg=0.368) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -112:sc= 2.11 (180deg=-0.574) USER MOD Single : B 62 SER OG : rot 77:sc= 0.407 USER MOD Single : B 66 ASN : amide:sc= -0.543 K(o=-0.54,f=-2!) USER MOD Single : B 67 GLN : amide:sc= -0.801 K(o=-0.8,f=-4.6) USER MOD Single : B 69 SER OG : rot 86:sc= 1.02 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 90 LYS NZ :NH3+ 174:sc= 1.15 (180deg=0.945) USER MOD Single : B 91 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00469) USER MOD Single : B 94 LYS NZ :NH3+ -170:sc= 0.514 (180deg=0.412) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 -13.762 -14.292 8.338 1.00 1.68 N ATOM 41 CA GLU A 4 -14.130 -13.244 7.402 1.00 1.70 C ATOM 42 C GLU A 4 -13.820 -13.729 5.983 1.00 1.99 C ATOM 43 O GLU A 4 -12.897 -14.523 5.807 1.00 2.09 O ATOM 44 CB GLU A 4 -13.402 -11.928 7.721 1.00 1.68 C ATOM 45 CG GLU A 4 -11.868 -11.999 7.625 1.00 2.25 C ATOM 46 CD GLU A 4 -11.201 -12.797 8.736 1.00 3.90 C ATOM 47 OE1 GLU A 4 -11.766 -12.856 9.848 1.00 4.49 O ATOM 48 OE2 GLU A 4 -10.095 -13.319 8.489 1.00 5.07 O ATOM 0 HA GLU A 4 -15.196 -13.035 7.488 1.00 1.70 H new ATOM 0 HB2 GLU A 4 -13.759 -11.157 7.038 1.00 1.68 H new ATOM 0 HB3 GLU A 4 -13.675 -11.613 8.728 1.00 1.68 H new ATOM 0 HG2 GLU A 4 -11.597 -12.440 6.666 1.00 2.25 H new ATOM 0 HG3 GLU A 4 -11.469 -10.985 7.634 1.00 2.25 H new ATOM 55 N PRO A 5 -14.571 -13.282 4.967 1.00 2.22 N ATOM 56 CA PRO A 5 -14.369 -13.707 3.598 1.00 2.54 C ATOM 57 C PRO A 5 -13.389 -12.736 2.937 1.00 2.45 C ATOM 58 O PRO A 5 -13.746 -12.091 1.955 1.00 2.68 O ATOM 59 CB PRO A 5 -15.773 -13.620 2.991 1.00 2.85 C ATOM 60 CG PRO A 5 -16.343 -12.362 3.653 1.00 2.72 C ATOM 61 CD PRO A 5 -15.691 -12.360 5.039 1.00 2.30 C ATOM 0 HA PRO A 5 -13.948 -14.705 3.479 1.00 2.54 H new ATOM 0 HB2 PRO A 5 -15.741 -13.528 1.905 1.00 2.85 H new ATOM 0 HB3 PRO A 5 -16.369 -14.504 3.219 1.00 2.85 H new ATOM 0 HG2 PRO A 5 -16.092 -11.463 3.090 1.00 2.72 H new ATOM 0 HG3 PRO A 5 -17.430 -12.402 3.721 1.00 2.72 H new ATOM 0 HD2 PRO A 5 -15.353 -11.359 5.308 1.00 2.30 H new ATOM 0 HD3 PRO A 5 -16.403 -12.672 5.803 1.00 2.30 H new ATOM 69 N LEU A 6 -12.164 -12.608 3.464 1.00 2.15 N ATOM 70 CA LEU A 6 -11.363 -11.450 3.073 1.00 1.76 C ATOM 71 C LEU A 6 -10.756 -11.622 1.675 1.00 1.68 C ATOM 72 O LEU A 6 -10.524 -12.740 1.212 1.00 2.17 O ATOM 73 CB LEU A 6 -10.291 -11.125 4.129 1.00 1.65 C ATOM 74 CG LEU A 6 -9.180 -12.175 4.342 1.00 1.79 C ATOM 75 CD1 LEU A 6 -8.065 -12.115 3.285 1.00 2.52 C ATOM 76 CD2 LEU A 6 -8.501 -11.902 5.687 1.00 2.33 C ATOM 0 H LEU A 6 -11.729 -13.253 4.124 1.00 2.15 H new ATOM 0 HA LEU A 6 -12.035 -10.593 3.021 1.00 1.76 H new ATOM 0 HB2 LEU A 6 -9.818 -10.182 3.854 1.00 1.65 H new ATOM 0 HB3 LEU A 6 -10.793 -10.963 5.083 1.00 1.65 H new ATOM 0 HG LEU A 6 -9.667 -13.149 4.285 1.00 1.79 H new ATOM 0 HD11 LEU A 6 -7.320 -12.881 3.498 1.00 2.52 H new ATOM 0 HD12 LEU A 6 -8.491 -12.288 2.297 1.00 2.52 H new ATOM 0 HD13 LEU A 6 -7.593 -11.133 3.309 1.00 2.52 H new ATOM 0 HD21 LEU A 6 -7.713 -12.636 5.852 1.00 2.33 H new ATOM 0 HD22 LEU A 6 -8.069 -10.901 5.680 1.00 2.33 H new ATOM 0 HD23 LEU A 6 -9.237 -11.974 6.487 1.00 2.33 H new ATOM 88 N THR A 7 -10.563 -10.493 0.991 1.00 1.20 N ATOM 89 CA THR A 7 -10.243 -10.399 -0.428 1.00 1.01 C ATOM 90 C THR A 7 -8.775 -9.987 -0.652 1.00 1.00 C ATOM 91 O THR A 7 -8.114 -9.470 0.249 1.00 1.20 O ATOM 92 CB THR A 7 -11.234 -9.411 -1.083 1.00 1.00 C ATOM 93 OG1 THR A 7 -12.496 -9.451 -0.440 1.00 1.41 O ATOM 94 CG2 THR A 7 -11.475 -9.744 -2.560 1.00 1.18 C ATOM 0 H THR A 7 -10.630 -9.578 1.436 1.00 1.20 H new ATOM 0 HA THR A 7 -10.349 -11.377 -0.897 1.00 1.01 H new ATOM 0 HB THR A 7 -10.781 -8.424 -0.987 1.00 1.00 H new ATOM 0 HG1 THR A 7 -12.503 -8.815 0.306 1.00 1.41 H new ATOM 0 HG21 THR A 7 -12.177 -9.027 -2.985 1.00 1.18 H new ATOM 0 HG22 THR A 7 -10.531 -9.693 -3.103 1.00 1.18 H new ATOM 0 HG23 THR A 7 -11.888 -10.749 -2.644 1.00 1.18 H new ATOM 102 N GLU A 8 -8.262 -10.202 -1.870 1.00 0.95 N ATOM 103 CA GLU A 8 -6.874 -9.960 -2.258 1.00 1.02 C ATOM 104 C GLU A 8 -6.389 -8.558 -1.871 1.00 0.96 C ATOM 105 O GLU A 8 -5.345 -8.390 -1.250 1.00 1.03 O ATOM 106 CB GLU A 8 -6.742 -10.154 -3.776 1.00 1.09 C ATOM 107 CG GLU A 8 -7.086 -11.578 -4.234 1.00 1.21 C ATOM 108 CD GLU A 8 -7.077 -11.654 -5.755 1.00 2.18 C ATOM 109 OE1 GLU A 8 -8.011 -11.065 -6.342 1.00 2.91 O ATOM 110 OE2 GLU A 8 -6.140 -12.277 -6.295 1.00 3.12 O ATOM 0 H GLU A 8 -8.827 -10.563 -2.639 1.00 0.95 H new ATOM 0 HA GLU A 8 -6.248 -10.672 -1.720 1.00 1.02 H new ATOM 0 HB2 GLU A 8 -7.397 -9.447 -4.285 1.00 1.09 H new ATOM 0 HB3 GLU A 8 -5.722 -9.918 -4.079 1.00 1.09 H new ATOM 0 HG2 GLU A 8 -6.366 -12.285 -3.822 1.00 1.21 H new ATOM 0 HG3 GLU A 8 -8.067 -11.864 -3.853 1.00 1.21 H new ATOM 117 N LEU A 9 -7.133 -7.526 -2.269 1.00 0.89 N ATOM 118 CA LEU A 9 -6.757 -6.151 -1.976 1.00 0.87 C ATOM 119 C LEU A 9 -6.697 -5.952 -0.459 1.00 0.91 C ATOM 120 O LEU A 9 -5.663 -5.548 0.081 1.00 0.99 O ATOM 121 CB LEU A 9 -7.746 -5.174 -2.627 1.00 0.88 C ATOM 122 CG LEU A 9 -7.596 -5.066 -4.154 1.00 0.93 C ATOM 123 CD1 LEU A 9 -7.867 -6.387 -4.895 1.00 1.96 C ATOM 124 CD2 LEU A 9 -8.447 -3.906 -4.688 1.00 2.32 C ATOM 0 H LEU A 9 -8.001 -7.621 -2.796 1.00 0.89 H new ATOM 0 HA LEU A 9 -5.771 -5.947 -2.393 1.00 0.87 H new ATOM 0 HB2 LEU A 9 -8.762 -5.490 -2.392 1.00 0.88 H new ATOM 0 HB3 LEU A 9 -7.610 -4.186 -2.187 1.00 0.88 H new ATOM 0 HG LEU A 9 -6.548 -4.847 -4.360 1.00 0.93 H new ATOM 0 HD11 LEU A 9 -7.743 -6.235 -5.967 1.00 1.96 H new ATOM 0 HD12 LEU A 9 -7.165 -7.147 -4.552 1.00 1.96 H new ATOM 0 HD13 LEU A 9 -8.886 -6.716 -4.691 1.00 1.96 H new ATOM 0 HD21 LEU A 9 -8.333 -3.839 -5.770 1.00 2.32 H new ATOM 0 HD22 LEU A 9 -9.495 -4.081 -4.444 1.00 2.32 H new ATOM 0 HD23 LEU A 9 -8.119 -2.973 -4.230 1.00 2.32 H new ATOM 136 N GLU A 10 -7.807 -6.232 0.232 1.00 0.89 N ATOM 137 CA GLU A 10 -7.869 -6.029 1.673 1.00 0.93 C ATOM 138 C GLU A 10 -6.807 -6.822 2.437 1.00 0.87 C ATOM 139 O GLU A 10 -6.313 -6.296 3.428 1.00 0.79 O ATOM 140 CB GLU A 10 -9.280 -6.169 2.244 1.00 1.00 C ATOM 141 CG GLU A 10 -9.888 -7.551 2.063 1.00 2.22 C ATOM 142 CD GLU A 10 -11.320 -7.604 2.567 1.00 2.96 C ATOM 143 OE1 GLU A 10 -11.660 -6.835 3.498 1.00 2.98 O ATOM 144 OE2 GLU A 10 -12.046 -8.444 1.993 1.00 4.51 O ATOM 0 H GLU A 10 -8.664 -6.596 -0.183 1.00 0.89 H new ATOM 0 HA GLU A 10 -7.609 -4.983 1.835 1.00 0.93 H new ATOM 0 HB2 GLU A 10 -9.255 -5.931 3.307 1.00 1.00 H new ATOM 0 HB3 GLU A 10 -9.928 -5.433 1.768 1.00 1.00 H new ATOM 0 HG2 GLU A 10 -9.863 -7.825 1.008 1.00 2.22 H new ATOM 0 HG3 GLU A 10 -9.286 -8.286 2.597 1.00 2.22 H new ATOM 151 N GLU A 11 -6.405 -8.012 1.968 1.00 1.02 N ATOM 152 CA GLU A 11 -5.242 -8.718 2.511 1.00 1.10 C ATOM 153 C GLU A 11 -4.067 -7.752 2.652 1.00 0.93 C ATOM 154 O GLU A 11 -3.541 -7.573 3.749 1.00 0.84 O ATOM 155 CB GLU A 11 -4.872 -9.933 1.635 1.00 1.55 C ATOM 156 CG GLU A 11 -3.660 -10.741 2.141 1.00 2.17 C ATOM 157 CD GLU A 11 -2.309 -10.147 1.732 1.00 3.88 C ATOM 158 OE1 GLU A 11 -1.934 -10.310 0.551 1.00 4.66 O ATOM 159 OE2 GLU A 11 -1.671 -9.524 2.604 1.00 4.99 O ATOM 0 H GLU A 11 -6.874 -8.506 1.209 1.00 1.02 H new ATOM 0 HA GLU A 11 -5.493 -9.100 3.500 1.00 1.10 H new ATOM 0 HB2 GLU A 11 -5.735 -10.596 1.573 1.00 1.55 H new ATOM 0 HB3 GLU A 11 -4.664 -9.585 0.623 1.00 1.55 H new ATOM 0 HG2 GLU A 11 -3.705 -10.804 3.228 1.00 2.17 H new ATOM 0 HG3 GLU A 11 -3.729 -11.760 1.760 1.00 2.17 H new ATOM 166 N SER A 12 -3.692 -7.076 1.560 1.00 0.98 N ATOM 167 CA SER A 12 -2.472 -6.275 1.558 1.00 0.98 C ATOM 168 C SER A 12 -2.599 -5.215 2.644 1.00 0.79 C ATOM 169 O SER A 12 -1.695 -4.949 3.437 1.00 0.84 O ATOM 170 CB SER A 12 -2.302 -5.606 0.191 1.00 1.11 C ATOM 171 OG SER A 12 -1.138 -4.805 0.180 1.00 2.59 O ATOM 0 H SER A 12 -4.210 -7.069 0.681 1.00 0.98 H new ATOM 0 HA SER A 12 -1.602 -6.903 1.750 1.00 0.98 H new ATOM 0 HB2 SER A 12 -2.237 -6.366 -0.588 1.00 1.11 H new ATOM 0 HB3 SER A 12 -3.175 -4.994 -0.033 1.00 1.11 H new ATOM 0 HG SER A 12 -0.407 -5.297 -0.249 1.00 2.59 H new ATOM 177 N ILE A 13 -3.782 -4.609 2.658 1.00 0.65 N ATOM 178 CA ILE A 13 -4.075 -3.480 3.495 1.00 0.51 C ATOM 179 C ILE A 13 -4.035 -3.913 4.961 1.00 0.47 C ATOM 180 O ILE A 13 -3.380 -3.256 5.773 1.00 0.50 O ATOM 181 CB ILE A 13 -5.418 -2.886 3.042 1.00 0.52 C ATOM 182 CG1 ILE A 13 -5.306 -2.445 1.573 1.00 0.73 C ATOM 183 CG2 ILE A 13 -5.867 -1.689 3.892 1.00 0.50 C ATOM 184 CD1 ILE A 13 -6.666 -2.203 0.959 1.00 0.55 C ATOM 0 H ILE A 13 -4.566 -4.902 2.076 1.00 0.65 H new ATOM 0 HA ILE A 13 -3.330 -2.690 3.401 1.00 0.51 H new ATOM 0 HB ILE A 13 -6.169 -3.666 3.165 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -4.711 -1.534 1.510 1.00 0.73 H new ATOM 0 HG13 ILE A 13 -4.779 -3.210 1.002 1.00 0.73 H new ATOM 0 HG21 ILE A 13 -6.822 -1.316 3.520 1.00 0.50 H new ATOM 0 HG22 ILE A 13 -5.979 -2.002 4.930 1.00 0.50 H new ATOM 0 HG23 ILE A 13 -5.120 -0.898 3.830 1.00 0.50 H new ATOM 0 HD11 ILE A 13 -6.547 -1.893 -0.079 1.00 0.55 H new ATOM 0 HD12 ILE A 13 -7.252 -3.121 0.998 1.00 0.55 H new ATOM 0 HD13 ILE A 13 -7.182 -1.420 1.514 1.00 0.55 H new ATOM 196 N GLU A 14 -4.722 -5.010 5.307 1.00 0.50 N ATOM 197 CA GLU A 14 -4.696 -5.512 6.667 1.00 0.54 C ATOM 198 C GLU A 14 -3.275 -5.907 7.073 1.00 0.56 C ATOM 199 O GLU A 14 -2.862 -5.634 8.195 1.00 0.57 O ATOM 200 CB GLU A 14 -5.770 -6.558 6.984 1.00 0.68 C ATOM 201 CG GLU A 14 -5.732 -7.924 6.314 1.00 1.28 C ATOM 202 CD GLU A 14 -6.199 -8.987 7.293 1.00 2.26 C ATOM 203 OE1 GLU A 14 -5.384 -9.463 8.116 1.00 2.97 O ATOM 204 OE2 GLU A 14 -7.420 -9.245 7.356 1.00 3.11 O ATOM 0 H GLU A 14 -5.295 -5.555 4.663 1.00 0.50 H new ATOM 0 HA GLU A 14 -4.988 -4.685 7.315 1.00 0.54 H new ATOM 0 HB2 GLU A 14 -5.749 -6.726 8.061 1.00 0.68 H new ATOM 0 HB3 GLU A 14 -6.736 -6.110 6.750 1.00 0.68 H new ATOM 0 HG2 GLU A 14 -6.370 -7.924 5.430 1.00 1.28 H new ATOM 0 HG3 GLU A 14 -4.720 -8.146 5.976 1.00 1.28 H new ATOM 211 N THR A 15 -2.503 -6.474 6.150 1.00 0.63 N ATOM 212 CA THR A 15 -1.116 -6.833 6.389 1.00 0.69 C ATOM 213 C THR A 15 -0.276 -5.590 6.709 1.00 0.66 C ATOM 214 O THR A 15 0.464 -5.602 7.689 1.00 0.72 O ATOM 215 CB THR A 15 -0.570 -7.695 5.241 1.00 0.77 C ATOM 216 OG1 THR A 15 -1.407 -8.828 5.140 1.00 0.86 O ATOM 217 CG2 THR A 15 0.848 -8.199 5.528 1.00 0.87 C ATOM 0 H THR A 15 -2.829 -6.697 5.210 1.00 0.63 H new ATOM 0 HA THR A 15 -1.051 -7.460 7.278 1.00 0.69 H new ATOM 0 HB THR A 15 -0.546 -7.095 4.332 1.00 0.77 H new ATOM 0 HG1 THR A 15 -1.212 -9.306 4.307 1.00 0.86 H new ATOM 0 HG21 THR A 15 1.195 -8.804 4.691 1.00 0.87 H new ATOM 0 HG22 THR A 15 1.516 -7.348 5.663 1.00 0.87 H new ATOM 0 HG23 THR A 15 0.843 -8.803 6.435 1.00 0.87 H new ATOM 225 N VAL A 16 -0.393 -4.484 5.961 1.00 0.63 N ATOM 226 CA VAL A 16 0.306 -3.255 6.325 1.00 0.65 C ATOM 227 C VAL A 16 -0.047 -2.832 7.759 1.00 0.62 C ATOM 228 O VAL A 16 0.827 -2.614 8.601 1.00 0.70 O ATOM 229 CB VAL A 16 -0.023 -2.134 5.326 1.00 0.68 C ATOM 230 CG1 VAL A 16 0.523 -0.808 5.851 1.00 0.73 C ATOM 231 CG2 VAL A 16 0.591 -2.400 3.950 1.00 0.76 C ATOM 0 H VAL A 16 -0.957 -4.420 5.114 1.00 0.63 H new ATOM 0 HA VAL A 16 1.379 -3.444 6.285 1.00 0.65 H new ATOM 0 HB VAL A 16 -1.107 -2.095 5.221 1.00 0.68 H new ATOM 0 HG11 VAL A 16 0.290 -0.013 5.143 1.00 0.73 H new ATOM 0 HG12 VAL A 16 0.065 -0.582 6.814 1.00 0.73 H new ATOM 0 HG13 VAL A 16 1.604 -0.882 5.971 1.00 0.73 H new ATOM 0 HG21 VAL A 16 0.335 -1.585 3.274 1.00 0.76 H new ATOM 0 HG22 VAL A 16 1.675 -2.468 4.042 1.00 0.76 H new ATOM 0 HG23 VAL A 16 0.201 -3.337 3.553 1.00 0.76 H new ATOM 241 N VAL A 17 -1.335 -2.669 8.048 1.00 0.56 N ATOM 242 CA VAL A 17 -1.731 -2.144 9.349 1.00 0.59 C ATOM 243 C VAL A 17 -1.368 -3.114 10.483 1.00 0.64 C ATOM 244 O VAL A 17 -0.931 -2.678 11.551 1.00 0.73 O ATOM 245 CB VAL A 17 -3.185 -1.658 9.338 1.00 0.55 C ATOM 246 CG1 VAL A 17 -3.381 -0.580 8.263 1.00 0.54 C ATOM 247 CG2 VAL A 17 -4.144 -2.816 9.096 1.00 0.51 C ATOM 0 H VAL A 17 -2.105 -2.887 7.416 1.00 0.56 H new ATOM 0 HA VAL A 17 -1.147 -1.249 9.563 1.00 0.59 H new ATOM 0 HB VAL A 17 -3.404 -1.228 10.315 1.00 0.55 H new ATOM 0 HG11 VAL A 17 -4.418 -0.245 8.268 1.00 0.54 H new ATOM 0 HG12 VAL A 17 -2.726 0.266 8.472 1.00 0.54 H new ATOM 0 HG13 VAL A 17 -3.138 -0.994 7.284 1.00 0.54 H new ATOM 0 HG21 VAL A 17 -5.169 -2.445 9.093 1.00 0.51 H new ATOM 0 HG22 VAL A 17 -3.922 -3.277 8.134 1.00 0.51 H new ATOM 0 HG23 VAL A 17 -4.028 -3.556 9.888 1.00 0.51 H new ATOM 257 N THR A 18 -1.483 -4.425 10.256 1.00 0.63 N ATOM 258 CA THR A 18 -1.043 -5.411 11.233 1.00 0.77 C ATOM 259 C THR A 18 0.477 -5.345 11.393 1.00 0.77 C ATOM 260 O THR A 18 0.978 -5.480 12.507 1.00 0.83 O ATOM 261 CB THR A 18 -1.568 -6.829 10.929 1.00 0.81 C ATOM 262 OG1 THR A 18 -1.931 -7.452 12.144 1.00 1.27 O ATOM 263 CG2 THR A 18 -0.545 -7.728 10.229 1.00 0.87 C ATOM 0 H THR A 18 -1.877 -4.823 9.404 1.00 0.63 H new ATOM 0 HA THR A 18 -1.486 -5.160 12.197 1.00 0.77 H new ATOM 0 HB THR A 18 -2.414 -6.707 10.253 1.00 0.81 H new ATOM 0 HG1 THR A 18 -2.268 -8.354 11.961 1.00 1.27 H new ATOM 0 HG21 THR A 18 -0.986 -8.708 10.048 1.00 0.87 H new ATOM 0 HG22 THR A 18 -0.256 -7.279 9.279 1.00 0.87 H new ATOM 0 HG23 THR A 18 0.336 -7.838 10.861 1.00 0.87 H new ATOM 271 N THR A 19 1.222 -5.103 10.309 1.00 0.77 N ATOM 272 CA THR A 19 2.664 -4.928 10.385 1.00 0.90 C ATOM 273 C THR A 19 2.968 -3.781 11.349 1.00 1.03 C ATOM 274 O THR A 19 3.736 -3.971 12.289 1.00 1.37 O ATOM 275 CB THR A 19 3.253 -4.721 8.984 1.00 1.05 C ATOM 276 OG1 THR A 19 3.105 -5.896 8.222 1.00 1.32 O ATOM 277 CG2 THR A 19 4.735 -4.365 8.996 1.00 1.30 C ATOM 0 H THR A 19 0.841 -5.025 9.366 1.00 0.77 H new ATOM 0 HA THR A 19 3.143 -5.825 10.778 1.00 0.90 H new ATOM 0 HB THR A 19 2.704 -3.885 8.552 1.00 1.05 H new ATOM 0 HG1 THR A 19 2.172 -5.985 7.936 1.00 1.32 H new ATOM 0 HG21 THR A 19 5.086 -4.233 7.972 1.00 1.30 H new ATOM 0 HG22 THR A 19 4.882 -3.439 9.552 1.00 1.30 H new ATOM 0 HG23 THR A 19 5.298 -5.168 9.472 1.00 1.30 H new ATOM 285 N PHE A 20 2.324 -2.620 11.177 1.00 0.93 N ATOM 286 CA PHE A 20 2.449 -1.540 12.157 1.00 1.15 C ATOM 287 C PHE A 20 2.059 -2.010 13.563 1.00 1.52 C ATOM 288 O PHE A 20 2.718 -1.665 14.539 1.00 1.77 O ATOM 289 CB PHE A 20 1.606 -0.320 11.759 1.00 1.06 C ATOM 290 CG PHE A 20 2.113 0.454 10.559 1.00 0.80 C ATOM 291 CD1 PHE A 20 3.389 1.045 10.602 1.00 2.21 C ATOM 292 CD2 PHE A 20 1.263 0.717 9.467 1.00 2.10 C ATOM 293 CE1 PHE A 20 3.815 1.873 9.553 1.00 2.53 C ATOM 294 CE2 PHE A 20 1.680 1.566 8.431 1.00 1.80 C ATOM 295 CZ PHE A 20 2.935 2.185 8.505 1.00 1.02 C ATOM 0 H PHE A 20 1.721 -2.408 10.382 1.00 0.93 H new ATOM 0 HA PHE A 20 3.498 -1.245 12.171 1.00 1.15 H new ATOM 0 HB2 PHE A 20 0.589 -0.654 11.552 1.00 1.06 H new ATOM 0 HB3 PHE A 20 1.552 0.357 12.611 1.00 1.06 H new ATOM 0 HD1 PHE A 20 4.041 0.861 11.443 1.00 2.21 H new ATOM 0 HD2 PHE A 20 0.284 0.262 9.427 1.00 2.10 H new ATOM 0 HE1 PHE A 20 4.819 2.270 9.552 1.00 2.53 H new ATOM 0 HE2 PHE A 20 1.037 1.742 7.581 1.00 1.80 H new ATOM 0 HZ PHE A 20 3.226 2.904 7.754 1.00 1.02 H new ATOM 305 N PHE A 21 0.968 -2.769 13.683 1.00 1.64 N ATOM 306 CA PHE A 21 0.517 -3.277 14.974 1.00 2.06 C ATOM 307 C PHE A 21 1.546 -4.218 15.614 1.00 2.23 C ATOM 308 O PHE A 21 1.687 -4.240 16.839 1.00 2.89 O ATOM 309 CB PHE A 21 -0.847 -3.963 14.843 1.00 2.07 C ATOM 310 CG PHE A 21 -1.484 -4.287 16.179 1.00 2.35 C ATOM 311 CD1 PHE A 21 -2.018 -3.252 16.970 1.00 3.28 C ATOM 312 CD2 PHE A 21 -1.457 -5.604 16.674 1.00 2.87 C ATOM 313 CE1 PHE A 21 -2.532 -3.536 18.248 1.00 3.61 C ATOM 314 CE2 PHE A 21 -1.973 -5.886 17.951 1.00 3.36 C ATOM 315 CZ PHE A 21 -2.511 -4.853 18.739 1.00 3.30 C ATOM 0 H PHE A 21 0.380 -3.045 12.896 1.00 1.64 H new ATOM 0 HA PHE A 21 0.409 -2.420 15.639 1.00 2.06 H new ATOM 0 HB2 PHE A 21 -1.518 -3.318 14.275 1.00 2.07 H new ATOM 0 HB3 PHE A 21 -0.730 -4.883 14.271 1.00 2.07 H new ATOM 0 HD1 PHE A 21 -2.033 -2.239 16.595 1.00 3.28 H new ATOM 0 HD2 PHE A 21 -1.040 -6.398 16.073 1.00 2.87 H new ATOM 0 HE1 PHE A 21 -2.943 -2.741 18.853 1.00 3.61 H new ATOM 0 HE2 PHE A 21 -1.956 -6.898 18.328 1.00 3.36 H new ATOM 0 HZ PHE A 21 -2.907 -5.071 19.720 1.00 3.30 H new ATOM 325 N THR A 22 2.306 -4.962 14.812 1.00 1.83 N ATOM 326 CA THR A 22 3.223 -5.983 15.296 1.00 2.15 C ATOM 327 C THR A 22 4.518 -5.307 15.743 1.00 3.14 C ATOM 328 O THR A 22 5.027 -4.411 15.075 1.00 4.12 O ATOM 329 CB THR A 22 3.472 -7.003 14.175 1.00 1.91 C ATOM 330 OG1 THR A 22 2.236 -7.571 13.799 1.00 2.63 O ATOM 331 CG2 THR A 22 4.396 -8.141 14.617 1.00 2.46 C ATOM 0 H THR A 22 2.299 -4.869 13.796 1.00 1.83 H new ATOM 0 HA THR A 22 2.802 -6.515 16.149 1.00 2.15 H new ATOM 0 HB THR A 22 3.949 -6.474 13.350 1.00 1.91 H new ATOM 0 HG1 THR A 22 1.732 -6.928 13.257 1.00 2.63 H new ATOM 0 HG21 THR A 22 4.540 -8.835 13.789 1.00 2.46 H new ATOM 0 HG22 THR A 22 5.360 -7.731 14.919 1.00 2.46 H new ATOM 0 HG23 THR A 22 3.947 -8.669 15.458 1.00 2.46 H new ATOM 478 N ASP A 31 1.842 4.963 15.158 1.00 1.21 N ATOM 479 CA ASP A 31 0.988 4.890 13.981 1.00 1.22 C ATOM 480 C ASP A 31 1.830 4.575 12.748 1.00 1.43 C ATOM 481 O ASP A 31 1.443 3.743 11.930 1.00 2.04 O ATOM 482 CB ASP A 31 0.180 6.185 13.795 1.00 1.58 C ATOM 483 CG ASP A 31 -1.171 6.096 14.484 1.00 2.35 C ATOM 484 OD1 ASP A 31 -1.980 5.246 14.050 1.00 2.90 O ATOM 485 OD2 ASP A 31 -1.365 6.827 15.479 1.00 3.57 O ATOM 0 HA ASP A 31 0.268 4.084 14.123 1.00 1.22 H new ATOM 0 HB2 ASP A 31 0.742 7.028 14.198 1.00 1.58 H new ATOM 0 HB3 ASP A 31 0.036 6.377 12.732 1.00 1.58 H new ATOM 490 N SER A 32 2.987 5.227 12.637 1.00 1.24 N ATOM 491 CA SER A 32 4.099 4.794 11.812 1.00 1.21 C ATOM 492 C SER A 32 5.378 5.288 12.495 1.00 1.22 C ATOM 493 O SER A 32 5.390 5.403 13.720 1.00 1.30 O ATOM 494 CB SER A 32 3.924 5.277 10.369 1.00 1.21 C ATOM 495 OG SER A 32 4.947 4.778 9.529 1.00 1.52 O ATOM 0 H SER A 32 3.175 6.096 13.136 1.00 1.24 H new ATOM 0 HA SER A 32 4.152 3.709 11.728 1.00 1.21 H new ATOM 0 HB2 SER A 32 2.953 4.956 9.992 1.00 1.21 H new ATOM 0 HB3 SER A 32 3.931 6.367 10.345 1.00 1.21 H new ATOM 0 HG SER A 32 4.687 3.899 9.184 1.00 1.52 H new ATOM 501 N LEU A 33 6.429 5.536 11.714 1.00 1.24 N ATOM 502 CA LEU A 33 7.800 5.707 12.161 1.00 1.14 C ATOM 503 C LEU A 33 8.272 7.137 11.936 1.00 1.01 C ATOM 504 O LEU A 33 7.603 7.962 11.314 1.00 1.08 O ATOM 505 CB LEU A 33 8.711 4.774 11.334 1.00 1.29 C ATOM 506 CG LEU A 33 8.701 3.277 11.681 1.00 1.22 C ATOM 507 CD1 LEU A 33 9.216 3.003 13.098 1.00 1.47 C ATOM 508 CD2 LEU A 33 7.334 2.630 11.477 1.00 1.56 C ATOM 0 H LEU A 33 6.336 5.627 10.702 1.00 1.24 H new ATOM 0 HA LEU A 33 7.847 5.474 13.225 1.00 1.14 H new ATOM 0 HB2 LEU A 33 8.433 4.877 10.285 1.00 1.29 H new ATOM 0 HB3 LEU A 33 9.735 5.134 11.430 1.00 1.29 H new ATOM 0 HG LEU A 33 9.391 2.814 10.976 1.00 1.22 H new ATOM 0 HD11 LEU A 33 9.189 1.931 13.294 1.00 1.47 H new ATOM 0 HD12 LEU A 33 10.241 3.363 13.188 1.00 1.47 H new ATOM 0 HD13 LEU A 33 8.585 3.520 13.821 1.00 1.47 H new ATOM 0 HD21 LEU A 33 7.389 1.573 11.738 1.00 1.56 H new ATOM 0 HD22 LEU A 33 6.599 3.123 12.114 1.00 1.56 H new ATOM 0 HD23 LEU A 33 7.036 2.731 10.433 1.00 1.56 H new ATOM 520 N SER A 34 9.495 7.385 12.388 1.00 0.92 N ATOM 521 CA SER A 34 10.297 8.507 11.957 1.00 0.73 C ATOM 522 C SER A 34 10.727 8.297 10.498 1.00 0.65 C ATOM 523 O SER A 34 10.905 7.163 10.053 1.00 0.70 O ATOM 524 CB SER A 34 11.497 8.646 12.901 1.00 0.80 C ATOM 525 OG SER A 34 11.058 8.571 14.243 1.00 1.61 O ATOM 0 H SER A 34 9.960 6.796 13.078 1.00 0.92 H new ATOM 0 HA SER A 34 9.725 9.434 11.998 1.00 0.73 H new ATOM 0 HB2 SER A 34 12.223 7.858 12.701 1.00 0.80 H new ATOM 0 HB3 SER A 34 12.002 9.596 12.726 1.00 0.80 H new ATOM 0 HG SER A 34 11.827 8.658 14.844 1.00 1.61 H new ATOM 531 N VAL A 35 10.869 9.376 9.725 1.00 0.62 N ATOM 532 CA VAL A 35 10.916 9.276 8.271 1.00 0.61 C ATOM 533 C VAL A 35 12.193 8.578 7.779 1.00 0.60 C ATOM 534 O VAL A 35 12.144 7.671 6.946 1.00 0.60 O ATOM 535 CB VAL A 35 10.767 10.684 7.686 1.00 0.71 C ATOM 536 CG1 VAL A 35 10.755 10.686 6.166 1.00 0.82 C ATOM 537 CG2 VAL A 35 9.519 11.423 8.177 1.00 0.81 C ATOM 0 H VAL A 35 10.953 10.327 10.085 1.00 0.62 H new ATOM 0 HA VAL A 35 10.093 8.651 7.925 1.00 0.61 H new ATOM 0 HB VAL A 35 11.649 11.213 8.047 1.00 0.71 H new ATOM 0 HG11 VAL A 35 10.647 11.709 5.804 1.00 0.82 H new ATOM 0 HG12 VAL A 35 11.690 10.266 5.794 1.00 0.82 H new ATOM 0 HG13 VAL A 35 9.919 10.085 5.808 1.00 0.82 H new ATOM 0 HG21 VAL A 35 9.479 12.412 7.722 1.00 0.81 H new ATOM 0 HG22 VAL A 35 8.629 10.859 7.898 1.00 0.81 H new ATOM 0 HG23 VAL A 35 9.559 11.524 9.262 1.00 0.81 H new ATOM 547 N ASN A 36 13.356 9.008 8.273 1.00 0.68 N ATOM 548 CA ASN A 36 14.631 8.423 7.865 1.00 0.76 C ATOM 549 C ASN A 36 14.650 6.934 8.224 1.00 0.73 C ATOM 550 O ASN A 36 14.944 6.093 7.378 1.00 0.75 O ATOM 551 CB ASN A 36 15.821 9.169 8.490 1.00 0.97 C ATOM 552 CG ASN A 36 17.048 9.092 7.578 1.00 1.97 C ATOM 553 OD1 ASN A 36 17.597 8.019 7.348 1.00 2.70 O ATOM 554 ND2 ASN A 36 17.488 10.210 7.004 1.00 2.42 N ATOM 0 H ASN A 36 13.439 9.760 8.957 1.00 0.68 H new ATOM 0 HA ASN A 36 14.732 8.524 6.784 1.00 0.76 H new ATOM 0 HB2 ASN A 36 15.554 10.212 8.661 1.00 0.97 H new ATOM 0 HB3 ASN A 36 16.057 8.737 9.463 1.00 0.97 H new ATOM 0 HD21 ASN A 36 18.286 10.178 6.369 1.00 2.42 H new ATOM 0 HD22 ASN A 36 17.027 11.099 7.199 1.00 2.42 H new ATOM 561 N GLU A 37 14.276 6.618 9.470 1.00 0.75 N ATOM 562 CA GLU A 37 14.165 5.246 9.947 1.00 0.79 C ATOM 563 C GLU A 37 13.257 4.445 9.012 1.00 0.75 C ATOM 564 O GLU A 37 13.661 3.396 8.525 1.00 0.84 O ATOM 565 CB GLU A 37 13.692 5.237 11.411 1.00 0.93 C ATOM 566 CG GLU A 37 13.538 3.832 12.018 1.00 1.34 C ATOM 567 CD GLU A 37 14.806 2.981 11.986 1.00 2.62 C ATOM 568 OE1 GLU A 37 15.902 3.579 11.995 1.00 3.54 O ATOM 569 OE2 GLU A 37 14.656 1.740 11.958 1.00 3.62 O ATOM 0 H GLU A 37 14.042 7.316 10.175 1.00 0.75 H new ATOM 0 HA GLU A 37 15.140 4.759 9.932 1.00 0.79 H new ATOM 0 HB2 GLU A 37 14.402 5.804 12.013 1.00 0.93 H new ATOM 0 HB3 GLU A 37 12.735 5.754 11.474 1.00 0.93 H new ATOM 0 HG2 GLU A 37 13.210 3.932 13.053 1.00 1.34 H new ATOM 0 HG3 GLU A 37 12.749 3.304 11.483 1.00 1.34 H new ATOM 576 N PHE A 38 12.061 4.957 8.693 1.00 0.69 N ATOM 577 CA PHE A 38 11.189 4.363 7.681 1.00 0.67 C ATOM 578 C PHE A 38 11.962 4.004 6.405 1.00 0.65 C ATOM 579 O PHE A 38 11.864 2.869 5.932 1.00 0.72 O ATOM 580 CB PHE A 38 9.995 5.274 7.374 1.00 0.63 C ATOM 581 CG PHE A 38 9.426 5.102 5.977 1.00 0.66 C ATOM 582 CD1 PHE A 38 8.646 3.973 5.677 1.00 1.99 C ATOM 583 CD2 PHE A 38 9.833 5.960 4.935 1.00 2.23 C ATOM 584 CE1 PHE A 38 8.165 3.776 4.372 1.00 1.95 C ATOM 585 CE2 PHE A 38 9.405 5.724 3.619 1.00 2.42 C ATOM 586 CZ PHE A 38 8.538 4.655 3.342 1.00 1.09 C ATOM 0 H PHE A 38 11.675 5.793 9.131 1.00 0.69 H new ATOM 0 HA PHE A 38 10.799 3.432 8.093 1.00 0.67 H new ATOM 0 HB2 PHE A 38 9.207 5.080 8.102 1.00 0.63 H new ATOM 0 HB3 PHE A 38 10.301 6.312 7.505 1.00 0.63 H new ATOM 0 HD1 PHE A 38 8.416 3.255 6.451 1.00 1.99 H new ATOM 0 HD2 PHE A 38 10.476 6.801 5.150 1.00 2.23 H new ATOM 0 HE1 PHE A 38 7.507 2.946 4.160 1.00 1.95 H new ATOM 0 HE2 PHE A 38 9.743 6.366 2.819 1.00 2.42 H new ATOM 0 HZ PHE A 38 8.159 4.509 2.341 1.00 1.09 H new ATOM 596 N LYS A 39 12.730 4.949 5.847 1.00 0.64 N ATOM 597 CA LYS A 39 13.523 4.662 4.654 1.00 0.72 C ATOM 598 C LYS A 39 14.419 3.438 4.892 1.00 0.85 C ATOM 599 O LYS A 39 14.505 2.551 4.038 1.00 0.86 O ATOM 600 CB LYS A 39 14.207 5.929 4.086 1.00 0.77 C ATOM 601 CG LYS A 39 15.678 5.830 3.638 1.00 1.55 C ATOM 602 CD LYS A 39 16.606 6.183 4.805 1.00 2.57 C ATOM 603 CE LYS A 39 18.093 6.209 4.431 1.00 3.30 C ATOM 604 NZ LYS A 39 18.943 6.439 5.621 1.00 4.40 N ATOM 0 H LYS A 39 12.816 5.903 6.199 1.00 0.64 H new ATOM 0 HA LYS A 39 12.868 4.367 3.834 1.00 0.72 H new ATOM 0 HB2 LYS A 39 13.622 6.267 3.231 1.00 0.77 H new ATOM 0 HB3 LYS A 39 14.143 6.709 4.845 1.00 0.77 H new ATOM 0 HG2 LYS A 39 15.892 4.821 3.285 1.00 1.55 H new ATOM 0 HG3 LYS A 39 15.858 6.506 2.802 1.00 1.55 H new ATOM 0 HD2 LYS A 39 16.323 7.159 5.199 1.00 2.57 H new ATOM 0 HD3 LYS A 39 16.456 5.460 5.607 1.00 2.57 H new ATOM 0 HE2 LYS A 39 18.369 5.265 3.962 1.00 3.30 H new ATOM 0 HE3 LYS A 39 18.272 6.994 3.696 1.00 3.30 H new ATOM 0 HZ1 LYS A 39 19.670 7.148 5.396 1.00 4.40 H new ATOM 0 HZ2 LYS A 39 18.355 6.783 6.406 1.00 4.40 H new ATOM 0 HZ3 LYS A 39 19.402 5.548 5.897 1.00 4.40 H new ATOM 618 N GLU A 40 15.043 3.348 6.068 1.00 1.04 N ATOM 619 CA GLU A 40 15.855 2.190 6.404 1.00 1.29 C ATOM 620 C GLU A 40 15.019 0.924 6.619 1.00 1.32 C ATOM 621 O GLU A 40 15.481 -0.159 6.258 1.00 1.51 O ATOM 622 CB GLU A 40 16.832 2.493 7.548 1.00 1.49 C ATOM 623 CG GLU A 40 17.688 3.706 7.150 1.00 1.53 C ATOM 624 CD GLU A 40 19.098 3.717 7.717 1.00 2.05 C ATOM 625 OE1 GLU A 40 19.452 2.804 8.488 1.00 3.09 O ATOM 626 OE2 GLU A 40 19.809 4.657 7.293 1.00 2.08 O ATOM 0 H GLU A 40 14.999 4.061 6.796 1.00 1.04 H new ATOM 0 HA GLU A 40 16.475 1.967 5.536 1.00 1.29 H new ATOM 0 HB2 GLU A 40 16.285 2.701 8.468 1.00 1.49 H new ATOM 0 HB3 GLU A 40 17.467 1.629 7.743 1.00 1.49 H new ATOM 0 HG2 GLU A 40 17.751 3.745 6.063 1.00 1.53 H new ATOM 0 HG3 GLU A 40 17.177 4.613 7.473 1.00 1.53 H new ATOM 633 N LEU A 41 13.803 1.017 7.167 1.00 1.23 N ATOM 634 CA LEU A 41 12.900 -0.129 7.217 1.00 1.29 C ATOM 635 C LEU A 41 12.693 -0.655 5.802 1.00 1.00 C ATOM 636 O LEU A 41 13.004 -1.810 5.527 1.00 1.05 O ATOM 637 CB LEU A 41 11.527 0.191 7.839 1.00 1.47 C ATOM 638 CG LEU A 41 11.451 0.007 9.360 1.00 1.87 C ATOM 639 CD1 LEU A 41 12.112 1.177 10.080 1.00 2.48 C ATOM 640 CD2 LEU A 41 9.984 -0.083 9.798 1.00 3.73 C ATOM 0 H LEU A 41 13.426 1.871 7.579 1.00 1.23 H new ATOM 0 HA LEU A 41 13.370 -0.873 7.860 1.00 1.29 H new ATOM 0 HB2 LEU A 41 11.266 1.222 7.598 1.00 1.47 H new ATOM 0 HB3 LEU A 41 10.775 -0.445 7.372 1.00 1.47 H new ATOM 0 HG LEU A 41 11.976 -0.912 9.619 1.00 1.87 H new ATOM 0 HD11 LEU A 41 12.046 1.025 11.157 1.00 2.48 H new ATOM 0 HD12 LEU A 41 13.160 1.240 9.786 1.00 2.48 H new ATOM 0 HD13 LEU A 41 11.603 2.103 9.812 1.00 2.48 H new ATOM 0 HD21 LEU A 41 9.934 -0.214 10.879 1.00 3.73 H new ATOM 0 HD22 LEU A 41 9.464 0.834 9.519 1.00 3.73 H new ATOM 0 HD23 LEU A 41 9.509 -0.933 9.308 1.00 3.73 H new ATOM 652 N VAL A 42 12.166 0.172 4.895 1.00 0.77 N ATOM 653 CA VAL A 42 11.818 -0.337 3.574 1.00 0.63 C ATOM 654 C VAL A 42 13.077 -0.886 2.893 1.00 0.68 C ATOM 655 O VAL A 42 13.038 -1.981 2.342 1.00 0.70 O ATOM 656 CB VAL A 42 11.058 0.677 2.699 1.00 0.53 C ATOM 657 CG1 VAL A 42 9.673 0.953 3.293 1.00 1.47 C ATOM 658 CG2 VAL A 42 11.789 2.002 2.489 1.00 1.33 C ATOM 0 H VAL A 42 11.977 1.163 5.046 1.00 0.77 H new ATOM 0 HA VAL A 42 11.107 -1.152 3.707 1.00 0.63 H new ATOM 0 HB VAL A 42 10.976 0.210 1.717 1.00 0.53 H new ATOM 0 HG11 VAL A 42 9.145 1.671 2.666 1.00 1.47 H new ATOM 0 HG12 VAL A 42 9.105 0.024 3.338 1.00 1.47 H new ATOM 0 HG13 VAL A 42 9.783 1.360 4.298 1.00 1.47 H new ATOM 0 HG21 VAL A 42 11.183 2.656 1.862 1.00 1.33 H new ATOM 0 HG22 VAL A 42 11.960 2.480 3.454 1.00 1.33 H new ATOM 0 HG23 VAL A 42 12.746 1.816 2.001 1.00 1.33 H new ATOM 668 N THR A 43 14.209 -0.174 2.970 1.00 0.82 N ATOM 669 CA THR A 43 15.424 -0.651 2.317 1.00 0.98 C ATOM 670 C THR A 43 15.856 -2.017 2.875 1.00 1.09 C ATOM 671 O THR A 43 16.224 -2.900 2.106 1.00 1.22 O ATOM 672 CB THR A 43 16.532 0.422 2.324 1.00 1.12 C ATOM 673 OG1 THR A 43 17.257 0.378 1.115 1.00 1.36 O ATOM 674 CG2 THR A 43 17.533 0.293 3.473 1.00 1.51 C ATOM 0 H THR A 43 14.304 0.712 3.466 1.00 0.82 H new ATOM 0 HA THR A 43 15.208 -0.824 1.263 1.00 0.98 H new ATOM 0 HB THR A 43 16.007 1.368 2.453 1.00 1.12 H new ATOM 0 HG1 THR A 43 17.957 1.064 1.128 1.00 1.36 H new ATOM 0 HG21 THR A 43 18.276 1.087 3.399 1.00 1.51 H new ATOM 0 HG22 THR A 43 17.007 0.375 4.424 1.00 1.51 H new ATOM 0 HG23 THR A 43 18.030 -0.675 3.415 1.00 1.51 H new ATOM 682 N GLN A 44 15.794 -2.212 4.200 1.00 1.11 N ATOM 683 CA GLN A 44 16.116 -3.505 4.800 1.00 1.23 C ATOM 684 C GLN A 44 15.118 -4.573 4.346 1.00 1.12 C ATOM 685 O GLN A 44 15.514 -5.683 3.998 1.00 1.21 O ATOM 686 CB GLN A 44 16.134 -3.392 6.329 1.00 1.39 C ATOM 687 CG GLN A 44 17.439 -2.762 6.824 1.00 1.57 C ATOM 688 CD GLN A 44 17.306 -2.311 8.272 1.00 2.49 C ATOM 689 OE1 GLN A 44 17.472 -3.083 9.216 1.00 3.15 O ATOM 690 NE2 GLN A 44 16.904 -1.064 8.473 1.00 3.60 N ATOM 0 H GLN A 44 15.525 -1.492 4.870 1.00 1.11 H new ATOM 0 HA GLN A 44 17.109 -3.806 4.465 1.00 1.23 H new ATOM 0 HB2 GLN A 44 15.288 -2.790 6.661 1.00 1.39 H new ATOM 0 HB3 GLN A 44 16.015 -4.381 6.771 1.00 1.39 H new ATOM 0 HG2 GLN A 44 18.252 -3.482 6.736 1.00 1.57 H new ATOM 0 HG3 GLN A 44 17.698 -1.910 6.195 1.00 1.57 H new ATOM 0 HE21 GLN A 44 16.771 -0.437 7.680 1.00 3.60 H new ATOM 0 HE22 GLN A 44 16.727 -0.732 9.421 1.00 3.60 H new ATOM 699 N GLN A 45 13.826 -4.245 4.367 1.00 0.97 N ATOM 700 CA GLN A 45 12.762 -5.186 4.059 1.00 0.94 C ATOM 701 C GLN A 45 12.745 -5.564 2.574 1.00 0.91 C ATOM 702 O GLN A 45 12.283 -6.654 2.240 1.00 1.00 O ATOM 703 CB GLN A 45 11.408 -4.603 4.470 1.00 0.90 C ATOM 704 CG GLN A 45 11.075 -4.760 5.965 1.00 1.05 C ATOM 705 CD GLN A 45 11.974 -4.060 6.982 1.00 1.18 C ATOM 706 OE1 GLN A 45 13.140 -4.399 7.159 1.00 1.81 O ATOM 707 NE2 GLN A 45 11.410 -3.129 7.748 1.00 2.50 N ATOM 0 H GLN A 45 13.491 -3.310 4.601 1.00 0.97 H new ATOM 0 HA GLN A 45 12.953 -6.096 4.628 1.00 0.94 H new ATOM 0 HB2 GLN A 45 11.390 -3.543 4.216 1.00 0.90 H new ATOM 0 HB3 GLN A 45 10.626 -5.085 3.883 1.00 0.90 H new ATOM 0 HG2 GLN A 45 10.057 -4.402 6.119 1.00 1.05 H new ATOM 0 HG3 GLN A 45 11.077 -5.825 6.196 1.00 1.05 H new ATOM 0 HE21 GLN A 45 10.440 -2.857 7.589 1.00 2.50 H new ATOM 0 HE22 GLN A 45 11.948 -2.687 8.494 1.00 2.50 H new ATOM 716 N LEU A 46 13.211 -4.668 1.694 1.00 0.86 N ATOM 717 CA LEU A 46 13.283 -4.875 0.253 1.00 0.88 C ATOM 718 C LEU A 46 14.741 -5.042 -0.206 1.00 0.94 C ATOM 719 O LEU A 46 15.255 -4.176 -0.913 1.00 1.10 O ATOM 720 CB LEU A 46 12.623 -3.694 -0.491 1.00 0.90 C ATOM 721 CG LEU A 46 11.088 -3.662 -0.411 1.00 0.99 C ATOM 722 CD1 LEU A 46 10.531 -3.019 0.864 1.00 1.42 C ATOM 723 CD2 LEU A 46 10.528 -2.897 -1.614 1.00 1.38 C ATOM 0 H LEU A 46 13.558 -3.753 1.981 1.00 0.86 H new ATOM 0 HA LEU A 46 12.742 -5.791 0.014 1.00 0.88 H new ATOM 0 HB2 LEU A 46 13.014 -2.762 -0.084 1.00 0.90 H new ATOM 0 HB3 LEU A 46 12.918 -3.732 -1.540 1.00 0.90 H new ATOM 0 HG LEU A 46 10.775 -4.706 -0.404 1.00 0.99 H new ATOM 0 HD11 LEU A 46 9.442 -3.039 0.836 1.00 1.42 H new ATOM 0 HD12 LEU A 46 10.882 -3.574 1.734 1.00 1.42 H new ATOM 0 HD13 LEU A 46 10.873 -1.986 0.930 1.00 1.42 H new ATOM 0 HD21 LEU A 46 9.440 -2.875 -1.557 1.00 1.38 H new ATOM 0 HD22 LEU A 46 10.913 -1.877 -1.608 1.00 1.38 H new ATOM 0 HD23 LEU A 46 10.833 -3.394 -2.535 1.00 1.38 H new ATOM 735 N PRO A 47 15.408 -6.173 0.079 1.00 0.96 N ATOM 736 CA PRO A 47 16.733 -6.449 -0.462 1.00 1.03 C ATOM 737 C PRO A 47 16.671 -6.914 -1.926 1.00 1.00 C ATOM 738 O PRO A 47 17.707 -7.243 -2.496 1.00 1.08 O ATOM 739 CB PRO A 47 17.293 -7.552 0.436 1.00 1.19 C ATOM 740 CG PRO A 47 16.045 -8.365 0.767 1.00 1.22 C ATOM 741 CD PRO A 47 14.960 -7.293 0.896 1.00 1.04 C ATOM 0 HA PRO A 47 17.357 -5.555 -0.469 1.00 1.03 H new ATOM 0 HB2 PRO A 47 18.045 -8.152 -0.077 1.00 1.19 H new ATOM 0 HB3 PRO A 47 17.764 -7.147 1.332 1.00 1.19 H new ATOM 0 HG2 PRO A 47 15.811 -9.083 -0.019 1.00 1.22 H new ATOM 0 HG3 PRO A 47 16.165 -8.931 1.691 1.00 1.22 H new ATOM 0 HD2 PRO A 47 13.997 -7.668 0.550 1.00 1.04 H new ATOM 0 HD3 PRO A 47 14.830 -6.991 1.935 1.00 1.04 H new ATOM 749 N HIS A 48 15.473 -6.964 -2.531 1.00 1.23 N ATOM 750 CA HIS A 48 15.233 -7.453 -3.884 1.00 1.38 C ATOM 751 C HIS A 48 16.265 -6.924 -4.889 1.00 1.50 C ATOM 752 O HIS A 48 16.770 -7.697 -5.702 1.00 2.50 O ATOM 753 CB HIS A 48 13.810 -7.069 -4.307 1.00 1.43 C ATOM 754 CG HIS A 48 13.448 -7.563 -5.685 1.00 1.80 C ATOM 755 ND1 HIS A 48 13.462 -6.817 -6.841 1.00 2.98 N ATOM 756 CD2 HIS A 48 13.119 -8.848 -6.026 1.00 3.07 C ATOM 757 CE1 HIS A 48 13.127 -7.634 -7.854 1.00 3.70 C ATOM 758 NE2 HIS A 48 12.902 -8.880 -7.409 1.00 3.55 N ATOM 0 H HIS A 48 14.619 -6.652 -2.068 1.00 1.23 H new ATOM 0 HA HIS A 48 15.339 -8.538 -3.880 1.00 1.38 H new ATOM 0 HB2 HIS A 48 13.101 -7.474 -3.585 1.00 1.43 H new ATOM 0 HB3 HIS A 48 13.709 -5.984 -4.279 1.00 1.43 H new ATOM 0 HD2 HIS A 48 13.041 -9.686 -5.350 1.00 3.07 H new ATOM 0 HE1 HIS A 48 13.049 -7.329 -8.887 1.00 3.70 H new ATOM 0 HE2 HIS A 48 12.628 -9.689 -7.967 1.00 3.55 H new ATOM 766 N LEU A 49 16.561 -5.615 -4.851 1.00 1.43 N ATOM 767 CA LEU A 49 17.649 -5.040 -5.642 1.00 1.48 C ATOM 768 C LEU A 49 18.017 -3.621 -5.189 1.00 1.42 C ATOM 769 O LEU A 49 19.195 -3.334 -5.005 1.00 1.59 O ATOM 770 CB LEU A 49 17.331 -5.072 -7.152 1.00 1.51 C ATOM 771 CG LEU A 49 18.493 -5.633 -7.989 1.00 1.85 C ATOM 772 CD1 LEU A 49 18.053 -5.745 -9.452 1.00 2.11 C ATOM 773 CD2 LEU A 49 19.744 -4.749 -7.906 1.00 2.75 C ATOM 0 H LEU A 49 16.058 -4.938 -4.278 1.00 1.43 H new ATOM 0 HA LEU A 49 18.522 -5.669 -5.467 1.00 1.48 H new ATOM 0 HB2 LEU A 49 16.441 -5.679 -7.319 1.00 1.51 H new ATOM 0 HB3 LEU A 49 17.097 -4.063 -7.492 1.00 1.51 H new ATOM 0 HG LEU A 49 18.750 -6.613 -7.586 1.00 1.85 H new ATOM 0 HD11 LEU A 49 18.874 -6.142 -10.049 1.00 2.11 H new ATOM 0 HD12 LEU A 49 17.195 -6.414 -9.524 1.00 2.11 H new ATOM 0 HD13 LEU A 49 17.777 -4.759 -9.825 1.00 2.11 H new ATOM 0 HD21 LEU A 49 20.538 -5.184 -8.512 1.00 2.75 H new ATOM 0 HD22 LEU A 49 19.510 -3.751 -8.277 1.00 2.75 H new ATOM 0 HD23 LEU A 49 20.074 -4.682 -6.869 1.00 2.75 H new ATOM 785 N LEU A 50 17.021 -2.735 -5.043 1.00 1.29 N ATOM 786 CA LEU A 50 17.202 -1.302 -4.799 1.00 1.25 C ATOM 787 C LEU A 50 17.900 -0.672 -6.006 1.00 1.24 C ATOM 788 O LEU A 50 19.079 -0.333 -5.994 1.00 1.51 O ATOM 789 CB LEU A 50 17.872 -1.040 -3.447 1.00 1.44 C ATOM 790 CG LEU A 50 17.025 -1.642 -2.312 1.00 1.71 C ATOM 791 CD1 LEU A 50 17.935 -2.012 -1.146 1.00 3.55 C ATOM 792 CD2 LEU A 50 15.912 -0.685 -1.874 1.00 2.74 C ATOM 0 H LEU A 50 16.039 -3.007 -5.093 1.00 1.29 H new ATOM 0 HA LEU A 50 16.236 -0.806 -4.708 1.00 1.25 H new ATOM 0 HB2 LEU A 50 18.871 -1.476 -3.437 1.00 1.44 H new ATOM 0 HB3 LEU A 50 17.991 0.032 -3.293 1.00 1.44 H new ATOM 0 HG LEU A 50 16.534 -2.544 -2.677 1.00 1.71 H new ATOM 0 HD11 LEU A 50 17.338 -2.439 -0.340 1.00 3.55 H new ATOM 0 HD12 LEU A 50 18.672 -2.743 -1.478 1.00 3.55 H new ATOM 0 HD13 LEU A 50 18.446 -1.119 -0.786 1.00 3.55 H new ATOM 0 HD21 LEU A 50 15.334 -1.142 -1.071 1.00 2.74 H new ATOM 0 HD22 LEU A 50 16.352 0.247 -1.519 1.00 2.74 H new ATOM 0 HD23 LEU A 50 15.257 -0.477 -2.720 1.00 2.74 H new ATOM 804 N LYS A 51 17.130 -0.621 -7.096 1.00 1.15 N ATOM 805 CA LYS A 51 17.551 -0.182 -8.416 1.00 1.29 C ATOM 806 C LYS A 51 17.546 1.344 -8.533 1.00 1.27 C ATOM 807 O LYS A 51 18.319 1.906 -9.304 1.00 1.52 O ATOM 808 CB LYS A 51 16.655 -0.853 -9.466 1.00 1.44 C ATOM 809 CG LYS A 51 15.208 -0.343 -9.417 1.00 1.26 C ATOM 810 CD LYS A 51 15.005 0.852 -10.367 1.00 1.28 C ATOM 811 CE LYS A 51 14.625 0.396 -11.779 1.00 1.57 C ATOM 812 NZ LYS A 51 14.598 1.536 -12.718 1.00 2.26 N ATOM 0 H LYS A 51 16.149 -0.900 -7.074 1.00 1.15 H new ATOM 0 HA LYS A 51 18.583 -0.486 -8.590 1.00 1.29 H new ATOM 0 HB2 LYS A 51 17.067 -0.673 -10.459 1.00 1.44 H new ATOM 0 HB3 LYS A 51 16.662 -1.932 -9.309 1.00 1.44 H new ATOM 0 HG2 LYS A 51 14.527 -1.148 -9.691 1.00 1.26 H new ATOM 0 HG3 LYS A 51 14.958 -0.047 -8.398 1.00 1.26 H new ATOM 0 HD2 LYS A 51 14.224 1.502 -9.972 1.00 1.28 H new ATOM 0 HD3 LYS A 51 15.920 1.443 -10.409 1.00 1.28 H new ATOM 0 HE2 LYS A 51 15.339 -0.350 -12.128 1.00 1.57 H new ATOM 0 HE3 LYS A 51 13.647 -0.085 -11.758 1.00 1.57 H new ATOM 0 HZ1 LYS A 51 14.338 1.198 -13.667 1.00 2.26 H new ATOM 0 HZ2 LYS A 51 13.899 2.235 -12.395 1.00 2.26 H new ATOM 0 HZ3 LYS A 51 15.538 1.978 -12.754 1.00 2.26 H new ATOM 826 N ASP A 52 16.595 1.976 -7.836 1.00 1.18 N ATOM 827 CA ASP A 52 16.482 3.404 -7.598 1.00 1.34 C ATOM 828 C ASP A 52 16.241 4.211 -8.873 1.00 1.25 C ATOM 829 O ASP A 52 17.173 4.667 -9.530 1.00 1.88 O ATOM 830 CB ASP A 52 17.681 3.913 -6.796 1.00 2.24 C ATOM 831 CG ASP A 52 17.870 3.191 -5.456 1.00 2.84 C ATOM 832 OD1 ASP A 52 17.082 2.255 -5.173 1.00 2.58 O ATOM 833 OD2 ASP A 52 18.778 3.622 -4.718 1.00 4.28 O ATOM 0 H ASP A 52 15.834 1.459 -7.396 1.00 1.18 H new ATOM 0 HA ASP A 52 15.587 3.560 -6.995 1.00 1.34 H new ATOM 0 HB2 ASP A 52 18.585 3.795 -7.394 1.00 2.24 H new ATOM 0 HB3 ASP A 52 17.558 4.980 -6.611 1.00 2.24 H new ATOM 838 N VAL A 53 14.963 4.411 -9.215 1.00 1.09 N ATOM 839 CA VAL A 53 14.561 5.343 -10.263 1.00 1.40 C ATOM 840 C VAL A 53 14.337 6.728 -9.646 1.00 1.10 C ATOM 841 O VAL A 53 14.408 6.873 -8.432 1.00 2.29 O ATOM 842 CB VAL A 53 13.341 4.775 -11.018 1.00 2.66 C ATOM 843 CG1 VAL A 53 11.984 5.230 -10.467 1.00 3.55 C ATOM 844 CG2 VAL A 53 13.406 5.074 -12.522 1.00 3.26 C ATOM 0 H VAL A 53 14.182 3.929 -8.770 1.00 1.09 H new ATOM 0 HA VAL A 53 15.344 5.465 -11.011 1.00 1.40 H new ATOM 0 HB VAL A 53 13.406 3.699 -10.854 1.00 2.66 H new ATOM 0 HG11 VAL A 53 11.184 4.783 -11.057 1.00 3.55 H new ATOM 0 HG12 VAL A 53 11.889 4.914 -9.428 1.00 3.55 H new ATOM 0 HG13 VAL A 53 11.914 6.316 -10.524 1.00 3.55 H new ATOM 0 HG21 VAL A 53 12.528 4.656 -13.014 1.00 3.26 H new ATOM 0 HG22 VAL A 53 13.431 6.153 -12.678 1.00 3.26 H new ATOM 0 HG23 VAL A 53 14.306 4.626 -12.943 1.00 3.26 H new ATOM 854 N GLY A 54 14.042 7.745 -10.461 1.00 1.13 N ATOM 855 CA GLY A 54 13.824 9.120 -10.016 1.00 1.42 C ATOM 856 C GLY A 54 12.951 9.261 -8.761 1.00 1.31 C ATOM 857 O GLY A 54 13.177 10.156 -7.953 1.00 1.46 O ATOM 0 H GLY A 54 13.947 7.630 -11.470 1.00 1.13 H new ATOM 0 HA2 GLY A 54 14.792 9.582 -9.821 1.00 1.42 H new ATOM 0 HA3 GLY A 54 13.361 9.681 -10.828 1.00 1.42 H new ATOM 861 N SER A 55 11.971 8.376 -8.563 1.00 1.14 N ATOM 862 CA SER A 55 11.080 8.490 -7.415 1.00 1.06 C ATOM 863 C SER A 55 11.772 8.093 -6.116 1.00 0.99 C ATOM 864 O SER A 55 11.399 8.562 -5.042 1.00 1.01 O ATOM 865 CB SER A 55 9.763 7.755 -7.653 1.00 1.10 C ATOM 866 OG SER A 55 9.156 8.277 -8.821 1.00 1.51 O ATOM 0 H SER A 55 11.779 7.584 -9.176 1.00 1.14 H new ATOM 0 HA SER A 55 10.820 9.542 -7.298 1.00 1.06 H new ATOM 0 HB2 SER A 55 9.942 6.686 -7.766 1.00 1.10 H new ATOM 0 HB3 SER A 55 9.101 7.879 -6.796 1.00 1.10 H new ATOM 0 HG SER A 55 8.870 9.200 -8.657 1.00 1.51 H new ATOM 872 N LEU A 56 12.841 7.297 -6.208 1.00 1.03 N ATOM 873 CA LEU A 56 13.748 7.135 -5.094 1.00 1.19 C ATOM 874 C LEU A 56 14.267 8.509 -4.729 1.00 1.31 C ATOM 875 O LEU A 56 14.128 8.914 -3.580 1.00 1.21 O ATOM 876 CB LEU A 56 14.886 6.180 -5.447 1.00 1.57 C ATOM 877 CG LEU A 56 15.888 5.939 -4.312 1.00 2.38 C ATOM 878 CD1 LEU A 56 16.906 7.063 -4.093 1.00 2.20 C ATOM 879 CD2 LEU A 56 15.233 5.510 -2.995 1.00 3.57 C ATOM 0 H LEU A 56 13.089 6.763 -7.041 1.00 1.03 H new ATOM 0 HA LEU A 56 13.232 6.693 -4.242 1.00 1.19 H new ATOM 0 HB2 LEU A 56 14.460 5.223 -5.748 1.00 1.57 H new ATOM 0 HB3 LEU A 56 15.422 6.576 -6.310 1.00 1.57 H new ATOM 0 HG LEU A 56 16.467 5.090 -4.676 1.00 2.38 H new ATOM 0 HD11 LEU A 56 17.569 6.798 -3.270 1.00 2.20 H new ATOM 0 HD12 LEU A 56 17.493 7.204 -5.001 1.00 2.20 H new ATOM 0 HD13 LEU A 56 16.381 7.988 -3.853 1.00 2.20 H new ATOM 0 HD21 LEU A 56 16.003 5.358 -2.238 1.00 3.57 H new ATOM 0 HD22 LEU A 56 14.545 6.286 -2.661 1.00 3.57 H new ATOM 0 HD23 LEU A 56 14.685 4.580 -3.147 1.00 3.57 H new ATOM 891 N ASP A 57 14.841 9.217 -5.705 1.00 1.62 N ATOM 892 CA ASP A 57 15.414 10.534 -5.481 1.00 1.89 C ATOM 893 C ASP A 57 14.382 11.481 -4.845 1.00 1.73 C ATOM 894 O ASP A 57 14.640 12.018 -3.766 1.00 1.77 O ATOM 895 CB ASP A 57 16.049 11.081 -6.766 1.00 2.34 C ATOM 896 CG ASP A 57 16.252 12.581 -6.683 1.00 2.53 C ATOM 897 OD1 ASP A 57 17.158 13.037 -5.952 1.00 3.45 O ATOM 898 OD2 ASP A 57 15.469 13.320 -7.319 1.00 2.57 O ATOM 0 H ASP A 57 14.918 8.889 -6.668 1.00 1.62 H new ATOM 0 HA ASP A 57 16.227 10.451 -4.759 1.00 1.89 H new ATOM 0 HB2 ASP A 57 17.007 10.591 -6.938 1.00 2.34 H new ATOM 0 HB3 ASP A 57 15.412 10.844 -7.618 1.00 2.34 H new ATOM 903 N GLU A 58 13.199 11.639 -5.465 1.00 1.65 N ATOM 904 CA GLU A 58 12.052 12.362 -4.893 1.00 1.65 C ATOM 905 C GLU A 58 11.916 12.078 -3.389 1.00 1.47 C ATOM 906 O GLU A 58 11.814 12.989 -2.564 1.00 1.60 O ATOM 907 CB GLU A 58 10.737 11.973 -5.597 1.00 1.63 C ATOM 908 CG GLU A 58 10.654 12.354 -7.084 1.00 2.45 C ATOM 909 CD GLU A 58 9.294 11.978 -7.677 1.00 2.97 C ATOM 910 OE1 GLU A 58 8.351 12.761 -7.442 1.00 2.97 O ATOM 911 OE2 GLU A 58 9.211 10.917 -8.338 1.00 4.39 O ATOM 0 H GLU A 58 13.011 11.261 -6.394 1.00 1.65 H new ATOM 0 HA GLU A 58 12.238 13.425 -5.046 1.00 1.65 H new ATOM 0 HB2 GLU A 58 10.600 10.896 -5.506 1.00 1.63 H new ATOM 0 HB3 GLU A 58 9.908 12.446 -5.070 1.00 1.63 H new ATOM 0 HG2 GLU A 58 10.819 13.425 -7.197 1.00 2.45 H new ATOM 0 HG3 GLU A 58 11.447 11.849 -7.636 1.00 2.45 H new ATOM 918 N LYS A 59 11.929 10.795 -3.029 1.00 1.20 N ATOM 919 CA LYS A 59 11.781 10.360 -1.651 1.00 1.05 C ATOM 920 C LYS A 59 13.001 10.773 -0.826 1.00 1.09 C ATOM 921 O LYS A 59 12.850 11.394 0.219 1.00 1.09 O ATOM 922 CB LYS A 59 11.504 8.846 -1.629 1.00 0.89 C ATOM 923 CG LYS A 59 10.241 8.480 -0.841 1.00 0.68 C ATOM 924 CD LYS A 59 9.482 7.283 -1.436 1.00 0.70 C ATOM 925 CE LYS A 59 10.251 5.965 -1.569 1.00 0.75 C ATOM 926 NZ LYS A 59 11.140 5.963 -2.751 1.00 0.97 N ATOM 0 H LYS A 59 12.043 10.029 -3.692 1.00 1.20 H new ATOM 0 HA LYS A 59 10.928 10.851 -1.183 1.00 1.05 H new ATOM 0 HB2 LYS A 59 11.404 8.486 -2.653 1.00 0.89 H new ATOM 0 HB3 LYS A 59 12.360 8.332 -1.192 1.00 0.89 H new ATOM 0 HG2 LYS A 59 10.516 8.252 0.189 1.00 0.68 H new ATOM 0 HG3 LYS A 59 9.577 9.344 -0.810 1.00 0.68 H new ATOM 0 HD2 LYS A 59 8.602 7.100 -0.819 1.00 0.70 H new ATOM 0 HD3 LYS A 59 9.124 7.567 -2.426 1.00 0.70 H new ATOM 0 HE2 LYS A 59 10.843 5.797 -0.669 1.00 0.75 H new ATOM 0 HE3 LYS A 59 9.545 5.138 -1.644 1.00 0.75 H new ATOM 0 HZ1 LYS A 59 11.525 5.008 -2.894 1.00 0.97 H new ATOM 0 HZ2 LYS A 59 10.599 6.248 -3.593 1.00 0.97 H new ATOM 0 HZ3 LYS A 59 11.921 6.632 -2.599 1.00 0.97 H new ATOM 940 N MET A 60 14.208 10.455 -1.291 1.00 1.22 N ATOM 941 CA MET A 60 15.454 10.832 -0.638 1.00 1.30 C ATOM 942 C MET A 60 15.447 12.305 -0.247 1.00 1.41 C ATOM 943 O MET A 60 15.653 12.591 0.927 1.00 1.36 O ATOM 944 CB MET A 60 16.685 10.484 -1.489 1.00 1.52 C ATOM 945 CG MET A 60 17.316 9.139 -1.097 1.00 2.76 C ATOM 946 SD MET A 60 18.614 9.154 0.177 1.00 3.62 S ATOM 947 CE MET A 60 17.781 9.853 1.619 1.00 4.61 C ATOM 0 H MET A 60 14.347 9.919 -2.147 1.00 1.22 H new ATOM 0 HA MET A 60 15.526 10.242 0.276 1.00 1.30 H new ATOM 0 HB2 MET A 60 16.398 10.453 -2.540 1.00 1.52 H new ATOM 0 HB3 MET A 60 17.429 11.274 -1.385 1.00 1.52 H new ATOM 0 HG2 MET A 60 16.517 8.481 -0.754 1.00 2.76 H new ATOM 0 HG3 MET A 60 17.735 8.690 -1.997 1.00 2.76 H new ATOM 0 HE1 MET A 60 18.465 9.858 2.468 1.00 4.61 H new ATOM 0 HE2 MET A 60 17.468 10.874 1.399 1.00 4.61 H new ATOM 0 HE3 MET A 60 16.906 9.250 1.862 1.00 4.61 H new ATOM 957 N LYS A 61 15.191 13.236 -1.174 1.00 1.59 N ATOM 958 CA LYS A 61 15.176 14.642 -0.753 1.00 1.78 C ATOM 959 C LYS A 61 14.059 14.895 0.266 1.00 1.64 C ATOM 960 O LYS A 61 14.286 15.559 1.277 1.00 1.67 O ATOM 961 CB LYS A 61 15.204 15.669 -1.897 1.00 2.16 C ATOM 962 CG LYS A 61 14.192 15.433 -3.023 1.00 2.21 C ATOM 963 CD LYS A 61 14.900 14.890 -4.266 1.00 3.28 C ATOM 964 CE LYS A 61 15.517 16.008 -5.112 1.00 3.52 C ATOM 965 NZ LYS A 61 16.326 15.459 -6.213 1.00 4.54 N ATOM 0 H LYS A 61 15.002 13.060 -2.161 1.00 1.59 H new ATOM 0 HA LYS A 61 16.130 14.812 -0.254 1.00 1.78 H new ATOM 0 HB2 LYS A 61 15.029 16.659 -1.477 1.00 2.16 H new ATOM 0 HB3 LYS A 61 16.205 15.679 -2.328 1.00 2.16 H new ATOM 0 HG2 LYS A 61 13.429 14.728 -2.694 1.00 2.21 H new ATOM 0 HG3 LYS A 61 13.682 16.366 -3.265 1.00 2.21 H new ATOM 0 HD2 LYS A 61 15.681 14.193 -3.962 1.00 3.28 H new ATOM 0 HD3 LYS A 61 14.189 14.328 -4.871 1.00 3.28 H new ATOM 0 HE2 LYS A 61 14.726 16.639 -5.518 1.00 3.52 H new ATOM 0 HE3 LYS A 61 16.139 16.643 -4.482 1.00 3.52 H new ATOM 0 HZ1 LYS A 61 16.813 16.234 -6.706 1.00 4.54 H new ATOM 0 HZ2 LYS A 61 17.030 14.797 -5.830 1.00 4.54 H new ATOM 0 HZ3 LYS A 61 15.707 14.958 -6.882 1.00 4.54 H new ATOM 979 N SER A 62 12.866 14.341 0.027 1.00 1.53 N ATOM 980 CA SER A 62 11.758 14.447 0.978 1.00 1.49 C ATOM 981 C SER A 62 12.190 14.045 2.402 1.00 1.36 C ATOM 982 O SER A 62 11.871 14.734 3.370 1.00 1.52 O ATOM 983 CB SER A 62 10.553 13.634 0.483 1.00 1.47 C ATOM 984 OG SER A 62 9.386 13.984 1.199 1.00 1.74 O ATOM 0 H SER A 62 12.644 13.814 -0.818 1.00 1.53 H new ATOM 0 HA SER A 62 11.452 15.492 1.036 1.00 1.49 H new ATOM 0 HB2 SER A 62 10.400 13.813 -0.581 1.00 1.47 H new ATOM 0 HB3 SER A 62 10.753 12.569 0.602 1.00 1.47 H new ATOM 0 HG SER A 62 8.629 13.457 0.868 1.00 1.74 H new ATOM 990 N LEU A 63 12.949 12.953 2.541 1.00 1.17 N ATOM 991 CA LEU A 63 13.512 12.553 3.826 1.00 1.11 C ATOM 992 C LEU A 63 14.565 13.574 4.278 1.00 1.30 C ATOM 993 O LEU A 63 14.472 14.120 5.377 1.00 1.37 O ATOM 994 CB LEU A 63 14.106 11.131 3.748 1.00 1.04 C ATOM 995 CG LEU A 63 13.127 9.944 3.614 1.00 1.15 C ATOM 996 CD1 LEU A 63 11.697 10.256 3.141 1.00 1.36 C ATOM 997 CD2 LEU A 63 13.710 8.919 2.641 1.00 1.74 C ATOM 0 H LEU A 63 13.186 12.329 1.770 1.00 1.17 H new ATOM 0 HA LEU A 63 12.714 12.532 4.568 1.00 1.11 H new ATOM 0 HB2 LEU A 63 14.787 11.100 2.898 1.00 1.04 H new ATOM 0 HB3 LEU A 63 14.706 10.970 4.644 1.00 1.04 H new ATOM 0 HG LEU A 63 13.025 9.585 4.638 1.00 1.15 H new ATOM 0 HD11 LEU A 63 11.120 9.332 3.092 1.00 1.36 H new ATOM 0 HD12 LEU A 63 11.224 10.943 3.842 1.00 1.36 H new ATOM 0 HD13 LEU A 63 11.733 10.714 2.153 1.00 1.36 H new ATOM 0 HD21 LEU A 63 13.023 8.079 2.543 1.00 1.74 H new ATOM 0 HD22 LEU A 63 13.856 9.385 1.666 1.00 1.74 H new ATOM 0 HD23 LEU A 63 14.668 8.562 3.019 1.00 1.74 H new ATOM 1009 N ASP A 64 15.568 13.816 3.434 1.00 1.45 N ATOM 1010 CA ASP A 64 16.746 14.624 3.728 1.00 1.74 C ATOM 1011 C ASP A 64 16.396 15.965 4.373 1.00 1.89 C ATOM 1012 O ASP A 64 17.035 16.359 5.348 1.00 2.05 O ATOM 1013 CB ASP A 64 17.544 14.845 2.441 1.00 1.96 C ATOM 1014 CG ASP A 64 18.817 15.631 2.709 1.00 2.32 C ATOM 1015 OD1 ASP A 64 19.790 14.991 3.162 1.00 3.54 O ATOM 1016 OD2 ASP A 64 18.791 16.851 2.442 1.00 2.14 O ATOM 0 H ASP A 64 15.580 13.437 2.487 1.00 1.45 H new ATOM 0 HA ASP A 64 17.348 14.077 4.454 1.00 1.74 H new ATOM 0 HB2 ASP A 64 17.795 13.882 1.996 1.00 1.96 H new ATOM 0 HB3 ASP A 64 16.929 15.380 1.717 1.00 1.96 H new ATOM 1021 N VAL A 65 15.383 16.663 3.849 1.00 1.90 N ATOM 1022 CA VAL A 65 15.073 18.006 4.338 1.00 2.19 C ATOM 1023 C VAL A 65 14.646 17.983 5.802 1.00 1.96 C ATOM 1024 O VAL A 65 15.212 18.692 6.631 1.00 2.13 O ATOM 1025 CB VAL A 65 14.049 18.743 3.453 1.00 2.48 C ATOM 1026 CG1 VAL A 65 14.636 18.887 2.056 1.00 4.31 C ATOM 1027 CG2 VAL A 65 12.675 18.072 3.328 1.00 2.21 C ATOM 0 H VAL A 65 14.776 16.327 3.101 1.00 1.90 H new ATOM 0 HA VAL A 65 15.997 18.580 4.273 1.00 2.19 H new ATOM 0 HB VAL A 65 13.869 19.698 3.947 1.00 2.48 H new ATOM 0 HG11 VAL A 65 13.925 19.407 1.414 1.00 4.31 H new ATOM 0 HG12 VAL A 65 15.563 19.458 2.108 1.00 4.31 H new ATOM 0 HG13 VAL A 65 14.841 17.899 1.644 1.00 4.31 H new ATOM 0 HG21 VAL A 65 12.034 18.674 2.684 1.00 2.21 H new ATOM 0 HG22 VAL A 65 12.793 17.078 2.896 1.00 2.21 H new ATOM 0 HG23 VAL A 65 12.221 17.987 4.315 1.00 2.21 H new ATOM 1037 N ASN A 66 13.623 17.186 6.115 1.00 1.66 N ATOM 1038 CA ASN A 66 13.029 17.182 7.457 1.00 1.39 C ATOM 1039 C ASN A 66 12.533 15.796 7.857 1.00 1.13 C ATOM 1040 O ASN A 66 11.400 15.633 8.310 1.00 1.18 O ATOM 1041 CB ASN A 66 11.878 18.200 7.545 1.00 1.64 C ATOM 1042 CG ASN A 66 12.339 19.641 7.348 1.00 2.39 C ATOM 1043 OD1 ASN A 66 12.193 20.204 6.268 1.00 3.68 O ATOM 1044 ND2 ASN A 66 12.889 20.260 8.390 1.00 2.85 N ATOM 0 H ASN A 66 13.188 16.536 5.461 1.00 1.66 H new ATOM 0 HA ASN A 66 13.814 17.469 8.156 1.00 1.39 H new ATOM 0 HB2 ASN A 66 11.128 17.958 6.792 1.00 1.64 H new ATOM 0 HB3 ASN A 66 11.394 18.109 8.517 1.00 1.64 H new ATOM 0 HD21 ASN A 66 13.201 21.227 8.302 1.00 2.85 H new ATOM 0 HD22 ASN A 66 12.998 19.767 9.276 1.00 2.85 H new ATOM 1051 N GLN A 67 13.429 14.810 7.822 1.00 1.00 N ATOM 1052 CA GLN A 67 13.100 13.455 8.238 1.00 0.84 C ATOM 1053 C GLN A 67 12.562 13.365 9.672 1.00 0.92 C ATOM 1054 O GLN A 67 11.855 12.423 10.030 1.00 1.04 O ATOM 1055 CB GLN A 67 14.311 12.527 8.130 1.00 0.95 C ATOM 1056 CG GLN A 67 15.593 13.087 8.771 1.00 1.11 C ATOM 1057 CD GLN A 67 16.485 13.720 7.716 1.00 1.68 C ATOM 1058 OE1 GLN A 67 17.062 12.997 6.907 1.00 2.47 O ATOM 1059 NE2 GLN A 67 16.586 15.044 7.709 1.00 2.24 N ATOM 0 H GLN A 67 14.392 14.930 7.508 1.00 1.00 H new ATOM 0 HA GLN A 67 12.311 13.141 7.554 1.00 0.84 H new ATOM 0 HB2 GLN A 67 14.068 11.575 8.602 1.00 0.95 H new ATOM 0 HB3 GLN A 67 14.504 12.321 7.077 1.00 0.95 H new ATOM 0 HG2 GLN A 67 15.334 13.827 9.528 1.00 1.11 H new ATOM 0 HG3 GLN A 67 16.132 12.287 9.278 1.00 1.11 H new ATOM 0 HE21 GLN A 67 16.085 15.597 8.404 1.00 2.24 H new ATOM 0 HE22 GLN A 67 17.164 15.508 7.008 1.00 2.24 H new ATOM 1068 N ASP A 68 12.959 14.320 10.508 1.00 1.01 N ATOM 1069 CA ASP A 68 12.576 14.380 11.904 1.00 1.18 C ATOM 1070 C ASP A 68 11.046 14.376 12.069 1.00 1.35 C ATOM 1071 O ASP A 68 10.519 13.843 13.041 1.00 1.60 O ATOM 1072 CB ASP A 68 13.199 15.660 12.475 1.00 1.31 C ATOM 1073 CG ASP A 68 12.730 15.940 13.893 1.00 2.19 C ATOM 1074 OD1 ASP A 68 13.356 15.379 14.816 1.00 2.76 O ATOM 1075 OD2 ASP A 68 11.775 16.734 14.016 1.00 3.25 O ATOM 0 H ASP A 68 13.568 15.087 10.222 1.00 1.01 H new ATOM 0 HA ASP A 68 12.935 13.502 12.441 1.00 1.18 H new ATOM 0 HB2 ASP A 68 14.285 15.570 12.464 1.00 1.31 H new ATOM 0 HB3 ASP A 68 12.942 16.504 11.835 1.00 1.31 H new ATOM 1080 N SER A 69 10.330 14.937 11.086 1.00 1.34 N ATOM 1081 CA SER A 69 8.938 15.376 11.169 1.00 1.77 C ATOM 1082 C SER A 69 7.861 14.280 11.322 1.00 2.13 C ATOM 1083 O SER A 69 6.709 14.557 10.983 1.00 3.86 O ATOM 1084 CB SER A 69 8.670 16.174 9.883 1.00 1.93 C ATOM 1085 OG SER A 69 7.449 16.887 9.947 1.00 2.45 O ATOM 0 H SER A 69 10.731 15.104 10.163 1.00 1.34 H new ATOM 0 HA SER A 69 8.845 15.947 12.093 1.00 1.77 H new ATOM 0 HB2 SER A 69 9.489 16.872 9.712 1.00 1.93 H new ATOM 0 HB3 SER A 69 8.648 15.494 9.032 1.00 1.93 H new ATOM 0 HG SER A 69 6.744 16.299 10.291 1.00 2.45 H new ATOM 1091 N GLU A 70 8.191 13.073 11.799 1.00 1.25 N ATOM 1092 CA GLU A 70 7.329 11.882 11.775 1.00 1.28 C ATOM 1093 C GLU A 70 6.934 11.489 10.348 1.00 1.32 C ATOM 1094 O GLU A 70 6.978 12.284 9.410 1.00 1.84 O ATOM 1095 CB GLU A 70 6.030 12.048 12.604 1.00 1.90 C ATOM 1096 CG GLU A 70 6.202 11.827 14.105 1.00 1.99 C ATOM 1097 CD GLU A 70 4.931 12.147 14.909 1.00 2.62 C ATOM 1098 OE1 GLU A 70 3.951 12.692 14.334 1.00 3.35 O ATOM 1099 OE2 GLU A 70 4.938 11.817 16.111 1.00 3.12 O ATOM 0 H GLU A 70 9.098 12.891 12.228 1.00 1.25 H new ATOM 0 HA GLU A 70 7.935 11.097 12.227 1.00 1.28 H new ATOM 0 HB2 GLU A 70 5.636 13.051 12.440 1.00 1.90 H new ATOM 0 HB3 GLU A 70 5.284 11.347 12.230 1.00 1.90 H new ATOM 0 HG2 GLU A 70 6.487 10.790 14.284 1.00 1.99 H new ATOM 0 HG3 GLU A 70 7.020 12.449 14.467 1.00 1.99 H new ATOM 1106 N LEU A 71 6.442 10.261 10.206 1.00 1.13 N ATOM 1107 CA LEU A 71 5.411 9.981 9.219 1.00 1.24 C ATOM 1108 C LEU A 71 4.338 9.104 9.850 1.00 1.05 C ATOM 1109 O LEU A 71 4.474 8.662 10.990 1.00 1.10 O ATOM 1110 CB LEU A 71 5.970 9.466 7.883 1.00 1.84 C ATOM 1111 CG LEU A 71 7.064 8.401 7.952 1.00 1.25 C ATOM 1112 CD1 LEU A 71 6.502 7.068 8.437 1.00 2.16 C ATOM 1113 CD2 LEU A 71 7.611 8.214 6.534 1.00 2.03 C ATOM 0 H LEU A 71 6.738 9.455 10.756 1.00 1.13 H new ATOM 0 HA LEU A 71 4.932 10.916 8.928 1.00 1.24 H new ATOM 0 HB2 LEU A 71 5.141 9.062 7.302 1.00 1.84 H new ATOM 0 HB3 LEU A 71 6.362 10.319 7.329 1.00 1.84 H new ATOM 0 HG LEU A 71 7.839 8.720 8.649 1.00 1.25 H new ATOM 0 HD11 LEU A 71 7.302 6.329 8.477 1.00 2.16 H new ATOM 0 HD12 LEU A 71 6.075 7.194 9.432 1.00 2.16 H new ATOM 0 HD13 LEU A 71 5.727 6.728 7.750 1.00 2.16 H new ATOM 0 HD21 LEU A 71 8.397 7.459 6.544 1.00 2.03 H new ATOM 0 HD22 LEU A 71 6.806 7.892 5.873 1.00 2.03 H new ATOM 0 HD23 LEU A 71 8.020 9.158 6.174 1.00 2.03 H new ATOM 1125 N LYS A 72 3.222 8.935 9.140 1.00 0.95 N ATOM 1126 CA LYS A 72 2.005 8.302 9.622 1.00 0.93 C ATOM 1127 C LYS A 72 1.548 7.349 8.521 1.00 0.83 C ATOM 1128 O LYS A 72 1.984 7.492 7.376 1.00 0.80 O ATOM 1129 CB LYS A 72 0.976 9.381 10.011 1.00 1.02 C ATOM 1130 CG LYS A 72 1.615 10.230 11.123 1.00 1.13 C ATOM 1131 CD LYS A 72 0.788 11.366 11.739 1.00 1.66 C ATOM 1132 CE LYS A 72 1.758 11.966 12.774 1.00 2.11 C ATOM 1133 NZ LYS A 72 1.327 13.195 13.455 1.00 3.55 N ATOM 0 H LYS A 72 3.143 9.251 8.173 1.00 0.95 H new ATOM 0 HA LYS A 72 2.153 7.721 10.532 1.00 0.93 H new ATOM 0 HB2 LYS A 72 0.722 10.000 9.151 1.00 1.02 H new ATOM 0 HB3 LYS A 72 0.050 8.923 10.359 1.00 1.02 H new ATOM 0 HG2 LYS A 72 1.907 9.557 11.929 1.00 1.13 H new ATOM 0 HG3 LYS A 72 2.531 10.665 10.724 1.00 1.13 H new ATOM 0 HD2 LYS A 72 0.488 12.100 10.991 1.00 1.66 H new ATOM 0 HD3 LYS A 72 -0.125 10.996 12.206 1.00 1.66 H new ATOM 0 HE2 LYS A 72 1.955 11.209 13.533 1.00 2.11 H new ATOM 0 HE3 LYS A 72 2.705 12.170 12.274 1.00 2.11 H new ATOM 0 HZ1 LYS A 72 2.103 13.554 14.048 1.00 3.55 H new ATOM 0 HZ2 LYS A 72 1.072 13.913 12.747 1.00 3.55 H new ATOM 0 HZ3 LYS A 72 0.501 12.989 14.053 1.00 3.55 H new ATOM 1147 N PHE A 73 0.748 6.338 8.876 1.00 0.83 N ATOM 1148 CA PHE A 73 0.493 5.180 8.023 1.00 0.80 C ATOM 1149 C PHE A 73 0.104 5.572 6.595 1.00 0.61 C ATOM 1150 O PHE A 73 0.562 4.945 5.645 1.00 0.54 O ATOM 1151 CB PHE A 73 -0.520 4.227 8.673 1.00 1.03 C ATOM 1152 CG PHE A 73 -1.807 4.875 9.143 1.00 0.89 C ATOM 1153 CD1 PHE A 73 -2.876 5.054 8.246 1.00 1.94 C ATOM 1154 CD2 PHE A 73 -1.955 5.246 10.493 1.00 2.12 C ATOM 1155 CE1 PHE A 73 -4.078 5.627 8.693 1.00 2.53 C ATOM 1156 CE2 PHE A 73 -3.147 5.846 10.932 1.00 2.56 C ATOM 1157 CZ PHE A 73 -4.210 6.037 10.032 1.00 2.35 C ATOM 0 H PHE A 73 0.258 6.303 9.770 1.00 0.83 H new ATOM 0 HA PHE A 73 1.433 4.636 7.928 1.00 0.80 H new ATOM 0 HB2 PHE A 73 -0.767 3.443 7.958 1.00 1.03 H new ATOM 0 HB3 PHE A 73 -0.044 3.743 9.525 1.00 1.03 H new ATOM 0 HD1 PHE A 73 -2.772 4.751 7.215 1.00 1.94 H new ATOM 0 HD2 PHE A 73 -1.151 5.069 11.192 1.00 2.12 H new ATOM 0 HE1 PHE A 73 -4.903 5.753 8.007 1.00 2.53 H new ATOM 0 HE2 PHE A 73 -3.247 6.160 11.960 1.00 2.56 H new ATOM 0 HZ PHE A 73 -5.127 6.498 10.368 1.00 2.35 H new ATOM 1167 N ASN A 74 -0.705 6.621 6.435 1.00 0.63 N ATOM 1168 CA ASN A 74 -1.093 7.115 5.119 1.00 0.64 C ATOM 1169 C ASN A 74 0.102 7.603 4.296 1.00 0.55 C ATOM 1170 O ASN A 74 0.223 7.304 3.109 1.00 0.59 O ATOM 1171 CB ASN A 74 -2.090 8.265 5.267 1.00 0.81 C ATOM 1172 CG ASN A 74 -2.555 8.695 3.884 1.00 2.26 C ATOM 1173 OD1 ASN A 74 -2.990 7.860 3.108 1.00 3.84 O ATOM 1174 ND2 ASN A 74 -2.475 9.974 3.546 1.00 3.04 N ATOM 0 H ASN A 74 -1.106 7.147 7.211 1.00 0.63 H new ATOM 0 HA ASN A 74 -1.545 6.276 4.590 1.00 0.64 H new ATOM 0 HB2 ASN A 74 -2.942 7.950 5.870 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -1.624 9.103 5.786 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -2.780 10.277 2.621 1.00 3.04 H new ATOM 0 HD22 ASN A 74 -2.108 10.655 4.211 1.00 3.04 H new ATOM 1181 N GLU A 75 0.973 8.392 4.923 1.00 0.54 N ATOM 1182 CA GLU A 75 2.101 9.004 4.244 1.00 0.59 C ATOM 1183 C GLU A 75 3.133 7.928 3.924 1.00 0.52 C ATOM 1184 O GLU A 75 3.630 7.861 2.801 1.00 0.52 O ATOM 1185 CB GLU A 75 2.665 10.159 5.080 1.00 0.85 C ATOM 1186 CG GLU A 75 1.563 11.101 5.602 1.00 1.76 C ATOM 1187 CD GLU A 75 0.576 11.531 4.522 1.00 3.02 C ATOM 1188 OE1 GLU A 75 1.030 11.910 3.419 1.00 3.53 O ATOM 1189 OE2 GLU A 75 -0.644 11.455 4.786 1.00 4.53 O ATOM 0 H GLU A 75 0.912 8.621 5.915 1.00 0.54 H new ATOM 0 HA GLU A 75 1.786 9.444 3.298 1.00 0.59 H new ATOM 0 HB2 GLU A 75 3.223 9.754 5.924 1.00 0.85 H new ATOM 0 HB3 GLU A 75 3.371 10.730 4.476 1.00 0.85 H new ATOM 0 HG2 GLU A 75 1.019 10.603 6.404 1.00 1.76 H new ATOM 0 HG3 GLU A 75 2.027 11.988 6.034 1.00 1.76 H new ATOM 1196 N TYR A 76 3.388 7.037 4.892 1.00 0.54 N ATOM 1197 CA TYR A 76 4.079 5.779 4.629 1.00 0.54 C ATOM 1198 C TYR A 76 3.519 5.164 3.349 1.00 0.48 C ATOM 1199 O TYR A 76 4.275 4.904 2.419 1.00 0.52 O ATOM 1200 CB TYR A 76 3.923 4.829 5.824 1.00 0.61 C ATOM 1201 CG TYR A 76 4.209 3.364 5.535 1.00 0.70 C ATOM 1202 CD1 TYR A 76 3.193 2.526 5.033 1.00 1.87 C ATOM 1203 CD2 TYR A 76 5.419 2.792 5.961 1.00 1.78 C ATOM 1204 CE1 TYR A 76 3.453 1.168 4.793 1.00 2.05 C ATOM 1205 CE2 TYR A 76 5.684 1.432 5.721 1.00 1.82 C ATOM 1206 CZ TYR A 76 4.709 0.630 5.103 1.00 1.18 C ATOM 1207 OH TYR A 76 4.986 -0.661 4.774 1.00 1.51 O ATOM 0 H TYR A 76 3.122 7.171 5.868 1.00 0.54 H new ATOM 0 HA TYR A 76 5.145 5.960 4.493 1.00 0.54 H new ATOM 0 HB2 TYR A 76 4.589 5.161 6.620 1.00 0.61 H new ATOM 0 HB3 TYR A 76 2.905 4.915 6.204 1.00 0.61 H new ATOM 0 HD1 TYR A 76 2.212 2.930 4.832 1.00 1.87 H new ATOM 0 HD2 TYR A 76 6.149 3.399 6.475 1.00 1.78 H new ATOM 0 HE1 TYR A 76 2.685 0.538 4.369 1.00 2.05 H new ATOM 0 HE2 TYR A 76 6.633 1.005 6.010 1.00 1.82 H new ATOM 0 HH TYR A 76 5.952 -0.813 4.831 1.00 1.51 H new ATOM 1217 N TRP A 77 2.200 4.957 3.298 1.00 0.44 N ATOM 1218 CA TRP A 77 1.525 4.372 2.156 1.00 0.42 C ATOM 1219 C TRP A 77 1.940 5.045 0.844 1.00 0.46 C ATOM 1220 O TRP A 77 2.642 4.447 0.028 1.00 0.50 O ATOM 1221 CB TRP A 77 0.017 4.439 2.378 1.00 0.45 C ATOM 1222 CG TRP A 77 -0.653 3.203 1.944 1.00 0.43 C ATOM 1223 CD1 TRP A 77 -0.964 2.914 0.671 1.00 0.43 C ATOM 1224 CD2 TRP A 77 -1.213 2.142 2.756 1.00 0.41 C ATOM 1225 NE1 TRP A 77 -1.531 1.671 0.616 1.00 0.43 N ATOM 1226 CE2 TRP A 77 -1.803 1.197 1.876 1.00 0.42 C ATOM 1227 CE3 TRP A 77 -1.393 1.936 4.139 1.00 0.43 C ATOM 1228 CZ2 TRP A 77 -2.527 0.102 2.338 1.00 0.44 C ATOM 1229 CZ3 TRP A 77 -2.158 0.848 4.590 1.00 0.45 C ATOM 1230 CH2 TRP A 77 -2.701 -0.077 3.710 1.00 0.46 C ATOM 0 H TRP A 77 1.570 5.197 4.064 1.00 0.44 H new ATOM 0 HA TRP A 77 1.822 3.327 2.066 1.00 0.42 H new ATOM 0 HB2 TRP A 77 -0.188 4.612 3.434 1.00 0.45 H new ATOM 0 HB3 TRP A 77 -0.394 5.287 1.830 1.00 0.45 H new ATOM 0 HD1 TRP A 77 -0.793 3.561 -0.177 1.00 0.43 H new ATOM 0 HE1 TRP A 77 -1.726 1.163 -0.247 1.00 0.43 H new ATOM 0 HE3 TRP A 77 -0.944 2.613 4.850 1.00 0.43 H new ATOM 0 HZ2 TRP A 77 -2.951 -0.604 1.639 1.00 0.44 H new ATOM 0 HZ3 TRP A 77 -2.328 0.728 5.650 1.00 0.45 H new ATOM 0 HH2 TRP A 77 -3.253 -0.927 4.084 1.00 0.46 H new ATOM 1241 N ARG A 78 1.516 6.300 0.657 1.00 0.53 N ATOM 1242 CA ARG A 78 1.877 7.151 -0.464 1.00 0.70 C ATOM 1243 C ARG A 78 3.361 6.955 -0.847 1.00 0.67 C ATOM 1244 O ARG A 78 3.658 6.749 -2.024 1.00 0.80 O ATOM 1245 CB ARG A 78 1.594 8.610 -0.047 1.00 0.94 C ATOM 1246 CG ARG A 78 0.100 8.934 0.180 1.00 1.76 C ATOM 1247 CD ARG A 78 -0.079 10.253 0.940 1.00 2.18 C ATOM 1248 NE ARG A 78 -1.381 10.897 0.672 1.00 3.66 N ATOM 1249 CZ ARG A 78 -1.674 12.157 1.030 1.00 4.34 C ATOM 1250 NH1 ARG A 78 -0.855 12.856 1.819 1.00 4.11 N ATOM 1251 NH2 ARG A 78 -2.806 12.704 0.582 1.00 5.97 N ATOM 0 H ARG A 78 0.887 6.762 1.314 1.00 0.53 H new ATOM 0 HA ARG A 78 1.290 6.893 -1.345 1.00 0.70 H new ATOM 0 HB2 ARG A 78 2.143 8.825 0.870 1.00 0.94 H new ATOM 0 HB3 ARG A 78 1.984 9.276 -0.816 1.00 0.94 H new ATOM 0 HG2 ARG A 78 -0.410 8.994 -0.781 1.00 1.76 H new ATOM 0 HG3 ARG A 78 -0.368 8.124 0.739 1.00 1.76 H new ATOM 0 HD2 ARG A 78 0.015 10.066 2.010 1.00 2.18 H new ATOM 0 HD3 ARG A 78 0.723 10.938 0.664 1.00 2.18 H new ATOM 0 HE ARG A 78 -2.097 10.354 0.188 1.00 3.66 H new ATOM 0 HH11 ARG A 78 0.009 12.434 2.159 1.00 4.11 H new ATOM 0 HH12 ARG A 78 -1.093 13.813 2.081 1.00 4.11 H new ATOM 0 HH21 ARG A 78 -3.429 12.166 -0.020 1.00 5.97 H new ATOM 0 HH22 ARG A 78 -3.048 13.660 0.842 1.00 5.97 H new ATOM 1265 N LEU A 79 4.280 6.974 0.130 1.00 0.57 N ATOM 1266 CA LEU A 79 5.709 6.777 -0.119 1.00 0.60 C ATOM 1267 C LEU A 79 6.050 5.354 -0.595 1.00 0.58 C ATOM 1268 O LEU A 79 6.790 5.211 -1.568 1.00 0.63 O ATOM 1269 CB LEU A 79 6.556 7.171 1.106 1.00 0.69 C ATOM 1270 CG LEU A 79 6.971 8.657 1.119 1.00 0.84 C ATOM 1271 CD1 LEU A 79 5.800 9.645 1.056 1.00 0.85 C ATOM 1272 CD2 LEU A 79 7.799 8.953 2.375 1.00 1.16 C ATOM 0 H LEU A 79 4.050 7.126 1.112 1.00 0.57 H new ATOM 0 HA LEU A 79 5.965 7.446 -0.940 1.00 0.60 H new ATOM 0 HB2 LEU A 79 5.992 6.952 2.013 1.00 0.69 H new ATOM 0 HB3 LEU A 79 7.453 6.552 1.131 1.00 0.69 H new ATOM 0 HG LEU A 79 7.553 8.806 0.209 1.00 0.84 H new ATOM 0 HD11 LEU A 79 6.184 10.665 1.070 1.00 0.85 H new ATOM 0 HD12 LEU A 79 5.235 9.482 0.138 1.00 0.85 H new ATOM 0 HD13 LEU A 79 5.147 9.491 1.915 1.00 0.85 H new ATOM 0 HD21 LEU A 79 8.090 10.003 2.380 1.00 1.16 H new ATOM 0 HD22 LEU A 79 7.204 8.737 3.262 1.00 1.16 H new ATOM 0 HD23 LEU A 79 8.693 8.329 2.377 1.00 1.16 H new ATOM 1284 N ILE A 80 5.578 4.278 0.049 1.00 0.52 N ATOM 1285 CA ILE A 80 5.937 2.939 -0.430 1.00 0.53 C ATOM 1286 C ILE A 80 5.408 2.721 -1.849 1.00 0.47 C ATOM 1287 O ILE A 80 6.006 1.986 -2.636 1.00 0.50 O ATOM 1288 CB ILE A 80 5.550 1.773 0.503 1.00 0.55 C ATOM 1289 CG1 ILE A 80 4.060 1.429 0.442 1.00 0.65 C ATOM 1290 CG2 ILE A 80 5.993 2.027 1.936 1.00 0.54 C ATOM 1291 CD1 ILE A 80 3.651 0.138 1.151 1.00 0.61 C ATOM 0 H ILE A 80 4.972 4.303 0.869 1.00 0.52 H new ATOM 0 HA ILE A 80 7.027 2.920 -0.435 1.00 0.53 H new ATOM 0 HB ILE A 80 6.089 0.901 0.132 1.00 0.55 H new ATOM 0 HG12 ILE A 80 3.497 2.255 0.876 1.00 0.65 H new ATOM 0 HG13 ILE A 80 3.765 1.357 -0.605 1.00 0.65 H new ATOM 0 HG21 ILE A 80 5.702 1.183 2.562 1.00 0.54 H new ATOM 0 HG22 ILE A 80 7.076 2.145 1.966 1.00 0.54 H new ATOM 0 HG23 ILE A 80 5.519 2.935 2.308 1.00 0.54 H new ATOM 0 HD11 ILE A 80 2.576 -0.010 1.046 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.178 -0.705 0.705 1.00 0.61 H new ATOM 0 HD13 ILE A 80 3.906 0.207 2.208 1.00 0.61 H new ATOM 1303 N GLY A 81 4.295 3.384 -2.179 1.00 0.43 N ATOM 1304 CA GLY A 81 3.798 3.453 -3.542 1.00 0.43 C ATOM 1305 C GLY A 81 4.917 3.778 -4.532 1.00 0.45 C ATOM 1306 O GLY A 81 5.018 3.165 -5.592 1.00 0.50 O ATOM 0 H GLY A 81 3.719 3.885 -1.503 1.00 0.43 H new ATOM 0 HA2 GLY A 81 3.338 2.502 -3.811 1.00 0.43 H new ATOM 0 HA3 GLY A 81 3.020 4.214 -3.608 1.00 0.43 H new ATOM 1310 N GLU A 82 5.774 4.737 -4.180 1.00 0.54 N ATOM 1311 CA GLU A 82 6.920 5.113 -4.988 1.00 0.62 C ATOM 1312 C GLU A 82 7.948 3.983 -5.033 1.00 0.63 C ATOM 1313 O GLU A 82 8.408 3.631 -6.120 1.00 0.73 O ATOM 1314 CB GLU A 82 7.426 6.482 -4.519 1.00 0.62 C ATOM 1315 CG GLU A 82 6.404 7.552 -4.943 1.00 0.91 C ATOM 1316 CD GLU A 82 6.291 8.763 -4.035 1.00 1.42 C ATOM 1317 OE1 GLU A 82 7.020 8.836 -3.025 1.00 2.50 O ATOM 1318 OE2 GLU A 82 5.403 9.579 -4.378 1.00 2.35 O ATOM 0 H GLU A 82 5.686 5.275 -3.318 1.00 0.54 H new ATOM 0 HA GLU A 82 6.652 5.246 -6.036 1.00 0.62 H new ATOM 0 HB2 GLU A 82 7.554 6.488 -3.437 1.00 0.62 H new ATOM 0 HB3 GLU A 82 8.401 6.695 -4.956 1.00 0.62 H new ATOM 0 HG2 GLU A 82 6.663 7.897 -5.944 1.00 0.91 H new ATOM 0 HG3 GLU A 82 5.423 7.082 -5.012 1.00 0.91 H new ATOM 1325 N LEU A 83 8.215 3.334 -3.895 1.00 0.55 N ATOM 1326 CA LEU A 83 9.033 2.126 -3.861 1.00 0.63 C ATOM 1327 C LEU A 83 8.555 1.110 -4.910 1.00 0.64 C ATOM 1328 O LEU A 83 9.370 0.570 -5.659 1.00 0.79 O ATOM 1329 CB LEU A 83 9.058 1.506 -2.451 1.00 0.70 C ATOM 1330 CG LEU A 83 10.457 1.160 -1.912 1.00 1.07 C ATOM 1331 CD1 LEU A 83 11.341 0.453 -2.945 1.00 2.12 C ATOM 1332 CD2 LEU A 83 11.165 2.407 -1.376 1.00 1.98 C ATOM 0 H LEU A 83 7.872 3.631 -2.981 1.00 0.55 H new ATOM 0 HA LEU A 83 10.056 2.408 -4.111 1.00 0.63 H new ATOM 0 HB2 LEU A 83 8.581 2.199 -1.758 1.00 0.70 H new ATOM 0 HB3 LEU A 83 8.455 0.598 -2.460 1.00 0.70 H new ATOM 0 HG LEU A 83 10.299 0.458 -1.093 1.00 1.07 H new ATOM 0 HD11 LEU A 83 12.314 0.236 -2.504 1.00 2.12 H new ATOM 0 HD12 LEU A 83 10.866 -0.479 -3.253 1.00 2.12 H new ATOM 0 HD13 LEU A 83 11.472 1.098 -3.814 1.00 2.12 H new ATOM 0 HD21 LEU A 83 12.151 2.133 -1.002 1.00 1.98 H new ATOM 0 HD22 LEU A 83 11.271 3.138 -2.178 1.00 1.98 H new ATOM 0 HD23 LEU A 83 10.577 2.840 -0.567 1.00 1.98 H new ATOM 1344 N ALA A 84 7.240 0.857 -4.982 1.00 0.55 N ATOM 1345 CA ALA A 84 6.678 -0.012 -6.014 1.00 0.63 C ATOM 1346 C ALA A 84 7.037 0.423 -7.447 1.00 0.67 C ATOM 1347 O ALA A 84 7.310 -0.435 -8.284 1.00 0.83 O ATOM 1348 CB ALA A 84 5.165 -0.151 -5.833 1.00 0.61 C ATOM 0 H ALA A 84 6.551 1.243 -4.337 1.00 0.55 H new ATOM 0 HA ALA A 84 7.140 -0.990 -5.882 1.00 0.63 H new ATOM 0 HB1 ALA A 84 4.764 -0.801 -6.610 1.00 0.61 H new ATOM 0 HB2 ALA A 84 4.954 -0.582 -4.854 1.00 0.61 H new ATOM 0 HB3 ALA A 84 4.698 0.831 -5.905 1.00 0.61 H new ATOM 1354 N LYS A 85 7.039 1.729 -7.758 1.00 0.64 N ATOM 1355 CA LYS A 85 7.504 2.202 -9.066 1.00 0.84 C ATOM 1356 C LYS A 85 8.994 1.888 -9.226 1.00 1.05 C ATOM 1357 O LYS A 85 9.409 1.343 -10.246 1.00 1.38 O ATOM 1358 CB LYS A 85 7.265 3.715 -9.264 1.00 1.11 C ATOM 1359 CG LYS A 85 6.276 4.033 -10.401 1.00 1.41 C ATOM 1360 CD LYS A 85 6.320 5.538 -10.740 1.00 1.75 C ATOM 1361 CE LYS A 85 4.996 6.124 -11.283 1.00 2.58 C ATOM 1362 NZ LYS A 85 4.000 6.337 -10.219 1.00 4.25 N ATOM 0 H LYS A 85 6.727 2.467 -7.127 1.00 0.64 H new ATOM 0 HA LYS A 85 6.925 1.680 -9.828 1.00 0.84 H new ATOM 0 HB2 LYS A 85 6.888 4.141 -8.334 1.00 1.11 H new ATOM 0 HB3 LYS A 85 8.217 4.202 -9.474 1.00 1.11 H new ATOM 0 HG2 LYS A 85 6.526 3.446 -11.285 1.00 1.41 H new ATOM 0 HG3 LYS A 85 5.266 3.749 -10.105 1.00 1.41 H new ATOM 0 HD2 LYS A 85 6.603 6.089 -9.843 1.00 1.75 H new ATOM 0 HD3 LYS A 85 7.104 5.706 -11.478 1.00 1.75 H new ATOM 0 HE2 LYS A 85 5.199 7.071 -11.783 1.00 2.58 H new ATOM 0 HE3 LYS A 85 4.584 5.450 -12.034 1.00 2.58 H new ATOM 0 HZ1 LYS A 85 3.093 6.617 -10.644 1.00 4.25 H new ATOM 0 HZ2 LYS A 85 3.873 5.456 -9.681 1.00 4.25 H new ATOM 0 HZ3 LYS A 85 4.330 7.088 -9.580 1.00 4.25 H new ATOM 1376 N GLU A 86 9.793 2.288 -8.232 1.00 0.93 N ATOM 1377 CA GLU A 86 11.239 2.123 -8.218 1.00 1.06 C ATOM 1378 C GLU A 86 11.619 0.660 -8.468 1.00 1.19 C ATOM 1379 O GLU A 86 12.118 0.321 -9.543 1.00 1.41 O ATOM 1380 CB GLU A 86 11.800 2.658 -6.890 1.00 0.94 C ATOM 1381 CG GLU A 86 11.620 4.181 -6.793 1.00 0.96 C ATOM 1382 CD GLU A 86 11.362 4.666 -5.374 1.00 1.18 C ATOM 1383 OE1 GLU A 86 12.010 4.181 -4.420 1.00 2.21 O ATOM 1384 OE2 GLU A 86 10.522 5.577 -5.212 1.00 1.74 O ATOM 0 H GLU A 86 9.436 2.748 -7.394 1.00 0.93 H new ATOM 0 HA GLU A 86 11.685 2.701 -9.027 1.00 1.06 H new ATOM 0 HB2 GLU A 86 11.293 2.174 -6.055 1.00 0.94 H new ATOM 0 HB3 GLU A 86 12.858 2.407 -6.810 1.00 0.94 H new ATOM 0 HG2 GLU A 86 12.513 4.671 -7.181 1.00 0.96 H new ATOM 0 HG3 GLU A 86 10.789 4.483 -7.430 1.00 0.96 H new ATOM 1391 N ILE A 87 11.388 -0.220 -7.493 1.00 1.12 N ATOM 1392 CA ILE A 87 11.647 -1.641 -7.678 1.00 1.30 C ATOM 1393 C ILE A 87 10.442 -2.238 -8.405 1.00 1.32 C ATOM 1394 O ILE A 87 9.554 -2.861 -7.822 1.00 1.38 O ATOM 1395 CB ILE A 87 12.066 -2.318 -6.352 1.00 1.34 C ATOM 1396 CG1 ILE A 87 13.571 -2.074 -6.140 1.00 1.85 C ATOM 1397 CG2 ILE A 87 11.826 -3.834 -6.293 1.00 2.27 C ATOM 1398 CD1 ILE A 87 14.437 -3.026 -6.984 1.00 1.98 C ATOM 0 H ILE A 87 11.024 0.028 -6.573 1.00 1.12 H new ATOM 0 HA ILE A 87 12.514 -1.825 -8.313 1.00 1.30 H new ATOM 0 HB ILE A 87 11.440 -1.874 -5.578 1.00 1.34 H new ATOM 0 HG12 ILE A 87 13.810 -1.042 -6.398 1.00 1.85 H new ATOM 0 HG13 ILE A 87 13.814 -2.203 -5.085 1.00 1.85 H new ATOM 0 HG21 ILE A 87 12.151 -4.216 -5.325 1.00 2.27 H new ATOM 0 HG22 ILE A 87 10.764 -4.040 -6.426 1.00 2.27 H new ATOM 0 HG23 ILE A 87 12.392 -4.323 -7.085 1.00 2.27 H new ATOM 0 HD11 ILE A 87 15.491 -2.817 -6.802 1.00 1.98 H new ATOM 0 HD12 ILE A 87 14.219 -4.058 -6.708 1.00 1.98 H new ATOM 0 HD13 ILE A 87 14.215 -2.879 -8.041 1.00 1.98 H new ATOM 1410 N ARG A 88 10.459 -2.092 -9.731 1.00 1.35 N ATOM 1411 CA ARG A 88 9.411 -2.605 -10.594 1.00 1.43 C ATOM 1412 C ARG A 88 9.688 -4.097 -10.784 1.00 1.41 C ATOM 1413 O ARG A 88 10.257 -4.510 -11.793 1.00 1.52 O ATOM 1414 CB ARG A 88 9.429 -1.834 -11.926 1.00 1.57 C ATOM 1415 CG ARG A 88 8.211 -2.169 -12.798 1.00 2.43 C ATOM 1416 CD ARG A 88 8.326 -1.488 -14.167 1.00 2.50 C ATOM 1417 NE ARG A 88 7.099 -1.675 -14.959 1.00 3.66 N ATOM 1418 CZ ARG A 88 6.944 -1.311 -16.244 1.00 4.14 C ATOM 1419 NH1 ARG A 88 7.970 -0.770 -16.911 1.00 3.60 N ATOM 1420 NH2 ARG A 88 5.766 -1.488 -16.854 1.00 5.50 N ATOM 0 H ARG A 88 11.206 -1.611 -10.232 1.00 1.35 H new ATOM 0 HA ARG A 88 8.418 -2.473 -10.165 1.00 1.43 H new ATOM 0 HB2 ARG A 88 9.448 -0.763 -11.725 1.00 1.57 H new ATOM 0 HB3 ARG A 88 10.342 -2.072 -12.471 1.00 1.57 H new ATOM 0 HG2 ARG A 88 8.135 -3.249 -12.928 1.00 2.43 H new ATOM 0 HG3 ARG A 88 7.298 -1.843 -12.299 1.00 2.43 H new ATOM 0 HD2 ARG A 88 8.516 -0.423 -14.032 1.00 2.50 H new ATOM 0 HD3 ARG A 88 9.178 -1.897 -14.709 1.00 2.50 H new ATOM 0 HE ARG A 88 6.304 -2.115 -14.496 1.00 3.66 H new ATOM 0 HH11 ARG A 88 8.867 -0.635 -16.445 1.00 3.60 H new ATOM 0 HH12 ARG A 88 7.855 -0.493 -17.886 1.00 3.60 H new ATOM 0 HH21 ARG A 88 4.984 -1.899 -16.344 1.00 5.50 H new ATOM 0 HH22 ARG A 88 5.650 -1.211 -17.829 1.00 5.50 H new ATOM 1434 N LYS A 89 9.315 -4.884 -9.766 1.00 1.44 N ATOM 1435 CA LYS A 89 9.487 -6.331 -9.706 1.00 1.44 C ATOM 1436 C LYS A 89 9.206 -6.979 -11.066 1.00 1.52 C ATOM 1437 O LYS A 89 8.131 -6.802 -11.636 1.00 1.94 O ATOM 1438 CB LYS A 89 8.579 -6.951 -8.634 1.00 1.74 C ATOM 1439 CG LYS A 89 8.804 -6.425 -7.203 1.00 1.51 C ATOM 1440 CD LYS A 89 7.682 -5.453 -6.803 1.00 1.60 C ATOM 1441 CE LYS A 89 7.854 -4.744 -5.451 1.00 1.91 C ATOM 1442 NZ LYS A 89 7.871 -5.669 -4.301 1.00 3.17 N ATOM 0 H LYS A 89 8.867 -4.509 -8.930 1.00 1.44 H new ATOM 0 HA LYS A 89 10.526 -6.524 -9.438 1.00 1.44 H new ATOM 0 HB2 LYS A 89 7.540 -6.771 -8.911 1.00 1.74 H new ATOM 0 HB3 LYS A 89 8.727 -8.031 -8.635 1.00 1.74 H new ATOM 0 HG2 LYS A 89 8.836 -7.260 -6.503 1.00 1.51 H new ATOM 0 HG3 LYS A 89 9.769 -5.921 -7.142 1.00 1.51 H new ATOM 0 HD2 LYS A 89 7.592 -4.694 -7.580 1.00 1.60 H new ATOM 0 HD3 LYS A 89 6.741 -6.003 -6.785 1.00 1.60 H new ATOM 0 HE2 LYS A 89 8.783 -4.175 -5.463 1.00 1.91 H new ATOM 0 HE3 LYS A 89 7.043 -4.028 -5.319 1.00 1.91 H new ATOM 0 HZ1 LYS A 89 7.650 -5.145 -3.430 1.00 3.17 H new ATOM 0 HZ2 LYS A 89 7.161 -6.416 -4.445 1.00 3.17 H new ATOM 0 HZ3 LYS A 89 8.814 -6.099 -4.216 1.00 3.17 H new ATOM 1456 N LYS A 90 10.195 -7.715 -11.583 1.00 1.77 N ATOM 1457 CA LYS A 90 10.206 -8.197 -12.954 1.00 2.04 C ATOM 1458 C LYS A 90 8.984 -9.061 -13.270 1.00 1.80 C ATOM 1459 O LYS A 90 8.430 -8.953 -14.364 1.00 2.49 O ATOM 1460 CB LYS A 90 11.523 -8.943 -13.213 1.00 2.90 C ATOM 1461 CG LYS A 90 11.665 -9.379 -14.678 1.00 3.55 C ATOM 1462 CD LYS A 90 13.073 -9.942 -14.916 1.00 4.68 C ATOM 1463 CE LYS A 90 13.299 -10.382 -16.371 1.00 5.61 C ATOM 1464 NZ LYS A 90 12.479 -11.554 -16.746 1.00 6.65 N ATOM 0 H LYS A 90 11.018 -7.992 -11.048 1.00 1.77 H new ATOM 0 HA LYS A 90 10.145 -7.343 -13.629 1.00 2.04 H new ATOM 0 HB2 LYS A 90 12.361 -8.300 -12.944 1.00 2.90 H new ATOM 0 HB3 LYS A 90 11.574 -9.820 -12.568 1.00 2.90 H new ATOM 0 HG2 LYS A 90 10.916 -10.134 -14.917 1.00 3.55 H new ATOM 0 HG3 LYS A 90 11.485 -8.531 -15.339 1.00 3.55 H new ATOM 0 HD2 LYS A 90 13.812 -9.186 -14.651 1.00 4.68 H new ATOM 0 HD3 LYS A 90 13.236 -10.793 -14.254 1.00 4.68 H new ATOM 0 HE2 LYS A 90 13.066 -9.552 -17.038 1.00 5.61 H new ATOM 0 HE3 LYS A 90 14.353 -10.620 -16.515 1.00 5.61 H new ATOM 0 HZ1 LYS A 90 12.670 -11.809 -17.736 1.00 6.65 H new ATOM 0 HZ2 LYS A 90 12.718 -12.357 -16.130 1.00 6.65 H new ATOM 0 HZ3 LYS A 90 11.471 -11.322 -16.636 1.00 6.65 H new ATOM 1478 N LYS A 91 8.593 -9.946 -12.347 1.00 1.78 N ATOM 1479 CA LYS A 91 7.418 -10.785 -12.540 1.00 2.22 C ATOM 1480 C LYS A 91 6.890 -11.308 -11.199 1.00 2.59 C ATOM 1481 O LYS A 91 5.772 -10.970 -10.821 1.00 3.12 O ATOM 1482 CB LYS A 91 7.764 -11.929 -13.512 1.00 2.75 C ATOM 1483 CG LYS A 91 6.515 -12.608 -14.087 1.00 3.64 C ATOM 1484 CD LYS A 91 6.935 -13.844 -14.900 1.00 4.15 C ATOM 1485 CE LYS A 91 5.767 -14.800 -15.183 1.00 5.12 C ATOM 1486 NZ LYS A 91 4.709 -14.179 -15.999 1.00 5.93 N ATOM 0 H LYS A 91 9.076 -10.096 -11.461 1.00 1.78 H new ATOM 0 HA LYS A 91 6.616 -10.192 -12.979 1.00 2.22 H new ATOM 0 HB2 LYS A 91 8.369 -11.537 -14.329 1.00 2.75 H new ATOM 0 HB3 LYS A 91 8.371 -12.671 -12.993 1.00 2.75 H new ATOM 0 HG2 LYS A 91 5.843 -12.901 -13.281 1.00 3.64 H new ATOM 0 HG3 LYS A 91 5.968 -11.911 -14.721 1.00 3.64 H new ATOM 0 HD2 LYS A 91 7.370 -13.520 -15.846 1.00 4.15 H new ATOM 0 HD3 LYS A 91 7.714 -14.381 -14.359 1.00 4.15 H new ATOM 0 HE2 LYS A 91 6.143 -15.685 -15.696 1.00 5.12 H new ATOM 0 HE3 LYS A 91 5.341 -15.136 -14.238 1.00 5.12 H new ATOM 0 HZ1 LYS A 91 3.946 -14.867 -16.160 1.00 5.93 H new ATOM 0 HZ2 LYS A 91 4.328 -13.350 -15.501 1.00 5.93 H new ATOM 0 HZ3 LYS A 91 5.105 -13.881 -16.913 1.00 5.93 H new ATOM 1500 N ASP A 92 7.705 -12.097 -10.484 1.00 2.68 N ATOM 1501 CA ASP A 92 7.245 -12.980 -9.405 1.00 3.33 C ATOM 1502 C ASP A 92 8.297 -12.996 -8.288 1.00 2.94 C ATOM 1503 O ASP A 92 8.881 -14.037 -7.992 1.00 3.72 O ATOM 1504 CB ASP A 92 7.041 -14.413 -9.942 1.00 4.26 C ATOM 1505 CG ASP A 92 6.139 -14.532 -11.160 1.00 5.19 C ATOM 1506 OD1 ASP A 92 4.997 -14.034 -11.113 1.00 6.02 O ATOM 1507 OD2 ASP A 92 6.624 -15.107 -12.159 1.00 5.60 O ATOM 0 H ASP A 92 8.712 -12.140 -10.641 1.00 2.68 H new ATOM 0 HA ASP A 92 6.296 -12.611 -9.016 1.00 3.33 H new ATOM 0 HB2 ASP A 92 8.016 -14.831 -10.191 1.00 4.26 H new ATOM 0 HB3 ASP A 92 6.626 -15.027 -9.142 1.00 4.26 H new ATOM 1512 N LEU A 93 8.591 -11.827 -7.710 1.00 2.04 N ATOM 1513 CA LEU A 93 9.817 -11.587 -6.950 1.00 1.60 C ATOM 1514 C LEU A 93 10.248 -12.721 -6.009 1.00 1.68 C ATOM 1515 O LEU A 93 11.394 -13.154 -6.121 1.00 1.99 O ATOM 1516 CB LEU A 93 9.828 -10.216 -6.264 1.00 1.70 C ATOM 1517 CG LEU A 93 8.617 -9.900 -5.378 1.00 1.71 C ATOM 1518 CD1 LEU A 93 9.044 -8.911 -4.288 1.00 2.92 C ATOM 1519 CD2 LEU A 93 7.386 -9.450 -6.183 1.00 2.09 C ATOM 0 H LEU A 93 7.977 -11.014 -7.758 1.00 2.04 H new ATOM 0 HA LEU A 93 10.595 -11.575 -7.714 1.00 1.60 H new ATOM 0 HB2 LEU A 93 10.729 -10.144 -5.654 1.00 1.70 H new ATOM 0 HB3 LEU A 93 9.901 -9.447 -7.033 1.00 1.70 H new ATOM 0 HG LEU A 93 8.282 -10.815 -4.890 1.00 1.71 H new ATOM 0 HD11 LEU A 93 8.190 -8.679 -3.652 1.00 2.92 H new ATOM 0 HD12 LEU A 93 9.836 -9.354 -3.685 1.00 2.92 H new ATOM 0 HD13 LEU A 93 9.410 -7.995 -4.751 1.00 2.92 H new ATOM 0 HD21 LEU A 93 6.562 -9.241 -5.501 1.00 2.09 H new ATOM 0 HD22 LEU A 93 7.629 -8.549 -6.746 1.00 2.09 H new ATOM 0 HD23 LEU A 93 7.094 -10.241 -6.874 1.00 2.09 H new ATOM 1531 N LYS A 94 9.360 -13.230 -5.135 1.00 1.74 N ATOM 1532 CA LYS A 94 9.719 -14.260 -4.151 1.00 1.83 C ATOM 1533 C LYS A 94 10.430 -15.469 -4.764 1.00 2.17 C ATOM 1534 O LYS A 94 11.070 -16.230 -4.039 1.00 2.35 O ATOM 1535 CB LYS A 94 8.513 -14.804 -3.366 1.00 2.04 C ATOM 1536 CG LYS A 94 7.689 -13.782 -2.583 1.00 2.11 C ATOM 1537 CD LYS A 94 6.713 -14.534 -1.663 1.00 2.44 C ATOM 1538 CE LYS A 94 5.809 -13.574 -0.877 1.00 2.99 C ATOM 1539 NZ LYS A 94 4.891 -14.286 0.036 1.00 3.72 N ATOM 0 H LYS A 94 8.383 -12.940 -5.093 1.00 1.74 H new ATOM 0 HA LYS A 94 10.395 -13.730 -3.480 1.00 1.83 H new ATOM 0 HB2 LYS A 94 7.850 -15.311 -4.068 1.00 2.04 H new ATOM 0 HB3 LYS A 94 8.874 -15.558 -2.667 1.00 2.04 H new ATOM 0 HG2 LYS A 94 8.344 -13.140 -1.994 1.00 2.11 H new ATOM 0 HG3 LYS A 94 7.140 -13.135 -3.268 1.00 2.11 H new ATOM 0 HD2 LYS A 94 6.096 -15.206 -2.260 1.00 2.44 H new ATOM 0 HD3 LYS A 94 7.277 -15.154 -0.966 1.00 2.44 H new ATOM 0 HE2 LYS A 94 6.428 -12.886 -0.302 1.00 2.99 H new ATOM 0 HE3 LYS A 94 5.228 -12.972 -1.576 1.00 2.99 H new ATOM 0 HZ1 LYS A 94 4.741 -13.715 0.892 1.00 3.72 H new ATOM 0 HZ2 LYS A 94 3.980 -14.442 -0.440 1.00 3.72 H new ATOM 0 HZ3 LYS A 94 5.305 -15.203 0.299 1.00 3.72 H new ATOM 1553 N ILE A 95 10.308 -15.688 -6.078 1.00 2.37 N ATOM 1554 CA ILE A 95 11.069 -16.702 -6.784 1.00 2.75 C ATOM 1555 C ILE A 95 12.576 -16.633 -6.497 1.00 2.90 C ATOM 1556 O ILE A 95 13.268 -17.615 -6.740 1.00 3.28 O ATOM 1557 CB ILE A 95 10.726 -16.639 -8.281 1.00 2.82 C ATOM 1558 CG1 ILE A 95 10.963 -17.997 -8.957 1.00 2.80 C ATOM 1559 CG2 ILE A 95 11.487 -15.508 -8.991 1.00 2.81 C ATOM 1560 CD1 ILE A 95 10.365 -18.011 -10.363 1.00 2.96 C ATOM 0 H ILE A 95 9.673 -15.160 -6.676 1.00 2.37 H new ATOM 0 HA ILE A 95 10.777 -17.683 -6.408 1.00 2.75 H new ATOM 0 HB ILE A 95 9.664 -16.408 -8.368 1.00 2.82 H new ATOM 0 HG12 ILE A 95 12.032 -18.201 -9.009 1.00 2.80 H new ATOM 0 HG13 ILE A 95 10.516 -18.790 -8.358 1.00 2.80 H new ATOM 0 HG21 ILE A 95 11.218 -15.496 -10.047 1.00 2.81 H new ATOM 0 HG22 ILE A 95 11.224 -14.552 -8.538 1.00 2.81 H new ATOM 0 HG23 ILE A 95 12.560 -15.673 -8.892 1.00 2.81 H new ATOM 0 HD11 ILE A 95 10.544 -18.982 -10.825 1.00 2.96 H new ATOM 0 HD12 ILE A 95 9.292 -17.829 -10.304 1.00 2.96 H new ATOM 0 HD13 ILE A 95 10.832 -17.232 -10.965 1.00 2.96 H new ATOM 1572 N ARG A 96 13.108 -15.506 -5.998 1.00 2.70 N ATOM 1573 CA ARG A 96 14.454 -15.459 -5.435 1.00 3.05 C ATOM 1574 C ARG A 96 15.477 -15.751 -6.540 1.00 3.58 C ATOM 1575 O ARG A 96 16.365 -16.588 -6.402 1.00 5.03 O ATOM 1576 CB ARG A 96 14.536 -16.371 -4.191 1.00 3.48 C ATOM 1577 CG ARG A 96 15.876 -16.553 -3.447 1.00 3.71 C ATOM 1578 CD ARG A 96 16.556 -15.385 -2.710 1.00 3.58 C ATOM 1579 NE ARG A 96 16.166 -14.042 -3.154 1.00 3.76 N ATOM 1580 CZ ARG A 96 16.698 -13.310 -4.138 1.00 4.30 C ATOM 1581 NH1 ARG A 96 17.599 -13.851 -4.963 1.00 4.66 N ATOM 1582 NH2 ARG A 96 16.285 -12.050 -4.280 1.00 5.38 N ATOM 0 H ARG A 96 12.617 -14.612 -5.976 1.00 2.70 H new ATOM 0 HA ARG A 96 14.701 -14.463 -5.067 1.00 3.05 H new ATOM 0 HB2 ARG A 96 13.813 -15.995 -3.467 1.00 3.48 H new ATOM 0 HB3 ARG A 96 14.198 -17.362 -4.494 1.00 3.48 H new ATOM 0 HG2 ARG A 96 15.725 -17.345 -2.713 1.00 3.71 H new ATOM 0 HG3 ARG A 96 16.594 -16.927 -4.176 1.00 3.71 H new ATOM 0 HD2 ARG A 96 16.338 -15.474 -1.646 1.00 3.58 H new ATOM 0 HD3 ARG A 96 17.635 -15.486 -2.823 1.00 3.58 H new ATOM 0 HE ARG A 96 15.391 -13.613 -2.648 1.00 3.76 H new ATOM 0 HH11 ARG A 96 17.882 -14.824 -4.842 1.00 4.66 H new ATOM 0 HH12 ARG A 96 18.004 -13.291 -5.713 1.00 4.66 H new ATOM 0 HH21 ARG A 96 15.582 -11.669 -3.647 1.00 5.38 H new ATOM 0 HH22 ARG A 96 16.673 -11.467 -5.022 1.00 5.38 H new ATOM 1681 N GLU B 4 11.131 -15.545 0.457 1.00 2.57 N ATOM 1682 CA GLU B 4 12.539 -15.280 0.181 1.00 2.31 C ATOM 1683 C GLU B 4 12.954 -14.375 1.355 1.00 2.18 C ATOM 1684 O GLU B 4 12.113 -14.171 2.235 1.00 2.74 O ATOM 1685 CB GLU B 4 12.757 -14.719 -1.238 1.00 2.19 C ATOM 1686 CG GLU B 4 12.560 -13.204 -1.456 1.00 2.09 C ATOM 1687 CD GLU B 4 13.378 -12.713 -2.636 1.00 2.55 C ATOM 1688 OE1 GLU B 4 13.001 -13.014 -3.781 1.00 3.49 O ATOM 1689 OE2 GLU B 4 14.468 -12.146 -2.393 1.00 3.06 O ATOM 0 HA GLU B 4 13.175 -16.164 0.145 1.00 2.31 H new ATOM 0 HB2 GLU B 4 13.772 -14.971 -1.545 1.00 2.19 H new ATOM 0 HB3 GLU B 4 12.081 -15.244 -1.912 1.00 2.19 H new ATOM 0 HG2 GLU B 4 11.505 -12.992 -1.627 1.00 2.09 H new ATOM 0 HG3 GLU B 4 12.852 -12.663 -0.556 1.00 2.09 H new ATOM 1696 N PRO B 5 14.184 -13.857 1.482 1.00 1.93 N ATOM 1697 CA PRO B 5 14.509 -12.956 2.581 1.00 1.89 C ATOM 1698 C PRO B 5 13.852 -11.565 2.412 1.00 1.55 C ATOM 1699 O PRO B 5 14.506 -10.548 2.622 1.00 1.66 O ATOM 1700 CB PRO B 5 16.041 -12.919 2.594 1.00 2.39 C ATOM 1701 CG PRO B 5 16.405 -13.072 1.117 1.00 2.25 C ATOM 1702 CD PRO B 5 15.297 -13.965 0.553 1.00 2.09 C ATOM 0 HA PRO B 5 14.115 -13.297 3.538 1.00 1.89 H new ATOM 0 HB2 PRO B 5 16.418 -11.983 3.007 1.00 2.39 H new ATOM 0 HB3 PRO B 5 16.458 -13.725 3.197 1.00 2.39 H new ATOM 0 HG2 PRO B 5 16.436 -12.107 0.611 1.00 2.25 H new ATOM 0 HG3 PRO B 5 17.387 -13.528 0.993 1.00 2.25 H new ATOM 0 HD2 PRO B 5 15.005 -13.640 -0.446 1.00 2.09 H new ATOM 0 HD3 PRO B 5 15.634 -14.998 0.467 1.00 2.09 H new ATOM 1710 N LEU B 6 12.555 -11.511 2.074 1.00 1.42 N ATOM 1711 CA LEU B 6 11.706 -10.332 2.167 1.00 1.40 C ATOM 1712 C LEU B 6 10.875 -10.413 3.448 1.00 1.30 C ATOM 1713 O LEU B 6 10.939 -11.403 4.177 1.00 1.48 O ATOM 1714 CB LEU B 6 10.870 -10.138 0.885 1.00 1.46 C ATOM 1715 CG LEU B 6 9.612 -10.997 0.619 1.00 1.38 C ATOM 1716 CD1 LEU B 6 9.831 -12.491 0.829 1.00 2.42 C ATOM 1717 CD2 LEU B 6 8.363 -10.568 1.396 1.00 2.79 C ATOM 0 H LEU B 6 12.056 -12.325 1.715 1.00 1.42 H new ATOM 0 HA LEU B 6 12.318 -9.433 2.237 1.00 1.40 H new ATOM 0 HB2 LEU B 6 10.555 -9.095 0.864 1.00 1.46 H new ATOM 0 HB3 LEU B 6 11.542 -10.285 0.040 1.00 1.46 H new ATOM 0 HG LEU B 6 9.428 -10.810 -0.439 1.00 1.38 H new ATOM 0 HD11 LEU B 6 8.904 -13.027 0.623 1.00 2.42 H new ATOM 0 HD12 LEU B 6 10.611 -12.843 0.154 1.00 2.42 H new ATOM 0 HD13 LEU B 6 10.134 -12.673 1.860 1.00 2.42 H new ATOM 0 HD21 LEU B 6 7.533 -11.228 1.144 1.00 2.79 H new ATOM 0 HD22 LEU B 6 8.562 -10.627 2.466 1.00 2.79 H new ATOM 0 HD23 LEU B 6 8.104 -9.543 1.131 1.00 2.79 H new ATOM 1729 N THR B 7 10.113 -9.360 3.740 1.00 1.28 N ATOM 1730 CA THR B 7 9.386 -9.201 4.994 1.00 1.28 C ATOM 1731 C THR B 7 7.978 -8.693 4.688 1.00 1.23 C ATOM 1732 O THR B 7 7.747 -8.172 3.599 1.00 1.26 O ATOM 1733 CB THR B 7 10.137 -8.157 5.822 1.00 1.32 C ATOM 1734 OG1 THR B 7 11.534 -8.369 5.782 1.00 1.52 O ATOM 1735 CG2 THR B 7 9.732 -8.119 7.298 1.00 1.35 C ATOM 0 H THR B 7 9.983 -8.579 3.097 1.00 1.28 H new ATOM 0 HA THR B 7 9.315 -10.145 5.535 1.00 1.28 H new ATOM 0 HB THR B 7 9.864 -7.209 5.359 1.00 1.32 H new ATOM 0 HG1 THR B 7 11.972 -7.790 6.440 1.00 1.52 H new ATOM 0 HG21 THR B 7 10.310 -7.353 7.814 1.00 1.35 H new ATOM 0 HG22 THR B 7 8.670 -7.887 7.378 1.00 1.35 H new ATOM 0 HG23 THR B 7 9.927 -9.090 7.754 1.00 1.35 H new ATOM 1743 N GLU B 8 7.064 -8.772 5.661 1.00 1.27 N ATOM 1744 CA GLU B 8 5.677 -8.352 5.517 1.00 1.28 C ATOM 1745 C GLU B 8 5.486 -6.973 4.872 1.00 1.16 C ATOM 1746 O GLU B 8 4.524 -6.798 4.128 1.00 1.23 O ATOM 1747 CB GLU B 8 4.936 -8.504 6.852 1.00 1.53 C ATOM 1748 CG GLU B 8 4.483 -9.965 6.988 1.00 2.36 C ATOM 1749 CD GLU B 8 4.141 -10.380 8.408 1.00 3.18 C ATOM 1750 OE1 GLU B 8 3.933 -9.492 9.259 1.00 3.98 O ATOM 1751 OE2 GLU B 8 4.158 -11.613 8.624 1.00 4.02 O ATOM 0 H GLU B 8 7.278 -9.138 6.588 1.00 1.27 H new ATOM 0 HA GLU B 8 5.221 -9.027 4.793 1.00 1.28 H new ATOM 0 HB2 GLU B 8 5.588 -8.230 7.681 1.00 1.53 H new ATOM 0 HB3 GLU B 8 4.076 -7.835 6.887 1.00 1.53 H new ATOM 0 HG2 GLU B 8 3.610 -10.124 6.355 1.00 2.36 H new ATOM 0 HG3 GLU B 8 5.273 -10.615 6.611 1.00 2.36 H new ATOM 1758 N LEU B 9 6.402 -6.011 5.078 1.00 1.07 N ATOM 1759 CA LEU B 9 6.315 -4.743 4.351 1.00 1.06 C ATOM 1760 C LEU B 9 6.227 -5.038 2.846 1.00 1.17 C ATOM 1761 O LEU B 9 5.270 -4.667 2.163 1.00 1.33 O ATOM 1762 CB LEU B 9 7.546 -3.856 4.640 1.00 1.00 C ATOM 1763 CG LEU B 9 7.465 -3.021 5.932 1.00 1.04 C ATOM 1764 CD1 LEU B 9 7.579 -3.807 7.248 1.00 2.02 C ATOM 1765 CD2 LEU B 9 8.480 -1.873 5.918 1.00 2.56 C ATOM 0 H LEU B 9 7.188 -6.086 5.724 1.00 1.07 H new ATOM 0 HA LEU B 9 5.426 -4.205 4.680 1.00 1.06 H new ATOM 0 HB2 LEU B 9 8.429 -4.494 4.693 1.00 1.00 H new ATOM 0 HB3 LEU B 9 7.692 -3.179 3.798 1.00 1.00 H new ATOM 0 HG LEU B 9 6.448 -2.629 5.921 1.00 1.04 H new ATOM 0 HD11 LEU B 9 7.509 -3.119 8.090 1.00 2.02 H new ATOM 0 HD12 LEU B 9 6.771 -4.536 7.307 1.00 2.02 H new ATOM 0 HD13 LEU B 9 8.538 -4.324 7.281 1.00 2.02 H new ATOM 0 HD21 LEU B 9 8.397 -1.303 6.843 1.00 2.56 H new ATOM 0 HD22 LEU B 9 9.488 -2.279 5.831 1.00 2.56 H new ATOM 0 HD23 LEU B 9 8.278 -1.219 5.070 1.00 2.56 H new ATOM 1777 N GLU B 10 7.247 -5.738 2.354 1.00 1.14 N ATOM 1778 CA GLU B 10 7.431 -6.088 0.959 1.00 1.15 C ATOM 1779 C GLU B 10 6.353 -7.083 0.515 1.00 1.11 C ATOM 1780 O GLU B 10 5.825 -6.980 -0.592 1.00 1.15 O ATOM 1781 CB GLU B 10 8.885 -6.557 0.801 1.00 1.11 C ATOM 1782 CG GLU B 10 9.341 -7.094 -0.563 1.00 1.25 C ATOM 1783 CD GLU B 10 9.136 -6.195 -1.778 1.00 1.84 C ATOM 1784 OE1 GLU B 10 8.242 -5.322 -1.781 1.00 3.19 O ATOM 1785 OE2 GLU B 10 9.824 -6.416 -2.800 1.00 2.32 O ATOM 0 H GLU B 10 7.998 -6.089 2.948 1.00 1.14 H new ATOM 0 HA GLU B 10 7.293 -5.243 0.284 1.00 1.15 H new ATOM 0 HB2 GLU B 10 9.533 -5.719 1.060 1.00 1.11 H new ATOM 0 HB3 GLU B 10 9.063 -7.338 1.540 1.00 1.11 H new ATOM 0 HG2 GLU B 10 10.403 -7.329 -0.494 1.00 1.25 H new ATOM 0 HG3 GLU B 10 8.818 -8.033 -0.747 1.00 1.25 H new ATOM 1792 N GLU B 11 5.960 -7.995 1.409 1.00 1.14 N ATOM 1793 CA GLU B 11 4.867 -8.916 1.139 1.00 1.20 C ATOM 1794 C GLU B 11 3.591 -8.143 0.780 1.00 1.12 C ATOM 1795 O GLU B 11 2.927 -8.456 -0.209 1.00 1.21 O ATOM 1796 CB GLU B 11 4.649 -9.879 2.312 1.00 1.38 C ATOM 1797 CG GLU B 11 3.888 -11.135 1.867 1.00 1.95 C ATOM 1798 CD GLU B 11 4.081 -12.302 2.824 1.00 2.25 C ATOM 1799 OE1 GLU B 11 4.258 -12.056 4.036 1.00 3.02 O ATOM 1800 OE2 GLU B 11 4.114 -13.435 2.292 1.00 2.70 O ATOM 0 H GLU B 11 6.388 -8.110 2.328 1.00 1.14 H new ATOM 0 HA GLU B 11 5.134 -9.528 0.277 1.00 1.20 H new ATOM 0 HB2 GLU B 11 5.612 -10.165 2.734 1.00 1.38 H new ATOM 0 HB3 GLU B 11 4.092 -9.374 3.101 1.00 1.38 H new ATOM 0 HG2 GLU B 11 2.826 -10.904 1.790 1.00 1.95 H new ATOM 0 HG3 GLU B 11 4.224 -11.426 0.872 1.00 1.95 H new ATOM 1807 N SER B 12 3.262 -7.090 1.543 1.00 1.08 N ATOM 1808 CA SER B 12 2.048 -6.336 1.257 1.00 1.10 C ATOM 1809 C SER B 12 2.174 -5.700 -0.121 1.00 1.00 C ATOM 1810 O SER B 12 1.224 -5.683 -0.908 1.00 1.07 O ATOM 1811 CB SER B 12 1.811 -5.250 2.306 1.00 1.19 C ATOM 1812 OG SER B 12 1.644 -5.819 3.587 1.00 1.77 O ATOM 0 H SER B 12 3.805 -6.754 2.338 1.00 1.08 H new ATOM 0 HA SER B 12 1.198 -7.018 1.282 1.00 1.10 H new ATOM 0 HB2 SER B 12 2.654 -4.559 2.317 1.00 1.19 H new ATOM 0 HB3 SER B 12 0.926 -4.670 2.042 1.00 1.19 H new ATOM 0 HG SER B 12 2.496 -6.197 3.891 1.00 1.77 H new ATOM 1818 N ILE B 13 3.359 -5.156 -0.398 1.00 0.94 N ATOM 1819 CA ILE B 13 3.630 -4.485 -1.651 1.00 0.92 C ATOM 1820 C ILE B 13 3.398 -5.441 -2.822 1.00 0.90 C ATOM 1821 O ILE B 13 2.702 -5.086 -3.779 1.00 0.91 O ATOM 1822 CB ILE B 13 5.045 -3.879 -1.617 1.00 0.93 C ATOM 1823 CG1 ILE B 13 5.051 -2.684 -0.657 1.00 1.11 C ATOM 1824 CG2 ILE B 13 5.590 -3.407 -2.971 1.00 0.84 C ATOM 1825 CD1 ILE B 13 6.413 -2.460 -0.026 1.00 0.99 C ATOM 0 H ILE B 13 4.151 -5.173 0.244 1.00 0.94 H new ATOM 0 HA ILE B 13 2.938 -3.656 -1.797 1.00 0.92 H new ATOM 0 HB ILE B 13 5.698 -4.689 -1.292 1.00 0.93 H new ATOM 0 HG12 ILE B 13 4.751 -1.786 -1.196 1.00 1.11 H new ATOM 0 HG13 ILE B 13 4.312 -2.847 0.127 1.00 1.11 H new ATOM 0 HG21 ILE B 13 6.591 -2.997 -2.837 1.00 0.84 H new ATOM 0 HG22 ILE B 13 5.632 -4.250 -3.660 1.00 0.84 H new ATOM 0 HG23 ILE B 13 4.935 -2.637 -3.379 1.00 0.84 H new ATOM 0 HD11 ILE B 13 6.366 -1.603 0.646 1.00 0.99 H new ATOM 0 HD12 ILE B 13 6.703 -3.347 0.537 1.00 0.99 H new ATOM 0 HD13 ILE B 13 7.149 -2.269 -0.807 1.00 0.99 H new ATOM 1837 N GLU B 14 3.984 -6.642 -2.771 1.00 0.94 N ATOM 1838 CA GLU B 14 3.860 -7.556 -3.892 1.00 1.02 C ATOM 1839 C GLU B 14 2.402 -7.957 -4.172 1.00 1.04 C ATOM 1840 O GLU B 14 2.013 -8.085 -5.334 1.00 1.08 O ATOM 1841 CB GLU B 14 4.851 -8.710 -3.846 1.00 1.16 C ATOM 1842 CG GLU B 14 4.748 -9.643 -2.653 1.00 1.50 C ATOM 1843 CD GLU B 14 5.840 -10.691 -2.762 1.00 2.01 C ATOM 1844 OE1 GLU B 14 5.907 -11.308 -3.847 1.00 2.44 O ATOM 1845 OE2 GLU B 14 6.597 -10.858 -1.783 1.00 3.25 O ATOM 0 H GLU B 14 4.533 -6.990 -1.985 1.00 0.94 H new ATOM 0 HA GLU B 14 4.162 -6.999 -4.779 1.00 1.02 H new ATOM 0 HB2 GLU B 14 4.729 -9.301 -4.753 1.00 1.16 H new ATOM 0 HB3 GLU B 14 5.859 -8.296 -3.869 1.00 1.16 H new ATOM 0 HG2 GLU B 14 4.853 -9.082 -1.724 1.00 1.50 H new ATOM 0 HG3 GLU B 14 3.768 -10.119 -2.629 1.00 1.50 H new ATOM 1852 N THR B 15 1.576 -8.082 -3.126 1.00 1.09 N ATOM 1853 CA THR B 15 0.142 -8.313 -3.287 1.00 1.23 C ATOM 1854 C THR B 15 -0.489 -7.232 -4.177 1.00 1.18 C ATOM 1855 O THR B 15 -1.219 -7.550 -5.117 1.00 1.27 O ATOM 1856 CB THR B 15 -0.586 -8.451 -1.937 1.00 1.43 C ATOM 1857 OG1 THR B 15 -0.092 -9.580 -1.249 1.00 1.59 O ATOM 1858 CG2 THR B 15 -2.096 -8.640 -2.150 1.00 1.71 C ATOM 0 H THR B 15 1.882 -8.026 -2.155 1.00 1.09 H new ATOM 0 HA THR B 15 0.021 -9.271 -3.792 1.00 1.23 H new ATOM 0 HB THR B 15 -0.412 -7.542 -1.361 1.00 1.43 H new ATOM 0 HG1 THR B 15 -0.790 -9.936 -0.661 1.00 1.59 H new ATOM 0 HG21 THR B 15 -2.591 -8.735 -1.183 1.00 1.71 H new ATOM 0 HG22 THR B 15 -2.499 -7.777 -2.681 1.00 1.71 H new ATOM 0 HG23 THR B 15 -2.271 -9.541 -2.737 1.00 1.71 H new ATOM 1866 N VAL B 16 -0.229 -5.947 -3.915 1.00 1.09 N ATOM 1867 CA VAL B 16 -0.831 -4.889 -4.712 1.00 1.09 C ATOM 1868 C VAL B 16 -0.411 -5.030 -6.175 1.00 1.08 C ATOM 1869 O VAL B 16 -1.250 -5.058 -7.073 1.00 1.18 O ATOM 1870 CB VAL B 16 -0.451 -3.512 -4.152 1.00 1.02 C ATOM 1871 CG1 VAL B 16 -0.861 -2.424 -5.144 1.00 1.04 C ATOM 1872 CG2 VAL B 16 -1.136 -3.264 -2.808 1.00 1.17 C ATOM 0 H VAL B 16 0.385 -5.624 -3.168 1.00 1.09 H new ATOM 0 HA VAL B 16 -1.916 -4.979 -4.661 1.00 1.09 H new ATOM 0 HB VAL B 16 0.628 -3.486 -4.001 1.00 1.02 H new ATOM 0 HG11 VAL B 16 -0.590 -1.447 -4.745 1.00 1.04 H new ATOM 0 HG12 VAL B 16 -0.347 -2.584 -6.092 1.00 1.04 H new ATOM 0 HG13 VAL B 16 -1.938 -2.465 -5.304 1.00 1.04 H new ATOM 0 HG21 VAL B 16 -0.852 -2.282 -2.430 1.00 1.17 H new ATOM 0 HG22 VAL B 16 -2.217 -3.304 -2.938 1.00 1.17 H new ATOM 0 HG23 VAL B 16 -0.828 -4.030 -2.096 1.00 1.17 H new ATOM 1882 N VAL B 17 0.894 -5.095 -6.434 1.00 1.00 N ATOM 1883 CA VAL B 17 1.352 -5.153 -7.814 1.00 1.05 C ATOM 1884 C VAL B 17 0.793 -6.390 -8.534 1.00 1.07 C ATOM 1885 O VAL B 17 0.298 -6.265 -9.654 1.00 1.15 O ATOM 1886 CB VAL B 17 2.873 -4.999 -7.937 1.00 0.88 C ATOM 1887 CG1 VAL B 17 3.337 -3.655 -7.360 1.00 1.16 C ATOM 1888 CG2 VAL B 17 3.586 -6.129 -7.212 1.00 0.77 C ATOM 0 H VAL B 17 1.630 -5.108 -5.728 1.00 1.00 H new ATOM 0 HA VAL B 17 0.944 -4.287 -8.335 1.00 1.05 H new ATOM 0 HB VAL B 17 3.123 -5.036 -8.997 1.00 0.88 H new ATOM 0 HG11 VAL B 17 4.419 -3.571 -7.459 1.00 1.16 H new ATOM 0 HG12 VAL B 17 2.858 -2.841 -7.904 1.00 1.16 H new ATOM 0 HG13 VAL B 17 3.064 -3.598 -6.306 1.00 1.16 H new ATOM 0 HG21 VAL B 17 4.664 -6.002 -7.311 1.00 0.77 H new ATOM 0 HG22 VAL B 17 3.314 -6.113 -6.157 1.00 0.77 H new ATOM 0 HG23 VAL B 17 3.292 -7.084 -7.648 1.00 0.77 H new ATOM 1898 N THR B 18 0.819 -7.570 -7.901 1.00 1.06 N ATOM 1899 CA THR B 18 0.284 -8.767 -8.542 1.00 1.18 C ATOM 1900 C THR B 18 -1.230 -8.665 -8.717 1.00 1.14 C ATOM 1901 O THR B 18 -1.765 -9.229 -9.668 1.00 1.06 O ATOM 1902 CB THR B 18 0.700 -10.061 -7.826 1.00 1.30 C ATOM 1903 OG1 THR B 18 0.536 -11.156 -8.704 1.00 1.89 O ATOM 1904 CG2 THR B 18 -0.127 -10.324 -6.569 1.00 1.51 C ATOM 0 H THR B 18 1.197 -7.716 -6.965 1.00 1.06 H new ATOM 0 HA THR B 18 0.729 -8.823 -9.536 1.00 1.18 H new ATOM 0 HB THR B 18 1.742 -9.943 -7.529 1.00 1.30 H new ATOM 0 HG1 THR B 18 0.802 -11.982 -8.250 1.00 1.89 H new ATOM 0 HG21 THR B 18 0.207 -11.250 -6.101 1.00 1.51 H new ATOM 0 HG22 THR B 18 0.001 -9.497 -5.870 1.00 1.51 H new ATOM 0 HG23 THR B 18 -1.180 -10.413 -6.838 1.00 1.51 H new ATOM 1912 N THR B 19 -1.941 -7.948 -7.844 1.00 1.26 N ATOM 1913 CA THR B 19 -3.365 -7.711 -8.045 1.00 1.45 C ATOM 1914 C THR B 19 -3.609 -7.052 -9.413 1.00 1.49 C ATOM 1915 O THR B 19 -4.547 -7.433 -10.112 1.00 1.62 O ATOM 1916 CB THR B 19 -3.931 -6.919 -6.861 1.00 1.68 C ATOM 1917 OG1 THR B 19 -3.885 -7.702 -5.688 1.00 1.78 O ATOM 1918 CG2 THR B 19 -5.377 -6.473 -7.071 1.00 1.95 C ATOM 0 H THR B 19 -1.555 -7.526 -6.999 1.00 1.26 H new ATOM 0 HA THR B 19 -3.907 -8.656 -8.070 1.00 1.45 H new ATOM 0 HB THR B 19 -3.309 -6.028 -6.771 1.00 1.68 H new ATOM 0 HG1 THR B 19 -2.963 -7.742 -5.357 1.00 1.78 H new ATOM 0 HG21 THR B 19 -5.717 -5.918 -6.197 1.00 1.95 H new ATOM 0 HG22 THR B 19 -5.436 -5.834 -7.952 1.00 1.95 H new ATOM 0 HG23 THR B 19 -6.011 -7.348 -7.214 1.00 1.95 H new ATOM 1926 N PHE B 20 -2.753 -6.117 -9.853 1.00 1.43 N ATOM 1927 CA PHE B 20 -2.864 -5.600 -11.221 1.00 1.53 C ATOM 1928 C PHE B 20 -2.672 -6.701 -12.271 1.00 1.62 C ATOM 1929 O PHE B 20 -3.174 -6.575 -13.383 1.00 1.98 O ATOM 1930 CB PHE B 20 -1.871 -4.464 -11.500 1.00 1.49 C ATOM 1931 CG PHE B 20 -1.964 -3.275 -10.567 1.00 1.29 C ATOM 1932 CD1 PHE B 20 -3.164 -2.549 -10.451 1.00 1.71 C ATOM 1933 CD2 PHE B 20 -0.831 -2.864 -9.848 1.00 1.93 C ATOM 1934 CE1 PHE B 20 -3.264 -1.511 -9.512 1.00 1.53 C ATOM 1935 CE2 PHE B 20 -0.934 -1.836 -8.895 1.00 1.80 C ATOM 1936 CZ PHE B 20 -2.150 -1.158 -8.730 1.00 0.88 C ATOM 0 H PHE B 20 -1.998 -5.714 -9.298 1.00 1.43 H new ATOM 0 HA PHE B 20 -3.877 -5.206 -11.300 1.00 1.53 H new ATOM 0 HB2 PHE B 20 -0.860 -4.867 -11.447 1.00 1.49 H new ATOM 0 HB3 PHE B 20 -2.022 -4.115 -12.522 1.00 1.49 H new ATOM 0 HD1 PHE B 20 -4.006 -2.790 -11.083 1.00 1.71 H new ATOM 0 HD2 PHE B 20 0.122 -3.339 -10.027 1.00 1.93 H new ATOM 0 HE1 PHE B 20 -4.198 -0.983 -9.390 1.00 1.53 H new ATOM 0 HE2 PHE B 20 -0.079 -1.569 -8.292 1.00 1.80 H new ATOM 0 HZ PHE B 20 -2.231 -0.364 -8.002 1.00 0.88 H new ATOM 1946 N PHE B 21 -1.909 -7.754 -11.957 1.00 1.41 N ATOM 1947 CA PHE B 21 -1.708 -8.879 -12.859 1.00 1.62 C ATOM 1948 C PHE B 21 -2.990 -9.710 -12.890 1.00 1.70 C ATOM 1949 O PHE B 21 -3.586 -9.870 -13.952 1.00 1.97 O ATOM 1950 CB PHE B 21 -0.473 -9.731 -12.504 1.00 1.67 C ATOM 1951 CG PHE B 21 0.920 -9.132 -12.685 1.00 3.09 C ATOM 1952 CD1 PHE B 21 1.198 -7.774 -12.419 1.00 4.87 C ATOM 1953 CD2 PHE B 21 1.997 -10.015 -12.903 1.00 3.70 C ATOM 1954 CE1 PHE B 21 2.523 -7.304 -12.407 1.00 6.57 C ATOM 1955 CE2 PHE B 21 3.324 -9.555 -12.845 1.00 5.22 C ATOM 1956 CZ PHE B 21 3.589 -8.198 -12.601 1.00 6.53 C ATOM 0 H PHE B 21 -1.416 -7.844 -11.069 1.00 1.41 H new ATOM 0 HA PHE B 21 -1.497 -8.490 -13.855 1.00 1.62 H new ATOM 0 HB2 PHE B 21 -0.569 -10.030 -11.460 1.00 1.67 H new ATOM 0 HB3 PHE B 21 -0.519 -10.641 -13.102 1.00 1.67 H new ATOM 0 HD1 PHE B 21 0.386 -7.090 -12.223 1.00 4.87 H new ATOM 0 HD2 PHE B 21 1.801 -11.055 -13.117 1.00 3.70 H new ATOM 0 HE1 PHE B 21 2.721 -6.254 -12.248 1.00 6.57 H new ATOM 0 HE2 PHE B 21 4.141 -10.247 -12.988 1.00 5.22 H new ATOM 0 HZ PHE B 21 4.608 -7.843 -12.563 1.00 6.53 H new ATOM 1966 N THR B 22 -3.445 -10.213 -11.739 1.00 1.62 N ATOM 1967 CA THR B 22 -4.695 -10.966 -11.675 1.00 1.85 C ATOM 1968 C THR B 22 -5.877 -10.000 -11.542 1.00 1.92 C ATOM 1969 O THR B 22 -6.683 -10.112 -10.619 1.00 2.02 O ATOM 1970 CB THR B 22 -4.637 -12.039 -10.567 1.00 2.04 C ATOM 1971 OG1 THR B 22 -5.872 -12.717 -10.502 1.00 2.86 O ATOM 1972 CG2 THR B 22 -4.296 -11.513 -9.167 1.00 2.78 C ATOM 0 H THR B 22 -2.967 -10.112 -10.844 1.00 1.62 H new ATOM 0 HA THR B 22 -4.844 -11.516 -12.604 1.00 1.85 H new ATOM 0 HB THR B 22 -3.818 -12.699 -10.852 1.00 2.04 H new ATOM 0 HG1 THR B 22 -6.601 -12.064 -10.453 1.00 2.86 H new ATOM 0 HG21 THR B 22 -4.280 -12.343 -8.461 1.00 2.78 H new ATOM 0 HG22 THR B 22 -3.317 -11.034 -9.187 1.00 2.78 H new ATOM 0 HG23 THR B 22 -5.049 -10.788 -8.858 1.00 2.78 H new ATOM 2097 N LYS B 30 -2.937 -2.444 -18.369 1.00 2.37 N ATOM 2098 CA LYS B 30 -2.528 -1.202 -18.998 1.00 2.53 C ATOM 2099 C LYS B 30 -1.525 -0.467 -18.100 1.00 2.69 C ATOM 2100 O LYS B 30 -0.380 -0.259 -18.495 1.00 3.49 O ATOM 2101 CB LYS B 30 -3.814 -0.433 -19.334 1.00 2.67 C ATOM 2102 CG LYS B 30 -3.682 0.597 -20.463 1.00 3.49 C ATOM 2103 CD LYS B 30 -3.276 1.972 -19.936 1.00 4.30 C ATOM 2104 CE LYS B 30 -1.821 2.359 -20.200 1.00 4.95 C ATOM 2105 NZ LYS B 30 -1.418 3.445 -19.292 1.00 6.01 N ATOM 0 HA LYS B 30 -1.985 -1.347 -19.932 1.00 2.53 H new ATOM 0 HB2 LYS B 30 -4.587 -1.151 -19.607 1.00 2.67 H new ATOM 0 HB3 LYS B 30 -4.158 0.079 -18.435 1.00 2.67 H new ATOM 0 HG2 LYS B 30 -2.941 0.252 -21.184 1.00 3.49 H new ATOM 0 HG3 LYS B 30 -4.631 0.677 -20.994 1.00 3.49 H new ATOM 0 HD2 LYS B 30 -3.924 2.724 -20.387 1.00 4.30 H new ATOM 0 HD3 LYS B 30 -3.455 2.000 -18.861 1.00 4.30 H new ATOM 0 HE2 LYS B 30 -1.174 1.494 -20.056 1.00 4.95 H new ATOM 0 HE3 LYS B 30 -1.702 2.677 -21.236 1.00 4.95 H new ATOM 0 HZ1 LYS B 30 -1.311 4.327 -19.832 1.00 6.01 H new ATOM 0 HZ2 LYS B 30 -2.145 3.573 -18.560 1.00 6.01 H new ATOM 0 HZ3 LYS B 30 -0.512 3.203 -18.842 1.00 6.01 H new ATOM 2119 N ASP B 31 -1.941 -0.119 -16.880 1.00 2.25 N ATOM 2120 CA ASP B 31 -1.053 0.239 -15.776 1.00 2.13 C ATOM 2121 C ASP B 31 -1.753 -0.280 -14.520 1.00 1.79 C ATOM 2122 O ASP B 31 -1.506 -1.404 -14.084 1.00 1.99 O ATOM 2123 CB ASP B 31 -0.790 1.759 -15.710 1.00 2.20 C ATOM 2124 CG ASP B 31 0.466 2.208 -16.448 1.00 2.85 C ATOM 2125 OD1 ASP B 31 1.571 1.909 -15.949 1.00 2.87 O ATOM 2126 OD2 ASP B 31 0.314 2.946 -17.450 1.00 4.12 O ATOM 0 H ASP B 31 -2.929 -0.078 -16.628 1.00 2.25 H new ATOM 0 HA ASP B 31 -0.064 -0.203 -15.896 1.00 2.13 H new ATOM 0 HB2 ASP B 31 -1.650 2.284 -16.127 1.00 2.20 H new ATOM 0 HB3 ASP B 31 -0.710 2.058 -14.665 1.00 2.20 H new ATOM 2131 N SER B 32 -2.695 0.512 -14.008 1.00 1.60 N ATOM 2132 CA SER B 32 -3.749 0.076 -13.111 1.00 1.34 C ATOM 2133 C SER B 32 -5.061 0.119 -13.913 1.00 1.24 C ATOM 2134 O SER B 32 -5.057 -0.283 -15.076 1.00 1.33 O ATOM 2135 CB SER B 32 -3.731 0.967 -11.864 1.00 1.13 C ATOM 2136 OG SER B 32 -2.434 1.012 -11.297 1.00 2.78 O ATOM 0 H SER B 32 -2.741 1.509 -14.218 1.00 1.60 H new ATOM 0 HA SER B 32 -3.620 -0.943 -12.746 1.00 1.34 H new ATOM 0 HB2 SER B 32 -4.053 1.975 -12.127 1.00 1.13 H new ATOM 0 HB3 SER B 32 -4.441 0.587 -11.130 1.00 1.13 H new ATOM 0 HG SER B 32 -2.357 0.326 -10.601 1.00 2.78 H new ATOM 2142 N LEU B 33 -6.164 0.592 -13.317 1.00 1.15 N ATOM 2143 CA LEU B 33 -7.482 0.654 -13.943 1.00 1.12 C ATOM 2144 C LEU B 33 -7.882 2.117 -14.154 1.00 0.98 C ATOM 2145 O LEU B 33 -7.112 3.028 -13.837 1.00 1.06 O ATOM 2146 CB LEU B 33 -8.535 -0.031 -13.050 1.00 1.10 C ATOM 2147 CG LEU B 33 -8.273 -1.463 -12.565 1.00 1.30 C ATOM 2148 CD1 LEU B 33 -7.817 -2.409 -13.680 1.00 2.16 C ATOM 2149 CD2 LEU B 33 -7.312 -1.468 -11.379 1.00 1.38 C ATOM 0 H LEU B 33 -6.159 0.950 -12.362 1.00 1.15 H new ATOM 0 HA LEU B 33 -7.436 0.138 -14.902 1.00 1.12 H new ATOM 0 HB2 LEU B 33 -8.678 0.595 -12.169 1.00 1.10 H new ATOM 0 HB3 LEU B 33 -9.479 -0.035 -13.596 1.00 1.10 H new ATOM 0 HG LEU B 33 -9.231 -1.858 -12.227 1.00 1.30 H new ATOM 0 HD11 LEU B 33 -7.650 -3.404 -13.267 1.00 2.16 H new ATOM 0 HD12 LEU B 33 -8.586 -2.460 -14.451 1.00 2.16 H new ATOM 0 HD13 LEU B 33 -6.890 -2.037 -14.116 1.00 2.16 H new ATOM 0 HD21 LEU B 33 -7.142 -2.494 -11.053 1.00 1.38 H new ATOM 0 HD22 LEU B 33 -6.364 -1.020 -11.677 1.00 1.38 H new ATOM 0 HD23 LEU B 33 -7.743 -0.894 -10.559 1.00 1.38 H new ATOM 2161 N SER B 34 -9.109 2.349 -14.624 1.00 0.96 N ATOM 2162 CA SER B 34 -9.665 3.699 -14.646 1.00 0.83 C ATOM 2163 C SER B 34 -9.971 4.119 -13.205 1.00 0.72 C ATOM 2164 O SER B 34 -10.227 3.265 -12.356 1.00 0.74 O ATOM 2165 CB SER B 34 -10.897 3.757 -15.558 1.00 0.89 C ATOM 2166 OG SER B 34 -10.527 3.434 -16.885 1.00 1.72 O ATOM 0 H SER B 34 -9.729 1.627 -14.990 1.00 0.96 H new ATOM 0 HA SER B 34 -8.947 4.406 -15.063 1.00 0.83 H new ATOM 0 HB2 SER B 34 -11.657 3.061 -15.203 1.00 0.89 H new ATOM 0 HB3 SER B 34 -11.338 4.753 -15.526 1.00 0.89 H new ATOM 0 HG SER B 34 -11.317 3.471 -17.463 1.00 1.72 H new ATOM 2172 N VAL B 35 -9.913 5.415 -12.877 1.00 0.69 N ATOM 2173 CA VAL B 35 -9.946 5.797 -11.469 1.00 0.67 C ATOM 2174 C VAL B 35 -11.341 5.539 -10.867 1.00 0.68 C ATOM 2175 O VAL B 35 -11.463 5.099 -9.724 1.00 0.69 O ATOM 2176 CB VAL B 35 -9.453 7.239 -11.258 1.00 0.86 C ATOM 2177 CG1 VAL B 35 -9.128 7.447 -9.780 1.00 1.12 C ATOM 2178 CG2 VAL B 35 -8.190 7.650 -12.039 1.00 0.93 C ATOM 0 H VAL B 35 -9.846 6.187 -13.541 1.00 0.69 H new ATOM 0 HA VAL B 35 -9.246 5.164 -10.924 1.00 0.67 H new ATOM 0 HB VAL B 35 -10.272 7.854 -11.630 1.00 0.86 H new ATOM 0 HG11 VAL B 35 -8.778 8.468 -9.625 1.00 1.12 H new ATOM 0 HG12 VAL B 35 -10.024 7.276 -9.183 1.00 1.12 H new ATOM 0 HG13 VAL B 35 -8.350 6.746 -9.476 1.00 1.12 H new ATOM 0 HG21 VAL B 35 -7.941 8.686 -11.809 1.00 0.93 H new ATOM 0 HG22 VAL B 35 -7.359 7.005 -11.753 1.00 0.93 H new ATOM 0 HG23 VAL B 35 -8.375 7.550 -13.109 1.00 0.93 H new ATOM 2188 N ASN B 36 -12.413 5.788 -11.627 1.00 0.81 N ATOM 2189 CA ASN B 36 -13.768 5.577 -11.122 1.00 0.97 C ATOM 2190 C ASN B 36 -14.028 4.076 -10.931 1.00 1.03 C ATOM 2191 O ASN B 36 -14.463 3.644 -9.865 1.00 1.13 O ATOM 2192 CB ASN B 36 -14.798 6.184 -12.075 1.00 1.15 C ATOM 2193 CG ASN B 36 -16.091 6.506 -11.337 1.00 2.19 C ATOM 2194 OD1 ASN B 36 -16.945 5.649 -11.160 1.00 3.16 O ATOM 2195 ND2 ASN B 36 -16.239 7.754 -10.892 1.00 2.69 N ATOM 0 H ASN B 36 -12.367 6.133 -12.586 1.00 0.81 H new ATOM 0 HA ASN B 36 -13.864 6.075 -10.157 1.00 0.97 H new ATOM 0 HB2 ASN B 36 -14.394 7.091 -12.524 1.00 1.15 H new ATOM 0 HB3 ASN B 36 -15.002 5.488 -12.889 1.00 1.15 H new ATOM 0 HD21 ASN B 36 -17.085 8.018 -10.387 1.00 2.69 H new ATOM 0 HD22 ASN B 36 -15.507 8.444 -11.057 1.00 2.69 H new ATOM 2202 N GLU B 37 -13.701 3.293 -11.971 1.00 1.04 N ATOM 2203 CA GLU B 37 -13.674 1.829 -11.972 1.00 1.17 C ATOM 2204 C GLU B 37 -12.989 1.355 -10.684 1.00 1.07 C ATOM 2205 O GLU B 37 -13.578 0.634 -9.878 1.00 1.19 O ATOM 2206 CB GLU B 37 -12.938 1.368 -13.251 1.00 1.25 C ATOM 2207 CG GLU B 37 -12.810 -0.146 -13.493 1.00 1.60 C ATOM 2208 CD GLU B 37 -11.968 -0.453 -14.736 1.00 2.68 C ATOM 2209 OE1 GLU B 37 -11.156 0.422 -15.111 1.00 3.83 O ATOM 2210 OE2 GLU B 37 -12.131 -1.568 -15.291 1.00 3.61 O ATOM 0 H GLU B 37 -13.436 3.686 -12.874 1.00 1.04 H new ATOM 0 HA GLU B 37 -14.674 1.395 -11.986 1.00 1.17 H new ATOM 0 HB2 GLU B 37 -13.451 1.803 -14.109 1.00 1.25 H new ATOM 0 HB3 GLU B 37 -11.934 1.791 -13.232 1.00 1.25 H new ATOM 0 HG2 GLU B 37 -12.356 -0.617 -12.621 1.00 1.60 H new ATOM 0 HG3 GLU B 37 -13.803 -0.581 -13.610 1.00 1.60 H new ATOM 2217 N PHE B 38 -11.755 1.823 -10.470 1.00 0.88 N ATOM 2218 CA PHE B 38 -11.018 1.588 -9.241 1.00 0.75 C ATOM 2219 C PHE B 38 -11.863 1.891 -8.010 1.00 0.77 C ATOM 2220 O PHE B 38 -11.956 1.018 -7.158 1.00 0.79 O ATOM 2221 CB PHE B 38 -9.705 2.373 -9.215 1.00 0.63 C ATOM 2222 CG PHE B 38 -9.182 2.672 -7.820 1.00 0.76 C ATOM 2223 CD1 PHE B 38 -8.478 1.689 -7.104 1.00 1.53 C ATOM 2224 CD2 PHE B 38 -9.450 3.915 -7.212 1.00 1.98 C ATOM 2225 CE1 PHE B 38 -7.921 1.996 -5.851 1.00 1.64 C ATOM 2226 CE2 PHE B 38 -8.905 4.217 -5.953 1.00 2.28 C ATOM 2227 CZ PHE B 38 -8.105 3.272 -5.291 1.00 1.50 C ATOM 0 H PHE B 38 -11.243 2.379 -11.155 1.00 0.88 H new ATOM 0 HA PHE B 38 -10.770 0.527 -9.215 1.00 0.75 H new ATOM 0 HB2 PHE B 38 -8.948 1.810 -9.761 1.00 0.63 H new ATOM 0 HB3 PHE B 38 -9.847 3.314 -9.746 1.00 0.63 H new ATOM 0 HD1 PHE B 38 -8.365 0.697 -7.517 1.00 1.53 H new ATOM 0 HD2 PHE B 38 -10.076 4.637 -7.715 1.00 1.98 H new ATOM 0 HE1 PHE B 38 -7.351 1.250 -5.317 1.00 1.64 H new ATOM 0 HE2 PHE B 38 -9.101 5.175 -5.495 1.00 2.28 H new ATOM 0 HZ PHE B 38 -7.632 3.525 -4.354 1.00 1.50 H new ATOM 2237 N LYS B 39 -12.441 3.093 -7.878 1.00 0.80 N ATOM 2238 CA LYS B 39 -13.175 3.460 -6.667 1.00 0.86 C ATOM 2239 C LYS B 39 -14.172 2.359 -6.289 1.00 0.95 C ATOM 2240 O LYS B 39 -14.189 1.885 -5.149 1.00 1.05 O ATOM 2241 CB LYS B 39 -13.895 4.811 -6.825 1.00 1.06 C ATOM 2242 CG LYS B 39 -14.471 5.277 -5.471 1.00 0.95 C ATOM 2243 CD LYS B 39 -15.972 5.586 -5.570 1.00 1.38 C ATOM 2244 CE LYS B 39 -16.523 5.968 -4.186 1.00 2.16 C ATOM 2245 NZ LYS B 39 -17.981 6.213 -4.207 1.00 3.16 N ATOM 0 H LYS B 39 -12.413 3.821 -8.592 1.00 0.80 H new ATOM 0 HA LYS B 39 -12.449 3.568 -5.861 1.00 0.86 H new ATOM 0 HB2 LYS B 39 -13.200 5.558 -7.208 1.00 1.06 H new ATOM 0 HB3 LYS B 39 -14.698 4.719 -7.556 1.00 1.06 H new ATOM 0 HG2 LYS B 39 -14.307 4.504 -4.720 1.00 0.95 H new ATOM 0 HG3 LYS B 39 -13.938 6.166 -5.135 1.00 0.95 H new ATOM 0 HD2 LYS B 39 -16.138 6.401 -6.274 1.00 1.38 H new ATOM 0 HD3 LYS B 39 -16.506 4.718 -5.956 1.00 1.38 H new ATOM 0 HE2 LYS B 39 -16.302 5.170 -3.477 1.00 2.16 H new ATOM 0 HE3 LYS B 39 -16.012 6.862 -3.829 1.00 2.16 H new ATOM 0 HZ1 LYS B 39 -18.304 6.467 -3.252 1.00 3.16 H new ATOM 0 HZ2 LYS B 39 -18.193 6.992 -4.863 1.00 3.16 H new ATOM 0 HZ3 LYS B 39 -18.473 5.353 -4.522 1.00 3.16 H new ATOM 2259 N GLU B 40 -14.998 1.959 -7.257 1.00 0.99 N ATOM 2260 CA GLU B 40 -15.979 0.916 -7.033 1.00 1.13 C ATOM 2261 C GLU B 40 -15.295 -0.413 -6.693 1.00 1.06 C ATOM 2262 O GLU B 40 -15.628 -1.033 -5.685 1.00 1.15 O ATOM 2263 CB GLU B 40 -16.935 0.825 -8.222 1.00 1.31 C ATOM 2264 CG GLU B 40 -17.645 2.173 -8.428 1.00 1.43 C ATOM 2265 CD GLU B 40 -18.977 2.016 -9.148 1.00 1.94 C ATOM 2266 OE1 GLU B 40 -19.083 1.072 -9.959 1.00 2.79 O ATOM 2267 OE2 GLU B 40 -19.873 2.833 -8.844 1.00 2.36 O ATOM 0 H GLU B 40 -15.001 2.346 -8.201 1.00 0.99 H new ATOM 0 HA GLU B 40 -16.587 1.169 -6.164 1.00 1.13 H new ATOM 0 HB2 GLU B 40 -16.384 0.553 -9.122 1.00 1.31 H new ATOM 0 HB3 GLU B 40 -17.671 0.040 -8.049 1.00 1.31 H new ATOM 0 HG2 GLU B 40 -17.810 2.646 -7.460 1.00 1.43 H new ATOM 0 HG3 GLU B 40 -17.000 2.838 -9.002 1.00 1.43 H new ATOM 2274 N LEU B 41 -14.317 -0.839 -7.494 1.00 1.00 N ATOM 2275 CA LEU B 41 -13.594 -2.079 -7.232 1.00 0.99 C ATOM 2276 C LEU B 41 -13.009 -2.100 -5.812 1.00 0.93 C ATOM 2277 O LEU B 41 -13.308 -3.007 -5.040 1.00 0.98 O ATOM 2278 CB LEU B 41 -12.515 -2.317 -8.302 1.00 1.03 C ATOM 2279 CG LEU B 41 -13.002 -3.212 -9.457 1.00 1.24 C ATOM 2280 CD1 LEU B 41 -14.194 -2.628 -10.224 1.00 2.26 C ATOM 2281 CD2 LEU B 41 -11.846 -3.450 -10.434 1.00 2.74 C ATOM 0 H LEU B 41 -14.009 -0.341 -8.329 1.00 1.00 H new ATOM 0 HA LEU B 41 -14.304 -2.904 -7.292 1.00 0.99 H new ATOM 0 HB2 LEU B 41 -12.192 -1.357 -8.705 1.00 1.03 H new ATOM 0 HB3 LEU B 41 -11.644 -2.777 -7.836 1.00 1.03 H new ATOM 0 HG LEU B 41 -13.341 -4.145 -9.008 1.00 1.24 H new ATOM 0 HD11 LEU B 41 -14.483 -3.311 -11.022 1.00 2.26 H new ATOM 0 HD12 LEU B 41 -15.033 -2.491 -9.542 1.00 2.26 H new ATOM 0 HD13 LEU B 41 -13.914 -1.666 -10.653 1.00 2.26 H new ATOM 0 HD21 LEU B 41 -12.187 -4.083 -11.253 1.00 2.74 H new ATOM 0 HD22 LEU B 41 -11.503 -2.495 -10.832 1.00 2.74 H new ATOM 0 HD23 LEU B 41 -11.024 -3.942 -9.913 1.00 2.74 H new ATOM 2293 N VAL B 42 -12.180 -1.119 -5.441 1.00 0.91 N ATOM 2294 CA VAL B 42 -11.530 -1.103 -4.139 1.00 0.95 C ATOM 2295 C VAL B 42 -12.585 -1.117 -3.030 1.00 0.99 C ATOM 2296 O VAL B 42 -12.483 -1.929 -2.114 1.00 1.06 O ATOM 2297 CB VAL B 42 -10.469 0.016 -3.992 1.00 0.99 C ATOM 2298 CG1 VAL B 42 -11.054 1.432 -3.929 1.00 1.82 C ATOM 2299 CG2 VAL B 42 -9.642 -0.209 -2.732 1.00 2.32 C ATOM 0 H VAL B 42 -11.946 -0.323 -6.034 1.00 0.91 H new ATOM 0 HA VAL B 42 -10.943 -2.016 -4.041 1.00 0.95 H new ATOM 0 HB VAL B 42 -9.859 -0.046 -4.893 1.00 0.99 H new ATOM 0 HG11 VAL B 42 -10.245 2.156 -3.826 1.00 1.82 H new ATOM 0 HG12 VAL B 42 -11.610 1.637 -4.844 1.00 1.82 H new ATOM 0 HG13 VAL B 42 -11.723 1.511 -3.072 1.00 1.82 H new ATOM 0 HG21 VAL B 42 -8.899 0.583 -2.638 1.00 2.32 H new ATOM 0 HG22 VAL B 42 -10.296 -0.198 -1.860 1.00 2.32 H new ATOM 0 HG23 VAL B 42 -9.138 -1.173 -2.795 1.00 2.32 H new ATOM 2309 N THR B 43 -13.616 -0.264 -3.096 1.00 1.02 N ATOM 2310 CA THR B 43 -14.602 -0.250 -2.019 1.00 1.14 C ATOM 2311 C THR B 43 -15.296 -1.617 -1.919 1.00 1.18 C ATOM 2312 O THR B 43 -15.379 -2.187 -0.832 1.00 1.45 O ATOM 2313 CB THR B 43 -15.537 0.974 -2.113 1.00 1.24 C ATOM 2314 OG1 THR B 43 -16.040 1.311 -0.839 1.00 1.54 O ATOM 2315 CG2 THR B 43 -16.741 0.797 -3.037 1.00 1.44 C ATOM 0 H THR B 43 -13.783 0.399 -3.853 1.00 1.02 H new ATOM 0 HA THR B 43 -14.102 -0.111 -1.060 1.00 1.14 H new ATOM 0 HB THR B 43 -14.907 1.758 -2.533 1.00 1.24 H new ATOM 0 HG1 THR B 43 -16.630 2.090 -0.916 1.00 1.54 H new ATOM 0 HG21 THR B 43 -17.337 1.709 -3.037 1.00 1.44 H new ATOM 0 HG22 THR B 43 -16.395 0.590 -4.050 1.00 1.44 H new ATOM 0 HG23 THR B 43 -17.351 -0.035 -2.685 1.00 1.44 H new ATOM 2323 N GLN B 44 -15.715 -2.189 -3.055 1.00 1.05 N ATOM 2324 CA GLN B 44 -16.323 -3.519 -3.095 1.00 1.10 C ATOM 2325 C GLN B 44 -15.396 -4.562 -2.456 1.00 1.08 C ATOM 2326 O GLN B 44 -15.839 -5.384 -1.659 1.00 1.14 O ATOM 2327 CB GLN B 44 -16.661 -3.891 -4.544 1.00 1.15 C ATOM 2328 CG GLN B 44 -17.839 -3.060 -5.075 1.00 1.63 C ATOM 2329 CD GLN B 44 -17.937 -3.088 -6.600 1.00 2.48 C ATOM 2330 OE1 GLN B 44 -17.276 -3.875 -7.271 1.00 3.34 O ATOM 2331 NE2 GLN B 44 -18.773 -2.224 -7.170 1.00 3.20 N ATOM 0 H GLN B 44 -15.641 -1.742 -3.969 1.00 1.05 H new ATOM 0 HA GLN B 44 -17.246 -3.504 -2.516 1.00 1.10 H new ATOM 0 HB2 GLN B 44 -15.787 -3.732 -5.176 1.00 1.15 H new ATOM 0 HB3 GLN B 44 -16.907 -4.951 -4.601 1.00 1.15 H new ATOM 0 HG2 GLN B 44 -18.768 -3.438 -4.648 1.00 1.63 H new ATOM 0 HG3 GLN B 44 -17.731 -2.028 -4.740 1.00 1.63 H new ATOM 0 HE21 GLN B 44 -19.312 -1.579 -6.592 1.00 3.20 H new ATOM 0 HE22 GLN B 44 -18.875 -2.206 -8.185 1.00 3.20 H new ATOM 2340 N GLN B 45 -14.107 -4.505 -2.791 1.00 1.01 N ATOM 2341 CA GLN B 45 -13.077 -5.384 -2.257 1.00 1.02 C ATOM 2342 C GLN B 45 -12.861 -5.235 -0.748 1.00 0.99 C ATOM 2343 O GLN B 45 -12.227 -6.104 -0.158 1.00 1.12 O ATOM 2344 CB GLN B 45 -11.750 -5.141 -2.984 1.00 1.04 C ATOM 2345 CG GLN B 45 -11.510 -6.098 -4.152 1.00 0.96 C ATOM 2346 CD GLN B 45 -12.478 -5.911 -5.319 1.00 1.13 C ATOM 2347 OE1 GLN B 45 -13.641 -6.289 -5.240 1.00 2.02 O ATOM 2348 NE2 GLN B 45 -11.997 -5.366 -6.433 1.00 2.49 N ATOM 0 H GLN B 45 -13.745 -3.826 -3.460 1.00 1.01 H new ATOM 0 HA GLN B 45 -13.431 -6.401 -2.427 1.00 1.02 H new ATOM 0 HB2 GLN B 45 -11.730 -4.116 -3.355 1.00 1.04 H new ATOM 0 HB3 GLN B 45 -10.931 -5.238 -2.271 1.00 1.04 H new ATOM 0 HG2 GLN B 45 -10.491 -5.964 -4.514 1.00 0.96 H new ATOM 0 HG3 GLN B 45 -11.588 -7.123 -3.790 1.00 0.96 H new ATOM 0 HE21 GLN B 45 -11.025 -5.060 -6.472 1.00 2.49 H new ATOM 0 HE22 GLN B 45 -12.600 -5.254 -7.248 1.00 2.49 H new ATOM 2357 N LEU B 46 -13.302 -4.135 -0.133 1.00 0.89 N ATOM 2358 CA LEU B 46 -13.119 -3.874 1.290 1.00 0.90 C ATOM 2359 C LEU B 46 -14.479 -3.849 1.994 1.00 0.93 C ATOM 2360 O LEU B 46 -14.882 -2.805 2.499 1.00 0.96 O ATOM 2361 CB LEU B 46 -12.361 -2.545 1.438 1.00 0.93 C ATOM 2362 CG LEU B 46 -10.854 -2.752 1.210 1.00 1.06 C ATOM 2363 CD1 LEU B 46 -10.276 -1.668 0.307 1.00 1.17 C ATOM 2364 CD2 LEU B 46 -10.129 -2.768 2.559 1.00 1.89 C ATOM 0 H LEU B 46 -13.803 -3.392 -0.620 1.00 0.89 H new ATOM 0 HA LEU B 46 -12.534 -4.663 1.762 1.00 0.90 H new ATOM 0 HB2 LEU B 46 -12.746 -1.819 0.722 1.00 0.93 H new ATOM 0 HB3 LEU B 46 -12.530 -2.132 2.433 1.00 0.93 H new ATOM 0 HG LEU B 46 -10.708 -3.709 0.709 1.00 1.06 H new ATOM 0 HD11 LEU B 46 -9.209 -1.843 0.166 1.00 1.17 H new ATOM 0 HD12 LEU B 46 -10.779 -1.693 -0.660 1.00 1.17 H new ATOM 0 HD13 LEU B 46 -10.426 -0.692 0.769 1.00 1.17 H new ATOM 0 HD21 LEU B 46 -9.061 -2.915 2.396 1.00 1.89 H new ATOM 0 HD22 LEU B 46 -10.291 -1.819 3.071 1.00 1.89 H new ATOM 0 HD23 LEU B 46 -10.518 -3.581 3.171 1.00 1.89 H new ATOM 2376 N PRO B 47 -15.191 -4.985 2.082 1.00 0.98 N ATOM 2377 CA PRO B 47 -16.512 -5.044 2.690 1.00 1.04 C ATOM 2378 C PRO B 47 -16.483 -4.749 4.192 1.00 1.10 C ATOM 2379 O PRO B 47 -17.522 -4.406 4.755 1.00 1.15 O ATOM 2380 CB PRO B 47 -17.023 -6.463 2.415 1.00 1.15 C ATOM 2381 CG PRO B 47 -15.739 -7.284 2.327 1.00 1.17 C ATOM 2382 CD PRO B 47 -14.785 -6.310 1.639 1.00 1.04 C ATOM 0 HA PRO B 47 -17.166 -4.281 2.267 1.00 1.04 H new ATOM 0 HB2 PRO B 47 -17.674 -6.818 3.213 1.00 1.15 H new ATOM 0 HB3 PRO B 47 -17.597 -6.512 1.490 1.00 1.15 H new ATOM 0 HG2 PRO B 47 -15.377 -7.582 3.311 1.00 1.17 H new ATOM 0 HG3 PRO B 47 -15.877 -8.197 1.748 1.00 1.17 H new ATOM 0 HD2 PRO B 47 -13.750 -6.515 1.914 1.00 1.04 H new ATOM 0 HD3 PRO B 47 -14.850 -6.398 0.554 1.00 1.04 H new ATOM 2390 N HIS B 48 -15.336 -4.929 4.862 1.00 1.48 N ATOM 2391 CA HIS B 48 -15.281 -4.787 6.308 1.00 1.58 C ATOM 2392 C HIS B 48 -15.697 -3.375 6.756 1.00 1.75 C ATOM 2393 O HIS B 48 -15.114 -2.376 6.340 1.00 3.08 O ATOM 2394 CB HIS B 48 -13.952 -5.293 6.889 1.00 2.25 C ATOM 2395 CG HIS B 48 -12.686 -4.606 6.440 1.00 2.62 C ATOM 2396 ND1 HIS B 48 -11.752 -5.141 5.577 1.00 4.44 N ATOM 2397 CD2 HIS B 48 -12.083 -3.561 7.092 1.00 2.64 C ATOM 2398 CE1 HIS B 48 -10.620 -4.436 5.721 1.00 5.16 C ATOM 2399 NE2 HIS B 48 -10.768 -3.446 6.620 1.00 4.16 N ATOM 0 H HIS B 48 -14.447 -5.170 4.424 1.00 1.48 H new ATOM 0 HA HIS B 48 -16.030 -5.447 6.745 1.00 1.58 H new ATOM 0 HB2 HIS B 48 -14.009 -5.216 7.975 1.00 2.25 H new ATOM 0 HB3 HIS B 48 -13.862 -6.352 6.649 1.00 2.25 H new ATOM 0 HD1 HIS B 48 -11.896 -5.929 4.945 1.00 4.44 H new ATOM 0 HD2 HIS B 48 -12.543 -2.934 7.841 1.00 2.64 H new ATOM 0 HE1 HIS B 48 -9.705 -4.638 5.183 1.00 5.16 H new ATOM 2407 N LEU B 49 -16.744 -3.316 7.584 1.00 2.23 N ATOM 2408 CA LEU B 49 -17.511 -2.165 8.047 1.00 2.26 C ATOM 2409 C LEU B 49 -18.089 -1.311 6.908 1.00 2.32 C ATOM 2410 O LEU B 49 -19.309 -1.202 6.802 1.00 2.68 O ATOM 2411 CB LEU B 49 -16.729 -1.348 9.086 1.00 2.15 C ATOM 2412 CG LEU B 49 -17.587 -0.773 10.230 1.00 2.44 C ATOM 2413 CD1 LEU B 49 -18.866 -0.076 9.749 1.00 2.01 C ATOM 2414 CD2 LEU B 49 -17.941 -1.850 11.264 1.00 4.09 C ATOM 0 H LEU B 49 -17.113 -4.176 7.990 1.00 2.23 H new ATOM 0 HA LEU B 49 -18.389 -2.563 8.556 1.00 2.26 H new ATOM 0 HB2 LEU B 49 -15.952 -1.980 9.515 1.00 2.15 H new ATOM 0 HB3 LEU B 49 -16.226 -0.525 8.578 1.00 2.15 H new ATOM 0 HG LEU B 49 -16.964 -0.011 10.699 1.00 2.44 H new ATOM 0 HD11 LEU B 49 -19.419 0.303 10.608 1.00 2.01 H new ATOM 0 HD12 LEU B 49 -18.603 0.753 9.092 1.00 2.01 H new ATOM 0 HD13 LEU B 49 -19.486 -0.788 9.205 1.00 2.01 H new ATOM 0 HD21 LEU B 49 -18.546 -1.409 12.056 1.00 4.09 H new ATOM 0 HD22 LEU B 49 -18.503 -2.649 10.780 1.00 4.09 H new ATOM 0 HD23 LEU B 49 -17.025 -2.259 11.692 1.00 4.09 H new ATOM 2426 N LEU B 50 -17.237 -0.715 6.065 1.00 2.10 N ATOM 2427 CA LEU B 50 -17.621 0.144 4.961 1.00 2.31 C ATOM 2428 C LEU B 50 -18.227 1.437 5.516 1.00 2.32 C ATOM 2429 O LEU B 50 -19.370 1.784 5.238 1.00 2.69 O ATOM 2430 CB LEU B 50 -18.528 -0.604 3.961 1.00 2.82 C ATOM 2431 CG LEU B 50 -18.317 -0.172 2.499 1.00 2.01 C ATOM 2432 CD1 LEU B 50 -18.211 1.345 2.331 1.00 2.84 C ATOM 2433 CD2 LEU B 50 -17.064 -0.836 1.928 1.00 2.24 C ATOM 0 H LEU B 50 -16.226 -0.828 6.144 1.00 2.10 H new ATOM 0 HA LEU B 50 -16.743 0.428 4.380 1.00 2.31 H new ATOM 0 HB2 LEU B 50 -18.343 -1.675 4.045 1.00 2.82 H new ATOM 0 HB3 LEU B 50 -19.570 -0.438 4.234 1.00 2.82 H new ATOM 0 HG LEU B 50 -19.201 -0.497 1.950 1.00 2.01 H new ATOM 0 HD11 LEU B 50 -18.063 1.585 1.278 1.00 2.84 H new ATOM 0 HD12 LEU B 50 -19.128 1.815 2.685 1.00 2.84 H new ATOM 0 HD13 LEU B 50 -17.366 1.717 2.910 1.00 2.84 H new ATOM 0 HD21 LEU B 50 -16.926 -0.523 0.893 1.00 2.24 H new ATOM 0 HD22 LEU B 50 -16.195 -0.540 2.516 1.00 2.24 H new ATOM 0 HD23 LEU B 50 -17.177 -1.919 1.967 1.00 2.24 H new ATOM 2445 N LYS B 51 -17.459 2.117 6.374 1.00 1.97 N ATOM 2446 CA LYS B 51 -17.887 3.379 6.966 1.00 1.91 C ATOM 2447 C LYS B 51 -17.638 4.592 6.053 1.00 1.97 C ATOM 2448 O LYS B 51 -18.456 5.505 6.059 1.00 2.13 O ATOM 2449 CB LYS B 51 -17.292 3.522 8.373 1.00 1.74 C ATOM 2450 CG LYS B 51 -15.776 3.718 8.346 1.00 1.57 C ATOM 2451 CD LYS B 51 -15.421 5.217 8.291 1.00 1.65 C ATOM 2452 CE LYS B 51 -15.048 5.850 9.641 1.00 1.69 C ATOM 2453 NZ LYS B 51 -14.097 6.972 9.467 1.00 2.68 N ATOM 0 H LYS B 51 -16.534 1.808 6.672 1.00 1.97 H new ATOM 0 HA LYS B 51 -18.972 3.358 7.072 1.00 1.91 H new ATOM 0 HB2 LYS B 51 -17.757 4.370 8.877 1.00 1.74 H new ATOM 0 HB3 LYS B 51 -17.531 2.634 8.958 1.00 1.74 H new ATOM 0 HG2 LYS B 51 -15.330 3.266 9.232 1.00 1.57 H new ATOM 0 HG3 LYS B 51 -15.354 3.207 7.481 1.00 1.57 H new ATOM 0 HD2 LYS B 51 -14.587 5.352 7.602 1.00 1.65 H new ATOM 0 HD3 LYS B 51 -16.270 5.760 7.875 1.00 1.65 H new ATOM 0 HE2 LYS B 51 -15.949 6.209 10.138 1.00 1.69 H new ATOM 0 HE3 LYS B 51 -14.606 5.094 10.290 1.00 1.69 H new ATOM 0 HZ1 LYS B 51 -13.891 7.399 10.393 1.00 2.68 H new ATOM 0 HZ2 LYS B 51 -13.215 6.617 9.046 1.00 2.68 H new ATOM 0 HZ3 LYS B 51 -14.516 7.688 8.840 1.00 2.68 H new ATOM 2467 N ASP B 52 -16.460 4.645 5.396 1.00 1.87 N ATOM 2468 CA ASP B 52 -16.023 5.686 4.454 1.00 1.88 C ATOM 2469 C ASP B 52 -16.622 7.069 4.728 1.00 2.07 C ATOM 2470 O ASP B 52 -17.320 7.659 3.912 1.00 2.08 O ATOM 2471 CB ASP B 52 -16.086 5.193 2.998 1.00 2.03 C ATOM 2472 CG ASP B 52 -17.485 5.056 2.410 1.00 3.04 C ATOM 2473 OD1 ASP B 52 -18.321 4.412 3.075 1.00 4.33 O ATOM 2474 OD2 ASP B 52 -17.658 5.523 1.263 1.00 3.84 O ATOM 0 H ASP B 52 -15.752 3.921 5.518 1.00 1.87 H new ATOM 0 HA ASP B 52 -14.964 5.868 4.638 1.00 1.88 H new ATOM 0 HB2 ASP B 52 -15.515 5.882 2.375 1.00 2.03 H new ATOM 0 HB3 ASP B 52 -15.590 4.224 2.939 1.00 2.03 H new ATOM 2479 N VAL B 53 -16.239 7.627 5.882 1.00 2.35 N ATOM 2480 CA VAL B 53 -16.288 9.053 6.152 1.00 2.41 C ATOM 2481 C VAL B 53 -14.894 9.442 6.620 1.00 2.53 C ATOM 2482 O VAL B 53 -14.282 8.701 7.400 1.00 3.03 O ATOM 2483 CB VAL B 53 -17.385 9.446 7.160 1.00 2.90 C ATOM 2484 CG1 VAL B 53 -18.769 9.136 6.582 1.00 4.22 C ATOM 2485 CG2 VAL B 53 -17.243 8.793 8.541 1.00 3.98 C ATOM 0 H VAL B 53 -15.880 7.081 6.665 1.00 2.35 H new ATOM 0 HA VAL B 53 -16.565 9.600 5.251 1.00 2.41 H new ATOM 0 HB VAL B 53 -17.265 10.518 7.320 1.00 2.90 H new ATOM 0 HG11 VAL B 53 -19.536 9.418 7.303 1.00 4.22 H new ATOM 0 HG12 VAL B 53 -18.913 9.700 5.660 1.00 4.22 H new ATOM 0 HG13 VAL B 53 -18.844 8.069 6.371 1.00 4.22 H new ATOM 0 HG21 VAL B 53 -18.056 9.125 9.186 1.00 3.98 H new ATOM 0 HG22 VAL B 53 -17.282 7.709 8.437 1.00 3.98 H new ATOM 0 HG23 VAL B 53 -16.289 9.080 8.983 1.00 3.98 H new ATOM 2495 N GLY B 54 -14.396 10.557 6.086 1.00 2.44 N ATOM 2496 CA GLY B 54 -13.005 10.959 6.125 1.00 2.69 C ATOM 2497 C GLY B 54 -12.584 11.252 4.688 1.00 2.44 C ATOM 2498 O GLY B 54 -13.322 11.905 3.951 1.00 3.04 O ATOM 0 H GLY B 54 -14.984 11.230 5.594 1.00 2.44 H new ATOM 0 HA2 GLY B 54 -12.876 11.841 6.752 1.00 2.69 H new ATOM 0 HA3 GLY B 54 -12.388 10.170 6.554 1.00 2.69 H new ATOM 2502 N SER B 55 -11.449 10.695 4.262 1.00 1.84 N ATOM 2503 CA SER B 55 -10.848 10.899 2.953 1.00 1.66 C ATOM 2504 C SER B 55 -11.750 10.454 1.803 1.00 1.68 C ATOM 2505 O SER B 55 -11.418 10.697 0.645 1.00 1.75 O ATOM 2506 CB SER B 55 -9.482 10.219 2.860 1.00 1.52 C ATOM 2507 OG SER B 55 -8.887 10.096 4.137 1.00 2.05 O ATOM 0 H SER B 55 -10.904 10.063 4.849 1.00 1.84 H new ATOM 0 HA SER B 55 -10.713 11.975 2.847 1.00 1.66 H new ATOM 0 HB2 SER B 55 -9.593 9.232 2.411 1.00 1.52 H new ATOM 0 HB3 SER B 55 -8.829 10.796 2.205 1.00 1.52 H new ATOM 0 HG SER B 55 -9.196 9.270 4.564 1.00 2.05 H new ATOM 2513 N LEU B 56 -12.818 9.696 2.085 1.00 1.71 N ATOM 2514 CA LEU B 56 -13.879 9.434 1.124 1.00 1.79 C ATOM 2515 C LEU B 56 -14.140 10.692 0.312 1.00 1.88 C ATOM 2516 O LEU B 56 -14.085 10.633 -0.912 1.00 1.86 O ATOM 2517 CB LEU B 56 -15.157 9.007 1.858 1.00 1.89 C ATOM 2518 CG LEU B 56 -16.384 8.763 0.954 1.00 2.45 C ATOM 2519 CD1 LEU B 56 -17.124 10.029 0.501 1.00 2.55 C ATOM 2520 CD2 LEU B 56 -16.081 7.853 -0.241 1.00 3.11 C ATOM 0 H LEU B 56 -12.964 9.250 2.990 1.00 1.71 H new ATOM 0 HA LEU B 56 -13.575 8.628 0.456 1.00 1.79 H new ATOM 0 HB2 LEU B 56 -14.949 8.094 2.415 1.00 1.89 H new ATOM 0 HB3 LEU B 56 -15.411 9.775 2.589 1.00 1.89 H new ATOM 0 HG LEU B 56 -17.073 8.238 1.615 1.00 2.45 H new ATOM 0 HD11 LEU B 56 -17.969 9.751 -0.129 1.00 2.55 H new ATOM 0 HD12 LEU B 56 -17.486 10.571 1.375 1.00 2.55 H new ATOM 0 HD13 LEU B 56 -16.444 10.665 -0.065 1.00 2.55 H new ATOM 0 HD21 LEU B 56 -16.984 7.721 -0.836 1.00 3.11 H new ATOM 0 HD22 LEU B 56 -15.304 8.307 -0.856 1.00 3.11 H new ATOM 0 HD23 LEU B 56 -15.739 6.883 0.118 1.00 3.11 H new ATOM 2532 N ASP B 57 -14.380 11.814 0.996 1.00 2.03 N ATOM 2533 CA ASP B 57 -14.689 13.068 0.333 1.00 2.22 C ATOM 2534 C ASP B 57 -13.547 13.475 -0.611 1.00 2.08 C ATOM 2535 O ASP B 57 -13.745 13.533 -1.821 1.00 2.14 O ATOM 2536 CB ASP B 57 -15.008 14.130 1.390 1.00 2.54 C ATOM 2537 CG ASP B 57 -15.296 15.484 0.765 1.00 2.79 C ATOM 2538 OD1 ASP B 57 -15.639 15.530 -0.432 1.00 3.70 O ATOM 2539 OD2 ASP B 57 -15.088 16.496 1.469 1.00 3.11 O ATOM 0 H ASP B 57 -14.364 11.871 2.014 1.00 2.03 H new ATOM 0 HA ASP B 57 -15.572 12.957 -0.296 1.00 2.22 H new ATOM 0 HB2 ASP B 57 -15.869 13.811 1.977 1.00 2.54 H new ATOM 0 HB3 ASP B 57 -14.168 14.220 2.079 1.00 2.54 H new ATOM 2544 N GLU B 58 -12.334 13.697 -0.087 1.00 1.96 N ATOM 2545 CA GLU B 58 -11.130 13.994 -0.870 1.00 1.92 C ATOM 2546 C GLU B 58 -11.028 13.124 -2.124 1.00 1.67 C ATOM 2547 O GLU B 58 -10.955 13.638 -3.238 1.00 1.88 O ATOM 2548 CB GLU B 58 -9.879 13.847 0.013 1.00 1.90 C ATOM 2549 CG GLU B 58 -9.607 15.121 0.829 1.00 2.42 C ATOM 2550 CD GLU B 58 -10.864 15.657 1.492 1.00 4.31 C ATOM 2551 OE1 GLU B 58 -11.498 14.857 2.212 1.00 5.64 O ATOM 2552 OE2 GLU B 58 -11.217 16.820 1.184 1.00 5.05 O ATOM 0 H GLU B 58 -12.160 13.674 0.918 1.00 1.96 H new ATOM 0 HA GLU B 58 -11.200 15.026 -1.213 1.00 1.92 H new ATOM 0 HB2 GLU B 58 -10.008 13.002 0.689 1.00 1.90 H new ATOM 0 HB3 GLU B 58 -9.015 13.625 -0.614 1.00 1.90 H new ATOM 0 HG2 GLU B 58 -8.858 14.909 1.592 1.00 2.42 H new ATOM 0 HG3 GLU B 58 -9.188 15.886 0.176 1.00 2.42 H new ATOM 2559 N LYS B 59 -11.027 11.803 -1.952 1.00 1.27 N ATOM 2560 CA LYS B 59 -10.927 10.900 -3.085 1.00 1.07 C ATOM 2561 C LYS B 59 -12.096 11.102 -4.046 1.00 1.17 C ATOM 2562 O LYS B 59 -11.893 11.231 -5.249 1.00 1.23 O ATOM 2563 CB LYS B 59 -10.839 9.453 -2.603 1.00 0.93 C ATOM 2564 CG LYS B 59 -9.600 9.290 -1.717 1.00 1.40 C ATOM 2565 CD LYS B 59 -9.202 7.825 -1.527 1.00 0.83 C ATOM 2566 CE LYS B 59 -10.358 6.900 -1.151 1.00 1.11 C ATOM 2567 NZ LYS B 59 -11.121 7.386 0.022 1.00 1.40 N ATOM 0 H LYS B 59 -11.094 11.342 -1.044 1.00 1.27 H new ATOM 0 HA LYS B 59 -10.013 11.127 -3.634 1.00 1.07 H new ATOM 0 HB2 LYS B 59 -11.737 9.188 -2.045 1.00 0.93 H new ATOM 0 HB3 LYS B 59 -10.782 8.776 -3.456 1.00 0.93 H new ATOM 0 HG2 LYS B 59 -8.766 9.835 -2.160 1.00 1.40 H new ATOM 0 HG3 LYS B 59 -9.793 9.740 -0.743 1.00 1.40 H new ATOM 0 HD2 LYS B 59 -8.748 7.462 -2.449 1.00 0.83 H new ATOM 0 HD3 LYS B 59 -8.439 7.766 -0.751 1.00 0.83 H new ATOM 0 HE2 LYS B 59 -11.032 6.803 -2.002 1.00 1.11 H new ATOM 0 HE3 LYS B 59 -9.967 5.905 -0.938 1.00 1.11 H new ATOM 0 HZ1 LYS B 59 -11.995 6.832 0.121 1.00 1.40 H new ATOM 0 HZ2 LYS B 59 -10.544 7.279 0.880 1.00 1.40 H new ATOM 0 HZ3 LYS B 59 -11.360 8.389 -0.111 1.00 1.40 H new ATOM 2581 N MET B 60 -13.319 11.129 -3.520 1.00 1.31 N ATOM 2582 CA MET B 60 -14.513 11.374 -4.318 1.00 1.41 C ATOM 2583 C MET B 60 -14.313 12.610 -5.194 1.00 1.50 C ATOM 2584 O MET B 60 -14.496 12.511 -6.402 1.00 1.47 O ATOM 2585 CB MET B 60 -15.777 11.442 -3.443 1.00 1.71 C ATOM 2586 CG MET B 60 -17.041 11.735 -4.265 1.00 1.73 C ATOM 2587 SD MET B 60 -17.333 13.484 -4.659 1.00 1.90 S ATOM 2588 CE MET B 60 -18.689 13.330 -5.843 1.00 2.68 C ATOM 0 H MET B 60 -13.507 10.981 -2.528 1.00 1.31 H new ATOM 0 HA MET B 60 -14.672 10.529 -4.988 1.00 1.41 H new ATOM 0 HB2 MET B 60 -15.901 10.497 -2.914 1.00 1.71 H new ATOM 0 HB3 MET B 60 -15.651 12.216 -2.686 1.00 1.71 H new ATOM 0 HG2 MET B 60 -16.983 11.175 -5.199 1.00 1.73 H new ATOM 0 HG3 MET B 60 -17.904 11.355 -3.719 1.00 1.73 H new ATOM 0 HE1 MET B 60 -18.988 14.321 -6.184 1.00 2.68 H new ATOM 0 HE2 MET B 60 -18.361 12.736 -6.696 1.00 2.68 H new ATOM 0 HE3 MET B 60 -19.537 12.840 -5.364 1.00 2.68 H new ATOM 2598 N LYS B 61 -13.887 13.737 -4.612 1.00 1.66 N ATOM 2599 CA LYS B 61 -13.563 14.940 -5.371 1.00 1.77 C ATOM 2600 C LYS B 61 -12.558 14.594 -6.469 1.00 1.72 C ATOM 2601 O LYS B 61 -12.821 14.821 -7.645 1.00 1.86 O ATOM 2602 CB LYS B 61 -12.971 16.024 -4.462 1.00 1.85 C ATOM 2603 CG LYS B 61 -13.935 16.581 -3.406 1.00 3.18 C ATOM 2604 CD LYS B 61 -13.133 16.880 -2.133 1.00 2.80 C ATOM 2605 CE LYS B 61 -13.768 17.974 -1.262 1.00 3.43 C ATOM 2606 NZ LYS B 61 -13.316 17.909 0.146 1.00 3.55 N ATOM 0 H LYS B 61 -13.759 13.836 -3.605 1.00 1.66 H new ATOM 0 HA LYS B 61 -14.482 15.325 -5.812 1.00 1.77 H new ATOM 0 HB2 LYS B 61 -12.097 15.615 -3.955 1.00 1.85 H new ATOM 0 HB3 LYS B 61 -12.622 16.848 -5.084 1.00 1.85 H new ATOM 0 HG2 LYS B 61 -14.418 17.487 -3.772 1.00 3.18 H new ATOM 0 HG3 LYS B 61 -14.726 15.861 -3.196 1.00 3.18 H new ATOM 0 HD2 LYS B 61 -13.040 15.966 -1.547 1.00 2.80 H new ATOM 0 HD3 LYS B 61 -12.124 17.185 -2.410 1.00 2.80 H new ATOM 0 HE2 LYS B 61 -13.521 18.952 -1.675 1.00 3.43 H new ATOM 0 HE3 LYS B 61 -14.853 17.878 -1.297 1.00 3.43 H new ATOM 0 HZ1 LYS B 61 -14.112 17.626 0.753 1.00 3.55 H new ATOM 0 HZ2 LYS B 61 -12.549 17.212 0.233 1.00 3.55 H new ATOM 0 HZ3 LYS B 61 -12.969 18.843 0.443 1.00 3.55 H new ATOM 2620 N SER B 62 -11.400 14.044 -6.096 1.00 1.56 N ATOM 2621 CA SER B 62 -10.374 13.665 -7.069 1.00 1.57 C ATOM 2622 C SER B 62 -10.933 12.864 -8.260 1.00 1.52 C ATOM 2623 O SER B 62 -10.603 13.151 -9.412 1.00 1.75 O ATOM 2624 CB SER B 62 -9.240 12.902 -6.378 1.00 1.48 C ATOM 2625 OG SER B 62 -8.783 13.615 -5.247 1.00 2.68 O ATOM 0 H SER B 62 -11.150 13.851 -5.126 1.00 1.56 H new ATOM 0 HA SER B 62 -9.980 14.591 -7.487 1.00 1.57 H new ATOM 0 HB2 SER B 62 -9.589 11.914 -6.076 1.00 1.48 H new ATOM 0 HB3 SER B 62 -8.417 12.750 -7.077 1.00 1.48 H new ATOM 0 HG SER B 62 -9.420 13.503 -4.510 1.00 2.68 H new ATOM 2631 N LEU B 63 -11.770 11.856 -7.999 1.00 1.31 N ATOM 2632 CA LEU B 63 -12.385 11.057 -9.056 1.00 1.27 C ATOM 2633 C LEU B 63 -13.362 11.932 -9.854 1.00 1.46 C ATOM 2634 O LEU B 63 -13.328 11.947 -11.083 1.00 1.60 O ATOM 2635 CB LEU B 63 -13.065 9.801 -8.476 1.00 1.14 C ATOM 2636 CG LEU B 63 -12.128 8.719 -7.896 1.00 1.04 C ATOM 2637 CD1 LEU B 63 -10.701 9.147 -7.520 1.00 1.11 C ATOM 2638 CD2 LEU B 63 -12.777 8.130 -6.643 1.00 1.27 C ATOM 0 H LEU B 63 -12.037 11.574 -7.056 1.00 1.31 H new ATOM 0 HA LEU B 63 -11.613 10.702 -9.738 1.00 1.27 H new ATOM 0 HB2 LEU B 63 -13.751 10.116 -7.690 1.00 1.14 H new ATOM 0 HB3 LEU B 63 -13.668 9.345 -9.261 1.00 1.14 H new ATOM 0 HG LEU B 63 -12.006 8.012 -8.716 1.00 1.04 H new ATOM 0 HD11 LEU B 63 -10.156 8.289 -7.127 1.00 1.11 H new ATOM 0 HD12 LEU B 63 -10.190 9.527 -8.405 1.00 1.11 H new ATOM 0 HD13 LEU B 63 -10.744 9.929 -6.762 1.00 1.11 H new ATOM 0 HD21 LEU B 63 -12.126 7.364 -6.222 1.00 1.27 H new ATOM 0 HD22 LEU B 63 -12.931 8.920 -5.907 1.00 1.27 H new ATOM 0 HD23 LEU B 63 -13.737 7.686 -6.905 1.00 1.27 H new ATOM 2650 N ASP B 64 -14.229 12.675 -9.164 1.00 1.52 N ATOM 2651 CA ASP B 64 -15.229 13.544 -9.777 1.00 1.68 C ATOM 2652 C ASP B 64 -14.583 14.504 -10.782 1.00 1.74 C ATOM 2653 O ASP B 64 -15.052 14.635 -11.910 1.00 1.76 O ATOM 2654 CB ASP B 64 -15.981 14.295 -8.674 1.00 1.89 C ATOM 2655 CG ASP B 64 -17.135 15.105 -9.236 1.00 2.14 C ATOM 2656 OD1 ASP B 64 -18.240 14.526 -9.316 1.00 2.92 O ATOM 2657 OD2 ASP B 64 -16.895 16.290 -9.549 1.00 2.01 O ATOM 0 H ASP B 64 -14.254 12.688 -8.144 1.00 1.52 H new ATOM 0 HA ASP B 64 -15.942 12.940 -10.338 1.00 1.68 H new ATOM 0 HB2 ASP B 64 -16.359 13.583 -7.941 1.00 1.89 H new ATOM 0 HB3 ASP B 64 -15.292 14.957 -8.149 1.00 1.89 H new ATOM 2662 N VAL B 65 -13.466 15.118 -10.380 1.00 1.80 N ATOM 2663 CA VAL B 65 -12.671 16.025 -11.202 1.00 1.85 C ATOM 2664 C VAL B 65 -12.318 15.369 -12.535 1.00 1.66 C ATOM 2665 O VAL B 65 -12.767 15.816 -13.587 1.00 1.69 O ATOM 2666 CB VAL B 65 -11.409 16.454 -10.429 1.00 2.08 C ATOM 2667 CG1 VAL B 65 -10.369 17.180 -11.293 1.00 2.20 C ATOM 2668 CG2 VAL B 65 -11.796 17.390 -9.290 1.00 2.82 C ATOM 0 H VAL B 65 -13.081 14.991 -9.444 1.00 1.80 H new ATOM 0 HA VAL B 65 -13.255 16.918 -11.424 1.00 1.85 H new ATOM 0 HB VAL B 65 -10.958 15.530 -10.067 1.00 2.08 H new ATOM 0 HG11 VAL B 65 -9.510 17.450 -10.679 1.00 2.20 H new ATOM 0 HG12 VAL B 65 -10.045 16.524 -12.101 1.00 2.20 H new ATOM 0 HG13 VAL B 65 -10.812 18.083 -11.714 1.00 2.20 H new ATOM 0 HG21 VAL B 65 -10.901 17.691 -8.746 1.00 2.82 H new ATOM 0 HG22 VAL B 65 -12.288 18.274 -9.696 1.00 2.82 H new ATOM 0 HG23 VAL B 65 -12.477 16.876 -8.612 1.00 2.82 H new ATOM 2678 N ASN B 66 -11.466 14.339 -12.495 1.00 1.53 N ATOM 2679 CA ASN B 66 -10.968 13.708 -13.722 1.00 1.40 C ATOM 2680 C ASN B 66 -10.606 12.239 -13.506 1.00 1.30 C ATOM 2681 O ASN B 66 -9.476 11.825 -13.773 1.00 1.50 O ATOM 2682 CB ASN B 66 -9.772 14.486 -14.315 1.00 1.68 C ATOM 2683 CG ASN B 66 -10.139 15.818 -14.964 1.00 2.21 C ATOM 2684 OD1 ASN B 66 -9.777 16.881 -14.471 1.00 3.38 O ATOM 2685 ND2 ASN B 66 -10.823 15.779 -16.105 1.00 2.55 N ATOM 0 H ASN B 66 -11.109 13.927 -11.633 1.00 1.53 H new ATOM 0 HA ASN B 66 -11.784 13.741 -14.444 1.00 1.40 H new ATOM 0 HB2 ASN B 66 -9.047 14.671 -13.523 1.00 1.68 H new ATOM 0 HB3 ASN B 66 -9.280 13.858 -15.058 1.00 1.68 H new ATOM 0 HD21 ASN B 66 -11.057 16.646 -16.589 1.00 2.55 H new ATOM 0 HD22 ASN B 66 -11.113 14.882 -16.495 1.00 2.55 H new ATOM 2692 N GLN B 67 -11.576 11.415 -13.100 1.00 1.12 N ATOM 2693 CA GLN B 67 -11.382 9.977 -12.957 1.00 1.04 C ATOM 2694 C GLN B 67 -10.761 9.323 -14.198 1.00 1.30 C ATOM 2695 O GLN B 67 -10.065 8.311 -14.110 1.00 1.52 O ATOM 2696 CB GLN B 67 -12.706 9.284 -12.606 1.00 1.03 C ATOM 2697 CG GLN B 67 -13.814 9.454 -13.668 1.00 1.33 C ATOM 2698 CD GLN B 67 -13.645 8.516 -14.865 1.00 2.96 C ATOM 2699 OE1 GLN B 67 -13.158 7.396 -14.715 1.00 4.47 O ATOM 2700 NE2 GLN B 67 -13.998 8.994 -16.053 1.00 3.37 N ATOM 0 H GLN B 67 -12.516 11.730 -12.862 1.00 1.12 H new ATOM 0 HA GLN B 67 -10.671 9.846 -12.141 1.00 1.04 H new ATOM 0 HB2 GLN B 67 -12.518 8.220 -12.461 1.00 1.03 H new ATOM 0 HB3 GLN B 67 -13.067 9.676 -11.655 1.00 1.03 H new ATOM 0 HG2 GLN B 67 -14.784 9.272 -13.205 1.00 1.33 H new ATOM 0 HG3 GLN B 67 -13.817 10.486 -14.020 1.00 1.33 H new ATOM 0 HE21 GLN B 67 -14.398 9.929 -16.128 1.00 3.37 H new ATOM 0 HE22 GLN B 67 -13.869 8.426 -16.890 1.00 3.37 H new ATOM 2709 N ASP B 68 -11.053 9.891 -15.369 1.00 1.41 N ATOM 2710 CA ASP B 68 -10.635 9.344 -16.650 1.00 1.70 C ATOM 2711 C ASP B 68 -9.109 9.354 -16.804 1.00 2.03 C ATOM 2712 O ASP B 68 -8.570 8.683 -17.678 1.00 2.46 O ATOM 2713 CB ASP B 68 -11.337 10.109 -17.783 1.00 1.53 C ATOM 2714 CG ASP B 68 -11.944 9.157 -18.804 1.00 1.90 C ATOM 2715 OD1 ASP B 68 -12.852 8.403 -18.386 1.00 2.73 O ATOM 2716 OD2 ASP B 68 -11.523 9.226 -19.977 1.00 3.05 O ATOM 0 H ASP B 68 -11.592 10.753 -15.450 1.00 1.41 H new ATOM 0 HA ASP B 68 -10.933 8.297 -16.701 1.00 1.70 H new ATOM 0 HB2 ASP B 68 -12.119 10.744 -17.366 1.00 1.53 H new ATOM 0 HB3 ASP B 68 -10.622 10.767 -18.277 1.00 1.53 H new ATOM 2721 N SER B 69 -8.396 10.094 -15.942 1.00 1.99 N ATOM 2722 CA SER B 69 -6.944 10.208 -15.991 1.00 2.40 C ATOM 2723 C SER B 69 -6.193 8.895 -15.829 1.00 2.51 C ATOM 2724 O SER B 69 -5.003 8.874 -16.138 1.00 3.89 O ATOM 2725 CB SER B 69 -6.453 11.190 -14.925 1.00 2.47 C ATOM 2726 OG SER B 69 -7.113 12.434 -15.039 1.00 3.58 O ATOM 0 H SER B 69 -8.822 10.632 -15.187 1.00 1.99 H new ATOM 0 HA SER B 69 -6.726 10.568 -16.996 1.00 2.40 H new ATOM 0 HB2 SER B 69 -6.626 10.772 -13.933 1.00 2.47 H new ATOM 0 HB3 SER B 69 -5.377 11.334 -15.027 1.00 2.47 H new ATOM 0 HG SER B 69 -7.956 12.404 -14.540 1.00 3.58 H new ATOM 2732 N GLU B 70 -6.861 7.841 -15.349 1.00 1.93 N ATOM 2733 CA GLU B 70 -6.302 6.502 -15.242 1.00 1.58 C ATOM 2734 C GLU B 70 -5.382 6.397 -14.023 1.00 1.38 C ATOM 2735 O GLU B 70 -4.644 7.330 -13.706 1.00 1.61 O ATOM 2736 CB GLU B 70 -5.585 6.129 -16.548 1.00 1.78 C ATOM 2737 CG GLU B 70 -5.435 4.629 -16.723 1.00 2.07 C ATOM 2738 CD GLU B 70 -4.658 4.336 -17.994 1.00 2.35 C ATOM 2739 OE1 GLU B 70 -3.414 4.497 -17.974 1.00 3.72 O ATOM 2740 OE2 GLU B 70 -5.308 3.957 -18.987 1.00 2.17 O ATOM 0 H GLU B 70 -7.824 7.903 -15.019 1.00 1.93 H new ATOM 0 HA GLU B 70 -7.108 5.784 -15.092 1.00 1.58 H new ATOM 0 HB2 GLU B 70 -6.141 6.536 -17.393 1.00 1.78 H new ATOM 0 HB3 GLU B 70 -4.599 6.593 -16.562 1.00 1.78 H new ATOM 0 HG2 GLU B 70 -4.918 4.203 -15.863 1.00 2.07 H new ATOM 0 HG3 GLU B 70 -6.417 4.159 -16.769 1.00 2.07 H new ATOM 2747 N LEU B 71 -5.432 5.267 -13.314 1.00 1.18 N ATOM 2748 CA LEU B 71 -4.515 5.023 -12.212 1.00 1.11 C ATOM 2749 C LEU B 71 -3.244 4.347 -12.699 1.00 1.02 C ATOM 2750 O LEU B 71 -3.207 3.696 -13.744 1.00 1.15 O ATOM 2751 CB LEU B 71 -5.174 4.198 -11.105 1.00 1.26 C ATOM 2752 CG LEU B 71 -6.123 5.025 -10.238 1.00 1.51 C ATOM 2753 CD1 LEU B 71 -6.703 4.107 -9.173 1.00 1.83 C ATOM 2754 CD2 LEU B 71 -5.441 6.214 -9.542 1.00 3.03 C ATOM 0 H LEU B 71 -6.097 4.513 -13.487 1.00 1.18 H new ATOM 0 HA LEU B 71 -4.248 5.992 -11.791 1.00 1.11 H new ATOM 0 HB2 LEU B 71 -5.725 3.371 -11.553 1.00 1.26 H new ATOM 0 HB3 LEU B 71 -4.400 3.761 -10.474 1.00 1.26 H new ATOM 0 HG LEU B 71 -6.888 5.441 -10.894 1.00 1.51 H new ATOM 0 HD11 LEU B 71 -7.386 4.672 -8.538 1.00 1.83 H new ATOM 0 HD12 LEU B 71 -7.244 3.291 -9.652 1.00 1.83 H new ATOM 0 HD13 LEU B 71 -5.895 3.699 -8.565 1.00 1.83 H new ATOM 0 HD21 LEU B 71 -6.174 6.755 -8.944 1.00 3.03 H new ATOM 0 HD22 LEU B 71 -4.644 5.848 -8.895 1.00 3.03 H new ATOM 0 HD23 LEU B 71 -5.020 6.883 -10.293 1.00 3.03 H new ATOM 2766 N LYS B 72 -2.204 4.500 -11.883 1.00 0.97 N ATOM 2767 CA LYS B 72 -0.871 3.966 -12.060 1.00 1.09 C ATOM 2768 C LYS B 72 -0.392 3.613 -10.654 1.00 1.13 C ATOM 2769 O LYS B 72 -0.987 4.087 -9.684 1.00 1.02 O ATOM 2770 CB LYS B 72 0.032 5.011 -12.739 1.00 1.25 C ATOM 2771 CG LYS B 72 -0.702 5.754 -13.871 1.00 1.74 C ATOM 2772 CD LYS B 72 0.238 6.505 -14.819 1.00 2.09 C ATOM 2773 CE LYS B 72 0.774 5.510 -15.857 1.00 2.66 C ATOM 2774 NZ LYS B 72 1.612 6.140 -16.891 1.00 4.04 N ATOM 0 H LYS B 72 -2.285 5.040 -11.022 1.00 0.97 H new ATOM 0 HA LYS B 72 -0.849 3.089 -12.707 1.00 1.09 H new ATOM 0 HB2 LYS B 72 0.377 5.730 -11.996 1.00 1.25 H new ATOM 0 HB3 LYS B 72 0.917 4.519 -13.142 1.00 1.25 H new ATOM 0 HG2 LYS B 72 -1.288 5.037 -14.446 1.00 1.74 H new ATOM 0 HG3 LYS B 72 -1.406 6.462 -13.434 1.00 1.74 H new ATOM 0 HD2 LYS B 72 -0.292 7.319 -15.313 1.00 2.09 H new ATOM 0 HD3 LYS B 72 1.061 6.952 -14.262 1.00 2.09 H new ATOM 0 HE2 LYS B 72 1.355 4.742 -15.347 1.00 2.66 H new ATOM 0 HE3 LYS B 72 -0.066 5.008 -16.337 1.00 2.66 H new ATOM 0 HZ1 LYS B 72 1.942 5.415 -17.560 1.00 4.04 H new ATOM 0 HZ2 LYS B 72 1.055 6.854 -17.402 1.00 4.04 H new ATOM 0 HZ3 LYS B 72 2.432 6.596 -16.443 1.00 4.04 H new ATOM 2788 N PHE B 73 0.645 2.783 -10.537 1.00 1.35 N ATOM 2789 CA PHE B 73 0.955 2.047 -9.312 1.00 1.27 C ATOM 2790 C PHE B 73 0.921 2.925 -8.054 1.00 0.94 C ATOM 2791 O PHE B 73 0.094 2.705 -7.172 1.00 0.64 O ATOM 2792 CB PHE B 73 2.296 1.309 -9.476 1.00 1.69 C ATOM 2793 CG PHE B 73 2.460 0.657 -10.840 1.00 1.12 C ATOM 2794 CD1 PHE B 73 1.563 -0.357 -11.224 1.00 2.03 C ATOM 2795 CD2 PHE B 73 3.278 1.261 -11.815 1.00 2.41 C ATOM 2796 CE1 PHE B 73 1.457 -0.744 -12.570 1.00 3.09 C ATOM 2797 CE2 PHE B 73 3.151 0.895 -13.167 1.00 2.77 C ATOM 2798 CZ PHE B 73 2.234 -0.100 -13.545 1.00 2.94 C ATOM 0 H PHE B 73 1.300 2.601 -11.298 1.00 1.35 H new ATOM 0 HA PHE B 73 0.167 1.310 -9.158 1.00 1.27 H new ATOM 0 HB2 PHE B 73 3.112 2.013 -9.317 1.00 1.69 H new ATOM 0 HB3 PHE B 73 2.379 0.545 -8.703 1.00 1.69 H new ATOM 0 HD1 PHE B 73 0.951 -0.842 -10.478 1.00 2.03 H new ATOM 0 HD2 PHE B 73 4.004 2.006 -11.524 1.00 2.41 H new ATOM 0 HE1 PHE B 73 0.779 -1.535 -12.854 1.00 3.09 H new ATOM 0 HE2 PHE B 73 3.760 1.380 -13.916 1.00 2.77 H new ATOM 0 HZ PHE B 73 2.127 -0.369 -14.585 1.00 2.94 H new ATOM 2808 N ASN B 74 1.789 3.941 -7.979 1.00 1.18 N ATOM 2809 CA ASN B 74 1.901 4.793 -6.795 1.00 1.19 C ATOM 2810 C ASN B 74 0.586 5.526 -6.564 1.00 0.91 C ATOM 2811 O ASN B 74 0.121 5.673 -5.441 1.00 0.83 O ATOM 2812 CB ASN B 74 2.979 5.882 -6.887 1.00 1.79 C ATOM 2813 CG ASN B 74 4.292 5.482 -7.501 1.00 2.44 C ATOM 2814 OD1 ASN B 74 4.393 4.450 -8.148 1.00 3.45 O ATOM 2815 ND2 ASN B 74 5.225 6.423 -7.560 1.00 3.43 N ATOM 0 H ASN B 74 2.428 4.192 -8.733 1.00 1.18 H new ATOM 0 HA ASN B 74 2.168 4.110 -5.989 1.00 1.19 H new ATOM 0 HB2 ASN B 74 2.574 6.714 -7.462 1.00 1.79 H new ATOM 0 HB3 ASN B 74 3.173 6.255 -5.881 1.00 1.79 H new ATOM 0 HD21 ASN B 74 6.045 6.292 -8.153 1.00 3.43 H new ATOM 0 HD22 ASN B 74 5.123 7.278 -7.013 1.00 3.43 H new ATOM 2822 N GLU B 75 0.023 6.055 -7.645 1.00 0.99 N ATOM 2823 CA GLU B 75 -1.128 6.928 -7.598 1.00 0.95 C ATOM 2824 C GLU B 75 -2.329 6.163 -7.027 1.00 0.83 C ATOM 2825 O GLU B 75 -2.988 6.647 -6.108 1.00 0.86 O ATOM 2826 CB GLU B 75 -1.332 7.532 -8.995 1.00 1.34 C ATOM 2827 CG GLU B 75 -0.282 8.621 -9.318 1.00 1.89 C ATOM 2828 CD GLU B 75 1.174 8.226 -9.071 1.00 3.33 C ATOM 2829 OE1 GLU B 75 1.664 7.310 -9.778 1.00 3.73 O ATOM 2830 OE2 GLU B 75 1.770 8.790 -8.121 1.00 4.90 O ATOM 0 H GLU B 75 0.365 5.882 -8.590 1.00 0.99 H new ATOM 0 HA GLU B 75 -0.986 7.770 -6.921 1.00 0.95 H new ATOM 0 HB2 GLU B 75 -1.275 6.741 -9.743 1.00 1.34 H new ATOM 0 HB3 GLU B 75 -2.331 7.962 -9.061 1.00 1.34 H new ATOM 0 HG2 GLU B 75 -0.390 8.906 -10.364 1.00 1.89 H new ATOM 0 HG3 GLU B 75 -0.506 9.505 -8.722 1.00 1.89 H new ATOM 2837 N TYR B 76 -2.563 4.936 -7.505 1.00 0.83 N ATOM 2838 CA TYR B 76 -3.470 3.984 -6.868 1.00 0.84 C ATOM 2839 C TYR B 76 -3.120 3.879 -5.385 1.00 0.70 C ATOM 2840 O TYR B 76 -3.972 4.059 -4.513 1.00 0.76 O ATOM 2841 CB TYR B 76 -3.344 2.620 -7.576 1.00 0.91 C ATOM 2842 CG TYR B 76 -4.056 1.440 -6.931 1.00 1.14 C ATOM 2843 CD1 TYR B 76 -3.438 0.741 -5.873 1.00 1.74 C ATOM 2844 CD2 TYR B 76 -5.195 0.885 -7.546 1.00 2.09 C ATOM 2845 CE1 TYR B 76 -3.974 -0.472 -5.410 1.00 1.97 C ATOM 2846 CE2 TYR B 76 -5.706 -0.349 -7.108 1.00 2.46 C ATOM 2847 CZ TYR B 76 -5.105 -1.021 -6.034 1.00 1.95 C ATOM 2848 OH TYR B 76 -5.615 -2.212 -5.613 1.00 2.39 O ATOM 0 H TYR B 76 -2.123 4.576 -8.352 1.00 0.83 H new ATOM 0 HA TYR B 76 -4.504 4.319 -6.952 1.00 0.84 H new ATOM 0 HB2 TYR B 76 -3.722 2.730 -8.593 1.00 0.91 H new ATOM 0 HB3 TYR B 76 -2.285 2.375 -7.654 1.00 0.91 H new ATOM 0 HD1 TYR B 76 -2.546 1.142 -5.415 1.00 1.74 H new ATOM 0 HD2 TYR B 76 -5.678 1.410 -8.357 1.00 2.09 H new ATOM 0 HE1 TYR B 76 -3.516 -0.982 -4.575 1.00 1.97 H new ATOM 0 HE2 TYR B 76 -6.565 -0.781 -7.600 1.00 2.46 H new ATOM 0 HH TYR B 76 -6.398 -2.442 -6.155 1.00 2.39 H new ATOM 2858 N TRP B 77 -1.845 3.588 -5.124 1.00 0.54 N ATOM 2859 CA TRP B 77 -1.303 3.371 -3.799 1.00 0.45 C ATOM 2860 C TRP B 77 -1.777 4.417 -2.794 1.00 0.44 C ATOM 2861 O TRP B 77 -2.504 4.090 -1.857 1.00 0.44 O ATOM 2862 CB TRP B 77 0.222 3.333 -3.888 1.00 0.45 C ATOM 2863 CG TRP B 77 0.786 2.312 -3.019 1.00 0.44 C ATOM 2864 CD1 TRP B 77 1.062 2.523 -1.732 1.00 0.47 C ATOM 2865 CD2 TRP B 77 1.256 0.985 -3.346 1.00 0.47 C ATOM 2866 NE1 TRP B 77 1.522 1.359 -1.183 1.00 0.51 N ATOM 2867 CE2 TRP B 77 1.738 0.397 -2.146 1.00 0.50 C ATOM 2868 CE3 TRP B 77 1.434 0.267 -4.545 1.00 0.53 C ATOM 2869 CZ2 TRP B 77 2.338 -0.861 -2.128 1.00 0.58 C ATOM 2870 CZ3 TRP B 77 2.092 -0.971 -4.530 1.00 0.61 C ATOM 2871 CH2 TRP B 77 2.494 -1.554 -3.334 1.00 0.63 C ATOM 0 H TRP B 77 -1.145 3.496 -5.860 1.00 0.54 H new ATOM 0 HA TRP B 77 -1.672 2.415 -3.428 1.00 0.45 H new ATOM 0 HB2 TRP B 77 0.522 3.140 -4.918 1.00 0.45 H new ATOM 0 HB3 TRP B 77 0.627 4.308 -3.615 1.00 0.45 H new ATOM 0 HD1 TRP B 77 0.942 3.460 -1.209 1.00 0.47 H new ATOM 0 HE1 TRP B 77 1.685 1.220 -0.186 1.00 0.51 H new ATOM 0 HE3 TRP B 77 1.064 0.670 -5.476 1.00 0.53 H new ATOM 0 HZ2 TRP B 77 2.677 -1.294 -1.198 1.00 0.58 H new ATOM 0 HZ3 TRP B 77 2.290 -1.479 -5.462 1.00 0.61 H new ATOM 0 HH2 TRP B 77 2.927 -2.543 -3.335 1.00 0.63 H new ATOM 2882 N ARG B 78 -1.369 5.671 -3.001 1.00 0.46 N ATOM 2883 CA ARG B 78 -1.766 6.833 -2.219 1.00 0.51 C ATOM 2884 C ARG B 78 -3.257 6.751 -1.841 1.00 0.53 C ATOM 2885 O ARG B 78 -3.595 6.861 -0.665 1.00 0.57 O ATOM 2886 CB ARG B 78 -1.519 8.090 -3.078 1.00 0.61 C ATOM 2887 CG ARG B 78 -0.055 8.310 -3.512 1.00 1.38 C ATOM 2888 CD ARG B 78 0.025 9.373 -4.616 1.00 1.22 C ATOM 2889 NE ARG B 78 1.195 9.214 -5.501 1.00 2.66 N ATOM 2890 CZ ARG B 78 2.479 9.385 -5.165 1.00 3.86 C ATOM 2891 NH1 ARG B 78 2.846 9.665 -3.915 1.00 4.24 N ATOM 2892 NH2 ARG B 78 3.415 9.280 -6.103 1.00 5.39 N ATOM 0 H ARG B 78 -0.724 5.910 -3.754 1.00 0.46 H new ATOM 0 HA ARG B 78 -1.185 6.873 -1.298 1.00 0.51 H new ATOM 0 HB2 ARG B 78 -2.141 8.028 -3.971 1.00 0.61 H new ATOM 0 HB3 ARG B 78 -1.851 8.964 -2.518 1.00 0.61 H new ATOM 0 HG2 ARG B 78 0.542 8.622 -2.655 1.00 1.38 H new ATOM 0 HG3 ARG B 78 0.369 7.372 -3.871 1.00 1.38 H new ATOM 0 HD2 ARG B 78 -0.884 9.331 -5.217 1.00 1.22 H new ATOM 0 HD3 ARG B 78 0.058 10.361 -4.157 1.00 1.22 H new ATOM 0 HE ARG B 78 1.006 8.947 -6.467 1.00 2.66 H new ATOM 0 HH11 ARG B 78 2.140 9.754 -3.184 1.00 4.24 H new ATOM 0 HH12 ARG B 78 3.833 9.790 -3.689 1.00 4.24 H new ATOM 0 HH21 ARG B 78 3.151 9.071 -7.066 1.00 5.39 H new ATOM 0 HH22 ARG B 78 4.397 9.408 -5.860 1.00 5.39 H new ATOM 2906 N LEU B 79 -4.149 6.521 -2.816 1.00 0.53 N ATOM 2907 CA LEU B 79 -5.587 6.499 -2.550 1.00 0.59 C ATOM 2908 C LEU B 79 -5.987 5.339 -1.632 1.00 0.51 C ATOM 2909 O LEU B 79 -6.809 5.542 -0.734 1.00 0.52 O ATOM 2910 CB LEU B 79 -6.431 6.495 -3.838 1.00 0.72 C ATOM 2911 CG LEU B 79 -6.657 7.904 -4.424 1.00 1.04 C ATOM 2912 CD1 LEU B 79 -5.412 8.478 -5.105 1.00 1.14 C ATOM 2913 CD2 LEU B 79 -7.793 7.865 -5.452 1.00 1.76 C ATOM 0 H LEU B 79 -3.897 6.349 -3.789 1.00 0.53 H new ATOM 0 HA LEU B 79 -5.805 7.430 -2.026 1.00 0.59 H new ATOM 0 HB2 LEU B 79 -5.938 5.873 -4.585 1.00 0.72 H new ATOM 0 HB3 LEU B 79 -7.398 6.037 -3.629 1.00 0.72 H new ATOM 0 HG LEU B 79 -6.907 8.549 -3.582 1.00 1.04 H new ATOM 0 HD11 LEU B 79 -5.636 9.470 -5.496 1.00 1.14 H new ATOM 0 HD12 LEU B 79 -4.601 8.548 -4.380 1.00 1.14 H new ATOM 0 HD13 LEU B 79 -5.111 7.825 -5.924 1.00 1.14 H new ATOM 0 HD21 LEU B 79 -7.947 8.863 -5.862 1.00 1.76 H new ATOM 0 HD22 LEU B 79 -7.532 7.179 -6.257 1.00 1.76 H new ATOM 0 HD23 LEU B 79 -8.709 7.525 -4.969 1.00 1.76 H new ATOM 2925 N ILE B 80 -5.450 4.125 -1.821 1.00 0.47 N ATOM 2926 CA ILE B 80 -5.760 3.055 -0.866 1.00 0.45 C ATOM 2927 C ILE B 80 -5.153 3.405 0.510 1.00 0.43 C ATOM 2928 O ILE B 80 -5.740 3.115 1.549 1.00 0.43 O ATOM 2929 CB ILE B 80 -5.463 1.617 -1.374 1.00 0.48 C ATOM 2930 CG1 ILE B 80 -4.099 1.132 -0.862 1.00 0.55 C ATOM 2931 CG2 ILE B 80 -5.557 1.480 -2.892 1.00 0.72 C ATOM 2932 CD1 ILE B 80 -3.713 -0.318 -1.151 1.00 0.44 C ATOM 0 H ILE B 80 -4.829 3.867 -2.588 1.00 0.47 H new ATOM 0 HA ILE B 80 -6.843 3.014 -0.748 1.00 0.45 H new ATOM 0 HB ILE B 80 -6.245 0.978 -0.964 1.00 0.48 H new ATOM 0 HG12 ILE B 80 -3.331 1.776 -1.289 1.00 0.55 H new ATOM 0 HG13 ILE B 80 -4.073 1.278 0.218 1.00 0.55 H new ATOM 0 HG21 ILE B 80 -5.338 0.451 -3.179 1.00 0.72 H new ATOM 0 HG22 ILE B 80 -6.563 1.742 -3.219 1.00 0.72 H new ATOM 0 HG23 ILE B 80 -4.837 2.149 -3.363 1.00 0.72 H new ATOM 0 HD11 ILE B 80 -2.727 -0.522 -0.733 1.00 0.44 H new ATOM 0 HD12 ILE B 80 -4.445 -0.987 -0.698 1.00 0.44 H new ATOM 0 HD13 ILE B 80 -3.691 -0.481 -2.229 1.00 0.44 H new ATOM 2944 N GLY B 81 -3.993 4.065 0.532 1.00 0.44 N ATOM 2945 CA GLY B 81 -3.447 4.668 1.743 1.00 0.47 C ATOM 2946 C GLY B 81 -4.505 5.503 2.443 1.00 0.49 C ATOM 2947 O GLY B 81 -4.789 5.324 3.626 1.00 0.58 O ATOM 0 H GLY B 81 -3.407 4.195 -0.293 1.00 0.44 H new ATOM 0 HA2 GLY B 81 -3.087 3.888 2.414 1.00 0.47 H new ATOM 0 HA3 GLY B 81 -2.590 5.292 1.491 1.00 0.47 H new ATOM 2951 N GLU B 82 -5.114 6.404 1.681 1.00 0.48 N ATOM 2952 CA GLU B 82 -6.132 7.287 2.196 1.00 0.51 C ATOM 2953 C GLU B 82 -7.340 6.471 2.680 1.00 0.50 C ATOM 2954 O GLU B 82 -7.828 6.724 3.779 1.00 0.55 O ATOM 2955 CB GLU B 82 -6.400 8.385 1.157 1.00 0.65 C ATOM 2956 CG GLU B 82 -5.174 9.318 1.111 1.00 0.85 C ATOM 2957 CD GLU B 82 -5.010 10.070 -0.197 1.00 1.62 C ATOM 2958 OE1 GLU B 82 -6.013 10.178 -0.933 1.00 2.33 O ATOM 2959 OE2 GLU B 82 -3.870 10.551 -0.410 1.00 2.72 O ATOM 0 H GLU B 82 -4.910 6.536 0.690 1.00 0.48 H new ATOM 0 HA GLU B 82 -5.814 7.821 3.092 1.00 0.51 H new ATOM 0 HB2 GLU B 82 -6.579 7.944 0.176 1.00 0.65 H new ATOM 0 HB3 GLU B 82 -7.295 8.947 1.421 1.00 0.65 H new ATOM 0 HG2 GLU B 82 -5.251 10.040 1.924 1.00 0.85 H new ATOM 0 HG3 GLU B 82 -4.276 8.728 1.292 1.00 0.85 H new ATOM 2966 N LEU B 83 -7.778 5.438 1.947 1.00 0.48 N ATOM 2967 CA LEU B 83 -8.855 4.581 2.446 1.00 0.53 C ATOM 2968 C LEU B 83 -8.483 3.865 3.748 1.00 0.51 C ATOM 2969 O LEU B 83 -9.351 3.681 4.601 1.00 0.61 O ATOM 2970 CB LEU B 83 -9.470 3.685 1.358 1.00 0.79 C ATOM 2971 CG LEU B 83 -8.937 2.249 1.229 1.00 1.74 C ATOM 2972 CD1 LEU B 83 -9.494 1.273 2.274 1.00 2.78 C ATOM 2973 CD2 LEU B 83 -9.320 1.719 -0.152 1.00 2.81 C ATOM 0 H LEU B 83 -7.412 5.182 1.030 1.00 0.48 H new ATOM 0 HA LEU B 83 -9.676 5.240 2.727 1.00 0.53 H new ATOM 0 HB2 LEU B 83 -10.544 3.629 1.537 1.00 0.79 H new ATOM 0 HB3 LEU B 83 -9.332 4.181 0.397 1.00 0.79 H new ATOM 0 HG LEU B 83 -7.860 2.304 1.385 1.00 1.74 H new ATOM 0 HD11 LEU B 83 -9.067 0.283 2.112 1.00 2.78 H new ATOM 0 HD12 LEU B 83 -9.233 1.621 3.273 1.00 2.78 H new ATOM 0 HD13 LEU B 83 -10.579 1.220 2.181 1.00 2.78 H new ATOM 0 HD21 LEU B 83 -8.951 0.700 -0.266 1.00 2.81 H new ATOM 0 HD22 LEU B 83 -10.405 1.726 -0.256 1.00 2.81 H new ATOM 0 HD23 LEU B 83 -8.877 2.353 -0.921 1.00 2.81 H new ATOM 2985 N ALA B 84 -7.214 3.476 3.946 1.00 0.50 N ATOM 2986 CA ALA B 84 -6.787 2.976 5.249 1.00 0.57 C ATOM 2987 C ALA B 84 -7.096 3.945 6.407 1.00 0.67 C ATOM 2988 O ALA B 84 -7.154 3.497 7.550 1.00 0.76 O ATOM 2989 CB ALA B 84 -5.308 2.577 5.225 1.00 0.59 C ATOM 0 H ALA B 84 -6.484 3.499 3.234 1.00 0.50 H new ATOM 0 HA ALA B 84 -7.380 2.083 5.446 1.00 0.57 H new ATOM 0 HB1 ALA B 84 -5.015 2.208 6.208 1.00 0.59 H new ATOM 0 HB2 ALA B 84 -5.154 1.794 4.483 1.00 0.59 H new ATOM 0 HB3 ALA B 84 -4.701 3.445 4.968 1.00 0.59 H new ATOM 2995 N LYS B 85 -7.302 5.248 6.148 1.00 0.82 N ATOM 2996 CA LYS B 85 -7.768 6.186 7.167 1.00 1.05 C ATOM 2997 C LYS B 85 -9.262 5.993 7.435 1.00 1.21 C ATOM 2998 O LYS B 85 -9.641 5.827 8.592 1.00 1.50 O ATOM 2999 CB LYS B 85 -7.510 7.644 6.761 1.00 1.43 C ATOM 3000 CG LYS B 85 -6.059 7.971 6.370 1.00 1.20 C ATOM 3001 CD LYS B 85 -6.018 9.224 5.483 1.00 1.48 C ATOM 3002 CE LYS B 85 -6.498 10.507 6.181 1.00 1.99 C ATOM 3003 NZ LYS B 85 -6.901 11.528 5.193 1.00 2.68 N ATOM 0 H LYS B 85 -7.150 5.671 5.233 1.00 0.82 H new ATOM 0 HA LYS B 85 -7.203 5.976 8.075 1.00 1.05 H new ATOM 0 HB2 LYS B 85 -8.159 7.890 5.921 1.00 1.43 H new ATOM 0 HB3 LYS B 85 -7.800 8.291 7.589 1.00 1.43 H new ATOM 0 HG2 LYS B 85 -5.460 8.132 7.267 1.00 1.20 H new ATOM 0 HG3 LYS B 85 -5.618 7.127 5.840 1.00 1.20 H new ATOM 0 HD2 LYS B 85 -4.997 9.375 5.133 1.00 1.48 H new ATOM 0 HD3 LYS B 85 -6.635 9.051 4.601 1.00 1.48 H new ATOM 0 HE2 LYS B 85 -7.339 10.277 6.835 1.00 1.99 H new ATOM 0 HE3 LYS B 85 -5.702 10.901 6.813 1.00 1.99 H new ATOM 0 HZ1 LYS B 85 -7.091 12.427 5.680 1.00 2.68 H new ATOM 0 HZ2 LYS B 85 -6.135 11.664 4.502 1.00 2.68 H new ATOM 0 HZ3 LYS B 85 -7.761 11.213 4.699 1.00 2.68 H new ATOM 3017 N GLU B 86 -10.096 6.055 6.384 1.00 1.16 N ATOM 3018 CA GLU B 86 -11.551 5.926 6.455 1.00 1.32 C ATOM 3019 C GLU B 86 -11.937 4.856 7.463 1.00 1.30 C ATOM 3020 O GLU B 86 -12.409 5.169 8.558 1.00 1.39 O ATOM 3021 CB GLU B 86 -12.141 5.568 5.079 1.00 1.53 C ATOM 3022 CG GLU B 86 -12.465 6.804 4.238 1.00 1.75 C ATOM 3023 CD GLU B 86 -11.205 7.486 3.761 1.00 1.74 C ATOM 3024 OE1 GLU B 86 -10.580 8.182 4.594 1.00 3.08 O ATOM 3025 OE2 GLU B 86 -10.909 7.330 2.556 1.00 1.91 O ATOM 0 H GLU B 86 -9.759 6.201 5.432 1.00 1.16 H new ATOM 0 HA GLU B 86 -11.956 6.887 6.771 1.00 1.32 H new ATOM 0 HB2 GLU B 86 -11.434 4.940 4.537 1.00 1.53 H new ATOM 0 HB3 GLU B 86 -13.048 4.980 5.219 1.00 1.53 H new ATOM 0 HG2 GLU B 86 -13.072 6.514 3.380 1.00 1.75 H new ATOM 0 HG3 GLU B 86 -13.059 7.503 4.827 1.00 1.75 H new ATOM 3032 N ILE B 87 -11.791 3.594 7.075 1.00 1.23 N ATOM 3033 CA ILE B 87 -12.285 2.497 7.871 1.00 1.26 C ATOM 3034 C ILE B 87 -11.250 2.223 8.963 1.00 1.20 C ATOM 3035 O ILE B 87 -10.087 1.937 8.682 1.00 1.03 O ATOM 3036 CB ILE B 87 -12.626 1.323 6.938 1.00 1.27 C ATOM 3037 CG1 ILE B 87 -13.649 0.344 7.525 1.00 1.62 C ATOM 3038 CG2 ILE B 87 -11.396 0.572 6.426 1.00 1.36 C ATOM 3039 CD1 ILE B 87 -13.358 -0.133 8.949 1.00 2.24 C ATOM 0 H ILE B 87 -11.331 3.313 6.209 1.00 1.23 H new ATOM 0 HA ILE B 87 -13.219 2.710 8.391 1.00 1.26 H new ATOM 0 HB ILE B 87 -13.096 1.803 6.080 1.00 1.27 H new ATOM 0 HG12 ILE B 87 -14.630 0.819 7.512 1.00 1.62 H new ATOM 0 HG13 ILE B 87 -13.708 -0.527 6.873 1.00 1.62 H new ATOM 0 HG21 ILE B 87 -11.712 -0.242 5.774 1.00 1.36 H new ATOM 0 HG22 ILE B 87 -10.758 1.257 5.868 1.00 1.36 H new ATOM 0 HG23 ILE B 87 -10.840 0.166 7.271 1.00 1.36 H new ATOM 0 HD11 ILE B 87 -14.141 -0.821 9.269 1.00 2.24 H new ATOM 0 HD12 ILE B 87 -12.395 -0.643 8.972 1.00 2.24 H new ATOM 0 HD13 ILE B 87 -13.331 0.724 9.622 1.00 2.24 H new ATOM 3051 N ARG B 88 -11.679 2.309 10.222 1.00 1.46 N ATOM 3052 CA ARG B 88 -10.820 2.273 11.398 1.00 1.46 C ATOM 3053 C ARG B 88 -10.446 0.823 11.723 1.00 1.38 C ATOM 3054 O ARG B 88 -10.677 0.336 12.828 1.00 1.81 O ATOM 3055 CB ARG B 88 -11.609 2.897 12.566 1.00 1.93 C ATOM 3056 CG ARG B 88 -12.994 2.231 12.740 1.00 3.89 C ATOM 3057 CD ARG B 88 -13.301 1.881 14.198 1.00 5.28 C ATOM 3058 NE ARG B 88 -14.454 0.969 14.272 1.00 7.36 N ATOM 3059 CZ ARG B 88 -15.724 1.277 14.585 1.00 8.74 C ATOM 3060 NH1 ARG B 88 -16.065 2.540 14.870 1.00 8.38 N ATOM 3061 NH2 ARG B 88 -16.657 0.323 14.613 1.00 10.78 N ATOM 0 H ARG B 88 -12.667 2.409 10.455 1.00 1.46 H new ATOM 0 HA ARG B 88 -9.899 2.828 11.223 1.00 1.46 H new ATOM 0 HB2 ARG B 88 -11.037 2.794 13.488 1.00 1.93 H new ATOM 0 HB3 ARG B 88 -11.738 3.965 12.389 1.00 1.93 H new ATOM 0 HG2 ARG B 88 -13.765 2.902 12.361 1.00 3.89 H new ATOM 0 HG3 ARG B 88 -13.035 1.324 12.136 1.00 3.89 H new ATOM 0 HD2 ARG B 88 -12.430 1.415 14.659 1.00 5.28 H new ATOM 0 HD3 ARG B 88 -13.511 2.790 14.761 1.00 5.28 H new ATOM 0 HE ARG B 88 -14.267 -0.011 14.061 1.00 7.36 H new ATOM 0 HH11 ARG B 88 -15.359 3.276 14.850 1.00 8.38 H new ATOM 0 HH12 ARG B 88 -17.031 2.766 15.107 1.00 8.38 H new ATOM 0 HH21 ARG B 88 -16.407 -0.642 14.397 1.00 10.78 H new ATOM 0 HH22 ARG B 88 -17.620 0.559 14.851 1.00 10.78 H new ATOM 3075 N LYS B 89 -9.833 0.131 10.761 1.00 1.13 N ATOM 3076 CA LYS B 89 -9.674 -1.310 10.843 1.00 1.16 C ATOM 3077 C LYS B 89 -8.731 -1.732 11.974 1.00 1.55 C ATOM 3078 O LYS B 89 -8.773 -2.879 12.407 1.00 1.74 O ATOM 3079 CB LYS B 89 -9.298 -1.908 9.482 1.00 1.51 C ATOM 3080 CG LYS B 89 -7.851 -1.642 9.044 1.00 1.47 C ATOM 3081 CD LYS B 89 -7.699 -0.550 7.977 1.00 1.56 C ATOM 3082 CE LYS B 89 -7.668 -1.129 6.558 1.00 2.04 C ATOM 3083 NZ LYS B 89 -8.991 -1.522 6.038 1.00 3.04 N ATOM 0 H LYS B 89 -9.441 0.551 9.918 1.00 1.13 H new ATOM 0 HA LYS B 89 -10.643 -1.732 11.108 1.00 1.16 H new ATOM 0 HB2 LYS B 89 -9.461 -2.985 9.516 1.00 1.51 H new ATOM 0 HB3 LYS B 89 -9.972 -1.507 8.725 1.00 1.51 H new ATOM 0 HG2 LYS B 89 -7.266 -1.361 9.919 1.00 1.47 H new ATOM 0 HG3 LYS B 89 -7.425 -2.569 8.660 1.00 1.47 H new ATOM 0 HD2 LYS B 89 -8.525 0.156 8.062 1.00 1.56 H new ATOM 0 HD3 LYS B 89 -6.781 0.009 8.160 1.00 1.56 H new ATOM 0 HE2 LYS B 89 -7.230 -0.391 5.886 1.00 2.04 H new ATOM 0 HE3 LYS B 89 -7.012 -1.999 6.547 1.00 2.04 H new ATOM 0 HZ1 LYS B 89 -8.873 -2.041 5.144 1.00 3.04 H new ATOM 0 HZ2 LYS B 89 -9.469 -2.132 6.731 1.00 3.04 H new ATOM 0 HZ3 LYS B 89 -9.565 -0.671 5.871 1.00 3.04 H new ATOM 3097 N LYS B 90 -7.882 -0.824 12.470 1.00 1.88 N ATOM 3098 CA LYS B 90 -7.037 -1.063 13.637 1.00 2.43 C ATOM 3099 C LYS B 90 -7.901 -1.054 14.911 1.00 1.56 C ATOM 3100 O LYS B 90 -7.644 -0.295 15.844 1.00 1.91 O ATOM 3101 CB LYS B 90 -5.897 -0.023 13.634 1.00 3.86 C ATOM 3102 CG LYS B 90 -4.787 -0.320 14.657 1.00 5.12 C ATOM 3103 CD LYS B 90 -3.490 0.456 14.369 1.00 6.81 C ATOM 3104 CE LYS B 90 -3.675 1.983 14.418 1.00 7.52 C ATOM 3105 NZ LYS B 90 -2.398 2.708 14.235 1.00 9.28 N ATOM 0 H LYS B 90 -7.764 0.105 12.066 1.00 1.88 H new ATOM 0 HA LYS B 90 -6.569 -2.047 13.606 1.00 2.43 H new ATOM 0 HB2 LYS B 90 -5.458 0.019 12.637 1.00 3.86 H new ATOM 0 HB3 LYS B 90 -6.315 0.962 13.840 1.00 3.86 H new ATOM 0 HG2 LYS B 90 -5.142 -0.067 15.656 1.00 5.12 H new ATOM 0 HG3 LYS B 90 -4.574 -1.389 14.655 1.00 5.12 H new ATOM 0 HD2 LYS B 90 -2.731 0.165 15.095 1.00 6.81 H new ATOM 0 HD3 LYS B 90 -3.115 0.173 13.385 1.00 6.81 H new ATOM 0 HE2 LYS B 90 -4.378 2.287 13.642 1.00 7.52 H new ATOM 0 HE3 LYS B 90 -4.116 2.263 15.375 1.00 7.52 H new ATOM 0 HZ1 LYS B 90 -2.584 3.729 14.174 1.00 9.28 H new ATOM 0 HZ2 LYS B 90 -1.772 2.518 15.044 1.00 9.28 H new ATOM 0 HZ3 LYS B 90 -1.939 2.387 13.359 1.00 9.28 H new ATOM 3119 N LYS B 91 -8.931 -1.907 14.938 1.00 1.48 N ATOM 3120 CA LYS B 91 -9.875 -2.112 16.021 1.00 2.32 C ATOM 3121 C LYS B 91 -10.747 -3.328 15.671 1.00 2.47 C ATOM 3122 O LYS B 91 -10.721 -4.319 16.398 1.00 3.19 O ATOM 3123 CB LYS B 91 -10.721 -0.844 16.267 1.00 3.38 C ATOM 3124 CG LYS B 91 -10.964 -0.579 17.758 1.00 3.91 C ATOM 3125 CD LYS B 91 -11.818 -1.676 18.414 1.00 4.25 C ATOM 3126 CE LYS B 91 -11.992 -1.469 19.926 1.00 4.70 C ATOM 3127 NZ LYS B 91 -12.698 -0.214 20.257 1.00 5.59 N ATOM 0 H LYS B 91 -9.134 -2.512 14.142 1.00 1.48 H new ATOM 0 HA LYS B 91 -9.344 -2.308 16.952 1.00 2.32 H new ATOM 0 HB2 LYS B 91 -10.217 0.016 15.826 1.00 3.38 H new ATOM 0 HB3 LYS B 91 -11.680 -0.947 15.759 1.00 3.38 H new ATOM 0 HG2 LYS B 91 -10.006 -0.511 18.273 1.00 3.91 H new ATOM 0 HG3 LYS B 91 -11.460 0.384 17.877 1.00 3.91 H new ATOM 0 HD2 LYS B 91 -12.799 -1.699 17.940 1.00 4.25 H new ATOM 0 HD3 LYS B 91 -11.355 -2.646 18.235 1.00 4.25 H new ATOM 0 HE2 LYS B 91 -12.545 -2.311 20.342 1.00 4.70 H new ATOM 0 HE3 LYS B 91 -11.012 -1.465 20.402 1.00 4.70 H new ATOM 0 HZ1 LYS B 91 -12.802 -0.136 21.289 1.00 5.59 H new ATOM 0 HZ2 LYS B 91 -12.151 0.596 19.901 1.00 5.59 H new ATOM 0 HZ3 LYS B 91 -13.639 -0.218 19.814 1.00 5.59 H new ATOM 3141 N ASP B 92 -11.500 -3.263 14.565 1.00 2.26 N ATOM 3142 CA ASP B 92 -12.559 -4.215 14.229 1.00 2.69 C ATOM 3143 C ASP B 92 -12.498 -4.647 12.755 1.00 2.03 C ATOM 3144 O ASP B 92 -13.457 -4.495 12.004 1.00 2.47 O ATOM 3145 CB ASP B 92 -13.922 -3.613 14.621 1.00 3.73 C ATOM 3146 CG ASP B 92 -14.237 -2.248 14.019 1.00 5.31 C ATOM 3147 OD1 ASP B 92 -13.302 -1.461 13.751 1.00 5.83 O ATOM 3148 OD2 ASP B 92 -15.434 -1.902 13.960 1.00 6.49 O ATOM 0 H ASP B 92 -11.385 -2.530 13.866 1.00 2.26 H new ATOM 0 HA ASP B 92 -12.413 -5.131 14.801 1.00 2.69 H new ATOM 0 HB2 ASP B 92 -14.706 -4.310 14.325 1.00 3.73 H new ATOM 0 HB3 ASP B 92 -13.963 -3.529 15.707 1.00 3.73 H new ATOM 3153 N LEU B 93 -11.367 -5.237 12.353 1.00 1.35 N ATOM 3154 CA LEU B 93 -11.122 -5.714 10.989 1.00 1.00 C ATOM 3155 C LEU B 93 -11.769 -7.080 10.746 1.00 0.92 C ATOM 3156 O LEU B 93 -12.675 -7.218 9.926 1.00 1.16 O ATOM 3157 CB LEU B 93 -9.598 -5.769 10.811 1.00 1.47 C ATOM 3158 CG LEU B 93 -9.030 -5.795 9.384 1.00 1.35 C ATOM 3159 CD1 LEU B 93 -7.555 -5.388 9.503 1.00 2.19 C ATOM 3160 CD2 LEU B 93 -9.187 -7.162 8.718 1.00 2.34 C ATOM 0 H LEU B 93 -10.580 -5.399 12.981 1.00 1.35 H new ATOM 0 HA LEU B 93 -11.571 -5.042 10.258 1.00 1.00 H new ATOM 0 HB2 LEU B 93 -9.173 -4.905 11.322 1.00 1.47 H new ATOM 0 HB3 LEU B 93 -9.235 -6.657 11.329 1.00 1.47 H new ATOM 0 HG LEU B 93 -9.580 -5.107 8.742 1.00 1.35 H new ATOM 0 HD11 LEU B 93 -7.096 -5.389 8.514 1.00 2.19 H new ATOM 0 HD12 LEU B 93 -7.487 -4.389 9.934 1.00 2.19 H new ATOM 0 HD13 LEU B 93 -7.033 -6.097 10.146 1.00 2.19 H new ATOM 0 HD21 LEU B 93 -8.770 -7.127 7.712 1.00 2.34 H new ATOM 0 HD22 LEU B 93 -8.659 -7.915 9.303 1.00 2.34 H new ATOM 0 HD23 LEU B 93 -10.244 -7.421 8.663 1.00 2.34 H new ATOM 3172 N LYS B 94 -11.335 -8.094 11.507 1.00 0.98 N ATOM 3173 CA LYS B 94 -11.790 -9.475 11.352 1.00 1.12 C ATOM 3174 C LYS B 94 -13.289 -9.594 11.650 1.00 1.16 C ATOM 3175 O LYS B 94 -13.959 -10.517 11.195 1.00 1.31 O ATOM 3176 CB LYS B 94 -10.976 -10.398 12.278 1.00 1.53 C ATOM 3177 CG LYS B 94 -9.475 -10.492 11.944 1.00 2.48 C ATOM 3178 CD LYS B 94 -9.230 -11.351 10.698 1.00 3.27 C ATOM 3179 CE LYS B 94 -7.762 -11.509 10.280 1.00 4.74 C ATOM 3180 NZ LYS B 94 -7.229 -10.269 9.689 1.00 5.90 N ATOM 0 H LYS B 94 -10.651 -7.973 12.254 1.00 0.98 H new ATOM 0 HA LYS B 94 -11.632 -9.782 10.318 1.00 1.12 H new ATOM 0 HB2 LYS B 94 -11.084 -10.046 13.304 1.00 1.53 H new ATOM 0 HB3 LYS B 94 -11.406 -11.399 12.238 1.00 1.53 H new ATOM 0 HG2 LYS B 94 -9.074 -9.492 11.782 1.00 2.48 H new ATOM 0 HG3 LYS B 94 -8.938 -10.917 12.792 1.00 2.48 H new ATOM 0 HD2 LYS B 94 -9.648 -12.342 10.874 1.00 3.27 H new ATOM 0 HD3 LYS B 94 -9.782 -10.916 9.865 1.00 3.27 H new ATOM 0 HE2 LYS B 94 -7.164 -11.785 11.148 1.00 4.74 H new ATOM 0 HE3 LYS B 94 -7.674 -12.323 9.560 1.00 4.74 H new ATOM 0 HZ1 LYS B 94 -6.298 -10.458 9.266 1.00 5.90 H new ATOM 0 HZ2 LYS B 94 -7.880 -9.927 8.954 1.00 5.90 H new ATOM 0 HZ3 LYS B 94 -7.132 -9.545 10.429 1.00 5.90 H new ATOM 3194 N ILE B 95 -13.827 -8.626 12.395 1.00 1.27 N ATOM 3195 CA ILE B 95 -15.246 -8.509 12.680 1.00 1.59 C ATOM 3196 C ILE B 95 -16.075 -8.387 11.394 1.00 1.73 C ATOM 3197 O ILE B 95 -17.276 -8.643 11.430 1.00 2.01 O ATOM 3198 CB ILE B 95 -15.479 -7.335 13.656 1.00 1.86 C ATOM 3199 CG1 ILE B 95 -14.577 -7.406 14.906 1.00 2.13 C ATOM 3200 CG2 ILE B 95 -16.950 -7.224 14.083 1.00 2.69 C ATOM 3201 CD1 ILE B 95 -14.716 -8.702 15.711 1.00 2.55 C ATOM 0 H ILE B 95 -13.269 -7.888 12.824 1.00 1.27 H new ATOM 0 HA ILE B 95 -15.591 -9.423 13.164 1.00 1.59 H new ATOM 0 HB ILE B 95 -15.207 -6.438 13.099 1.00 1.86 H new ATOM 0 HG12 ILE B 95 -13.538 -7.294 14.597 1.00 2.13 H new ATOM 0 HG13 ILE B 95 -14.809 -6.562 15.556 1.00 2.13 H new ATOM 0 HG21 ILE B 95 -17.067 -6.385 14.769 1.00 2.69 H new ATOM 0 HG22 ILE B 95 -17.573 -7.063 13.203 1.00 2.69 H new ATOM 0 HG23 ILE B 95 -17.255 -8.145 14.580 1.00 2.69 H new ATOM 0 HD11 ILE B 95 -14.048 -8.669 16.572 1.00 2.55 H new ATOM 0 HD12 ILE B 95 -15.745 -8.808 16.054 1.00 2.55 H new ATOM 0 HD13 ILE B 95 -14.454 -9.552 15.081 1.00 2.55 H new ATOM 3213 N ARG B 96 -15.461 -8.007 10.264 1.00 1.69 N ATOM 3214 CA ARG B 96 -16.133 -7.915 8.976 1.00 1.97 C ATOM 3215 C ARG B 96 -17.073 -6.705 9.019 1.00 2.31 C ATOM 3216 O ARG B 96 -16.592 -5.578 9.066 1.00 2.93 O ATOM 3217 CB ARG B 96 -16.798 -9.256 8.607 1.00 2.00 C ATOM 3218 CG ARG B 96 -17.267 -9.345 7.148 1.00 2.42 C ATOM 3219 CD ARG B 96 -18.517 -10.232 6.981 1.00 2.98 C ATOM 3220 NE ARG B 96 -18.291 -11.646 7.337 1.00 3.70 N ATOM 3221 CZ ARG B 96 -18.187 -12.185 8.567 1.00 4.11 C ATOM 3222 NH1 ARG B 96 -18.722 -11.601 9.641 1.00 3.76 N ATOM 3223 NH2 ARG B 96 -17.523 -13.336 8.701 1.00 5.82 N ATOM 0 H ARG B 96 -14.474 -7.754 10.227 1.00 1.69 H new ATOM 0 HA ARG B 96 -15.429 -7.741 8.162 1.00 1.97 H new ATOM 0 HB2 ARG B 96 -16.092 -10.064 8.800 1.00 2.00 H new ATOM 0 HB3 ARG B 96 -17.654 -9.417 9.263 1.00 2.00 H new ATOM 0 HG2 ARG B 96 -17.485 -8.343 6.778 1.00 2.42 H new ATOM 0 HG3 ARG B 96 -16.459 -9.743 6.534 1.00 2.42 H new ATOM 0 HD2 ARG B 96 -19.320 -9.834 7.601 1.00 2.98 H new ATOM 0 HD3 ARG B 96 -18.856 -10.176 5.947 1.00 2.98 H new ATOM 0 HE ARG B 96 -18.203 -12.295 6.555 1.00 3.70 H new ATOM 0 HH11 ARG B 96 -19.228 -10.720 9.544 1.00 3.76 H new ATOM 0 HH12 ARG B 96 -18.625 -12.035 10.559 1.00 3.76 H new ATOM 0 HH21 ARG B 96 -17.110 -13.785 7.883 1.00 5.82 H new ATOM 0 HH22 ARG B 96 -17.429 -13.766 9.621 1.00 5.82 H new