USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1187 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 THR OG1 : rot 143:sc= 2.28 USER MOD Set 1.2: A 133 THR OG1 : rot -91:sc= 1.18 USER MOD Set 2.1: A 119 GLN :FLIP amide:sc= 0.0627 F(o=0.037!,f=1.4) USER MOD Set 2.2: A 137 SER OG : rot -61:sc= 1.3 USER MOD Single : A 1 MET CE :methyl -136:sc= -0.217 (180deg=-0.911) USER MOD Single : A 1 MET N :NH3+ 140:sc= 0.0842 (180deg=-0.00785) USER MOD Single : A 3 SER OG : rot -130:sc= 0.969 USER MOD Single : A 7 LYS NZ :NH3+ -166:sc= -0.0111 (180deg=-0.219) USER MOD Single : A 9 LYS NZ :NH3+ -167:sc= -0.0504 (180deg=-0.305) USER MOD Single : A 15 LYS NZ :NH3+ -171:sc= -0.704 (180deg=-0.849) USER MOD Single : A 17 THR OG1 : rot -108:sc= 1.01 USER MOD Single : A 21 LYS NZ :NH3+ -147:sc= 1.25 (180deg=0.634) USER MOD Single : A 25 SER OG : rot 64:sc= 0.753 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -139:sc= -0.375 (180deg=-4.03!) USER MOD Single : A 35 ASN : amide:sc= -0.209 K(o=-0.21,f=-0.79) USER MOD Single : A 38 SER OG : rot -15:sc= -2.01! USER MOD Single : A 41 TYR OH : rot 12:sc= 1.49 USER MOD Single : A 44 LYS NZ :NH3+ -174:sc= 1.2 (180deg=1.07) USER MOD Single : A 46 SER OG : rot 14:sc= 0.0117 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.296 USER MOD Single : A 49 ASN : amide:sc= -3.38! C(o=-3.4!,f=-12!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0706 USER MOD Single : A 53 HIS : no HE2:sc= 0.756 K(o=0.76,f=-2.4!) USER MOD Single : A 54 SER OG : rot -42:sc= 1.37 USER MOD Single : A 58 CYS SG : rot -17:sc= -0.658 USER MOD Single : A 61 SER OG : rot 180:sc= -0.0163 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS :FLIP no HD1:sc= -1.81 F(o=-2.7,f=-1.8) USER MOD Single : A 66 SER OG : rot 110:sc= 0.8 USER MOD Single : A 73 LYS NZ :NH3+ -163:sc= 1.16 (180deg=0.301) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= 1.03 (180deg=0.95) USER MOD Single : A 81 SER OG : rot 18:sc= 0.601 USER MOD Single : A 83 LYS NZ :NH3+ -168:sc=-0.00769 (180deg=-0.177) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl 157:sc= -0.2 (180deg=-0.919) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 51:sc= -0.773 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.566 K(o=0.57,f=-0.82) USER MOD Single : A 116 TYR OH : rot 150:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 144:sc= 1.18 (180deg=0.952) USER MOD Single : A 143 LYS NZ :NH3+ 170:sc= -0.0176 (180deg=-0.138) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.987 -7.148 2.269 1.00 10.79 N ATOM 2 CA MET A 1 26.483 -6.683 3.581 1.00 10.01 C ATOM 3 C MET A 1 26.756 -5.201 3.757 1.00 9.13 C ATOM 4 O MET A 1 27.681 -4.665 3.146 1.00 8.77 O ATOM 5 CB MET A 1 27.151 -7.453 4.724 1.00 10.16 C ATOM 6 CG MET A 1 28.659 -7.256 4.791 1.00 10.63 C ATOM 7 SD MET A 1 29.386 -7.911 6.306 1.00 11.28 S ATOM 8 CE MET A 1 28.623 -6.843 7.524 1.00 12.11 C ATOM 0 H1 MET A 1 27.423 -8.086 2.377 1.00 10.79 H new ATOM 0 H2 MET A 1 26.197 -7.210 1.596 1.00 10.79 H new ATOM 0 H3 MET A 1 27.695 -6.476 1.911 1.00 10.79 H new ATOM 0 HA MET A 1 25.408 -6.863 3.608 1.00 10.01 H new ATOM 0 HB2 MET A 1 26.709 -7.139 5.670 1.00 10.16 H new ATOM 0 HB3 MET A 1 26.936 -8.516 4.610 1.00 10.16 H new ATOM 0 HG2 MET A 1 29.122 -7.742 3.932 1.00 10.63 H new ATOM 0 HG3 MET A 1 28.885 -6.192 4.716 1.00 10.63 H new ATOM 0 HE1 MET A 1 29.373 -6.522 8.247 1.00 12.11 H new ATOM 0 HE2 MET A 1 28.200 -5.969 7.028 1.00 12.11 H new ATOM 0 HE3 MET A 1 27.831 -7.386 8.039 1.00 12.11 H new ATOM 20 N ALA A 2 25.949 -4.556 4.598 1.00 9.02 N ATOM 21 CA ALA A 2 26.141 -3.154 4.959 1.00 8.49 C ATOM 22 C ALA A 2 26.113 -2.237 3.737 1.00 7.47 C ATOM 23 O ALA A 2 25.623 -2.612 2.668 1.00 7.51 O ATOM 24 CB ALA A 2 27.445 -2.982 5.728 1.00 8.92 C ATOM 0 H ALA A 2 25.144 -4.992 5.048 1.00 9.02 H new ATOM 0 HA ALA A 2 25.308 -2.863 5.599 1.00 8.49 H new ATOM 0 HB1 ALA A 2 27.576 -1.932 5.991 1.00 8.92 H new ATOM 0 HB2 ALA A 2 27.413 -3.583 6.637 1.00 8.92 H new ATOM 0 HB3 ALA A 2 28.279 -3.307 5.107 1.00 8.92 H new ATOM 30 N SER A 3 26.607 -1.025 3.918 1.00 6.83 N ATOM 31 CA SER A 3 26.696 -0.066 2.836 1.00 6.03 C ATOM 32 C SER A 3 28.051 -0.186 2.151 1.00 6.30 C ATOM 33 O SER A 3 29.026 -0.636 2.757 1.00 6.25 O ATOM 34 CB SER A 3 26.501 1.354 3.380 1.00 6.05 C ATOM 35 OG SER A 3 26.512 2.317 2.338 1.00 6.36 O ATOM 0 H SER A 3 26.955 -0.681 4.813 1.00 6.83 H new ATOM 0 HA SER A 3 25.912 -0.273 2.107 1.00 6.03 H new ATOM 0 HB2 SER A 3 25.556 1.411 3.920 1.00 6.05 H new ATOM 0 HB3 SER A 3 27.291 1.582 4.096 1.00 6.05 H new ATOM 0 HG SER A 3 27.127 3.044 2.571 1.00 6.36 H new ATOM 41 N LEU A 4 28.112 0.211 0.894 1.00 6.90 N ATOM 42 CA LEU A 4 29.367 0.215 0.163 1.00 7.44 C ATOM 43 C LEU A 4 30.042 1.571 0.328 1.00 8.08 C ATOM 44 O LEU A 4 29.378 2.554 0.655 1.00 8.54 O ATOM 45 CB LEU A 4 29.148 -0.097 -1.327 1.00 8.03 C ATOM 46 CG LEU A 4 28.724 -1.538 -1.664 1.00 8.33 C ATOM 47 CD1 LEU A 4 29.646 -2.546 -0.993 1.00 8.55 C ATOM 48 CD2 LEU A 4 27.274 -1.792 -1.274 1.00 8.49 C ATOM 0 H LEU A 4 27.308 0.535 0.357 1.00 6.90 H new ATOM 0 HA LEU A 4 30.010 -0.565 0.570 1.00 7.44 H new ATOM 0 HB2 LEU A 4 28.387 0.583 -1.711 1.00 8.03 H new ATOM 0 HB3 LEU A 4 30.072 0.123 -1.862 1.00 8.03 H new ATOM 0 HG LEU A 4 28.808 -1.664 -2.743 1.00 8.33 H new ATOM 0 HD11 LEU A 4 29.326 -3.557 -1.246 1.00 8.55 H new ATOM 0 HD12 LEU A 4 30.668 -2.391 -1.340 1.00 8.55 H new ATOM 0 HD13 LEU A 4 29.605 -2.413 0.088 1.00 8.55 H new ATOM 0 HD21 LEU A 4 27.004 -2.818 -1.524 1.00 8.49 H new ATOM 0 HD22 LEU A 4 27.153 -1.636 -0.202 1.00 8.49 H new ATOM 0 HD23 LEU A 4 26.626 -1.104 -1.816 1.00 8.49 H new ATOM 60 N LEU A 5 31.356 1.606 0.115 1.00 8.35 N ATOM 61 CA LEU A 5 32.157 2.832 0.240 1.00 9.16 C ATOM 62 C LEU A 5 32.282 3.288 1.697 1.00 9.51 C ATOM 63 O LEU A 5 33.373 3.265 2.270 1.00 9.84 O ATOM 64 CB LEU A 5 31.595 3.974 -0.625 1.00 9.53 C ATOM 65 CG LEU A 5 31.914 3.902 -2.125 1.00 9.85 C ATOM 66 CD1 LEU A 5 31.225 2.717 -2.785 1.00 10.47 C ATOM 67 CD2 LEU A 5 31.509 5.197 -2.811 1.00 9.72 C ATOM 0 H LEU A 5 31.901 0.785 -0.150 1.00 8.35 H new ATOM 0 HA LEU A 5 33.154 2.585 -0.126 1.00 9.16 H new ATOM 0 HB2 LEU A 5 30.512 3.995 -0.505 1.00 9.53 H new ATOM 0 HB3 LEU A 5 31.977 4.918 -0.237 1.00 9.53 H new ATOM 0 HG LEU A 5 32.990 3.763 -2.232 1.00 9.85 H new ATOM 0 HD11 LEU A 5 31.473 2.697 -3.846 1.00 10.47 H new ATOM 0 HD12 LEU A 5 31.562 1.793 -2.316 1.00 10.47 H new ATOM 0 HD13 LEU A 5 30.146 2.811 -2.666 1.00 10.47 H new ATOM 0 HD21 LEU A 5 31.740 5.133 -3.874 1.00 9.72 H new ATOM 0 HD22 LEU A 5 30.439 5.358 -2.682 1.00 9.72 H new ATOM 0 HD23 LEU A 5 32.057 6.029 -2.370 1.00 9.72 H new ATOM 79 N ASP A 6 31.173 3.695 2.300 1.00 9.65 N ATOM 80 CA ASP A 6 31.199 4.220 3.664 1.00 10.15 C ATOM 81 C ASP A 6 30.979 3.109 4.689 1.00 10.22 C ATOM 82 O ASP A 6 31.393 3.233 5.847 1.00 10.27 O ATOM 83 CB ASP A 6 30.144 5.318 3.841 1.00 10.65 C ATOM 84 CG ASP A 6 28.727 4.783 3.805 1.00 11.12 C ATOM 85 OD1 ASP A 6 28.198 4.557 2.699 1.00 11.06 O ATOM 86 OD2 ASP A 6 28.144 4.584 4.884 1.00 11.69 O ATOM 0 H ASP A 6 30.248 3.673 1.871 1.00 9.65 H new ATOM 0 HA ASP A 6 32.186 4.650 3.834 1.00 10.15 H new ATOM 0 HB2 ASP A 6 30.311 5.826 4.791 1.00 10.65 H new ATOM 0 HB3 ASP A 6 30.266 6.063 3.055 1.00 10.65 H new ATOM 91 N LYS A 7 30.310 2.038 4.256 1.00 10.47 N ATOM 92 CA LYS A 7 30.076 0.844 5.084 1.00 10.82 C ATOM 93 C LYS A 7 29.188 1.126 6.299 1.00 10.96 C ATOM 94 O LYS A 7 28.977 0.233 7.124 1.00 11.26 O ATOM 95 CB LYS A 7 31.402 0.239 5.564 1.00 11.03 C ATOM 96 CG LYS A 7 32.235 -0.411 4.470 1.00 11.00 C ATOM 97 CD LYS A 7 33.538 -0.962 5.031 1.00 11.19 C ATOM 98 CE LYS A 7 34.335 -1.722 3.982 1.00 11.04 C ATOM 99 NZ LYS A 7 33.612 -2.923 3.488 1.00 11.42 N ATOM 0 H LYS A 7 29.913 1.970 3.319 1.00 10.47 H new ATOM 0 HA LYS A 7 29.553 0.135 4.442 1.00 10.82 H new ATOM 0 HB2 LYS A 7 31.994 1.023 6.036 1.00 11.03 H new ATOM 0 HB3 LYS A 7 31.190 -0.505 6.331 1.00 11.03 H new ATOM 0 HG2 LYS A 7 31.666 -1.216 4.005 1.00 11.00 H new ATOM 0 HG3 LYS A 7 32.451 0.319 3.690 1.00 11.00 H new ATOM 0 HD2 LYS A 7 34.141 -0.141 5.420 1.00 11.19 H new ATOM 0 HD3 LYS A 7 33.320 -1.623 5.870 1.00 11.19 H new ATOM 0 HE2 LYS A 7 34.552 -1.060 3.143 1.00 11.04 H new ATOM 0 HE3 LYS A 7 35.293 -2.025 4.405 1.00 11.04 H new ATOM 0 HZ1 LYS A 7 34.271 -3.534 2.964 1.00 11.42 H new ATOM 0 HZ2 LYS A 7 33.220 -3.449 4.295 1.00 11.42 H new ATOM 0 HZ3 LYS A 7 32.838 -2.628 2.859 1.00 11.42 H new ATOM 113 N ALA A 8 28.658 2.348 6.398 1.00 10.94 N ATOM 114 CA ALA A 8 27.908 2.784 7.577 1.00 11.28 C ATOM 115 C ALA A 8 28.782 2.691 8.826 1.00 11.40 C ATOM 116 O ALA A 8 28.289 2.533 9.947 1.00 11.50 O ATOM 117 CB ALA A 8 26.631 1.967 7.738 1.00 11.58 C ATOM 0 H ALA A 8 28.736 3.057 5.669 1.00 10.94 H new ATOM 0 HA ALA A 8 27.620 3.826 7.440 1.00 11.28 H new ATOM 0 HB1 ALA A 8 26.090 2.308 8.620 1.00 11.58 H new ATOM 0 HB2 ALA A 8 26.004 2.094 6.856 1.00 11.58 H new ATOM 0 HB3 ALA A 8 26.885 0.913 7.853 1.00 11.58 H new ATOM 123 N LYS A 9 30.091 2.808 8.616 1.00 11.60 N ATOM 124 CA LYS A 9 31.065 2.696 9.694 1.00 11.93 C ATOM 125 C LYS A 9 31.243 4.038 10.401 1.00 11.76 C ATOM 126 O LYS A 9 31.849 4.119 11.469 1.00 12.08 O ATOM 127 CB LYS A 9 32.409 2.219 9.129 1.00 12.75 C ATOM 128 CG LYS A 9 33.480 1.995 10.186 1.00 13.65 C ATOM 129 CD LYS A 9 34.843 1.750 9.557 1.00 14.38 C ATOM 130 CE LYS A 9 35.920 1.555 10.613 1.00 15.18 C ATOM 131 NZ LYS A 9 36.024 2.721 11.532 1.00 15.74 N ATOM 0 H LYS A 9 30.503 2.982 7.699 1.00 11.60 H new ATOM 0 HA LYS A 9 30.700 1.970 10.421 1.00 11.93 H new ATOM 0 HB2 LYS A 9 32.252 1.289 8.583 1.00 12.75 H new ATOM 0 HB3 LYS A 9 32.771 2.954 8.410 1.00 12.75 H new ATOM 0 HG2 LYS A 9 33.532 2.864 10.842 1.00 13.65 H new ATOM 0 HG3 LYS A 9 33.206 1.142 10.807 1.00 13.65 H new ATOM 0 HD2 LYS A 9 34.796 0.869 8.917 1.00 14.38 H new ATOM 0 HD3 LYS A 9 35.107 2.593 8.919 1.00 14.38 H new ATOM 0 HE2 LYS A 9 35.701 0.657 11.191 1.00 15.18 H new ATOM 0 HE3 LYS A 9 36.881 1.393 10.124 1.00 15.18 H new ATOM 0 HZ1 LYS A 9 36.900 2.648 12.088 1.00 15.74 H new ATOM 0 HZ2 LYS A 9 36.038 3.600 10.977 1.00 15.74 H new ATOM 0 HZ3 LYS A 9 35.206 2.731 12.175 1.00 15.74 H new ATOM 145 N ASP A 10 30.704 5.090 9.804 1.00 11.46 N ATOM 146 CA ASP A 10 30.858 6.432 10.343 1.00 11.51 C ATOM 147 C ASP A 10 29.536 7.181 10.269 1.00 10.95 C ATOM 148 O ASP A 10 28.800 7.047 9.293 1.00 10.81 O ATOM 149 CB ASP A 10 31.943 7.182 9.562 1.00 11.95 C ATOM 150 CG ASP A 10 32.252 8.542 10.147 1.00 12.36 C ATOM 151 OD1 ASP A 10 32.892 8.606 11.215 1.00 12.69 O ATOM 152 OD2 ASP A 10 31.855 9.559 9.539 1.00 12.50 O ATOM 0 H ASP A 10 30.156 5.040 8.945 1.00 11.46 H new ATOM 0 HA ASP A 10 31.159 6.366 11.389 1.00 11.51 H new ATOM 0 HB2 ASP A 10 32.853 6.583 9.547 1.00 11.95 H new ATOM 0 HB3 ASP A 10 31.623 7.301 8.527 1.00 11.95 H new ATOM 157 N PHE A 11 29.231 7.955 11.304 1.00 10.84 N ATOM 158 CA PHE A 11 27.982 8.702 11.351 1.00 10.58 C ATOM 159 C PHE A 11 28.083 9.953 10.493 1.00 9.71 C ATOM 160 O PHE A 11 28.580 10.991 10.936 1.00 9.93 O ATOM 161 CB PHE A 11 27.626 9.079 12.792 1.00 11.21 C ATOM 162 CG PHE A 11 27.438 7.896 13.700 1.00 12.04 C ATOM 163 CD1 PHE A 11 26.252 7.184 13.693 1.00 12.82 C ATOM 164 CD2 PHE A 11 28.450 7.496 14.557 1.00 12.19 C ATOM 165 CE1 PHE A 11 26.077 6.094 14.524 1.00 13.71 C ATOM 166 CE2 PHE A 11 28.281 6.408 15.391 1.00 13.10 C ATOM 167 CZ PHE A 11 27.094 5.711 15.382 1.00 13.85 C ATOM 0 H PHE A 11 29.830 8.081 12.120 1.00 10.84 H new ATOM 0 HA PHE A 11 27.190 8.065 10.957 1.00 10.58 H new ATOM 0 HB2 PHE A 11 28.414 9.714 13.197 1.00 11.21 H new ATOM 0 HB3 PHE A 11 26.711 9.671 12.787 1.00 11.21 H new ATOM 0 HD1 PHE A 11 25.454 7.484 13.030 1.00 12.82 H new ATOM 0 HD2 PHE A 11 29.382 8.041 14.573 1.00 12.19 H new ATOM 0 HE1 PHE A 11 25.149 5.542 14.504 1.00 13.71 H new ATOM 0 HE2 PHE A 11 29.080 6.104 16.050 1.00 13.10 H new ATOM 0 HZ PHE A 11 26.956 4.868 16.042 1.00 13.85 H new ATOM 177 N VAL A 12 27.641 9.838 9.255 1.00 8.87 N ATOM 178 CA VAL A 12 27.698 10.948 8.320 1.00 8.10 C ATOM 179 C VAL A 12 26.422 11.779 8.373 1.00 8.03 C ATOM 180 O VAL A 12 25.344 11.270 8.685 1.00 8.27 O ATOM 181 CB VAL A 12 27.931 10.457 6.874 1.00 7.45 C ATOM 182 CG1 VAL A 12 29.276 9.755 6.758 1.00 7.79 C ATOM 183 CG2 VAL A 12 26.803 9.539 6.422 1.00 7.55 C ATOM 0 H VAL A 12 27.237 8.984 8.871 1.00 8.87 H new ATOM 0 HA VAL A 12 28.541 11.571 8.619 1.00 8.10 H new ATOM 0 HB VAL A 12 27.940 11.327 6.218 1.00 7.45 H new ATOM 0 HG11 VAL A 12 29.422 9.416 5.732 1.00 7.79 H new ATOM 0 HG12 VAL A 12 30.073 10.448 7.028 1.00 7.79 H new ATOM 0 HG13 VAL A 12 29.298 8.897 7.430 1.00 7.79 H new ATOM 0 HG21 VAL A 12 26.991 9.207 5.401 1.00 7.55 H new ATOM 0 HG22 VAL A 12 26.753 8.673 7.082 1.00 7.55 H new ATOM 0 HG23 VAL A 12 25.857 10.079 6.460 1.00 7.55 H new ATOM 193 N ALA A 13 26.562 13.065 8.094 1.00 7.99 N ATOM 194 CA ALA A 13 25.422 13.967 8.027 1.00 8.22 C ATOM 195 C ALA A 13 25.425 14.723 6.705 1.00 7.61 C ATOM 196 O ALA A 13 24.378 15.142 6.214 1.00 7.80 O ATOM 197 CB ALA A 13 25.434 14.936 9.198 1.00 8.91 C ATOM 0 H ALA A 13 27.461 13.511 7.909 1.00 7.99 H new ATOM 0 HA ALA A 13 24.509 13.375 8.086 1.00 8.22 H new ATOM 0 HB1 ALA A 13 24.573 15.601 9.129 1.00 8.91 H new ATOM 0 HB2 ALA A 13 25.387 14.378 10.133 1.00 8.91 H new ATOM 0 HB3 ALA A 13 26.351 15.525 9.173 1.00 8.91 H new ATOM 203 N ASP A 14 26.612 14.887 6.129 1.00 7.15 N ATOM 204 CA ASP A 14 26.751 15.558 4.839 1.00 6.85 C ATOM 205 C ASP A 14 26.512 14.571 3.702 1.00 6.18 C ATOM 206 O ASP A 14 26.299 14.962 2.553 1.00 6.06 O ATOM 207 CB ASP A 14 28.141 16.192 4.694 1.00 7.60 C ATOM 208 CG ASP A 14 29.237 15.172 4.442 1.00 8.14 C ATOM 209 OD1 ASP A 14 29.769 14.612 5.424 1.00 8.60 O ATOM 210 OD2 ASP A 14 29.566 14.917 3.264 1.00 8.32 O ATOM 0 H ASP A 14 27.491 14.565 6.534 1.00 7.15 H new ATOM 0 HA ASP A 14 26.004 16.350 4.790 1.00 6.85 H new ATOM 0 HB2 ASP A 14 28.123 16.908 3.872 1.00 7.60 H new ATOM 0 HB3 ASP A 14 28.375 16.752 5.600 1.00 7.60 H new ATOM 215 N LYS A 15 26.557 13.286 4.031 1.00 6.06 N ATOM 216 CA LYS A 15 26.311 12.235 3.055 1.00 5.70 C ATOM 217 C LYS A 15 24.978 11.564 3.351 1.00 5.00 C ATOM 218 O LYS A 15 24.262 11.964 4.269 1.00 5.32 O ATOM 219 CB LYS A 15 27.429 11.187 3.084 1.00 6.54 C ATOM 220 CG LYS A 15 28.824 11.756 2.889 1.00 7.17 C ATOM 221 CD LYS A 15 29.860 10.654 2.717 1.00 7.82 C ATOM 222 CE LYS A 15 30.087 10.291 1.251 1.00 8.59 C ATOM 223 NZ LYS A 15 28.842 9.862 0.555 1.00 9.04 N ATOM 0 H LYS A 15 26.763 12.947 4.971 1.00 6.06 H new ATOM 0 HA LYS A 15 26.286 12.687 2.063 1.00 5.70 H new ATOM 0 HB2 LYS A 15 27.394 10.661 4.038 1.00 6.54 H new ATOM 0 HB3 LYS A 15 27.239 10.448 2.306 1.00 6.54 H new ATOM 0 HG2 LYS A 15 28.834 12.405 2.013 1.00 7.17 H new ATOM 0 HG3 LYS A 15 29.089 12.374 3.747 1.00 7.17 H new ATOM 0 HD2 LYS A 15 30.803 10.974 3.159 1.00 7.82 H new ATOM 0 HD3 LYS A 15 29.537 9.767 3.262 1.00 7.82 H new ATOM 0 HE2 LYS A 15 30.509 11.151 0.731 1.00 8.59 H new ATOM 0 HE3 LYS A 15 30.824 9.490 1.191 1.00 8.59 H new ATOM 0 HZ1 LYS A 15 29.082 9.485 -0.384 1.00 9.04 H new ATOM 0 HZ2 LYS A 15 28.369 9.123 1.114 1.00 9.04 H new ATOM 0 HZ3 LYS A 15 28.205 10.677 0.449 1.00 9.04 H new ATOM 237 N LEU A 16 24.653 10.535 2.587 1.00 4.38 N ATOM 238 CA LEU A 16 23.423 9.796 2.799 1.00 3.98 C ATOM 239 C LEU A 16 23.681 8.298 2.697 1.00 3.20 C ATOM 240 O LEU A 16 23.660 7.719 1.608 1.00 3.50 O ATOM 241 CB LEU A 16 22.316 10.231 1.816 1.00 4.41 C ATOM 242 CG LEU A 16 22.609 10.060 0.316 1.00 4.83 C ATOM 243 CD1 LEU A 16 21.314 10.117 -0.479 1.00 5.58 C ATOM 244 CD2 LEU A 16 23.568 11.135 -0.181 1.00 5.22 C ATOM 0 H LEU A 16 25.225 10.193 1.815 1.00 4.38 H new ATOM 0 HA LEU A 16 23.068 10.023 3.804 1.00 3.98 H new ATOM 0 HB2 LEU A 16 21.413 9.668 2.051 1.00 4.41 H new ATOM 0 HB3 LEU A 16 22.093 11.282 2.000 1.00 4.41 H new ATOM 0 HG LEU A 16 23.079 9.087 0.172 1.00 4.83 H new ATOM 0 HD11 LEU A 16 21.533 9.995 -1.540 1.00 5.58 H new ATOM 0 HD12 LEU A 16 20.650 9.317 -0.151 1.00 5.58 H new ATOM 0 HD13 LEU A 16 20.830 11.080 -0.317 1.00 5.58 H new ATOM 0 HD21 LEU A 16 23.758 10.990 -1.245 1.00 5.22 H new ATOM 0 HD22 LEU A 16 23.126 12.119 -0.022 1.00 5.22 H new ATOM 0 HD23 LEU A 16 24.507 11.066 0.368 1.00 5.22 H new ATOM 256 N THR A 17 23.974 7.680 3.833 1.00 2.59 N ATOM 257 CA THR A 17 24.164 6.243 3.886 1.00 2.16 C ATOM 258 C THR A 17 22.823 5.538 3.783 1.00 1.94 C ATOM 259 O THR A 17 22.195 5.223 4.799 1.00 2.69 O ATOM 260 CB THR A 17 24.857 5.806 5.184 1.00 2.27 C ATOM 261 OG1 THR A 17 26.108 6.492 5.329 1.00 2.61 O ATOM 262 CG2 THR A 17 25.095 4.301 5.199 1.00 2.60 C ATOM 0 H THR A 17 24.085 8.155 4.729 1.00 2.59 H new ATOM 0 HA THR A 17 24.802 5.969 3.046 1.00 2.16 H new ATOM 0 HB THR A 17 24.202 6.061 6.017 1.00 2.27 H new ATOM 0 HG1 THR A 17 26.845 5.863 5.183 1.00 2.61 H new ATOM 0 HG21 THR A 17 25.587 4.020 6.130 1.00 2.60 H new ATOM 0 HG22 THR A 17 24.140 3.781 5.122 1.00 2.60 H new ATOM 0 HG23 THR A 17 25.728 4.024 4.356 1.00 2.60 H new ATOM 270 N ALA A 18 22.373 5.339 2.555 1.00 1.42 N ATOM 271 CA ALA A 18 21.127 4.657 2.294 1.00 1.18 C ATOM 272 C ALA A 18 20.923 4.471 0.804 1.00 0.99 C ATOM 273 O ALA A 18 21.727 4.931 -0.008 1.00 1.68 O ATOM 274 CB ALA A 18 19.955 5.401 2.920 1.00 1.35 C ATOM 0 H ALA A 18 22.864 5.647 1.716 1.00 1.42 H new ATOM 0 HA ALA A 18 21.176 3.670 2.755 1.00 1.18 H new ATOM 0 HB1 ALA A 18 19.029 4.866 2.708 1.00 1.35 H new ATOM 0 HB2 ALA A 18 20.099 5.465 3.999 1.00 1.35 H new ATOM 0 HB3 ALA A 18 19.897 6.406 2.502 1.00 1.35 H new ATOM 280 N ILE A 19 19.849 3.797 0.460 1.00 0.98 N ATOM 281 CA ILE A 19 19.571 3.447 -0.918 1.00 1.09 C ATOM 282 C ILE A 19 18.865 4.606 -1.631 1.00 1.12 C ATOM 283 O ILE A 19 18.249 5.447 -0.977 1.00 1.42 O ATOM 284 CB ILE A 19 18.715 2.156 -0.992 1.00 1.63 C ATOM 285 CG1 ILE A 19 17.245 2.432 -0.643 1.00 2.29 C ATOM 286 CG2 ILE A 19 19.282 1.100 -0.045 1.00 1.55 C ATOM 287 CD1 ILE A 19 17.001 2.783 0.811 1.00 3.19 C ATOM 0 H ILE A 19 19.144 3.476 1.124 1.00 0.98 H new ATOM 0 HA ILE A 19 20.518 3.256 -1.424 1.00 1.09 H new ATOM 0 HB ILE A 19 18.754 1.788 -2.017 1.00 1.63 H new ATOM 0 HG12 ILE A 19 16.884 3.250 -1.267 1.00 2.29 H new ATOM 0 HG13 ILE A 19 16.653 1.552 -0.896 1.00 2.29 H new ATOM 0 HG21 ILE A 19 18.675 0.196 -0.103 1.00 1.55 H new ATOM 0 HG22 ILE A 19 20.308 0.867 -0.331 1.00 1.55 H new ATOM 0 HG23 ILE A 19 19.268 1.482 0.976 1.00 1.55 H new ATOM 0 HD11 ILE A 19 15.937 2.962 0.969 1.00 3.19 H new ATOM 0 HD12 ILE A 19 17.328 1.958 1.444 1.00 3.19 H new ATOM 0 HD13 ILE A 19 17.562 3.682 1.067 1.00 3.19 H new ATOM 299 N PRO A 20 18.963 4.678 -2.971 1.00 1.27 N ATOM 300 CA PRO A 20 18.374 5.776 -3.753 1.00 1.56 C ATOM 301 C PRO A 20 16.855 5.864 -3.602 1.00 1.80 C ATOM 302 O PRO A 20 16.329 6.843 -3.067 1.00 2.42 O ATOM 303 CB PRO A 20 18.751 5.436 -5.203 1.00 2.12 C ATOM 304 CG PRO A 20 19.894 4.486 -5.095 1.00 2.16 C ATOM 305 CD PRO A 20 19.664 3.710 -3.831 1.00 1.66 C ATOM 0 HA PRO A 20 18.744 6.745 -3.419 1.00 1.56 H new ATOM 0 HB2 PRO A 20 17.912 4.985 -5.733 1.00 2.12 H new ATOM 0 HB3 PRO A 20 19.034 6.331 -5.757 1.00 2.12 H new ATOM 0 HG2 PRO A 20 19.934 3.823 -5.959 1.00 2.16 H new ATOM 0 HG3 PRO A 20 20.844 5.020 -5.059 1.00 2.16 H new ATOM 0 HD2 PRO A 20 19.063 2.818 -4.009 1.00 1.66 H new ATOM 0 HD3 PRO A 20 20.602 3.378 -3.385 1.00 1.66 H new ATOM 313 N LYS A 21 16.151 4.840 -4.071 1.00 1.78 N ATOM 314 CA LYS A 21 14.699 4.812 -3.982 1.00 2.16 C ATOM 315 C LYS A 21 14.184 3.375 -3.984 1.00 1.84 C ATOM 316 O LYS A 21 14.148 2.713 -5.023 1.00 2.42 O ATOM 317 CB LYS A 21 14.078 5.603 -5.137 1.00 3.10 C ATOM 318 CG LYS A 21 12.563 5.719 -5.060 1.00 4.04 C ATOM 319 CD LYS A 21 12.116 6.513 -3.842 1.00 4.86 C ATOM 320 CE LYS A 21 10.602 6.659 -3.798 1.00 5.68 C ATOM 321 NZ LYS A 21 10.066 7.293 -5.032 1.00 6.38 N ATOM 0 H LYS A 21 16.563 4.020 -4.516 1.00 1.78 H new ATOM 0 HA LYS A 21 14.405 5.279 -3.042 1.00 2.16 H new ATOM 0 HB2 LYS A 21 14.509 6.604 -5.152 1.00 3.10 H new ATOM 0 HB3 LYS A 21 14.349 5.125 -6.079 1.00 3.10 H new ATOM 0 HG2 LYS A 21 12.189 6.200 -5.964 1.00 4.04 H new ATOM 0 HG3 LYS A 21 12.124 4.722 -5.025 1.00 4.04 H new ATOM 0 HD2 LYS A 21 12.461 6.016 -2.935 1.00 4.86 H new ATOM 0 HD3 LYS A 21 12.578 7.500 -3.860 1.00 4.86 H new ATOM 0 HE2 LYS A 21 10.147 5.677 -3.668 1.00 5.68 H new ATOM 0 HE3 LYS A 21 10.321 7.258 -2.932 1.00 5.68 H new ATOM 0 HZ1 LYS A 21 9.231 7.866 -4.794 1.00 6.38 H new ATOM 0 HZ2 LYS A 21 10.795 7.903 -5.454 1.00 6.38 H new ATOM 0 HZ3 LYS A 21 9.796 6.554 -5.713 1.00 6.38 H new ATOM 335 N PRO A 22 13.810 2.869 -2.803 1.00 1.54 N ATOM 336 CA PRO A 22 13.271 1.527 -2.641 1.00 1.96 C ATOM 337 C PRO A 22 11.756 1.509 -2.686 1.00 1.56 C ATOM 338 O PRO A 22 11.102 1.491 -1.647 1.00 2.15 O ATOM 339 CB PRO A 22 13.741 1.164 -1.243 1.00 2.77 C ATOM 340 CG PRO A 22 13.750 2.458 -0.489 1.00 2.68 C ATOM 341 CD PRO A 22 13.894 3.566 -1.508 1.00 1.75 C ATOM 0 HA PRO A 22 13.594 0.848 -3.430 1.00 1.96 H new ATOM 0 HB2 PRO A 22 13.072 0.440 -0.777 1.00 2.77 H new ATOM 0 HB3 PRO A 22 14.733 0.713 -1.265 1.00 2.77 H new ATOM 0 HG2 PRO A 22 12.829 2.577 0.082 1.00 2.68 H new ATOM 0 HG3 PRO A 22 14.573 2.482 0.225 1.00 2.68 H new ATOM 0 HD2 PRO A 22 13.105 4.310 -1.403 1.00 1.75 H new ATOM 0 HD3 PRO A 22 14.843 4.090 -1.397 1.00 1.75 H new ATOM 349 N GLU A 23 11.180 1.510 -3.869 1.00 0.92 N ATOM 350 CA GLU A 23 9.773 1.714 -3.963 1.00 0.94 C ATOM 351 C GLU A 23 9.113 0.561 -4.656 1.00 0.56 C ATOM 352 O GLU A 23 9.414 0.233 -5.805 1.00 1.14 O ATOM 353 CB GLU A 23 9.453 3.020 -4.687 1.00 1.69 C ATOM 354 CG GLU A 23 10.043 3.084 -6.082 1.00 2.20 C ATOM 355 CD GLU A 23 9.518 4.257 -6.886 1.00 2.88 C ATOM 356 OE1 GLU A 23 10.090 5.361 -6.798 1.00 3.39 O ATOM 357 OE2 GLU A 23 8.518 4.077 -7.614 1.00 3.25 O ATOM 0 H GLU A 23 11.664 1.374 -4.757 1.00 0.92 H new ATOM 0 HA GLU A 23 9.380 1.781 -2.949 1.00 0.94 H new ATOM 0 HB2 GLU A 23 8.371 3.138 -4.750 1.00 1.69 H new ATOM 0 HB3 GLU A 23 9.831 3.857 -4.100 1.00 1.69 H new ATOM 0 HG2 GLU A 23 11.128 3.155 -6.010 1.00 2.20 H new ATOM 0 HG3 GLU A 23 9.818 2.157 -6.610 1.00 2.20 H new ATOM 364 N GLY A 24 8.239 -0.069 -3.936 1.00 0.54 N ATOM 365 CA GLY A 24 7.397 -1.037 -4.517 1.00 0.46 C ATOM 366 C GLY A 24 6.582 -1.771 -3.480 1.00 0.33 C ATOM 367 O GLY A 24 7.145 -2.348 -2.560 1.00 0.39 O ATOM 0 H GLY A 24 8.098 0.080 -2.937 1.00 0.54 H new ATOM 0 HA2 GLY A 24 6.728 -0.555 -5.230 1.00 0.46 H new ATOM 0 HA3 GLY A 24 7.999 -1.752 -5.078 1.00 0.46 H new ATOM 371 N SER A 25 5.267 -1.665 -3.594 1.00 0.28 N ATOM 372 CA SER A 25 4.318 -2.532 -2.887 1.00 0.30 C ATOM 373 C SER A 25 2.926 -2.272 -3.420 1.00 0.32 C ATOM 374 O SER A 25 1.929 -2.386 -2.713 1.00 0.39 O ATOM 375 CB SER A 25 4.310 -2.328 -1.373 1.00 0.37 C ATOM 376 OG SER A 25 5.432 -2.930 -0.751 1.00 1.20 O ATOM 0 H SER A 25 4.816 -0.967 -4.186 1.00 0.28 H new ATOM 0 HA SER A 25 4.637 -3.559 -3.067 1.00 0.30 H new ATOM 0 HB2 SER A 25 4.301 -1.261 -1.151 1.00 0.37 H new ATOM 0 HB3 SER A 25 3.395 -2.748 -0.955 1.00 0.37 H new ATOM 0 HG SER A 25 6.253 -2.498 -1.068 1.00 1.20 H new ATOM 382 N VAL A 26 2.874 -1.942 -4.686 1.00 0.28 N ATOM 383 CA VAL A 26 1.638 -1.532 -5.318 1.00 0.30 C ATOM 384 C VAL A 26 1.468 -2.255 -6.642 1.00 0.30 C ATOM 385 O VAL A 26 2.454 -2.643 -7.265 1.00 0.30 O ATOM 386 CB VAL A 26 1.607 -0.001 -5.553 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.724 0.755 -4.240 1.00 0.93 C ATOM 388 CG2 VAL A 26 2.716 0.408 -6.508 1.00 0.88 C ATOM 0 H VAL A 26 3.682 -1.949 -5.309 1.00 0.28 H new ATOM 0 HA VAL A 26 0.817 -1.792 -4.650 1.00 0.30 H new ATOM 0 HB VAL A 26 0.648 0.256 -6.002 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.700 1.827 -4.434 1.00 0.93 H new ATOM 0 HG12 VAL A 26 0.892 0.485 -3.589 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.664 0.496 -3.753 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.682 1.486 -6.664 1.00 0.88 H new ATOM 0 HG22 VAL A 26 3.682 0.133 -6.084 1.00 0.88 H new ATOM 0 HG23 VAL A 26 2.581 -0.101 -7.462 1.00 0.88 H new ATOM 398 N THR A 27 0.228 -2.515 -7.008 1.00 0.33 N ATOM 399 CA THR A 27 -0.113 -2.907 -8.367 1.00 0.36 C ATOM 400 C THR A 27 -1.627 -2.906 -8.596 1.00 0.38 C ATOM 401 O THR A 27 -2.091 -2.408 -9.621 1.00 0.48 O ATOM 402 CB THR A 27 0.474 -4.283 -8.754 1.00 0.39 C ATOM 403 OG1 THR A 27 -0.101 -4.733 -9.990 1.00 0.47 O ATOM 404 CG2 THR A 27 0.240 -5.315 -7.662 1.00 0.39 C ATOM 0 H THR A 27 -0.571 -2.462 -6.376 1.00 0.33 H new ATOM 0 HA THR A 27 0.340 -2.156 -9.014 1.00 0.36 H new ATOM 0 HB THR A 27 1.551 -4.166 -8.878 1.00 0.39 H new ATOM 0 HG1 THR A 27 0.278 -5.605 -10.229 1.00 0.47 H new ATOM 0 HG21 THR A 27 0.666 -6.271 -7.967 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.717 -4.983 -6.740 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.831 -5.431 -7.495 1.00 0.39 H new ATOM 412 N ASP A 28 -2.401 -3.446 -7.653 1.00 0.35 N ATOM 413 CA ASP A 28 -3.843 -3.591 -7.860 1.00 0.42 C ATOM 414 C ASP A 28 -4.579 -3.691 -6.538 1.00 0.35 C ATOM 415 O ASP A 28 -4.012 -4.116 -5.540 1.00 0.37 O ATOM 416 CB ASP A 28 -4.121 -4.860 -8.665 1.00 0.57 C ATOM 417 CG ASP A 28 -5.495 -4.873 -9.310 1.00 1.08 C ATOM 418 OD1 ASP A 28 -6.471 -5.241 -8.624 1.00 1.44 O ATOM 419 OD2 ASP A 28 -5.608 -4.491 -10.492 1.00 1.69 O ATOM 0 H ASP A 28 -2.061 -3.785 -6.753 1.00 0.35 H new ATOM 0 HA ASP A 28 -4.194 -2.710 -8.398 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -3.362 -4.963 -9.441 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -4.027 -5.726 -8.009 1.00 0.57 H new ATOM 424 N VAL A 29 -5.837 -3.292 -6.536 1.00 0.39 N ATOM 425 CA VAL A 29 -6.714 -3.506 -5.396 1.00 0.41 C ATOM 426 C VAL A 29 -8.121 -3.849 -5.887 1.00 0.37 C ATOM 427 O VAL A 29 -8.751 -3.064 -6.603 1.00 0.42 O ATOM 428 CB VAL A 29 -6.781 -2.274 -4.461 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.833 -2.491 -3.393 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.431 -1.991 -3.808 1.00 1.14 C ATOM 0 H VAL A 29 -6.280 -2.812 -7.320 1.00 0.39 H new ATOM 0 HA VAL A 29 -6.299 -4.333 -4.819 1.00 0.41 H new ATOM 0 HB VAL A 29 -7.049 -1.409 -5.068 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.873 -1.619 -2.740 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.805 -2.637 -3.864 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.579 -3.373 -2.806 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.516 -1.120 -3.159 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -5.124 -2.854 -3.218 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.687 -1.797 -4.580 1.00 1.14 H new ATOM 440 N ASP A 30 -8.607 -5.024 -5.508 1.00 0.37 N ATOM 441 CA ASP A 30 -9.910 -5.503 -5.968 1.00 0.38 C ATOM 442 C ASP A 30 -10.902 -5.605 -4.821 1.00 0.42 C ATOM 443 O ASP A 30 -10.751 -6.444 -3.931 1.00 0.54 O ATOM 444 CB ASP A 30 -9.762 -6.869 -6.639 1.00 0.51 C ATOM 445 CG ASP A 30 -11.102 -7.528 -6.924 1.00 1.00 C ATOM 446 OD1 ASP A 30 -11.790 -7.102 -7.875 1.00 1.16 O ATOM 447 OD2 ASP A 30 -11.469 -8.489 -6.208 1.00 1.83 O ATOM 0 H ASP A 30 -8.120 -5.666 -4.882 1.00 0.37 H new ATOM 0 HA ASP A 30 -10.293 -4.780 -6.688 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -9.212 -6.753 -7.573 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -9.169 -7.522 -5.999 1.00 0.51 H new ATOM 452 N LEU A 31 -11.914 -4.749 -4.851 1.00 0.47 N ATOM 453 CA LEU A 31 -12.958 -4.761 -3.835 1.00 0.57 C ATOM 454 C LEU A 31 -13.863 -5.969 -4.033 1.00 0.58 C ATOM 455 O LEU A 31 -14.211 -6.315 -5.163 1.00 0.67 O ATOM 456 CB LEU A 31 -13.763 -3.451 -3.880 1.00 0.71 C ATOM 457 CG LEU A 31 -14.795 -3.245 -2.753 1.00 0.85 C ATOM 458 CD1 LEU A 31 -16.090 -3.985 -3.050 1.00 0.94 C ATOM 459 CD2 LEU A 31 -14.228 -3.702 -1.415 1.00 0.86 C ATOM 0 H LEU A 31 -12.035 -4.036 -5.570 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.497 -4.837 -2.850 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -13.061 -2.617 -3.858 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -14.285 -3.403 -4.835 1.00 0.71 H new ATOM 0 HG LEU A 31 -15.015 -2.179 -2.698 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -16.798 -3.821 -2.237 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -16.515 -3.614 -3.982 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -15.886 -5.052 -3.143 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -14.972 -3.548 -0.633 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -13.973 -4.760 -1.470 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -13.333 -3.125 -1.183 1.00 0.86 H new ATOM 471 N LYS A 32 -14.243 -6.606 -2.932 1.00 0.56 N ATOM 472 CA LYS A 32 -15.039 -7.815 -3.003 1.00 0.60 C ATOM 473 C LYS A 32 -16.096 -7.907 -1.903 1.00 0.82 C ATOM 474 O LYS A 32 -17.084 -7.188 -1.913 1.00 1.33 O ATOM 475 CB LYS A 32 -14.127 -9.043 -2.971 1.00 0.62 C ATOM 476 CG LYS A 32 -12.933 -8.913 -2.037 1.00 0.65 C ATOM 477 CD LYS A 32 -12.088 -10.174 -2.002 1.00 0.90 C ATOM 478 CE LYS A 32 -11.182 -10.318 -3.221 1.00 1.10 C ATOM 479 NZ LYS A 32 -11.930 -10.562 -4.483 1.00 1.32 N ATOM 0 H LYS A 32 -14.012 -6.304 -1.986 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.582 -7.781 -3.948 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -14.715 -9.910 -2.671 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -13.764 -9.238 -3.980 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -12.315 -8.073 -2.355 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.285 -8.686 -1.031 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -11.476 -10.170 -1.100 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -12.744 -11.043 -1.939 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -10.584 -9.413 -3.330 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -10.487 -11.141 -3.054 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -11.431 -11.277 -5.050 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -12.886 -10.904 -4.259 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -11.997 -9.676 -5.024 1.00 1.32 H new ATOM 493 N ASP A 33 -15.801 -8.665 -0.875 1.00 0.60 N ATOM 494 CA ASP A 33 -16.818 -9.283 -0.061 1.00 0.94 C ATOM 495 C ASP A 33 -17.135 -8.406 1.105 1.00 0.53 C ATOM 496 O ASP A 33 -16.587 -7.337 1.219 1.00 1.46 O ATOM 497 CB ASP A 33 -16.315 -10.624 0.450 1.00 2.08 C ATOM 498 CG ASP A 33 -16.161 -11.656 -0.651 1.00 2.37 C ATOM 499 OD1 ASP A 33 -17.181 -12.258 -1.056 1.00 2.32 O ATOM 500 OD2 ASP A 33 -15.023 -11.866 -1.123 1.00 2.85 O ATOM 0 H ASP A 33 -14.847 -8.871 -0.579 1.00 0.60 H new ATOM 0 HA ASP A 33 -17.715 -9.429 -0.663 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -15.354 -10.481 0.944 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -17.007 -11.003 1.202 1.00 2.08 H new ATOM 505 N VAL A 34 -18.064 -8.827 1.922 1.00 0.54 N ATOM 506 CA VAL A 34 -18.546 -8.007 3.013 1.00 1.14 C ATOM 507 C VAL A 34 -19.067 -8.878 4.141 1.00 0.77 C ATOM 508 O VAL A 34 -18.925 -8.554 5.329 1.00 0.92 O ATOM 509 CB VAL A 34 -19.715 -7.124 2.581 1.00 2.31 C ATOM 510 CG1 VAL A 34 -20.130 -6.244 3.751 1.00 2.83 C ATOM 511 CG2 VAL A 34 -19.417 -6.300 1.340 1.00 3.26 C ATOM 0 H VAL A 34 -18.509 -9.742 1.855 1.00 0.54 H new ATOM 0 HA VAL A 34 -17.702 -7.395 3.332 1.00 1.14 H new ATOM 0 HB VAL A 34 -20.542 -7.776 2.299 1.00 2.31 H new ATOM 0 HG11 VAL A 34 -20.964 -5.610 3.451 1.00 2.83 H new ATOM 0 HG12 VAL A 34 -20.434 -6.872 4.589 1.00 2.83 H new ATOM 0 HG13 VAL A 34 -19.289 -5.619 4.052 1.00 2.83 H new ATOM 0 HG21 VAL A 34 -20.288 -5.695 1.087 1.00 3.26 H new ATOM 0 HG22 VAL A 34 -18.566 -5.647 1.533 1.00 3.26 H new ATOM 0 HG23 VAL A 34 -19.183 -6.965 0.509 1.00 3.26 H new ATOM 521 N ASN A 35 -19.719 -9.951 3.737 1.00 1.02 N ATOM 522 CA ASN A 35 -20.406 -10.849 4.654 1.00 1.38 C ATOM 523 C ASN A 35 -21.649 -10.146 5.183 1.00 1.25 C ATOM 524 O ASN A 35 -22.754 -10.421 4.726 1.00 1.86 O ATOM 525 CB ASN A 35 -19.459 -11.290 5.786 1.00 1.73 C ATOM 526 CG ASN A 35 -20.173 -11.791 7.024 1.00 2.46 C ATOM 527 OD1 ASN A 35 -21.221 -12.435 6.948 1.00 3.16 O ATOM 528 ND2 ASN A 35 -19.610 -11.473 8.178 1.00 2.69 N ATOM 0 H ASN A 35 -19.789 -10.229 2.758 1.00 1.02 H new ATOM 0 HA ASN A 35 -20.716 -11.757 4.136 1.00 1.38 H new ATOM 0 HB2 ASN A 35 -18.804 -12.077 5.413 1.00 1.73 H new ATOM 0 HB3 ASN A 35 -18.822 -10.450 6.061 1.00 1.73 H new ATOM 0 HD21 ASN A 35 -20.044 -11.763 9.054 1.00 2.69 H new ATOM 0 HD22 ASN A 35 -18.742 -10.938 8.192 1.00 2.69 H new ATOM 535 N ARG A 36 -21.439 -9.202 6.095 1.00 0.85 N ATOM 536 CA ARG A 36 -22.499 -8.379 6.652 1.00 1.08 C ATOM 537 C ARG A 36 -21.973 -7.488 7.773 1.00 0.99 C ATOM 538 O ARG A 36 -22.748 -6.895 8.521 1.00 1.18 O ATOM 539 CB ARG A 36 -23.628 -9.240 7.203 1.00 1.64 C ATOM 540 CG ARG A 36 -24.973 -8.601 6.991 1.00 2.03 C ATOM 541 CD ARG A 36 -25.328 -8.600 5.516 1.00 2.67 C ATOM 542 NE ARG A 36 -25.534 -9.951 4.998 1.00 3.55 N ATOM 543 CZ ARG A 36 -26.252 -10.234 3.913 1.00 4.51 C ATOM 544 NH1 ARG A 36 -26.936 -9.282 3.294 1.00 4.82 N ATOM 545 NH2 ARG A 36 -26.296 -11.476 3.457 1.00 5.46 N ATOM 0 H ARG A 36 -20.515 -8.987 6.471 1.00 0.85 H new ATOM 0 HA ARG A 36 -22.878 -7.756 5.841 1.00 1.08 H new ATOM 0 HB2 ARG A 36 -23.609 -10.217 6.719 1.00 1.64 H new ATOM 0 HB3 ARG A 36 -23.470 -9.409 8.268 1.00 1.64 H new ATOM 0 HG2 ARG A 36 -25.733 -9.142 7.555 1.00 2.03 H new ATOM 0 HG3 ARG A 36 -24.962 -7.579 7.370 1.00 2.03 H new ATOM 0 HD2 ARG A 36 -26.232 -8.012 5.362 1.00 2.67 H new ATOM 0 HD3 ARG A 36 -24.532 -8.114 4.952 1.00 2.67 H new ATOM 0 HE ARG A 36 -25.100 -10.726 5.499 1.00 3.55 H new ATOM 0 HH11 ARG A 36 -26.914 -8.326 3.648 1.00 4.82 H new ATOM 0 HH12 ARG A 36 -27.484 -9.506 2.463 1.00 4.82 H new ATOM 0 HH21 ARG A 36 -25.781 -12.214 3.937 1.00 5.46 H new ATOM 0 HH22 ARG A 36 -26.845 -11.695 2.626 1.00 5.46 H new ATOM 559 N ASP A 37 -20.662 -7.373 7.882 1.00 0.82 N ATOM 560 CA ASP A 37 -20.061 -6.664 9.002 1.00 0.91 C ATOM 561 C ASP A 37 -18.931 -5.800 8.512 1.00 0.73 C ATOM 562 O ASP A 37 -18.576 -4.798 9.130 1.00 0.84 O ATOM 563 CB ASP A 37 -19.514 -7.647 10.045 1.00 1.10 C ATOM 564 CG ASP A 37 -20.596 -8.394 10.797 1.00 1.48 C ATOM 565 OD1 ASP A 37 -21.141 -7.839 11.769 1.00 1.92 O ATOM 566 OD2 ASP A 37 -20.886 -9.554 10.437 1.00 1.80 O ATOM 0 H ASP A 37 -19.994 -7.758 7.214 1.00 0.82 H new ATOM 0 HA ASP A 37 -20.833 -6.049 9.464 1.00 0.91 H new ATOM 0 HB2 ASP A 37 -18.864 -8.368 9.548 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -18.897 -7.101 10.759 1.00 1.10 H new ATOM 571 N SER A 38 -18.360 -6.202 7.390 1.00 0.54 N ATOM 572 CA SER A 38 -17.192 -5.519 6.860 1.00 0.48 C ATOM 573 C SER A 38 -16.903 -5.936 5.431 1.00 0.50 C ATOM 574 O SER A 38 -16.783 -7.123 5.131 1.00 0.94 O ATOM 575 CB SER A 38 -15.991 -5.858 7.719 1.00 0.55 C ATOM 576 OG SER A 38 -14.925 -4.943 7.527 1.00 0.76 O ATOM 0 H SER A 38 -18.683 -6.992 6.831 1.00 0.54 H new ATOM 0 HA SER A 38 -17.391 -4.447 6.872 1.00 0.48 H new ATOM 0 HB2 SER A 38 -16.284 -5.858 8.769 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.650 -6.866 7.484 1.00 0.55 H new ATOM 0 HG SER A 38 -15.086 -4.419 6.715 1.00 0.76 H new ATOM 582 N VAL A 39 -16.745 -4.960 4.565 1.00 0.33 N ATOM 583 CA VAL A 39 -16.426 -5.231 3.181 1.00 0.35 C ATOM 584 C VAL A 39 -14.946 -5.575 3.083 1.00 0.31 C ATOM 585 O VAL A 39 -14.173 -5.228 3.972 1.00 0.34 O ATOM 586 CB VAL A 39 -16.791 -4.027 2.297 1.00 0.43 C ATOM 587 CG1 VAL A 39 -16.624 -4.353 0.821 1.00 0.86 C ATOM 588 CG2 VAL A 39 -18.218 -3.602 2.596 1.00 0.86 C ATOM 0 H VAL A 39 -16.832 -3.970 4.795 1.00 0.33 H new ATOM 0 HA VAL A 39 -17.010 -6.077 2.820 1.00 0.35 H new ATOM 0 HB VAL A 39 -16.112 -3.205 2.525 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.890 -3.481 0.223 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -15.587 -4.626 0.624 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -17.275 -5.186 0.557 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -18.482 -2.748 1.972 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.896 -4.429 2.385 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -18.302 -3.323 3.646 1.00 0.86 H new ATOM 598 N GLU A 40 -14.535 -6.300 2.061 1.00 0.33 N ATOM 599 CA GLU A 40 -13.172 -6.753 2.017 1.00 0.36 C ATOM 600 C GLU A 40 -12.634 -6.578 0.627 1.00 0.38 C ATOM 601 O GLU A 40 -13.385 -6.670 -0.335 1.00 0.50 O ATOM 602 CB GLU A 40 -13.101 -8.211 2.472 1.00 0.52 C ATOM 603 CG GLU A 40 -13.639 -8.414 3.881 1.00 0.62 C ATOM 604 CD GLU A 40 -13.617 -9.855 4.337 1.00 0.89 C ATOM 605 OE1 GLU A 40 -14.532 -10.614 3.964 1.00 1.16 O ATOM 606 OE2 GLU A 40 -12.669 -10.243 5.050 1.00 1.19 O ATOM 0 H GLU A 40 -15.115 -6.579 1.270 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.556 -6.162 2.695 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.668 -8.832 1.778 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.066 -8.550 2.430 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -13.051 -7.813 4.575 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.663 -8.043 3.927 1.00 0.62 H new ATOM 613 N TYR A 41 -11.359 -6.262 0.505 1.00 0.37 N ATOM 614 CA TYR A 41 -10.771 -6.162 -0.830 1.00 0.56 C ATOM 615 C TYR A 41 -9.350 -6.670 -0.877 1.00 0.43 C ATOM 616 O TYR A 41 -8.564 -6.436 0.032 1.00 0.40 O ATOM 617 CB TYR A 41 -10.840 -4.747 -1.400 1.00 0.89 C ATOM 618 CG TYR A 41 -10.246 -3.668 -0.542 1.00 0.86 C ATOM 619 CD1 TYR A 41 -8.882 -3.611 -0.301 1.00 1.65 C ATOM 620 CD2 TYR A 41 -11.053 -2.696 0.013 1.00 1.30 C ATOM 621 CE1 TYR A 41 -8.344 -2.621 0.481 1.00 2.63 C ATOM 622 CE2 TYR A 41 -10.524 -1.700 0.792 1.00 2.04 C ATOM 623 CZ TYR A 41 -9.172 -1.668 1.022 1.00 2.72 C ATOM 624 OH TYR A 41 -8.655 -0.694 1.819 1.00 3.73 O ATOM 0 H TYR A 41 -10.723 -6.075 1.280 1.00 0.37 H new ATOM 0 HA TYR A 41 -11.383 -6.808 -1.460 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -10.332 -4.739 -2.365 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -11.885 -4.502 -1.588 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -8.233 -4.357 -0.735 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -12.117 -2.720 -0.169 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -7.281 -2.591 0.669 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -11.167 -0.946 1.222 1.00 2.04 H new ATOM 0 HH TYR A 41 -7.677 -0.700 1.751 1.00 3.73 H new ATOM 634 N LEU A 42 -9.018 -7.339 -1.958 1.00 0.41 N ATOM 635 CA LEU A 42 -7.701 -7.911 -2.100 1.00 0.38 C ATOM 636 C LEU A 42 -6.759 -6.829 -2.582 1.00 0.34 C ATOM 637 O LEU A 42 -6.874 -6.351 -3.715 1.00 0.38 O ATOM 638 CB LEU A 42 -7.731 -9.088 -3.088 1.00 0.49 C ATOM 639 CG LEU A 42 -6.589 -10.111 -2.964 1.00 0.55 C ATOM 640 CD1 LEU A 42 -5.242 -9.493 -3.307 1.00 0.71 C ATOM 641 CD2 LEU A 42 -6.557 -10.706 -1.563 1.00 0.81 C ATOM 0 H LEU A 42 -9.641 -7.499 -2.749 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.356 -8.295 -1.140 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -8.677 -9.615 -2.964 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -7.721 -8.685 -4.101 1.00 0.49 H new ATOM 0 HG LEU A 42 -6.781 -10.908 -3.683 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -4.460 -10.246 -3.208 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -5.262 -9.123 -4.332 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.037 -8.666 -2.627 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -5.743 -11.428 -1.493 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -6.401 -9.911 -0.834 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -7.504 -11.206 -1.358 1.00 0.81 H new ATOM 653 N ALA A 43 -5.851 -6.423 -1.720 1.00 0.33 N ATOM 654 CA ALA A 43 -4.870 -5.430 -2.088 1.00 0.36 C ATOM 655 C ALA A 43 -3.638 -6.128 -2.621 1.00 0.35 C ATOM 656 O ALA A 43 -2.820 -6.648 -1.863 1.00 0.37 O ATOM 657 CB ALA A 43 -4.537 -4.532 -0.907 1.00 0.42 C ATOM 0 H ALA A 43 -5.773 -6.765 -0.762 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.277 -4.788 -2.869 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.796 -3.792 -1.210 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.440 -4.024 -0.570 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -4.136 -5.135 -0.093 1.00 0.42 H new ATOM 663 N LYS A 44 -3.525 -6.163 -3.932 1.00 0.38 N ATOM 664 CA LYS A 44 -2.441 -6.864 -4.567 1.00 0.39 C ATOM 665 C LYS A 44 -1.224 -5.964 -4.606 1.00 0.36 C ATOM 666 O LYS A 44 -1.276 -4.826 -5.079 1.00 0.47 O ATOM 667 CB LYS A 44 -2.833 -7.320 -5.970 1.00 0.53 C ATOM 668 CG LYS A 44 -1.817 -8.253 -6.611 1.00 0.95 C ATOM 669 CD LYS A 44 -2.360 -8.875 -7.886 1.00 1.58 C ATOM 670 CE LYS A 44 -3.596 -9.721 -7.611 1.00 1.61 C ATOM 671 NZ LYS A 44 -3.295 -10.908 -6.763 1.00 2.63 N ATOM 0 H LYS A 44 -4.175 -5.712 -4.576 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.205 -7.759 -3.991 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -3.798 -7.824 -5.923 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -2.961 -6.444 -6.606 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -0.904 -7.701 -6.834 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -1.549 -9.040 -5.906 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -2.607 -8.089 -8.599 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -1.590 -9.493 -8.347 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -4.350 -9.108 -7.118 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -4.024 -10.053 -8.557 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -4.143 -11.505 -6.688 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -2.523 -11.456 -7.194 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -3.009 -10.593 -5.814 1.00 2.63 H new ATOM 685 N VAL A 45 -0.142 -6.484 -4.086 1.00 0.31 N ATOM 686 CA VAL A 45 1.078 -5.734 -3.914 1.00 0.33 C ATOM 687 C VAL A 45 2.134 -6.216 -4.877 1.00 0.28 C ATOM 688 O VAL A 45 2.186 -7.388 -5.230 1.00 0.30 O ATOM 689 CB VAL A 45 1.591 -5.901 -2.469 1.00 0.44 C ATOM 690 CG1 VAL A 45 3.028 -5.439 -2.308 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.687 -5.153 -1.511 1.00 0.51 C ATOM 0 H VAL A 45 -0.081 -7.451 -3.766 1.00 0.31 H new ATOM 0 HA VAL A 45 0.871 -4.683 -4.113 1.00 0.33 H new ATOM 0 HB VAL A 45 1.571 -6.966 -2.236 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.341 -5.578 -1.273 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.674 -6.023 -2.964 1.00 0.82 H new ATOM 0 HG13 VAL A 45 3.103 -4.384 -2.571 1.00 0.82 H new ATOM 0 HG21 VAL A 45 1.055 -5.275 -0.492 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.680 -4.094 -1.769 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.326 -5.550 -1.581 1.00 0.51 H new ATOM 701 N SER A 46 2.937 -5.305 -5.346 1.00 0.25 N ATOM 702 CA SER A 46 4.146 -5.671 -6.012 1.00 0.25 C ATOM 703 C SER A 46 5.295 -4.900 -5.387 1.00 0.24 C ATOM 704 O SER A 46 5.508 -3.728 -5.698 1.00 0.26 O ATOM 705 CB SER A 46 4.000 -5.391 -7.497 1.00 0.28 C ATOM 706 OG SER A 46 3.219 -6.389 -8.130 1.00 0.72 O ATOM 0 H SER A 46 2.773 -4.301 -5.277 1.00 0.25 H new ATOM 0 HA SER A 46 4.355 -6.735 -5.900 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.536 -4.415 -7.642 1.00 0.28 H new ATOM 0 HB3 SER A 46 4.986 -5.348 -7.961 1.00 0.28 H new ATOM 0 HG SER A 46 2.754 -6.920 -7.450 1.00 0.72 H new ATOM 712 N VAL A 47 6.002 -5.547 -4.462 1.00 0.25 N ATOM 713 CA VAL A 47 7.068 -4.882 -3.740 1.00 0.28 C ATOM 714 C VAL A 47 8.378 -4.973 -4.493 1.00 0.28 C ATOM 715 O VAL A 47 8.792 -6.042 -4.944 1.00 0.30 O ATOM 716 CB VAL A 47 7.222 -5.347 -2.256 1.00 0.41 C ATOM 717 CG1 VAL A 47 6.915 -6.819 -2.063 1.00 1.14 C ATOM 718 CG2 VAL A 47 8.618 -5.019 -1.721 1.00 1.05 C ATOM 0 H VAL A 47 5.853 -6.522 -4.201 1.00 0.25 H new ATOM 0 HA VAL A 47 6.775 -3.834 -3.681 1.00 0.28 H new ATOM 0 HB VAL A 47 6.481 -4.790 -1.683 1.00 0.41 H new ATOM 0 HG11 VAL A 47 7.039 -7.082 -1.013 1.00 1.14 H new ATOM 0 HG12 VAL A 47 5.888 -7.020 -2.368 1.00 1.14 H new ATOM 0 HG13 VAL A 47 7.597 -7.415 -2.669 1.00 1.14 H new ATOM 0 HG21 VAL A 47 8.699 -5.353 -0.687 1.00 1.05 H new ATOM 0 HG22 VAL A 47 9.368 -5.528 -2.326 1.00 1.05 H new ATOM 0 HG23 VAL A 47 8.782 -3.943 -1.769 1.00 1.05 H new ATOM 728 N THR A 48 9.009 -3.825 -4.625 1.00 0.30 N ATOM 729 CA THR A 48 10.204 -3.684 -5.418 1.00 0.31 C ATOM 730 C THR A 48 11.355 -3.281 -4.526 1.00 0.34 C ATOM 731 O THR A 48 11.340 -2.199 -3.922 1.00 0.37 O ATOM 732 CB THR A 48 10.034 -2.629 -6.531 1.00 0.36 C ATOM 733 OG1 THR A 48 8.868 -2.918 -7.316 1.00 0.41 O ATOM 734 CG2 THR A 48 11.261 -2.597 -7.434 1.00 0.41 C ATOM 0 H THR A 48 8.702 -2.960 -4.181 1.00 0.30 H new ATOM 0 HA THR A 48 10.404 -4.645 -5.891 1.00 0.31 H new ATOM 0 HB THR A 48 9.918 -1.653 -6.059 1.00 0.36 H new ATOM 0 HG1 THR A 48 8.770 -2.241 -8.018 1.00 0.41 H new ATOM 0 HG21 THR A 48 11.121 -1.847 -8.212 1.00 0.41 H new ATOM 0 HG22 THR A 48 12.142 -2.346 -6.843 1.00 0.41 H new ATOM 0 HG23 THR A 48 11.400 -3.575 -7.894 1.00 0.41 H new ATOM 742 N ASN A 49 12.323 -4.173 -4.429 1.00 0.38 N ATOM 743 CA ASN A 49 13.545 -3.922 -3.691 1.00 0.44 C ATOM 744 C ASN A 49 14.566 -3.321 -4.654 1.00 0.42 C ATOM 745 O ASN A 49 14.708 -3.822 -5.760 1.00 0.46 O ATOM 746 CB ASN A 49 14.037 -5.252 -3.096 1.00 0.59 C ATOM 747 CG ASN A 49 15.542 -5.356 -2.917 1.00 0.73 C ATOM 748 OD1 ASN A 49 16.224 -4.401 -2.554 1.00 1.48 O ATOM 749 ND2 ASN A 49 16.073 -6.539 -3.185 1.00 0.76 N ATOM 0 H ASN A 49 12.283 -5.096 -4.862 1.00 0.38 H new ATOM 0 HA ASN A 49 13.387 -3.221 -2.872 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.560 -5.398 -2.127 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.706 -6.066 -3.741 1.00 0.59 H new ATOM 0 HD21 ASN A 49 17.079 -6.679 -3.092 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.476 -7.310 -3.484 1.00 0.76 H new ATOM 756 N PRO A 50 15.261 -2.234 -4.272 1.00 0.46 N ATOM 757 CA PRO A 50 16.174 -1.511 -5.166 1.00 0.51 C ATOM 758 C PRO A 50 17.622 -2.007 -5.118 1.00 0.53 C ATOM 759 O PRO A 50 18.511 -1.396 -5.707 1.00 0.65 O ATOM 760 CB PRO A 50 16.103 -0.105 -4.595 1.00 0.64 C ATOM 761 CG PRO A 50 16.014 -0.333 -3.126 1.00 0.73 C ATOM 762 CD PRO A 50 15.197 -1.592 -2.946 1.00 0.55 C ATOM 0 HA PRO A 50 15.889 -1.623 -6.212 1.00 0.51 H new ATOM 0 HB2 PRO A 50 16.984 0.480 -4.858 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.236 0.438 -4.971 1.00 0.64 H new ATOM 0 HG2 PRO A 50 17.006 -0.446 -2.688 1.00 0.73 H new ATOM 0 HG3 PRO A 50 15.541 0.513 -2.628 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.613 -2.233 -2.169 1.00 0.55 H new ATOM 0 HD3 PRO A 50 14.170 -1.367 -2.658 1.00 0.55 H new ATOM 770 N TYR A 51 17.858 -3.110 -4.430 1.00 0.53 N ATOM 771 CA TYR A 51 19.205 -3.617 -4.248 1.00 0.68 C ATOM 772 C TYR A 51 19.298 -4.998 -4.863 1.00 0.88 C ATOM 773 O TYR A 51 18.398 -5.818 -4.692 1.00 1.88 O ATOM 774 CB TYR A 51 19.583 -3.654 -2.764 1.00 0.74 C ATOM 775 CG TYR A 51 21.056 -3.908 -2.528 1.00 0.88 C ATOM 776 CD1 TYR A 51 21.986 -2.881 -2.621 1.00 1.22 C ATOM 777 CD2 TYR A 51 21.516 -5.180 -2.208 1.00 1.06 C ATOM 778 CE1 TYR A 51 23.329 -3.115 -2.399 1.00 1.63 C ATOM 779 CE2 TYR A 51 22.859 -5.420 -1.985 1.00 1.36 C ATOM 780 CZ TYR A 51 23.768 -4.363 -2.104 1.00 1.64 C ATOM 781 OH TYR A 51 25.100 -4.612 -1.860 1.00 2.08 O ATOM 0 H TYR A 51 17.131 -3.673 -3.987 1.00 0.53 H new ATOM 0 HA TYR A 51 19.910 -2.951 -4.745 1.00 0.68 H new ATOM 0 HB2 TYR A 51 19.306 -2.706 -2.302 1.00 0.74 H new ATOM 0 HB3 TYR A 51 19.003 -4.432 -2.268 1.00 0.74 H new ATOM 0 HD1 TYR A 51 21.654 -1.884 -2.871 1.00 1.22 H new ATOM 0 HD2 TYR A 51 20.812 -5.995 -2.132 1.00 1.06 H new ATOM 0 HE1 TYR A 51 24.034 -2.299 -2.461 1.00 1.63 H new ATOM 0 HE2 TYR A 51 23.202 -6.410 -1.723 1.00 1.36 H new ATOM 0 HH TYR A 51 25.224 -5.564 -1.665 1.00 2.08 H new ATOM 791 N SER A 52 20.402 -5.268 -5.532 1.00 0.69 N ATOM 792 CA SER A 52 20.510 -6.402 -6.436 1.00 0.66 C ATOM 793 C SER A 52 20.743 -7.722 -5.700 1.00 0.65 C ATOM 794 O SER A 52 21.472 -8.593 -6.175 1.00 0.77 O ATOM 795 CB SER A 52 21.645 -6.109 -7.402 1.00 0.80 C ATOM 796 OG SER A 52 22.778 -5.631 -6.692 1.00 1.51 O ATOM 0 H SER A 52 21.252 -4.708 -5.466 1.00 0.69 H new ATOM 0 HA SER A 52 19.568 -6.527 -6.969 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.906 -7.012 -7.953 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.327 -5.368 -8.136 1.00 0.80 H new ATOM 0 HG SER A 52 23.505 -5.446 -7.322 1.00 1.51 H new ATOM 802 N HIS A 53 20.098 -7.876 -4.556 1.00 0.58 N ATOM 803 CA HIS A 53 20.192 -9.096 -3.774 1.00 0.66 C ATOM 804 C HIS A 53 18.871 -9.369 -3.073 1.00 0.65 C ATOM 805 O HIS A 53 18.271 -8.465 -2.490 1.00 1.08 O ATOM 806 CB HIS A 53 21.331 -9.014 -2.750 1.00 0.74 C ATOM 807 CG HIS A 53 22.693 -9.165 -3.356 1.00 0.95 C ATOM 808 ND1 HIS A 53 23.517 -8.098 -3.639 1.00 1.06 N ATOM 809 CD2 HIS A 53 23.370 -10.271 -3.743 1.00 1.41 C ATOM 810 CE1 HIS A 53 24.638 -8.540 -4.173 1.00 1.43 C ATOM 811 NE2 HIS A 53 24.577 -9.856 -4.247 1.00 1.67 N ATOM 0 H HIS A 53 19.497 -7.162 -4.145 1.00 0.58 H new ATOM 0 HA HIS A 53 20.412 -9.919 -4.454 1.00 0.66 H new ATOM 0 HB2 HIS A 53 21.276 -8.056 -2.234 1.00 0.74 H new ATOM 0 HB3 HIS A 53 21.189 -9.790 -1.998 1.00 0.74 H new ATOM 0 HD1 HIS A 53 23.294 -7.118 -3.463 1.00 1.06 H new ATOM 0 HD2 HIS A 53 23.024 -11.291 -3.669 1.00 1.41 H new ATOM 0 HE1 HIS A 53 25.467 -7.928 -4.496 1.00 1.43 H new ATOM 820 N SER A 54 18.402 -10.599 -3.217 1.00 0.55 N ATOM 821 CA SER A 54 17.249 -11.115 -2.513 1.00 0.51 C ATOM 822 C SER A 54 17.239 -10.731 -1.041 1.00 0.47 C ATOM 823 O SER A 54 17.843 -11.413 -0.245 1.00 0.51 O ATOM 824 CB SER A 54 17.296 -12.640 -2.616 1.00 0.61 C ATOM 825 OG SER A 54 17.559 -13.043 -3.950 1.00 1.39 O ATOM 0 H SER A 54 18.828 -11.281 -3.845 1.00 0.55 H new ATOM 0 HA SER A 54 16.352 -10.691 -2.964 1.00 0.51 H new ATOM 0 HB2 SER A 54 18.068 -13.031 -1.954 1.00 0.61 H new ATOM 0 HB3 SER A 54 16.347 -13.062 -2.283 1.00 0.61 H new ATOM 0 HG SER A 54 17.037 -12.490 -4.568 1.00 1.39 H new ATOM 831 N ILE A 55 16.468 -9.725 -0.647 1.00 0.44 N ATOM 832 CA ILE A 55 16.497 -9.297 0.747 1.00 0.49 C ATOM 833 C ILE A 55 15.731 -10.306 1.573 1.00 0.58 C ATOM 834 O ILE A 55 15.199 -11.242 1.015 1.00 1.03 O ATOM 835 CB ILE A 55 15.895 -7.890 0.970 1.00 0.49 C ATOM 836 CG1 ILE A 55 14.617 -7.681 0.158 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.921 -6.823 0.643 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.792 -6.504 0.627 1.00 0.56 C ATOM 0 H ILE A 55 15.833 -9.203 -1.251 1.00 0.44 H new ATOM 0 HA ILE A 55 17.542 -9.239 1.050 1.00 0.49 H new ATOM 0 HB ILE A 55 15.623 -7.808 2.022 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.881 -7.536 -0.890 1.00 0.47 H new ATOM 0 HG13 ILE A 55 14.010 -8.585 0.211 1.00 0.47 H new ATOM 0 HG21 ILE A 55 16.485 -5.837 0.804 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.791 -6.945 1.288 1.00 0.48 H new ATOM 0 HG23 ILE A 55 17.226 -6.919 -0.399 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.900 -6.415 0.007 1.00 0.56 H new ATOM 0 HD12 ILE A 55 13.498 -6.657 1.665 1.00 0.56 H new ATOM 0 HD13 ILE A 55 14.382 -5.591 0.548 1.00 0.56 H new ATOM 850 N PRO A 56 15.751 -10.220 2.905 1.00 0.35 N ATOM 851 CA PRO A 56 15.066 -11.188 3.736 1.00 0.34 C ATOM 852 C PRO A 56 13.607 -10.842 4.019 1.00 0.30 C ATOM 853 O PRO A 56 12.708 -11.624 3.720 1.00 0.32 O ATOM 854 CB PRO A 56 15.866 -11.178 5.036 1.00 0.37 C ATOM 855 CG PRO A 56 16.815 -10.016 4.955 1.00 0.35 C ATOM 856 CD PRO A 56 16.469 -9.237 3.714 1.00 0.35 C ATOM 0 HA PRO A 56 15.022 -12.157 3.238 1.00 0.34 H new ATOM 0 HB2 PRO A 56 15.204 -11.077 5.896 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.411 -12.114 5.161 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.727 -9.386 5.840 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.847 -10.365 4.914 1.00 0.35 H new ATOM 0 HD2 PRO A 56 15.849 -8.369 3.941 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.360 -8.868 3.206 1.00 0.35 H new ATOM 864 N ILE A 57 13.371 -9.693 4.629 1.00 0.29 N ATOM 865 CA ILE A 57 12.031 -9.373 5.118 1.00 0.30 C ATOM 866 C ILE A 57 11.628 -7.932 4.827 1.00 0.27 C ATOM 867 O ILE A 57 12.476 -7.062 4.649 1.00 0.30 O ATOM 868 CB ILE A 57 11.943 -9.671 6.638 1.00 0.38 C ATOM 869 CG1 ILE A 57 12.112 -11.171 6.869 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.630 -9.189 7.250 1.00 0.38 C ATOM 871 CD1 ILE A 57 12.128 -11.553 8.325 1.00 1.23 C ATOM 0 H ILE A 57 14.074 -8.973 4.798 1.00 0.29 H new ATOM 0 HA ILE A 57 11.326 -10.006 4.580 1.00 0.30 H new ATOM 0 HB ILE A 57 12.744 -9.122 7.133 1.00 0.38 H new ATOM 0 HG12 ILE A 57 11.301 -11.702 6.371 1.00 0.58 H new ATOM 0 HG13 ILE A 57 13.041 -11.500 6.404 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.618 -9.421 8.315 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.538 -8.112 7.112 1.00 0.38 H new ATOM 0 HG23 ILE A 57 9.795 -9.690 6.760 1.00 0.38 H new ATOM 0 HD11 ILE A 57 12.251 -12.632 8.417 1.00 1.23 H new ATOM 0 HD12 ILE A 57 12.956 -11.050 8.824 1.00 1.23 H new ATOM 0 HD13 ILE A 57 11.189 -11.254 8.790 1.00 1.23 H new ATOM 883 N CYS A 58 10.319 -7.701 4.763 1.00 0.26 N ATOM 884 CA CYS A 58 9.785 -6.384 4.514 1.00 0.24 C ATOM 885 C CYS A 58 8.586 -6.098 5.407 1.00 0.23 C ATOM 886 O CYS A 58 8.181 -6.918 6.227 1.00 0.25 O ATOM 887 CB CYS A 58 9.364 -6.241 3.056 1.00 0.26 C ATOM 888 SG CYS A 58 8.136 -7.453 2.510 1.00 1.15 S ATOM 0 H CYS A 58 9.610 -8.424 4.883 1.00 0.26 H new ATOM 0 HA CYS A 58 10.574 -5.666 4.738 1.00 0.24 H new ATOM 0 HB2 CYS A 58 8.961 -5.240 2.903 1.00 0.26 H new ATOM 0 HB3 CYS A 58 10.248 -6.328 2.425 1.00 0.26 H new ATOM 0 HG CYS A 58 8.097 -8.441 3.354 1.00 1.15 H new ATOM 894 N GLU A 59 8.045 -4.923 5.211 1.00 0.25 N ATOM 895 CA GLU A 59 6.889 -4.477 5.937 1.00 0.27 C ATOM 896 C GLU A 59 5.981 -3.697 5.028 1.00 0.29 C ATOM 897 O GLU A 59 6.339 -2.642 4.504 1.00 0.32 O ATOM 898 CB GLU A 59 7.281 -3.631 7.149 1.00 0.32 C ATOM 899 CG GLU A 59 6.084 -3.109 7.925 1.00 0.39 C ATOM 900 CD GLU A 59 6.469 -2.206 9.077 1.00 0.67 C ATOM 901 OE1 GLU A 59 7.080 -1.145 8.831 1.00 1.04 O ATOM 902 OE2 GLU A 59 6.137 -2.536 10.234 1.00 1.36 O ATOM 0 H GLU A 59 8.399 -4.245 4.537 1.00 0.25 H new ATOM 0 HA GLU A 59 6.361 -5.357 6.304 1.00 0.27 H new ATOM 0 HB2 GLU A 59 7.905 -4.228 7.814 1.00 0.32 H new ATOM 0 HB3 GLU A 59 7.886 -2.788 6.815 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.429 -2.562 7.246 1.00 0.39 H new ATOM 0 HG3 GLU A 59 5.512 -3.953 8.309 1.00 0.39 H new ATOM 909 N ILE A 60 4.822 -4.260 4.837 1.00 0.32 N ATOM 910 CA ILE A 60 3.770 -3.609 4.114 1.00 0.34 C ATOM 911 C ILE A 60 2.821 -2.921 5.085 1.00 0.31 C ATOM 912 O ILE A 60 2.091 -3.558 5.846 1.00 0.36 O ATOM 913 CB ILE A 60 3.027 -4.625 3.224 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.456 -6.047 3.595 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.310 -4.352 1.756 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.452 -6.781 4.455 1.00 1.05 C ATOM 0 H ILE A 60 4.580 -5.189 5.181 1.00 0.32 H new ATOM 0 HA ILE A 60 4.198 -2.847 3.463 1.00 0.34 H new ATOM 0 HB ILE A 60 1.954 -4.523 3.389 1.00 0.48 H new ATOM 0 HG12 ILE A 60 3.623 -6.617 2.681 1.00 0.33 H new ATOM 0 HG13 ILE A 60 4.409 -6.003 4.122 1.00 0.33 H new ATOM 0 HG21 ILE A 60 2.778 -5.078 1.142 1.00 0.99 H new ATOM 0 HG22 ILE A 60 2.975 -3.347 1.502 1.00 0.99 H new ATOM 0 HG23 ILE A 60 4.381 -4.435 1.570 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.825 -7.781 4.677 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.302 -6.235 5.386 1.00 1.05 H new ATOM 0 HD13 ILE A 60 1.504 -6.857 3.923 1.00 1.05 H new ATOM 928 N SER A 61 2.885 -1.603 5.051 1.00 0.26 N ATOM 929 CA SER A 61 2.091 -0.755 5.912 1.00 0.25 C ATOM 930 C SER A 61 1.064 -0.032 5.064 1.00 0.24 C ATOM 931 O SER A 61 1.393 0.936 4.392 1.00 0.24 O ATOM 932 CB SER A 61 2.989 0.255 6.618 1.00 0.29 C ATOM 933 OG SER A 61 4.126 -0.375 7.184 1.00 0.83 O ATOM 0 H SER A 61 3.497 -1.089 4.417 1.00 0.26 H new ATOM 0 HA SER A 61 1.588 -1.359 6.668 1.00 0.25 H new ATOM 0 HB2 SER A 61 3.309 1.019 5.909 1.00 0.29 H new ATOM 0 HB3 SER A 61 2.425 0.763 7.400 1.00 0.29 H new ATOM 0 HG SER A 61 4.685 0.296 7.629 1.00 0.83 H new ATOM 939 N PHE A 62 -0.173 -0.477 5.092 1.00 0.24 N ATOM 940 CA PHE A 62 -1.148 -0.002 4.135 1.00 0.25 C ATOM 941 C PHE A 62 -2.164 0.873 4.833 1.00 0.26 C ATOM 942 O PHE A 62 -2.796 0.464 5.793 1.00 0.30 O ATOM 943 CB PHE A 62 -1.836 -1.180 3.423 1.00 0.27 C ATOM 944 CG PHE A 62 -2.103 -2.362 4.320 1.00 0.29 C ATOM 945 CD1 PHE A 62 -3.296 -2.460 5.019 1.00 0.31 C ATOM 946 CD2 PHE A 62 -1.166 -3.374 4.460 1.00 0.34 C ATOM 947 CE1 PHE A 62 -3.550 -3.543 5.837 1.00 0.37 C ATOM 948 CE2 PHE A 62 -1.413 -4.459 5.278 1.00 0.40 C ATOM 949 CZ PHE A 62 -2.581 -4.540 5.982 1.00 0.40 C ATOM 0 H PHE A 62 -0.526 -1.161 5.761 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.637 0.590 3.376 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.780 -0.836 3.001 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -1.213 -1.502 2.589 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -4.036 -1.679 4.923 1.00 0.31 H new ATOM 0 HD2 PHE A 62 -0.231 -3.313 3.923 1.00 0.34 H new ATOM 0 HE1 PHE A 62 -4.491 -3.619 6.361 1.00 0.37 H new ATOM 0 HE2 PHE A 62 -0.679 -5.247 5.362 1.00 0.40 H new ATOM 0 HZ PHE A 62 -2.755 -5.372 6.649 1.00 0.40 H new ATOM 959 N THR A 63 -2.276 2.090 4.365 1.00 0.25 N ATOM 960 CA THR A 63 -3.223 3.034 4.899 1.00 0.27 C ATOM 961 C THR A 63 -4.164 3.484 3.795 1.00 0.25 C ATOM 962 O THR A 63 -3.800 4.264 2.926 1.00 0.27 O ATOM 963 CB THR A 63 -2.502 4.247 5.509 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.635 3.819 6.569 1.00 0.36 O ATOM 965 CG2 THR A 63 -3.494 5.265 6.037 1.00 0.38 C ATOM 0 H THR A 63 -1.710 2.455 3.599 1.00 0.25 H new ATOM 0 HA THR A 63 -3.795 2.549 5.690 1.00 0.27 H new ATOM 0 HB THR A 63 -1.912 4.720 4.724 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.178 4.597 6.952 1.00 0.36 H new ATOM 0 HG21 THR A 63 -2.955 6.112 6.462 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.129 5.612 5.221 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.113 4.805 6.807 1.00 0.38 H new ATOM 973 N PHE A 64 -5.369 2.980 3.830 1.00 0.24 N ATOM 974 CA PHE A 64 -6.322 3.224 2.773 1.00 0.24 C ATOM 975 C PHE A 64 -7.279 4.348 3.145 1.00 0.22 C ATOM 976 O PHE A 64 -7.678 4.484 4.299 1.00 0.23 O ATOM 977 CB PHE A 64 -7.114 1.965 2.483 1.00 0.27 C ATOM 978 CG PHE A 64 -6.282 0.826 1.978 1.00 0.43 C ATOM 979 CD1 PHE A 64 -5.992 0.705 0.626 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.823 -0.148 2.850 1.00 0.65 C ATOM 981 CE1 PHE A 64 -5.258 -0.366 0.161 1.00 0.84 C ATOM 982 CE2 PHE A 64 -5.083 -1.215 2.386 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.800 -1.322 1.042 1.00 0.96 C ATOM 0 H PHE A 64 -5.719 2.392 4.586 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.766 3.520 1.884 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.626 1.652 3.393 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.884 2.194 1.746 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -6.344 1.455 -0.067 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -6.047 -0.071 3.904 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -5.042 -0.456 -0.893 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.726 -1.966 3.075 1.00 0.90 H new ATOM 0 HZ PHE A 64 -4.218 -2.156 0.678 1.00 0.96 H new ATOM 993 N HIS A 65 -7.602 5.175 2.164 1.00 0.24 N ATOM 994 CA HIS A 65 -8.591 6.243 2.310 1.00 0.26 C ATOM 995 C HIS A 65 -9.521 6.171 1.122 1.00 0.24 C ATOM 996 O HIS A 65 -9.090 5.794 0.041 1.00 0.36 O ATOM 997 CB HIS A 65 -7.965 7.645 2.312 1.00 0.42 C ATOM 998 CG HIS A 65 -6.855 7.895 3.292 1.00 0.51 C ATOM 999 ND1 HIS A 65 -5.894 7.084 3.791 1.00 1.02 N flip ATOM 1000 CD2 HIS A 65 -6.617 9.138 3.836 1.00 0.53 C flip ATOM 1001 CE1 HIS A 65 -5.099 7.843 4.616 1.00 1.29 C flip ATOM 1002 NE2 HIS A 65 -5.564 9.079 4.624 1.00 1.02 N flip ATOM 0 H HIS A 65 -7.185 5.128 1.235 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.096 6.097 3.265 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -7.585 7.848 1.311 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.757 8.369 2.505 1.00 0.42 H new ATOM 0 HD2 HIS A 65 -7.204 10.024 3.645 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -4.239 7.489 5.165 1.00 1.29 H new ATOM 0 HE2 HIS A 65 -5.172 9.858 5.153 1.00 1.02 H new ATOM 1011 N SER A 66 -10.792 6.474 1.302 1.00 0.22 N ATOM 1012 CA SER A 66 -11.665 6.581 0.152 1.00 0.25 C ATOM 1013 C SER A 66 -12.086 8.020 -0.081 1.00 0.24 C ATOM 1014 O SER A 66 -11.312 8.790 -0.639 1.00 0.30 O ATOM 1015 CB SER A 66 -12.882 5.682 0.280 1.00 0.38 C ATOM 1016 OG SER A 66 -13.725 5.789 -0.854 1.00 1.27 O ATOM 0 H SER A 66 -11.233 6.646 2.206 1.00 0.22 H new ATOM 0 HA SER A 66 -11.096 6.244 -0.714 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.561 4.647 0.400 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.441 5.949 1.177 1.00 0.38 H new ATOM 0 HG SER A 66 -13.676 4.962 -1.377 1.00 1.27 H new ATOM 1022 N ALA A 67 -13.282 8.399 0.387 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.822 9.719 0.095 1.00 0.28 C ATOM 1024 C ALA A 67 -12.872 10.775 0.611 1.00 0.30 C ATOM 1025 O ALA A 67 -12.383 11.612 -0.143 1.00 0.36 O ATOM 1026 CB ALA A 67 -15.200 9.883 0.720 1.00 0.32 C ATOM 0 H ALA A 67 -13.884 7.811 0.964 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.929 9.832 -0.984 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -15.588 10.876 0.491 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.875 9.128 0.316 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -15.126 9.763 1.801 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.627 10.754 1.910 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.526 11.497 2.462 1.00 0.32 C ATOM 1034 C GLY A 68 -11.248 11.017 3.862 1.00 0.34 C ATOM 1035 O GLY A 68 -10.589 11.694 4.650 1.00 0.39 O ATOM 0 H GLY A 68 -13.177 10.231 2.592 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.640 11.370 1.840 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.760 12.562 2.471 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.759 9.825 4.169 1.00 0.36 N ATOM 1040 CA ARG A 69 -11.618 9.263 5.492 1.00 0.46 C ATOM 1041 C ARG A 69 -10.686 8.065 5.427 1.00 0.52 C ATOM 1042 O ARG A 69 -10.035 7.848 4.411 1.00 1.08 O ATOM 1043 CB ARG A 69 -12.985 8.879 6.065 1.00 0.48 C ATOM 1044 CG ARG A 69 -13.704 7.752 5.338 1.00 0.47 C ATOM 1045 CD ARG A 69 -14.837 8.269 4.462 1.00 0.58 C ATOM 1046 NE ARG A 69 -15.351 9.574 4.904 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.051 9.802 6.023 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -16.210 8.857 6.941 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -16.552 11.008 6.245 1.00 1.04 N ATOM 0 H ARG A 69 -12.273 9.237 3.512 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.186 10.007 6.161 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -12.855 8.591 7.108 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -13.625 9.761 6.055 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -12.990 7.205 4.722 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -14.103 7.047 6.067 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -14.486 8.352 3.433 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.651 7.544 4.464 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.157 10.377 4.305 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -15.795 7.936 6.802 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -16.747 9.052 7.786 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -16.404 11.755 5.566 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -17.086 11.190 7.095 1.00 1.04 H new ATOM 1063 N GLU A 70 -10.653 7.264 6.469 1.00 0.52 N ATOM 1064 CA GLU A 70 -9.664 6.227 6.576 1.00 0.52 C ATOM 1065 C GLU A 70 -10.316 4.878 6.371 1.00 0.67 C ATOM 1066 O GLU A 70 -10.944 4.318 7.265 1.00 1.28 O ATOM 1067 CB GLU A 70 -8.920 6.309 7.915 1.00 0.66 C ATOM 1068 CG GLU A 70 -9.825 6.479 9.127 1.00 1.35 C ATOM 1069 CD GLU A 70 -9.041 6.703 10.403 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -8.618 5.709 11.028 1.00 2.61 O ATOM 1071 OE2 GLU A 70 -8.835 7.876 10.785 1.00 2.12 O ATOM 0 H GLU A 70 -11.303 7.315 7.253 1.00 0.52 H new ATOM 0 HA GLU A 70 -8.916 6.365 5.795 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -8.327 5.403 8.044 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -8.221 7.145 7.878 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -10.495 7.323 8.962 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -10.450 5.593 9.238 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.182 4.399 5.153 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.767 3.149 4.726 1.00 0.28 C ATOM 1080 C ILE A 71 -10.165 1.972 5.479 1.00 0.29 C ATOM 1081 O ILE A 71 -10.873 1.062 5.902 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.565 2.981 3.206 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.725 3.597 2.444 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.406 1.533 2.830 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -13.024 2.859 2.645 1.00 0.40 C ATOM 0 H ILE A 71 -9.655 4.876 4.421 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.834 3.169 4.949 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.647 3.502 2.934 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.850 4.633 2.760 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -11.485 3.615 1.381 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -10.266 1.450 1.752 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.538 1.117 3.342 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.299 0.981 3.123 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.813 3.349 2.074 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.914 1.830 2.303 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.285 2.864 3.703 1.00 0.40 H new ATOM 1097 N GLY A 72 -8.860 2.011 5.663 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.188 0.924 6.336 1.00 0.36 C ATOM 1099 C GLY A 72 -6.763 1.282 6.663 1.00 0.34 C ATOM 1100 O GLY A 72 -6.249 2.268 6.146 1.00 0.49 O ATOM 0 H GLY A 72 -8.254 2.773 5.360 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -8.722 0.675 7.253 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.207 0.035 5.705 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.129 0.522 7.537 1.00 0.36 N ATOM 1105 CA LYS A 73 -4.706 0.697 7.786 1.00 0.35 C ATOM 1106 C LYS A 73 -4.145 -0.470 8.581 1.00 0.39 C ATOM 1107 O LYS A 73 -4.881 -1.181 9.267 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.415 2.015 8.517 1.00 0.44 C ATOM 1109 CG LYS A 73 -4.675 1.967 10.013 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.154 1.828 10.351 1.00 0.68 C ATOM 1111 CE LYS A 73 -6.931 3.094 10.035 1.00 1.26 C ATOM 1112 NZ LYS A 73 -6.410 4.260 10.789 1.00 1.81 N ATOM 0 H LYS A 73 -6.571 -0.217 8.084 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.214 0.732 6.814 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.373 2.288 8.349 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.026 2.804 8.078 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -4.128 1.129 10.446 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.285 2.874 10.474 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -6.577 0.994 9.791 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -6.263 1.590 11.409 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -6.875 3.298 8.966 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -7.983 2.945 10.277 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -7.117 5.023 10.780 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -6.216 3.979 11.771 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -5.532 4.596 10.345 1.00 1.81 H new ATOM 1126 N GLY A 74 -2.842 -0.670 8.461 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.158 -1.691 9.218 1.00 0.43 C ATOM 1128 C GLY A 74 -0.787 -1.950 8.647 1.00 0.34 C ATOM 1129 O GLY A 74 -0.521 -1.605 7.498 1.00 0.32 O ATOM 0 H GLY A 74 -2.238 -0.131 7.840 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.071 -1.381 10.259 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -2.742 -2.611 9.207 1.00 0.43 H new ATOM 1133 N LYS A 75 0.080 -2.547 9.436 1.00 0.37 N ATOM 1134 CA LYS A 75 1.425 -2.842 8.981 1.00 0.37 C ATOM 1135 C LYS A 75 1.826 -4.238 9.418 1.00 0.39 C ATOM 1136 O LYS A 75 1.649 -4.615 10.579 1.00 0.50 O ATOM 1137 CB LYS A 75 2.415 -1.782 9.480 1.00 0.56 C ATOM 1138 CG LYS A 75 2.544 -1.693 10.992 1.00 0.84 C ATOM 1139 CD LYS A 75 2.816 -0.263 11.447 1.00 0.90 C ATOM 1140 CE LYS A 75 3.983 0.382 10.705 1.00 1.17 C ATOM 1141 NZ LYS A 75 5.307 -0.157 11.123 1.00 1.72 N ATOM 0 H LYS A 75 -0.120 -2.838 10.393 1.00 0.37 H new ATOM 0 HA LYS A 75 1.446 -2.812 7.892 1.00 0.37 H new ATOM 0 HB2 LYS A 75 3.397 -1.995 9.057 1.00 0.56 H new ATOM 0 HB3 LYS A 75 2.107 -0.809 9.098 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.628 -2.056 11.458 1.00 0.84 H new ATOM 0 HG3 LYS A 75 3.352 -2.343 11.328 1.00 0.84 H new ATOM 0 HD2 LYS A 75 1.919 0.338 11.297 1.00 0.90 H new ATOM 0 HD3 LYS A 75 3.026 -0.261 12.517 1.00 0.90 H new ATOM 0 HE2 LYS A 75 3.856 0.227 9.634 1.00 1.17 H new ATOM 0 HE3 LYS A 75 3.965 1.458 10.876 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 6.050 0.230 10.506 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 5.498 0.117 12.108 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 5.299 -1.194 11.047 1.00 1.72 H new ATOM 1155 N ILE A 76 2.337 -5.014 8.478 1.00 0.35 N ATOM 1156 CA ILE A 76 2.659 -6.404 8.734 1.00 0.39 C ATOM 1157 C ILE A 76 4.033 -6.742 8.172 1.00 0.34 C ATOM 1158 O ILE A 76 4.279 -6.583 6.975 1.00 0.35 O ATOM 1159 CB ILE A 76 1.607 -7.352 8.106 1.00 0.45 C ATOM 1160 CG1 ILE A 76 0.206 -7.040 8.644 1.00 0.51 C ATOM 1161 CG2 ILE A 76 1.966 -8.808 8.376 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -0.894 -7.857 7.999 1.00 0.73 C ATOM 0 H ILE A 76 2.538 -4.702 7.528 1.00 0.35 H new ATOM 0 HA ILE A 76 2.658 -6.546 9.815 1.00 0.39 H new ATOM 0 HB ILE A 76 1.606 -7.190 7.028 1.00 0.45 H new ATOM 0 HG12 ILE A 76 0.193 -7.216 9.720 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.004 -5.981 8.491 1.00 0.51 H new ATOM 0 HG21 ILE A 76 1.215 -9.457 7.927 1.00 0.56 H new ATOM 0 HG22 ILE A 76 2.942 -9.028 7.943 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.999 -8.981 9.452 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -1.855 -7.579 8.432 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -0.910 -7.663 6.926 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -0.710 -8.917 8.174 1.00 0.73 H new ATOM 1174 N PRO A 77 4.959 -7.174 9.032 1.00 0.34 N ATOM 1175 CA PRO A 77 6.254 -7.686 8.593 1.00 0.32 C ATOM 1176 C PRO A 77 6.081 -8.995 7.830 1.00 0.33 C ATOM 1177 O PRO A 77 5.624 -9.991 8.390 1.00 0.44 O ATOM 1178 CB PRO A 77 7.027 -7.918 9.900 1.00 0.40 C ATOM 1179 CG PRO A 77 6.259 -7.186 10.950 1.00 0.57 C ATOM 1180 CD PRO A 77 4.830 -7.183 10.492 1.00 0.42 C ATOM 0 HA PRO A 77 6.769 -7.003 7.918 1.00 0.32 H new ATOM 0 HB2 PRO A 77 7.096 -8.981 10.133 1.00 0.40 H new ATOM 0 HB3 PRO A 77 8.047 -7.542 9.825 1.00 0.40 H new ATOM 0 HG2 PRO A 77 6.357 -7.677 11.918 1.00 0.57 H new ATOM 0 HG3 PRO A 77 6.633 -6.169 11.069 1.00 0.57 H new ATOM 0 HD2 PRO A 77 4.290 -8.061 10.845 1.00 0.42 H new ATOM 0 HD3 PRO A 77 4.290 -6.309 10.856 1.00 0.42 H new ATOM 1188 N ASP A 78 6.420 -8.985 6.553 1.00 0.30 N ATOM 1189 CA ASP A 78 6.234 -10.155 5.706 1.00 0.35 C ATOM 1190 C ASP A 78 7.566 -10.521 5.084 1.00 0.32 C ATOM 1191 O ASP A 78 8.360 -9.626 4.791 1.00 0.28 O ATOM 1192 CB ASP A 78 5.203 -9.854 4.609 1.00 0.39 C ATOM 1193 CG ASP A 78 4.602 -11.107 3.995 1.00 0.52 C ATOM 1194 OD1 ASP A 78 3.674 -11.688 4.593 1.00 0.79 O ATOM 1195 OD2 ASP A 78 5.062 -11.518 2.905 1.00 0.52 O ATOM 0 H ASP A 78 6.826 -8.179 6.077 1.00 0.30 H new ATOM 0 HA ASP A 78 5.865 -10.988 6.304 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.404 -9.243 5.028 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.678 -9.264 3.825 1.00 0.39 H new ATOM 1200 N PRO A 79 7.857 -11.824 4.921 1.00 0.39 N ATOM 1201 CA PRO A 79 9.087 -12.288 4.272 1.00 0.40 C ATOM 1202 C PRO A 79 9.301 -11.634 2.909 1.00 0.38 C ATOM 1203 O PRO A 79 8.843 -12.126 1.879 1.00 0.47 O ATOM 1204 CB PRO A 79 8.896 -13.804 4.127 1.00 0.52 C ATOM 1205 CG PRO A 79 7.470 -14.072 4.482 1.00 0.58 C ATOM 1206 CD PRO A 79 7.028 -12.947 5.375 1.00 0.49 C ATOM 0 HA PRO A 79 9.970 -12.028 4.856 1.00 0.40 H new ATOM 0 HB2 PRO A 79 9.113 -14.130 3.110 1.00 0.52 H new ATOM 0 HB3 PRO A 79 9.572 -14.348 4.787 1.00 0.52 H new ATOM 0 HG2 PRO A 79 6.851 -14.121 3.586 1.00 0.58 H new ATOM 0 HG3 PRO A 79 7.372 -15.031 4.990 1.00 0.58 H new ATOM 0 HD2 PRO A 79 5.965 -12.736 5.263 1.00 0.49 H new ATOM 0 HD3 PRO A 79 7.198 -13.175 6.427 1.00 0.49 H new ATOM 1214 N GLY A 80 9.992 -10.506 2.935 1.00 0.34 N ATOM 1215 CA GLY A 80 10.271 -9.737 1.744 1.00 0.40 C ATOM 1216 C GLY A 80 11.454 -10.270 0.974 1.00 0.35 C ATOM 1217 O GLY A 80 12.104 -9.542 0.229 1.00 0.40 O ATOM 0 H GLY A 80 10.375 -10.100 3.789 1.00 0.34 H new ATOM 0 HA2 GLY A 80 9.392 -9.740 1.100 1.00 0.40 H new ATOM 0 HA3 GLY A 80 10.460 -8.700 2.021 1.00 0.40 H new ATOM 1221 N SER A 81 11.724 -11.543 1.157 1.00 0.34 N ATOM 1222 CA SER A 81 12.838 -12.188 0.513 1.00 0.36 C ATOM 1223 C SER A 81 12.520 -12.395 -0.964 1.00 0.37 C ATOM 1224 O SER A 81 11.564 -13.101 -1.297 1.00 0.43 O ATOM 1225 CB SER A 81 13.127 -13.507 1.232 1.00 0.41 C ATOM 1226 OG SER A 81 12.115 -14.470 0.985 1.00 0.62 O ATOM 0 H SER A 81 11.175 -12.158 1.758 1.00 0.34 H new ATOM 0 HA SER A 81 13.733 -11.568 0.571 1.00 0.36 H new ATOM 0 HB2 SER A 81 14.090 -13.898 0.903 1.00 0.41 H new ATOM 0 HB3 SER A 81 13.205 -13.328 2.304 1.00 0.41 H new ATOM 0 HG SER A 81 11.597 -14.205 0.196 1.00 0.62 H new ATOM 1232 N LEU A 82 13.295 -11.780 -1.868 1.00 0.37 N ATOM 1233 CA LEU A 82 12.794 -11.667 -3.250 1.00 0.39 C ATOM 1234 C LEU A 82 13.888 -11.664 -4.316 1.00 0.49 C ATOM 1235 O LEU A 82 15.052 -11.880 -4.022 1.00 0.82 O ATOM 1236 CB LEU A 82 11.912 -10.413 -3.408 1.00 0.36 C ATOM 1237 CG LEU A 82 12.639 -9.107 -3.757 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.647 -7.965 -3.894 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.687 -8.772 -2.717 1.00 1.08 C ATOM 0 H LEU A 82 14.214 -11.375 -1.689 1.00 0.37 H new ATOM 0 HA LEU A 82 12.204 -12.568 -3.417 1.00 0.39 H new ATOM 0 HB2 LEU A 82 11.173 -10.611 -4.184 1.00 0.36 H new ATOM 0 HB3 LEU A 82 11.364 -10.261 -2.478 1.00 0.36 H new ATOM 0 HG LEU A 82 13.143 -9.249 -4.713 1.00 0.52 H new ATOM 0 HD11 LEU A 82 12.181 -7.047 -4.142 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.934 -8.195 -4.686 1.00 1.10 H new ATOM 0 HD13 LEU A 82 11.113 -7.832 -2.953 1.00 1.10 H new ATOM 0 HD21 LEU A 82 14.186 -7.842 -2.990 1.00 1.08 H new ATOM 0 HD22 LEU A 82 13.210 -8.656 -1.744 1.00 1.08 H new ATOM 0 HD23 LEU A 82 14.421 -9.577 -2.667 1.00 1.08 H new ATOM 1251 N LYS A 83 13.468 -11.381 -5.553 1.00 0.40 N ATOM 1252 CA LYS A 83 14.309 -11.479 -6.749 1.00 0.46 C ATOM 1253 C LYS A 83 15.707 -10.879 -6.565 1.00 0.47 C ATOM 1254 O LYS A 83 16.615 -11.545 -6.066 1.00 0.63 O ATOM 1255 CB LYS A 83 13.603 -10.792 -7.921 1.00 0.52 C ATOM 1256 CG LYS A 83 12.173 -11.275 -8.137 1.00 0.58 C ATOM 1257 CD LYS A 83 11.558 -10.667 -9.387 1.00 0.68 C ATOM 1258 CE LYS A 83 10.167 -11.220 -9.658 1.00 1.08 C ATOM 1259 NZ LYS A 83 10.186 -12.677 -9.960 1.00 1.84 N ATOM 0 H LYS A 83 12.517 -11.072 -5.754 1.00 0.40 H new ATOM 0 HA LYS A 83 14.453 -12.541 -6.949 1.00 0.46 H new ATOM 0 HB2 LYS A 83 13.592 -9.716 -7.748 1.00 0.52 H new ATOM 0 HB3 LYS A 83 14.177 -10.963 -8.832 1.00 0.52 H new ATOM 0 HG2 LYS A 83 12.164 -12.362 -8.219 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.566 -11.016 -7.270 1.00 0.58 H new ATOM 0 HD2 LYS A 83 11.503 -9.584 -9.275 1.00 0.68 H new ATOM 0 HD3 LYS A 83 12.202 -10.867 -10.243 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.532 -11.039 -8.791 1.00 1.08 H new ATOM 0 HE3 LYS A 83 9.722 -10.683 -10.496 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 9.259 -12.966 -10.334 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 10.922 -12.875 -10.668 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 10.390 -13.209 -9.090 1.00 1.84 H new ATOM 1273 N ALA A 84 15.869 -9.629 -6.988 1.00 0.47 N ATOM 1274 CA ALA A 84 17.143 -8.929 -6.921 1.00 0.50 C ATOM 1275 C ALA A 84 16.974 -7.584 -7.588 1.00 0.58 C ATOM 1276 O ALA A 84 16.885 -7.515 -8.811 1.00 0.99 O ATOM 1277 CB ALA A 84 18.257 -9.714 -7.606 1.00 0.56 C ATOM 0 H ALA A 84 15.114 -9.072 -7.389 1.00 0.47 H new ATOM 0 HA ALA A 84 17.430 -8.811 -5.876 1.00 0.50 H new ATOM 0 HB1 ALA A 84 19.192 -9.158 -7.534 1.00 0.56 H new ATOM 0 HB2 ALA A 84 18.373 -10.682 -7.119 1.00 0.56 H new ATOM 0 HB3 ALA A 84 18.004 -9.864 -8.656 1.00 0.56 H new ATOM 1283 N LYS A 85 16.904 -6.538 -6.771 1.00 0.49 N ATOM 1284 CA LYS A 85 16.551 -5.189 -7.217 1.00 0.54 C ATOM 1285 C LYS A 85 15.400 -5.232 -8.219 1.00 0.53 C ATOM 1286 O LYS A 85 15.437 -4.609 -9.280 1.00 0.61 O ATOM 1287 CB LYS A 85 17.757 -4.426 -7.778 1.00 0.65 C ATOM 1288 CG LYS A 85 18.344 -5.000 -9.046 1.00 1.07 C ATOM 1289 CD LYS A 85 18.876 -3.890 -9.931 1.00 1.25 C ATOM 1290 CE LYS A 85 20.028 -3.148 -9.269 1.00 1.60 C ATOM 1291 NZ LYS A 85 20.513 -2.015 -10.103 1.00 1.84 N ATOM 0 H LYS A 85 17.092 -6.600 -5.770 1.00 0.49 H new ATOM 0 HA LYS A 85 16.216 -4.636 -6.339 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.459 -3.395 -7.968 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.536 -4.397 -7.016 1.00 0.65 H new ATOM 0 HG2 LYS A 85 19.147 -5.695 -8.801 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.584 -5.568 -9.582 1.00 1.07 H new ATOM 0 HD2 LYS A 85 19.210 -4.309 -10.880 1.00 1.25 H new ATOM 0 HD3 LYS A 85 18.073 -3.188 -10.158 1.00 1.25 H new ATOM 0 HE2 LYS A 85 19.707 -2.772 -8.298 1.00 1.60 H new ATOM 0 HE3 LYS A 85 20.849 -3.841 -9.087 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 21.297 -1.536 -9.616 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 20.844 -2.376 -11.021 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 19.737 -1.340 -10.256 1.00 1.84 H new ATOM 1305 N ASP A 86 14.353 -5.937 -7.833 1.00 0.48 N ATOM 1306 CA ASP A 86 13.264 -6.237 -8.750 1.00 0.46 C ATOM 1307 C ASP A 86 11.934 -6.207 -8.011 1.00 0.40 C ATOM 1308 O ASP A 86 11.889 -5.985 -6.799 1.00 0.38 O ATOM 1309 CB ASP A 86 13.485 -7.612 -9.401 1.00 0.49 C ATOM 1310 CG ASP A 86 12.885 -7.730 -10.798 1.00 0.53 C ATOM 1311 OD1 ASP A 86 11.678 -7.462 -10.967 1.00 0.55 O ATOM 1312 OD2 ASP A 86 13.621 -8.099 -11.734 1.00 0.64 O ATOM 0 H ASP A 86 14.232 -6.313 -6.893 1.00 0.48 H new ATOM 0 HA ASP A 86 13.243 -5.480 -9.534 1.00 0.46 H new ATOM 0 HB2 ASP A 86 14.555 -7.810 -9.457 1.00 0.49 H new ATOM 0 HB3 ASP A 86 13.051 -8.381 -8.762 1.00 0.49 H new ATOM 1317 N MET A 87 10.869 -6.464 -8.744 1.00 0.39 N ATOM 1318 CA MET A 87 9.516 -6.340 -8.232 1.00 0.35 C ATOM 1319 C MET A 87 8.894 -7.712 -8.024 1.00 0.34 C ATOM 1320 O MET A 87 8.751 -8.491 -8.966 1.00 0.37 O ATOM 1321 CB MET A 87 8.671 -5.529 -9.215 1.00 0.35 C ATOM 1322 CG MET A 87 7.258 -5.255 -8.732 1.00 0.35 C ATOM 1323 SD MET A 87 6.258 -4.413 -9.971 1.00 0.41 S ATOM 1324 CE MET A 87 6.225 -5.646 -11.271 1.00 1.35 C ATOM 0 H MET A 87 10.917 -6.766 -9.717 1.00 0.39 H new ATOM 0 HA MET A 87 9.549 -5.828 -7.270 1.00 0.35 H new ATOM 0 HB2 MET A 87 9.169 -4.579 -9.409 1.00 0.35 H new ATOM 0 HB3 MET A 87 8.623 -6.063 -10.164 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.780 -6.197 -8.463 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.298 -4.648 -7.828 1.00 0.35 H new ATOM 0 HE1 MET A 87 5.355 -5.481 -11.907 1.00 1.35 H new ATOM 0 HE2 MET A 87 7.132 -5.567 -11.870 1.00 1.35 H new ATOM 0 HE3 MET A 87 6.168 -6.640 -10.828 1.00 1.35 H new ATOM 1334 N THR A 88 8.537 -8.004 -6.791 1.00 0.31 N ATOM 1335 CA THR A 88 7.925 -9.272 -6.454 1.00 0.30 C ATOM 1336 C THR A 88 6.436 -9.067 -6.182 1.00 0.27 C ATOM 1337 O THR A 88 6.032 -8.041 -5.632 1.00 0.27 O ATOM 1338 CB THR A 88 8.604 -9.912 -5.222 1.00 0.32 C ATOM 1339 OG1 THR A 88 8.284 -11.307 -5.148 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.160 -9.227 -3.941 1.00 0.54 C ATOM 0 H THR A 88 8.662 -7.374 -5.999 1.00 0.31 H new ATOM 0 HA THR A 88 8.053 -9.950 -7.298 1.00 0.30 H new ATOM 0 HB THR A 88 9.681 -9.790 -5.332 1.00 0.32 H new ATOM 0 HG1 THR A 88 8.721 -11.702 -4.365 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.652 -9.696 -3.089 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.430 -8.172 -3.980 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.079 -9.322 -3.834 1.00 0.54 H new ATOM 1348 N ALA A 89 5.618 -10.016 -6.590 1.00 0.27 N ATOM 1349 CA ALA A 89 4.192 -9.926 -6.353 1.00 0.28 C ATOM 1350 C ALA A 89 3.846 -10.442 -4.962 1.00 0.29 C ATOM 1351 O ALA A 89 4.175 -11.569 -4.593 1.00 0.48 O ATOM 1352 CB ALA A 89 3.418 -10.669 -7.428 1.00 0.31 C ATOM 0 H ALA A 89 5.915 -10.856 -7.086 1.00 0.27 H new ATOM 0 HA ALA A 89 3.900 -8.877 -6.402 1.00 0.28 H new ATOM 0 HB1 ALA A 89 2.349 -10.588 -7.229 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.640 -10.234 -8.402 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.708 -11.720 -7.425 1.00 0.31 H new ATOM 1358 N LEU A 90 3.197 -9.585 -4.200 1.00 0.27 N ATOM 1359 CA LEU A 90 2.809 -9.864 -2.829 1.00 0.30 C ATOM 1360 C LEU A 90 1.297 -9.650 -2.715 1.00 0.29 C ATOM 1361 O LEU A 90 0.709 -8.993 -3.570 1.00 0.32 O ATOM 1362 CB LEU A 90 3.613 -8.929 -1.903 1.00 0.35 C ATOM 1363 CG LEU A 90 3.348 -9.022 -0.396 1.00 0.40 C ATOM 1364 CD1 LEU A 90 4.609 -8.672 0.379 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.235 -8.071 0.010 1.00 0.72 C ATOM 0 H LEU A 90 2.919 -8.658 -4.521 1.00 0.27 H new ATOM 0 HA LEU A 90 3.027 -10.891 -2.534 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.673 -9.121 -2.070 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.422 -7.902 -2.215 1.00 0.35 H new ATOM 0 HG LEU A 90 3.048 -10.044 -0.166 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.410 -8.741 1.448 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.405 -9.368 0.112 1.00 0.77 H new ATOM 0 HD13 LEU A 90 4.917 -7.656 0.132 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.061 -8.151 1.083 1.00 0.72 H new ATOM 0 HD22 LEU A 90 2.522 -7.049 -0.236 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.322 -8.330 -0.526 1.00 0.72 H new ATOM 1377 N ASP A 91 0.654 -10.199 -1.699 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.795 -10.063 -1.588 1.00 0.43 C ATOM 1379 C ASP A 91 -1.210 -9.683 -0.176 1.00 0.43 C ATOM 1380 O ASP A 91 -0.897 -10.381 0.790 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.512 -11.349 -2.021 1.00 0.63 C ATOM 1382 CG ASP A 91 -1.496 -11.559 -3.524 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -2.336 -10.956 -4.225 1.00 1.67 O ATOM 1384 OD2 ASP A 91 -0.634 -12.317 -4.019 1.00 1.81 O ATOM 0 H ASP A 91 1.097 -10.733 -0.952 1.00 0.35 H new ATOM 0 HA ASP A 91 -1.093 -9.259 -2.261 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -1.040 -12.203 -1.535 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -2.545 -11.317 -1.675 1.00 0.63 H new ATOM 1389 N ILE A 92 -1.906 -8.561 -0.074 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.440 -8.083 1.190 1.00 0.38 C ATOM 1391 C ILE A 92 -3.863 -8.593 1.370 1.00 0.38 C ATOM 1392 O ILE A 92 -4.603 -8.716 0.390 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.438 -6.531 1.240 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.011 -5.996 1.147 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.122 -5.997 2.493 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.067 -6.595 2.161 1.00 0.65 C ATOM 0 H ILE A 92 -2.116 -7.956 -0.868 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.807 -8.458 1.994 1.00 0.38 H new ATOM 0 HB ILE A 92 -3.009 -6.179 0.381 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -0.625 -6.190 0.146 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.030 -4.914 1.277 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.097 -4.907 2.485 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.158 -6.336 2.515 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.601 -6.366 3.377 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.926 -6.165 2.032 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.428 -6.378 3.166 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.017 -7.674 2.018 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.249 -8.937 2.616 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.627 -9.315 2.948 1.00 0.55 C ATOM 1410 C PRO A 93 -6.667 -8.291 2.475 1.00 0.61 C ATOM 1411 O PRO A 93 -6.353 -7.308 1.805 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.611 -9.406 4.475 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.200 -9.735 4.815 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.358 -9.028 3.791 1.00 0.52 C ATOM 0 HA PRO A 93 -5.918 -10.241 2.452 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -5.920 -8.466 4.932 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.295 -10.175 4.834 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -3.952 -9.402 5.823 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -4.031 -10.811 4.785 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -3.048 -8.042 4.137 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.450 -9.586 3.564 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.904 -8.501 2.883 1.00 0.38 N ATOM 1423 CA VAL A 94 -9.027 -7.830 2.281 1.00 0.34 C ATOM 1424 C VAL A 94 -9.691 -6.890 3.285 1.00 0.34 C ATOM 1425 O VAL A 94 -10.623 -7.267 3.966 1.00 0.36 O ATOM 1426 CB VAL A 94 -10.029 -8.904 1.777 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.497 -9.590 0.531 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -10.283 -9.958 2.852 1.00 0.46 C ATOM 0 H VAL A 94 -8.152 -9.140 3.638 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.691 -7.223 1.440 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.964 -8.396 1.542 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.214 -10.339 0.194 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -9.348 -8.851 -0.256 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -8.547 -10.074 0.759 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.988 -10.699 2.475 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -9.344 -10.448 3.110 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -10.698 -9.480 3.739 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.284 -5.631 3.313 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.580 -4.810 4.484 1.00 0.35 C ATOM 1440 C VAL A 95 -10.303 -3.492 4.189 1.00 0.36 C ATOM 1441 O VAL A 95 -9.707 -2.521 3.731 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.273 -4.512 5.248 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.231 -3.902 4.315 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.541 -3.602 6.432 1.00 0.45 C ATOM 0 H VAL A 95 -8.766 -5.165 2.569 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.274 -5.400 5.083 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.875 -5.453 5.629 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.317 -3.699 4.873 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -7.015 -4.599 3.506 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.616 -2.971 3.899 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.607 -3.404 6.957 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -8.965 -2.662 6.080 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.244 -4.085 7.111 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.600 -3.469 4.444 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.331 -2.216 4.553 1.00 0.34 C ATOM 1456 C VAL A 96 -13.539 -2.365 5.471 1.00 0.36 C ATOM 1457 O VAL A 96 -14.555 -2.941 5.084 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.755 -1.646 3.184 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -13.418 -2.703 2.318 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.672 -0.448 3.366 1.00 1.07 C ATOM 0 H VAL A 96 -12.170 -4.304 4.580 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.641 -1.496 4.993 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.852 -1.319 2.668 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.703 -2.264 1.362 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.721 -3.523 2.147 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -14.307 -3.082 2.822 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.961 -0.059 2.390 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.564 -0.752 3.914 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -13.150 0.328 3.926 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.449 -1.877 6.711 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.577 -1.913 7.632 1.00 0.36 C ATOM 1472 C PRO A 97 -15.846 -1.385 6.977 1.00 0.33 C ATOM 1473 O PRO A 97 -15.834 -0.328 6.341 1.00 0.34 O ATOM 1474 CB PRO A 97 -14.133 -1.015 8.780 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.645 -1.099 8.762 1.00 0.48 C ATOM 1476 CD PRO A 97 -12.255 -1.263 7.317 1.00 0.36 C ATOM 0 HA PRO A 97 -14.821 -2.924 7.957 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.475 0.010 8.638 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -14.539 -1.357 9.732 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -12.198 -0.200 9.187 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -12.295 -1.941 9.359 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -12.016 -0.306 6.854 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.376 -1.898 7.207 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.932 -2.143 7.125 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.207 -1.835 6.476 1.00 0.37 C ATOM 1486 C TYR A 98 -18.603 -0.372 6.705 1.00 0.36 C ATOM 1487 O TYR A 98 -19.155 0.274 5.818 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.290 -2.806 7.000 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.706 -2.552 6.510 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -21.428 -1.440 6.930 1.00 0.90 C ATOM 1491 CD2 TYR A 98 -21.332 -3.450 5.657 1.00 1.04 C ATOM 1492 CE1 TYR A 98 -22.722 -1.227 6.505 1.00 1.06 C ATOM 1493 CE2 TYR A 98 -22.630 -3.245 5.231 1.00 1.23 C ATOM 1494 CZ TYR A 98 -23.321 -2.133 5.662 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.616 -1.930 5.249 1.00 1.31 O ATOM 0 H TYR A 98 -16.953 -2.987 7.697 1.00 0.35 H new ATOM 0 HA TYR A 98 -18.106 -1.969 5.399 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -19.006 -3.820 6.720 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -19.291 -2.764 8.089 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -20.967 -0.731 7.601 1.00 0.90 H new ATOM 0 HD2 TYR A 98 -20.795 -4.324 5.320 1.00 1.04 H new ATOM 0 HE1 TYR A 98 -23.263 -0.352 6.833 1.00 1.06 H new ATOM 0 HE2 TYR A 98 -23.101 -3.952 4.564 1.00 1.23 H new ATOM 0 HH TYR A 98 -24.706 -1.023 4.890 1.00 1.31 H new ATOM 1505 N SER A 99 -18.273 0.146 7.882 1.00 0.37 N ATOM 1506 CA SER A 99 -18.636 1.504 8.261 1.00 0.41 C ATOM 1507 C SER A 99 -17.989 2.553 7.350 1.00 0.38 C ATOM 1508 O SER A 99 -18.560 3.618 7.124 1.00 0.39 O ATOM 1509 CB SER A 99 -18.230 1.762 9.713 1.00 0.50 C ATOM 1510 OG SER A 99 -18.785 2.971 10.202 1.00 1.20 O ATOM 0 H SER A 99 -17.749 -0.361 8.596 1.00 0.37 H new ATOM 0 HA SER A 99 -19.717 1.596 8.152 1.00 0.41 H new ATOM 0 HB2 SER A 99 -18.559 0.931 10.337 1.00 0.50 H new ATOM 0 HB3 SER A 99 -17.143 1.804 9.786 1.00 0.50 H new ATOM 0 HG SER A 99 -18.508 3.105 11.132 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.815 2.264 6.811 1.00 0.36 N ATOM 1517 CA ILE A 100 -16.090 3.272 6.047 1.00 0.37 C ATOM 1518 C ILE A 100 -16.700 3.437 4.656 1.00 0.34 C ATOM 1519 O ILE A 100 -17.042 4.551 4.252 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.593 2.948 5.912 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -14.046 2.308 7.195 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.830 4.225 5.595 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -14.231 3.152 8.438 1.00 0.51 C ATOM 0 H ILE A 100 -16.350 1.359 6.884 1.00 0.36 H new ATOM 0 HA ILE A 100 -16.180 4.205 6.604 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.462 2.231 5.102 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.537 1.347 7.346 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.983 2.106 7.062 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.768 4.000 5.498 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.198 4.646 4.659 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.976 4.946 6.400 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.817 2.627 9.299 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.716 4.104 8.311 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -15.294 3.333 8.600 1.00 0.51 H new ATOM 1535 N LEU A 101 -16.817 2.324 3.928 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.574 2.292 2.666 1.00 0.34 C ATOM 1537 C LEU A 101 -18.988 2.818 2.878 1.00 0.34 C ATOM 1538 O LEU A 101 -19.606 3.372 1.976 1.00 0.36 O ATOM 1539 CB LEU A 101 -17.622 0.880 2.076 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.325 0.391 1.426 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -16.514 -0.993 0.851 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -15.867 1.341 0.334 1.00 1.00 C ATOM 0 H LEU A 101 -16.398 1.431 4.188 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.057 2.937 1.956 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -17.895 0.183 2.869 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.417 0.843 1.331 1.00 0.35 H new ATOM 0 HG LEU A 101 -15.557 0.358 2.199 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -15.583 -1.327 0.392 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -16.794 -1.683 1.647 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.302 -0.970 0.098 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -14.944 0.968 -0.109 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -16.637 1.410 -0.435 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -15.691 2.328 0.761 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.448 2.667 4.102 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.774 3.119 4.479 1.00 0.36 C ATOM 1556 C PHE A 102 -20.827 4.645 4.369 1.00 0.35 C ATOM 1557 O PHE A 102 -21.789 5.212 3.856 1.00 0.36 O ATOM 1558 CB PHE A 102 -21.127 2.651 5.893 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.556 2.887 6.279 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.549 2.024 5.857 1.00 0.74 C ATOM 1561 CD2 PHE A 102 -22.905 3.978 7.055 1.00 0.80 C ATOM 1562 CE1 PHE A 102 -24.867 2.241 6.203 1.00 0.90 C ATOM 1563 CE2 PHE A 102 -24.221 4.203 7.403 1.00 0.96 C ATOM 1564 CZ PHE A 102 -25.198 3.310 7.014 1.00 0.94 C ATOM 0 H PHE A 102 -18.920 2.232 4.859 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.513 2.687 3.805 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -20.911 1.586 5.976 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.480 3.163 6.605 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -23.291 1.170 5.249 1.00 0.74 H new ATOM 0 HD2 PHE A 102 -22.139 4.661 7.392 1.00 0.80 H new ATOM 0 HE1 PHE A 102 -25.638 1.577 5.841 1.00 0.90 H new ATOM 0 HE2 PHE A 102 -24.486 5.077 7.979 1.00 0.96 H new ATOM 0 HZ PHE A 102 -26.218 3.446 7.342 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.757 5.299 4.812 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.672 6.756 4.768 1.00 0.38 C ATOM 1576 C ASN A 103 -19.431 7.280 3.351 1.00 0.36 C ATOM 1577 O ASN A 103 -20.223 8.064 2.836 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.545 7.240 5.679 1.00 0.43 C ATOM 1579 CG ASN A 103 -18.937 7.292 7.147 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -19.391 8.321 7.640 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -18.768 6.186 7.855 1.00 0.49 N ATOM 0 H ASN A 103 -18.935 4.842 5.206 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.631 7.144 5.112 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.685 6.580 5.563 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -18.230 8.233 5.359 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -19.018 6.170 8.844 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.388 5.350 7.412 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.341 6.842 2.719 1.00 0.36 N ATOM 1589 CA LEU A 104 -18.006 7.284 1.360 1.00 0.39 C ATOM 1590 C LEU A 104 -19.120 7.006 0.341 1.00 0.37 C ATOM 1591 O LEU A 104 -19.488 7.892 -0.419 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.715 6.619 0.903 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.773 5.100 0.814 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -16.896 4.648 -0.633 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.557 4.499 1.473 1.00 0.65 C ATOM 0 H LEU A 104 -17.675 6.183 3.123 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.881 8.366 1.405 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.446 7.016 -0.076 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.917 6.898 1.591 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.659 4.750 1.343 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -16.936 3.559 -0.672 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -17.807 5.060 -1.067 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -16.033 5.000 -1.199 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.606 3.412 1.405 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.658 4.854 0.970 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.527 4.796 2.521 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.639 5.780 0.306 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.706 5.424 -0.638 1.00 0.38 C ATOM 1609 C ALA A 105 -21.959 6.224 -0.335 1.00 0.37 C ATOM 1610 O ALA A 105 -22.791 6.469 -1.194 1.00 0.39 O ATOM 1611 CB ALA A 105 -21.003 3.936 -0.595 1.00 0.43 C ATOM 0 H ALA A 105 -19.343 5.018 0.915 1.00 0.35 H new ATOM 0 HA ALA A 105 -20.365 5.667 -1.644 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -21.797 3.703 -1.304 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -20.105 3.378 -0.859 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -21.321 3.657 0.410 1.00 0.43 H new ATOM 1617 N ARG A 106 -22.064 6.623 0.903 1.00 0.36 N ATOM 1618 CA ARG A 106 -23.140 7.496 1.314 1.00 0.40 C ATOM 1619 C ARG A 106 -22.954 8.891 0.720 1.00 0.38 C ATOM 1620 O ARG A 106 -23.861 9.423 0.097 1.00 0.40 O ATOM 1621 CB ARG A 106 -23.237 7.563 2.824 1.00 0.48 C ATOM 1622 CG ARG A 106 -24.024 8.751 3.337 1.00 0.53 C ATOM 1623 CD ARG A 106 -24.207 8.658 4.838 1.00 0.73 C ATOM 1624 NE ARG A 106 -23.110 7.913 5.451 1.00 0.91 N ATOM 1625 CZ ARG A 106 -23.026 7.632 6.743 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -23.959 8.059 7.585 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -22.008 6.907 7.187 1.00 1.81 N ATOM 0 H ARG A 106 -21.419 6.360 1.648 1.00 0.36 H new ATOM 0 HA ARG A 106 -24.076 7.084 0.936 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.701 6.647 3.189 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -22.231 7.599 3.242 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.504 9.675 3.085 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -24.997 8.789 2.848 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -24.255 9.660 5.265 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -25.155 8.169 5.063 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.358 7.587 4.843 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -24.747 8.607 7.238 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -23.888 7.839 8.579 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -21.299 6.571 6.536 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -21.934 6.685 8.180 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.767 9.464 0.887 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.521 10.840 0.448 1.00 0.41 C ATOM 1643 C ASP A 107 -21.211 10.916 -1.050 1.00 0.38 C ATOM 1644 O ASP A 107 -21.890 11.605 -1.822 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.343 11.413 1.242 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.086 12.878 0.951 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -19.437 13.178 -0.072 1.00 0.68 O ATOM 1648 OD2 ASP A 107 -20.556 13.735 1.725 1.00 0.80 O ATOM 0 H ASP A 107 -20.965 9.005 1.319 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.426 11.420 0.628 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.536 11.289 2.308 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.445 10.840 1.012 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.222 10.165 -1.485 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.822 10.213 -2.874 1.00 0.33 C ATOM 1655 C VAL A 108 -20.699 9.282 -3.700 1.00 0.32 C ATOM 1656 O VAL A 108 -20.885 9.494 -4.888 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.335 9.849 -3.074 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.860 10.313 -4.437 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -17.458 10.447 -1.983 1.00 0.88 C ATOM 0 H VAL A 108 -19.686 9.521 -0.904 1.00 0.34 H new ATOM 0 HA VAL A 108 -19.951 11.242 -3.211 1.00 0.33 H new ATOM 0 HB VAL A 108 -18.249 8.764 -3.013 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.810 10.050 -4.565 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -18.453 9.829 -5.213 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -17.975 11.394 -4.514 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -16.419 10.169 -2.158 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -17.550 11.533 -1.997 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -17.776 10.068 -1.012 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.217 8.232 -3.064 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.203 7.388 -3.722 1.00 0.30 C ATOM 1671 C GLY A 109 -23.540 8.080 -3.827 1.00 0.33 C ATOM 1672 O GLY A 109 -24.403 7.684 -4.610 1.00 0.38 O ATOM 0 H GLY A 109 -20.974 7.952 -2.114 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.850 7.123 -4.719 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.316 6.457 -3.166 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.699 9.094 -2.991 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.787 10.041 -3.159 1.00 0.46 C ATOM 1678 C VAL A 110 -24.727 10.530 -4.604 1.00 0.47 C ATOM 1679 O VAL A 110 -25.747 10.627 -5.291 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.721 11.220 -2.155 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.638 12.574 -2.845 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.918 11.183 -1.219 1.00 0.78 C ATOM 0 H VAL A 110 -23.091 9.281 -2.193 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.738 9.551 -2.950 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.803 11.096 -1.581 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.594 13.363 -2.094 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.742 12.612 -3.464 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.518 12.718 -3.471 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.859 12.017 -0.519 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.837 11.262 -1.800 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.918 10.244 -0.665 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.512 10.849 -5.053 1.00 0.45 N ATOM 1693 CA ASP A 111 -23.247 10.950 -6.494 1.00 0.52 C ATOM 1694 C ASP A 111 -23.294 9.561 -7.134 1.00 0.59 C ATOM 1695 O ASP A 111 -24.349 9.130 -7.605 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.892 11.613 -6.786 1.00 0.60 C ATOM 1697 CG ASP A 111 -21.895 13.106 -6.531 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -21.682 13.519 -5.373 1.00 1.87 O ATOM 1699 OD2 ASP A 111 -22.096 13.879 -7.489 1.00 1.86 O ATOM 0 H ASP A 111 -22.708 11.039 -4.455 1.00 0.45 H new ATOM 0 HA ASP A 111 -24.024 11.581 -6.926 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -21.125 11.146 -6.168 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -21.620 11.428 -7.825 1.00 0.60 H new ATOM 1704 N TRP A 112 -22.140 8.882 -7.153 1.00 0.43 N ATOM 1705 CA TRP A 112 -22.044 7.473 -7.571 1.00 0.45 C ATOM 1706 C TRP A 112 -20.589 6.976 -7.566 1.00 0.42 C ATOM 1707 O TRP A 112 -20.276 5.957 -6.977 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.671 7.239 -8.965 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.945 7.894 -10.104 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -21.743 9.229 -10.317 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -21.332 7.219 -11.196 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -21.017 9.413 -11.470 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -20.758 8.192 -12.029 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -21.208 5.877 -11.537 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -20.067 7.861 -13.191 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -20.528 5.544 -12.692 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -19.961 6.534 -13.507 1.00 1.17 C ATOM 0 H TRP A 112 -21.246 9.291 -6.880 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.611 6.898 -6.839 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.716 6.166 -9.151 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.698 7.603 -8.951 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -22.100 10.021 -9.675 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -20.720 10.313 -11.847 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -21.636 5.109 -10.910 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -19.631 8.623 -13.820 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -20.432 4.505 -12.972 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -19.430 6.243 -14.402 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.717 7.695 -8.239 1.00 0.42 N ATOM 1729 CA ASP A 113 -18.330 7.257 -8.395 1.00 0.42 C ATOM 1730 C ASP A 113 -17.440 7.893 -7.321 1.00 0.40 C ATOM 1731 O ASP A 113 -17.468 9.110 -7.139 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.843 7.639 -9.798 1.00 0.51 C ATOM 1733 CG ASP A 113 -16.458 7.119 -10.135 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -15.468 7.726 -9.671 1.00 1.61 O ATOM 1735 OD2 ASP A 113 -16.354 6.081 -10.823 1.00 2.15 O ATOM 0 H ASP A 113 -19.934 8.584 -8.689 1.00 0.42 H new ATOM 0 HA ASP A 113 -18.274 6.175 -8.274 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -18.552 7.258 -10.533 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -17.844 8.725 -9.888 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.641 7.077 -6.624 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.880 7.546 -5.458 1.00 0.32 C ATOM 1742 C ILE A 114 -14.382 7.411 -5.711 1.00 0.32 C ATOM 1743 O ILE A 114 -13.955 6.634 -6.559 1.00 0.33 O ATOM 1744 CB ILE A 114 -16.233 6.770 -4.143 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.740 6.610 -3.973 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.647 7.459 -2.923 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -18.289 5.425 -4.724 1.00 0.38 C ATOM 0 H ILE A 114 -16.504 6.091 -6.846 1.00 0.32 H new ATOM 0 HA ILE A 114 -16.157 8.591 -5.319 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.790 5.778 -4.232 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.972 6.502 -2.913 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -18.238 7.516 -4.318 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.909 6.897 -2.027 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.562 7.506 -3.018 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -16.049 8.470 -2.848 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.366 5.361 -4.566 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -18.085 5.542 -5.788 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.814 4.513 -4.362 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.590 8.160 -4.965 1.00 0.35 N ATOM 1760 CA ASP A 115 -12.145 8.092 -5.069 1.00 0.38 C ATOM 1761 C ASP A 115 -11.576 7.295 -3.902 1.00 0.34 C ATOM 1762 O ASP A 115 -12.208 7.186 -2.853 1.00 0.31 O ATOM 1763 CB ASP A 115 -11.529 9.495 -5.130 1.00 0.46 C ATOM 1764 CG ASP A 115 -11.904 10.390 -3.971 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -13.101 10.730 -3.850 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -11.013 10.718 -3.154 1.00 1.36 O ATOM 0 H ASP A 115 -13.929 8.829 -4.274 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.888 7.582 -5.997 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -10.444 9.401 -5.165 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -11.838 9.975 -6.059 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.416 6.686 -4.109 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.754 5.899 -3.075 1.00 0.37 C ATOM 1773 C TYR A 116 -8.252 6.166 -3.137 1.00 0.40 C ATOM 1774 O TYR A 116 -7.766 6.715 -4.123 1.00 0.62 O ATOM 1775 CB TYR A 116 -9.994 4.390 -3.261 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.437 3.945 -3.164 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.337 4.190 -4.196 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.897 3.267 -2.043 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.650 3.776 -4.109 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -13.210 2.849 -1.950 1.00 0.42 C ATOM 1781 CZ TYR A 116 -14.082 3.107 -2.983 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.390 2.693 -2.893 1.00 0.45 O ATOM 0 H TYR A 116 -9.909 6.723 -4.993 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.168 6.193 -2.111 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.605 4.095 -4.236 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.414 3.852 -2.511 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -12.002 4.713 -5.080 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -11.216 3.063 -1.230 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.336 3.975 -4.919 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.551 2.322 -1.071 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.439 1.882 -2.345 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.524 5.766 -2.099 1.00 0.27 N ATOM 1793 CA GLU A 117 -6.072 5.892 -2.078 1.00 0.28 C ATOM 1794 C GLU A 117 -5.477 4.880 -1.117 1.00 0.28 C ATOM 1795 O GLU A 117 -5.942 4.736 0.015 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.631 7.299 -1.659 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.114 7.496 -1.675 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.689 8.806 -1.052 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.071 9.066 0.107 1.00 0.80 O ATOM 1800 OE2 GLU A 117 -2.975 9.581 -1.722 1.00 0.66 O ATOM 0 H GLU A 117 -7.920 5.349 -1.256 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.713 5.706 -3.090 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.091 8.028 -2.326 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.005 7.504 -0.656 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.639 6.673 -1.140 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.757 7.455 -2.704 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.465 4.176 -1.577 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.703 3.288 -0.729 1.00 0.28 C ATOM 1809 C LEU A 118 -2.377 3.945 -0.390 1.00 0.28 C ATOM 1810 O LEU A 118 -1.625 4.347 -1.277 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.532 1.922 -1.427 1.00 0.35 C ATOM 1812 CG LEU A 118 -2.438 0.966 -0.904 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -1.085 1.286 -1.516 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -2.357 0.999 0.616 1.00 1.25 C ATOM 0 H LEU A 118 -4.149 4.204 -2.546 1.00 0.29 H new ATOM 0 HA LEU A 118 -4.228 3.102 0.208 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -4.486 1.398 -1.371 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -3.333 2.110 -2.482 1.00 0.35 H new ATOM 0 HG LEU A 118 -2.717 -0.043 -1.208 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -0.337 0.595 -1.127 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -1.143 1.186 -2.600 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -0.803 2.307 -1.261 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -1.578 0.316 0.954 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.120 2.011 0.946 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -3.315 0.694 1.038 1.00 1.25 H new ATOM 1826 N GLN A 119 -2.117 4.075 0.893 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.875 4.643 1.364 1.00 0.27 C ATOM 1828 C GLN A 119 -0.029 3.534 1.960 1.00 0.26 C ATOM 1829 O GLN A 119 -0.243 3.128 3.096 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.146 5.712 2.425 1.00 0.30 C ATOM 1831 CG GLN A 119 0.017 6.655 2.637 1.00 0.37 C ATOM 1832 CD GLN A 119 0.217 7.540 1.436 1.00 0.46 C ATOM 1833 OE1 GLN A 119 0.851 6.988 0.429 1.00 0.63 O flip ATOM 1834 NE2 GLN A 119 -0.242 8.678 1.392 1.00 0.51 N flip ATOM 0 H GLN A 119 -2.757 3.791 1.634 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.350 5.110 0.531 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -2.024 6.289 2.133 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.385 5.224 3.370 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.163 7.268 3.520 1.00 0.37 H new ATOM 0 HG3 GLN A 119 0.925 6.082 2.827 1.00 0.37 H new ATOM 0 HE21 GLN A 119 -0.728 9.064 2.202 1.00 0.51 H new ATOM 0 HE22 GLN A 119 -0.138 9.238 0.546 1.00 0.51 H new ATOM 1843 N ILE A 120 0.917 3.037 1.197 1.00 0.26 N ATOM 1844 CA ILE A 120 1.702 1.903 1.640 1.00 0.26 C ATOM 1845 C ILE A 120 3.114 2.338 2.028 1.00 0.23 C ATOM 1846 O ILE A 120 3.846 2.921 1.227 1.00 0.24 O ATOM 1847 CB ILE A 120 1.727 0.784 0.565 1.00 0.31 C ATOM 1848 CG1 ILE A 120 2.460 -0.456 1.071 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.338 1.267 -0.734 1.00 0.36 C ATOM 1850 CD1 ILE A 120 1.622 -1.308 1.995 1.00 0.81 C ATOM 0 H ILE A 120 1.162 3.395 0.274 1.00 0.26 H new ATOM 0 HA ILE A 120 1.226 1.489 2.529 1.00 0.26 H new ATOM 0 HB ILE A 120 0.690 0.512 0.366 1.00 0.31 H new ATOM 0 HG12 ILE A 120 2.774 -1.058 0.218 1.00 0.45 H new ATOM 0 HG13 ILE A 120 3.365 -0.147 1.594 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.337 0.455 -1.461 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.754 2.102 -1.122 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.363 1.593 -0.555 1.00 0.36 H new ATOM 0 HD11 ILE A 120 2.202 -2.173 2.318 1.00 0.81 H new ATOM 0 HD12 ILE A 120 1.329 -0.721 2.866 1.00 0.81 H new ATOM 0 HD13 ILE A 120 0.729 -1.646 1.469 1.00 0.81 H new ATOM 1862 N GLY A 121 3.464 2.111 3.286 1.00 0.23 N ATOM 1863 CA GLY A 121 4.801 2.381 3.751 1.00 0.23 C ATOM 1864 C GLY A 121 5.698 1.192 3.526 1.00 0.22 C ATOM 1865 O GLY A 121 5.369 0.075 3.928 1.00 0.26 O ATOM 0 H GLY A 121 2.834 1.740 3.997 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.203 3.249 3.229 1.00 0.23 H new ATOM 0 HA3 GLY A 121 4.778 2.629 4.812 1.00 0.23 H new ATOM 1869 N LEU A 122 6.816 1.429 2.874 1.00 0.23 N ATOM 1870 CA LEU A 122 7.730 0.371 2.485 1.00 0.25 C ATOM 1871 C LEU A 122 8.877 0.249 3.461 1.00 0.23 C ATOM 1872 O LEU A 122 9.789 1.069 3.459 1.00 0.30 O ATOM 1873 CB LEU A 122 8.298 0.666 1.104 1.00 0.30 C ATOM 1874 CG LEU A 122 7.480 0.194 -0.097 1.00 0.45 C ATOM 1875 CD1 LEU A 122 5.995 0.132 0.201 1.00 1.20 C ATOM 1876 CD2 LEU A 122 7.726 1.127 -1.262 1.00 1.00 C ATOM 0 H LEU A 122 7.120 2.363 2.597 1.00 0.23 H new ATOM 0 HA LEU A 122 7.171 -0.565 2.478 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.436 1.744 1.018 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.287 0.212 1.040 1.00 0.30 H new ATOM 0 HG LEU A 122 7.802 -0.818 -0.340 1.00 0.45 H new ATOM 0 HD11 LEU A 122 5.460 -0.209 -0.685 1.00 1.20 H new ATOM 0 HD12 LEU A 122 5.817 -0.563 1.022 1.00 1.20 H new ATOM 0 HD13 LEU A 122 5.638 1.123 0.481 1.00 1.20 H new ATOM 0 HD21 LEU A 122 7.145 0.796 -2.123 1.00 1.00 H new ATOM 0 HD22 LEU A 122 7.425 2.138 -0.988 1.00 1.00 H new ATOM 0 HD23 LEU A 122 8.786 1.121 -1.516 1.00 1.00 H new ATOM 1888 N THR A 123 8.821 -0.765 4.292 1.00 0.22 N ATOM 1889 CA THR A 123 9.931 -1.089 5.161 1.00 0.21 C ATOM 1890 C THR A 123 10.577 -2.380 4.700 1.00 0.23 C ATOM 1891 O THR A 123 10.131 -3.457 5.049 1.00 0.32 O ATOM 1892 CB THR A 123 9.470 -1.264 6.616 1.00 0.24 C ATOM 1893 OG1 THR A 123 8.780 -0.088 7.063 1.00 0.26 O ATOM 1894 CG2 THR A 123 10.646 -1.553 7.538 1.00 0.26 C ATOM 0 H THR A 123 8.015 -1.383 4.386 1.00 0.22 H new ATOM 0 HA THR A 123 10.643 -0.265 5.114 1.00 0.21 H new ATOM 0 HB THR A 123 8.792 -2.116 6.650 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.036 -0.347 7.645 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.286 -1.672 8.560 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.142 -2.470 7.219 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.353 -0.725 7.496 1.00 0.26 H new ATOM 1902 N ILE A 124 11.614 -2.282 3.909 1.00 0.20 N ATOM 1903 CA ILE A 124 12.279 -3.476 3.426 1.00 0.21 C ATOM 1904 C ILE A 124 13.671 -3.577 4.016 1.00 0.24 C ATOM 1905 O ILE A 124 14.441 -2.616 3.969 1.00 0.32 O ATOM 1906 CB ILE A 124 12.326 -3.518 1.885 1.00 0.23 C ATOM 1907 CG1 ILE A 124 12.837 -2.191 1.314 1.00 0.25 C ATOM 1908 CG2 ILE A 124 10.943 -3.846 1.338 1.00 0.25 C ATOM 1909 CD1 ILE A 124 12.886 -2.162 -0.200 1.00 0.98 C ATOM 0 H ILE A 124 12.016 -1.402 3.586 1.00 0.20 H new ATOM 0 HA ILE A 124 11.699 -4.339 3.753 1.00 0.21 H new ATOM 0 HB ILE A 124 13.022 -4.298 1.577 1.00 0.23 H new ATOM 0 HG12 ILE A 124 12.195 -1.383 1.664 1.00 0.25 H new ATOM 0 HG13 ILE A 124 13.836 -1.997 1.705 1.00 0.25 H new ATOM 0 HG21 ILE A 124 10.980 -3.875 0.249 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.623 -4.817 1.716 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.235 -3.081 1.657 1.00 0.25 H new ATOM 0 HD11 ILE A 124 13.257 -1.193 -0.534 1.00 0.98 H new ATOM 0 HD12 ILE A 124 13.551 -2.948 -0.558 1.00 0.98 H new ATOM 0 HD13 ILE A 124 11.885 -2.324 -0.600 1.00 0.98 H new ATOM 1921 N ASP A 125 13.985 -4.730 4.595 1.00 0.25 N ATOM 1922 CA ASP A 125 15.249 -4.895 5.279 1.00 0.30 C ATOM 1923 C ASP A 125 16.316 -5.203 4.260 1.00 0.30 C ATOM 1924 O ASP A 125 16.371 -6.306 3.716 1.00 0.31 O ATOM 1925 CB ASP A 125 15.174 -6.004 6.332 1.00 0.37 C ATOM 1926 CG ASP A 125 16.414 -6.061 7.207 1.00 0.91 C ATOM 1927 OD1 ASP A 125 16.525 -5.248 8.150 1.00 1.52 O ATOM 1928 OD2 ASP A 125 17.297 -6.907 6.944 1.00 1.44 O ATOM 0 H ASP A 125 13.384 -5.554 4.602 1.00 0.25 H new ATOM 0 HA ASP A 125 15.493 -3.970 5.802 1.00 0.30 H new ATOM 0 HB2 ASP A 125 14.297 -5.845 6.960 1.00 0.37 H new ATOM 0 HB3 ASP A 125 15.040 -6.964 5.834 1.00 0.37 H new ATOM 1933 N LEU A 126 17.142 -4.203 4.012 1.00 0.32 N ATOM 1934 CA LEU A 126 18.167 -4.254 2.992 1.00 0.33 C ATOM 1935 C LEU A 126 19.529 -4.442 3.649 1.00 0.37 C ATOM 1936 O LEU A 126 19.621 -4.510 4.869 1.00 0.55 O ATOM 1937 CB LEU A 126 18.138 -2.941 2.193 1.00 0.42 C ATOM 1938 CG LEU A 126 16.769 -2.541 1.635 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.801 -1.118 1.108 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.339 -3.492 0.538 1.00 1.28 C ATOM 0 H LEU A 126 17.117 -3.320 4.523 1.00 0.32 H new ATOM 0 HA LEU A 126 17.985 -5.091 2.318 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.499 -2.137 2.835 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.839 -3.025 1.363 1.00 0.42 H new ATOM 0 HG LEU A 126 16.044 -2.596 2.447 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.819 -0.853 0.716 1.00 1.26 H new ATOM 0 HD12 LEU A 126 17.065 -0.436 1.917 1.00 1.26 H new ATOM 0 HD13 LEU A 126 17.542 -1.041 0.312 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.364 -3.190 0.156 1.00 1.28 H new ATOM 0 HD22 LEU A 126 17.069 -3.468 -0.271 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.274 -4.504 0.938 1.00 1.28 H new ATOM 1952 N PRO A 127 20.605 -4.588 2.869 1.00 0.43 N ATOM 1953 CA PRO A 127 21.959 -4.615 3.422 1.00 0.52 C ATOM 1954 C PRO A 127 22.477 -3.226 3.822 1.00 0.60 C ATOM 1955 O PRO A 127 23.071 -3.065 4.889 1.00 0.74 O ATOM 1956 CB PRO A 127 22.810 -5.189 2.278 1.00 0.60 C ATOM 1957 CG PRO A 127 21.840 -5.676 1.252 1.00 0.73 C ATOM 1958 CD PRO A 127 20.602 -4.847 1.423 1.00 0.55 C ATOM 0 HA PRO A 127 21.996 -5.201 4.340 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.470 -4.428 1.862 1.00 0.60 H new ATOM 0 HB3 PRO A 127 23.444 -6.001 2.633 1.00 0.60 H new ATOM 0 HG2 PRO A 127 22.247 -5.565 0.247 1.00 0.73 H new ATOM 0 HG3 PRO A 127 21.623 -6.735 1.393 1.00 0.73 H new ATOM 0 HD2 PRO A 127 20.645 -3.925 0.843 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.706 -5.381 1.106 1.00 0.55 H new ATOM 1966 N VAL A 128 22.213 -2.224 2.978 1.00 0.60 N ATOM 1967 CA VAL A 128 22.856 -0.907 3.097 1.00 0.72 C ATOM 1968 C VAL A 128 22.581 -0.224 4.441 1.00 0.71 C ATOM 1969 O VAL A 128 23.508 0.081 5.188 1.00 0.82 O ATOM 1970 CB VAL A 128 22.403 0.028 1.952 1.00 0.83 C ATOM 1971 CG1 VAL A 128 23.082 1.386 2.053 1.00 1.12 C ATOM 1972 CG2 VAL A 128 22.683 -0.613 0.601 1.00 1.02 C ATOM 0 H VAL A 128 21.556 -2.298 2.201 1.00 0.60 H new ATOM 0 HA VAL A 128 23.929 -1.089 3.032 1.00 0.72 H new ATOM 0 HB VAL A 128 21.328 0.184 2.046 1.00 0.83 H new ATOM 0 HG11 VAL A 128 22.745 2.023 1.235 1.00 1.12 H new ATOM 0 HG12 VAL A 128 22.826 1.851 3.005 1.00 1.12 H new ATOM 0 HG13 VAL A 128 24.163 1.258 1.991 1.00 1.12 H new ATOM 0 HG21 VAL A 128 22.358 0.058 -0.194 1.00 1.02 H new ATOM 0 HG22 VAL A 128 23.752 -0.802 0.502 1.00 1.02 H new ATOM 0 HG23 VAL A 128 22.140 -1.555 0.526 1.00 1.02 H new ATOM 1982 N VAL A 129 21.311 0.003 4.749 1.00 0.62 N ATOM 1983 CA VAL A 129 20.925 0.638 6.015 1.00 0.63 C ATOM 1984 C VAL A 129 20.257 -0.398 6.887 1.00 0.55 C ATOM 1985 O VAL A 129 19.979 -0.198 8.068 1.00 0.55 O ATOM 1986 CB VAL A 129 19.919 1.782 5.793 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.922 2.747 6.970 1.00 1.35 C ATOM 1988 CG2 VAL A 129 20.208 2.500 4.495 1.00 1.26 C ATOM 0 H VAL A 129 20.527 -0.241 4.144 1.00 0.62 H new ATOM 0 HA VAL A 129 21.824 1.044 6.478 1.00 0.63 H new ATOM 0 HB VAL A 129 18.921 1.350 5.724 1.00 0.69 H new ATOM 0 HG11 VAL A 129 19.203 3.545 6.788 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.648 2.212 7.879 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.918 3.175 7.087 1.00 1.35 H new ATOM 0 HG21 VAL A 129 19.486 3.305 4.356 1.00 1.26 H new ATOM 0 HG22 VAL A 129 21.215 2.917 4.526 1.00 1.26 H new ATOM 0 HG23 VAL A 129 20.132 1.797 3.665 1.00 1.26 H new ATOM 1998 N GLY A 130 20.033 -1.513 6.251 1.00 0.53 N ATOM 1999 CA GLY A 130 19.142 -2.498 6.770 1.00 0.55 C ATOM 2000 C GLY A 130 17.767 -2.185 6.280 1.00 0.58 C ATOM 2001 O GLY A 130 17.602 -1.735 5.143 1.00 1.05 O ATOM 0 H GLY A 130 20.464 -1.760 5.360 1.00 0.53 H new ATOM 0 HA2 GLY A 130 19.444 -3.494 6.445 1.00 0.55 H new ATOM 0 HA3 GLY A 130 19.167 -2.497 7.860 1.00 0.55 H new ATOM 2005 N GLU A 131 16.791 -2.409 7.109 1.00 0.49 N ATOM 2006 CA GLU A 131 15.436 -2.030 6.782 1.00 0.46 C ATOM 2007 C GLU A 131 15.352 -0.518 6.570 1.00 0.49 C ATOM 2008 O GLU A 131 15.842 0.269 7.386 1.00 0.75 O ATOM 2009 CB GLU A 131 14.474 -2.472 7.883 1.00 0.59 C ATOM 2010 CG GLU A 131 14.549 -1.627 9.143 1.00 0.73 C ATOM 2011 CD GLU A 131 13.644 -2.134 10.239 1.00 0.93 C ATOM 2012 OE1 GLU A 131 14.012 -3.117 10.911 1.00 1.01 O ATOM 2013 OE2 GLU A 131 12.553 -1.556 10.432 1.00 1.16 O ATOM 0 H GLU A 131 16.902 -2.853 8.021 1.00 0.49 H new ATOM 0 HA GLU A 131 15.146 -2.530 5.858 1.00 0.46 H new ATOM 0 HB2 GLU A 131 13.455 -2.440 7.496 1.00 0.59 H new ATOM 0 HB3 GLU A 131 14.685 -3.510 8.141 1.00 0.59 H new ATOM 0 HG2 GLU A 131 15.577 -1.612 9.505 1.00 0.73 H new ATOM 0 HG3 GLU A 131 14.280 -0.598 8.902 1.00 0.73 H new ATOM 2020 N PHE A 132 14.779 -0.112 5.457 1.00 0.39 N ATOM 2021 CA PHE A 132 14.554 1.296 5.211 1.00 0.48 C ATOM 2022 C PHE A 132 13.076 1.515 4.931 1.00 0.35 C ATOM 2023 O PHE A 132 12.428 0.655 4.335 1.00 0.33 O ATOM 2024 CB PHE A 132 15.406 1.798 4.040 1.00 0.69 C ATOM 2025 CG PHE A 132 15.622 3.287 4.064 1.00 1.02 C ATOM 2026 CD1 PHE A 132 16.600 3.838 4.876 1.00 1.22 C ATOM 2027 CD2 PHE A 132 14.850 4.131 3.283 1.00 1.31 C ATOM 2028 CE1 PHE A 132 16.804 5.204 4.908 1.00 1.66 C ATOM 2029 CE2 PHE A 132 15.050 5.499 3.310 1.00 1.74 C ATOM 2030 CZ PHE A 132 16.029 6.036 4.124 1.00 1.91 C ATOM 0 H PHE A 132 14.462 -0.733 4.712 1.00 0.39 H new ATOM 0 HA PHE A 132 14.850 1.864 6.093 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.373 1.296 4.061 1.00 0.69 H new ATOM 0 HB3 PHE A 132 14.923 1.522 3.102 1.00 0.69 H new ATOM 0 HD1 PHE A 132 17.210 3.192 5.491 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.083 3.716 2.646 1.00 1.31 H new ATOM 0 HE1 PHE A 132 17.569 5.621 5.546 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.442 6.147 2.696 1.00 1.74 H new ATOM 0 HZ PHE A 132 16.188 7.104 4.147 1.00 1.91 H new ATOM 2040 N THR A 133 12.547 2.649 5.363 1.00 0.37 N ATOM 2041 CA THR A 133 11.114 2.892 5.268 1.00 0.32 C ATOM 2042 C THR A 133 10.798 4.146 4.456 1.00 0.31 C ATOM 2043 O THR A 133 11.072 5.264 4.888 1.00 0.36 O ATOM 2044 CB THR A 133 10.477 3.012 6.668 1.00 0.44 C ATOM 2045 OG1 THR A 133 10.754 1.832 7.435 1.00 1.19 O ATOM 2046 CG2 THR A 133 8.971 3.212 6.568 1.00 1.17 C ATOM 0 H THR A 133 13.082 3.411 5.780 1.00 0.37 H new ATOM 0 HA THR A 133 10.687 2.033 4.751 1.00 0.32 H new ATOM 0 HB THR A 133 10.910 3.881 7.163 1.00 0.44 H new ATOM 0 HG1 THR A 133 10.036 1.178 7.301 1.00 1.19 H new ATOM 0 HG21 THR A 133 8.548 3.293 7.569 1.00 1.17 H new ATOM 0 HG22 THR A 133 8.761 4.125 6.010 1.00 1.17 H new ATOM 0 HG23 THR A 133 8.524 2.361 6.053 1.00 1.17 H new ATOM 2054 N ILE A 134 10.248 3.944 3.267 1.00 0.28 N ATOM 2055 CA ILE A 134 9.728 5.039 2.457 1.00 0.31 C ATOM 2056 C ILE A 134 8.294 4.722 2.056 1.00 0.28 C ATOM 2057 O ILE A 134 7.960 3.566 1.835 1.00 0.26 O ATOM 2058 CB ILE A 134 10.580 5.289 1.187 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.580 4.058 0.276 1.00 0.41 C ATOM 2060 CG2 ILE A 134 12.002 5.682 1.559 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.640 4.185 -0.905 1.00 0.50 C ATOM 0 H ILE A 134 10.149 3.024 2.838 1.00 0.28 H new ATOM 0 HA ILE A 134 9.768 5.948 3.058 1.00 0.31 H new ATOM 0 HB ILE A 134 10.130 6.116 0.638 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.592 3.887 -0.091 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.300 3.182 0.861 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.582 5.852 0.652 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.983 6.595 2.154 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.461 4.881 2.138 1.00 0.41 H new ATOM 0 HD11 ILE A 134 9.690 3.279 -1.509 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.621 4.326 -0.545 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.932 5.042 -1.512 1.00 0.50 H new ATOM 2073 N PRO A 135 7.412 5.717 1.984 1.00 0.30 N ATOM 2074 CA PRO A 135 6.032 5.491 1.595 1.00 0.29 C ATOM 2075 C PRO A 135 5.785 5.684 0.098 1.00 0.28 C ATOM 2076 O PRO A 135 6.587 6.295 -0.610 1.00 0.31 O ATOM 2077 CB PRO A 135 5.296 6.554 2.402 1.00 0.35 C ATOM 2078 CG PRO A 135 6.266 7.693 2.525 1.00 0.45 C ATOM 2079 CD PRO A 135 7.657 7.129 2.310 1.00 0.39 C ATOM 0 HA PRO A 135 5.712 4.467 1.785 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.381 6.868 1.899 1.00 0.35 H new ATOM 0 HB3 PRO A 135 5.007 6.175 3.382 1.00 0.35 H new ATOM 0 HG2 PRO A 135 6.047 8.465 1.788 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.188 8.159 3.507 1.00 0.45 H new ATOM 0 HD2 PRO A 135 8.177 7.643 1.501 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.274 7.233 3.203 1.00 0.39 H new ATOM 2087 N ILE A 136 4.663 5.150 -0.364 1.00 0.26 N ATOM 2088 CA ILE A 136 4.223 5.309 -1.737 1.00 0.27 C ATOM 2089 C ILE A 136 2.705 5.090 -1.775 1.00 0.26 C ATOM 2090 O ILE A 136 2.123 4.617 -0.794 1.00 0.26 O ATOM 2091 CB ILE A 136 4.985 4.352 -2.705 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.679 4.687 -4.181 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.676 2.896 -2.394 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.724 3.733 -4.870 1.00 0.32 C ATOM 0 H ILE A 136 4.031 4.591 0.209 1.00 0.26 H new ATOM 0 HA ILE A 136 4.453 6.315 -2.087 1.00 0.27 H new ATOM 0 HB ILE A 136 6.053 4.505 -2.548 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.262 5.693 -4.231 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.617 4.703 -4.736 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.221 2.253 -3.085 1.00 0.33 H new ATOM 0 HG22 ILE A 136 4.979 2.670 -1.372 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.606 2.720 -2.502 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.572 4.052 -5.901 1.00 0.32 H new ATOM 0 HD12 ILE A 136 4.144 2.727 -4.859 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.768 3.733 -4.346 1.00 0.32 H new ATOM 2106 N SER A 137 2.066 5.440 -2.873 1.00 0.28 N ATOM 2107 CA SER A 137 0.617 5.476 -2.909 1.00 0.30 C ATOM 2108 C SER A 137 0.081 4.788 -4.148 1.00 0.30 C ATOM 2109 O SER A 137 0.721 4.799 -5.199 1.00 0.32 O ATOM 2110 CB SER A 137 0.128 6.924 -2.887 1.00 0.34 C ATOM 2111 OG SER A 137 1.014 7.766 -2.162 1.00 0.88 O ATOM 0 H SER A 137 2.523 5.702 -3.747 1.00 0.28 H new ATOM 0 HA SER A 137 0.249 4.947 -2.030 1.00 0.30 H new ATOM 0 HB2 SER A 137 0.031 7.291 -3.909 1.00 0.34 H new ATOM 0 HB3 SER A 137 -0.864 6.966 -2.438 1.00 0.34 H new ATOM 0 HG SER A 137 1.064 7.464 -1.231 1.00 0.88 H new ATOM 2117 N SER A 138 -1.092 4.193 -4.029 1.00 0.31 N ATOM 2118 CA SER A 138 -1.776 3.637 -5.170 1.00 0.34 C ATOM 2119 C SER A 138 -3.250 3.986 -5.040 1.00 0.34 C ATOM 2120 O SER A 138 -3.966 3.409 -4.225 1.00 0.35 O ATOM 2121 CB SER A 138 -1.565 2.119 -5.227 1.00 0.40 C ATOM 2122 OG SER A 138 -2.109 1.555 -6.409 1.00 0.96 O ATOM 0 H SER A 138 -1.589 4.085 -3.145 1.00 0.31 H new ATOM 0 HA SER A 138 -1.381 4.051 -6.098 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.499 1.898 -5.176 1.00 0.40 H new ATOM 0 HB3 SER A 138 -2.028 1.655 -4.356 1.00 0.40 H new ATOM 0 HG SER A 138 -1.954 0.587 -6.411 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.681 4.969 -5.803 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.010 5.521 -5.642 1.00 0.38 C ATOM 2130 C LYS A 139 -5.765 5.522 -6.955 1.00 0.41 C ATOM 2131 O LYS A 139 -5.157 5.491 -8.026 1.00 0.47 O ATOM 2132 CB LYS A 139 -4.892 6.941 -5.102 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.174 7.898 -6.039 1.00 0.57 C ATOM 2134 CD LYS A 139 -3.591 9.076 -5.283 1.00 0.92 C ATOM 2135 CE LYS A 139 -4.622 9.728 -4.377 1.00 1.35 C ATOM 2136 NZ LYS A 139 -4.076 10.922 -3.682 1.00 1.76 N ATOM 0 H LYS A 139 -3.129 5.403 -6.543 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.569 4.901 -4.941 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -5.891 7.327 -4.900 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.362 6.914 -4.150 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -3.378 7.369 -6.562 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -4.869 8.258 -6.797 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.742 8.742 -4.687 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -3.212 9.812 -5.992 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -5.491 10.018 -4.967 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -4.965 9.004 -3.638 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -4.820 11.644 -3.596 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -3.746 10.651 -2.734 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -3.280 11.308 -4.229 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.084 5.530 -6.877 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.886 5.638 -8.064 1.00 0.50 C ATOM 2152 C GLY A 140 -9.336 5.922 -7.734 1.00 0.46 C ATOM 2153 O GLY A 140 -9.825 5.543 -6.671 1.00 0.47 O ATOM 0 H GLY A 140 -7.612 5.463 -6.007 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.494 6.434 -8.697 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.817 4.713 -8.636 1.00 0.50 H new ATOM 2157 N GLU A 141 -10.004 6.604 -8.639 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.427 6.871 -8.490 1.00 0.42 C ATOM 2159 C GLU A 141 -12.201 5.863 -9.317 1.00 0.43 C ATOM 2160 O GLU A 141 -11.975 5.746 -10.525 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.789 8.291 -8.926 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.859 9.358 -8.375 1.00 0.52 C ATOM 2163 CD GLU A 141 -11.295 10.761 -8.746 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -12.082 11.364 -7.988 1.00 2.10 O ATOM 2165 OE2 GLU A 141 -10.850 11.268 -9.799 1.00 1.51 O ATOM 0 H GLU A 141 -9.588 6.986 -9.488 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.687 6.780 -7.436 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.779 8.340 -10.015 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.808 8.510 -8.607 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -10.815 9.271 -7.289 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -9.850 9.184 -8.750 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.119 5.149 -8.687 1.00 0.42 N ATOM 2173 CA ILE A 142 -13.829 4.064 -9.333 1.00 0.47 C ATOM 2174 C ILE A 142 -15.279 4.103 -8.865 1.00 0.46 C ATOM 2175 O ILE A 142 -15.592 4.786 -7.887 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.187 2.683 -9.029 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -12.929 2.503 -7.528 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -11.891 2.509 -9.808 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -14.015 1.737 -6.804 1.00 0.67 C ATOM 0 H ILE A 142 -13.391 5.306 -7.716 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.774 4.195 -10.414 1.00 0.47 H new ATOM 0 HB ILE A 142 -13.894 1.916 -9.345 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -11.980 1.984 -7.393 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -12.823 3.485 -7.068 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.458 1.535 -9.580 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -12.097 2.574 -10.876 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.189 3.293 -9.526 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -13.758 1.652 -5.748 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -14.963 2.266 -6.906 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -14.107 0.740 -7.236 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.159 3.392 -9.545 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.589 3.521 -9.284 1.00 0.57 C ATOM 2193 C LYS A 143 -17.976 2.992 -7.905 1.00 0.54 C ATOM 2194 O LYS A 143 -17.146 2.470 -7.160 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.403 2.812 -10.367 1.00 0.70 C ATOM 2196 CG LYS A 143 -18.095 1.332 -10.499 1.00 1.44 C ATOM 2197 CD LYS A 143 -18.864 0.705 -11.650 1.00 2.04 C ATOM 2198 CE LYS A 143 -18.509 1.349 -12.986 1.00 2.74 C ATOM 2199 NZ LYS A 143 -17.064 1.204 -13.312 1.00 3.53 N ATOM 0 H LYS A 143 -15.917 2.724 -10.277 1.00 0.53 H new ATOM 0 HA LYS A 143 -17.819 4.586 -9.303 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -19.464 2.934 -10.148 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -18.217 3.299 -11.324 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -17.025 1.194 -10.657 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -18.349 0.822 -9.570 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -18.648 -0.363 -11.692 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -19.934 0.807 -11.470 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -19.106 0.894 -13.777 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -18.769 2.407 -12.958 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -16.898 1.502 -14.295 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -16.502 1.799 -12.670 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -16.781 0.210 -13.199 1.00 3.53 H new ATOM 2213 N LEU A 144 -19.260 3.120 -7.602 1.00 0.60 N ATOM 2214 CA LEU A 144 -19.826 2.706 -6.325 1.00 0.66 C ATOM 2215 C LEU A 144 -19.491 1.244 -6.018 1.00 0.60 C ATOM 2216 O LEU A 144 -19.644 0.369 -6.874 1.00 0.63 O ATOM 2217 CB LEU A 144 -21.345 2.893 -6.397 1.00 0.83 C ATOM 2218 CG LEU A 144 -21.934 4.133 -5.711 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -23.447 4.147 -5.858 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -21.552 4.208 -4.242 1.00 1.23 C ATOM 0 H LEU A 144 -19.946 3.519 -8.243 1.00 0.60 H new ATOM 0 HA LEU A 144 -19.401 3.313 -5.525 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -21.632 2.920 -7.448 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -21.815 2.011 -5.961 1.00 0.83 H new ATOM 0 HG LEU A 144 -21.513 5.009 -6.205 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -23.852 5.032 -5.367 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -23.710 4.167 -6.916 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -23.866 3.252 -5.397 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -21.991 5.101 -3.797 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -21.924 3.324 -3.724 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -20.467 4.252 -4.150 1.00 1.23 H new ATOM 2232 N PRO A 145 -18.997 0.974 -4.798 1.00 0.61 N ATOM 2233 CA PRO A 145 -18.666 -0.384 -4.348 1.00 0.64 C ATOM 2234 C PRO A 145 -19.898 -1.280 -4.280 1.00 0.66 C ATOM 2235 O PRO A 145 -21.011 -0.809 -4.484 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.080 -0.171 -2.946 1.00 0.71 C ATOM 2237 CG PRO A 145 -18.609 1.150 -2.507 1.00 0.69 C ATOM 2238 CD PRO A 145 -18.715 1.977 -3.754 1.00 0.67 C ATOM 0 HA PRO A 145 -17.981 -0.884 -5.033 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -18.386 -0.965 -2.265 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -16.990 -0.173 -2.969 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.580 1.042 -2.024 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -17.943 1.618 -1.782 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -19.512 2.717 -3.680 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -17.792 2.521 -3.956 1.00 0.67 H new ATOM 2246 N THR A 146 -19.686 -2.568 -4.011 1.00 0.77 N ATOM 2247 CA THR A 146 -20.777 -3.532 -3.897 1.00 0.90 C ATOM 2248 C THR A 146 -21.878 -3.019 -2.961 1.00 0.92 C ATOM 2249 O THR A 146 -21.765 -3.115 -1.739 1.00 1.05 O ATOM 2250 CB THR A 146 -20.258 -4.883 -3.367 1.00 1.14 C ATOM 2251 OG1 THR A 146 -19.047 -5.243 -4.052 1.00 1.71 O ATOM 2252 CG2 THR A 146 -21.297 -5.980 -3.560 1.00 1.66 C ATOM 0 H THR A 146 -18.759 -2.969 -3.867 1.00 0.77 H new ATOM 0 HA THR A 146 -21.194 -3.667 -4.895 1.00 0.90 H new ATOM 0 HB THR A 146 -20.060 -4.777 -2.300 1.00 1.14 H new ATOM 0 HG1 THR A 146 -18.721 -6.101 -3.710 1.00 1.71 H new ATOM 0 HG21 THR A 146 -20.906 -6.923 -3.178 1.00 1.66 H new ATOM 0 HG22 THR A 146 -22.207 -5.719 -3.019 1.00 1.66 H new ATOM 0 HG23 THR A 146 -21.523 -6.084 -4.621 1.00 1.66 H new ATOM 2260 N PHE A 147 -22.929 -2.459 -3.545 1.00 0.95 N ATOM 2261 CA PHE A 147 -24.009 -1.871 -2.773 1.00 1.04 C ATOM 2262 C PHE A 147 -25.339 -2.495 -3.158 1.00 1.29 C ATOM 2263 O PHE A 147 -25.526 -2.921 -4.299 1.00 2.10 O ATOM 2264 CB PHE A 147 -24.063 -0.350 -2.990 1.00 1.24 C ATOM 2265 CG PHE A 147 -24.514 0.061 -4.369 1.00 1.45 C ATOM 2266 CD1 PHE A 147 -23.684 -0.096 -5.468 1.00 1.49 C ATOM 2267 CD2 PHE A 147 -25.775 0.608 -4.565 1.00 1.97 C ATOM 2268 CE1 PHE A 147 -24.096 0.280 -6.730 1.00 2.08 C ATOM 2269 CE2 PHE A 147 -26.192 0.987 -5.827 1.00 2.58 C ATOM 2270 CZ PHE A 147 -25.352 0.822 -6.911 1.00 2.64 C ATOM 0 H PHE A 147 -23.054 -2.401 -4.556 1.00 0.95 H new ATOM 0 HA PHE A 147 -23.819 -2.069 -1.718 1.00 1.04 H new ATOM 0 HB2 PHE A 147 -24.737 0.087 -2.254 1.00 1.24 H new ATOM 0 HB3 PHE A 147 -23.074 0.068 -2.804 1.00 1.24 H new ATOM 0 HD1 PHE A 147 -22.699 -0.519 -5.334 1.00 1.49 H new ATOM 0 HD2 PHE A 147 -26.437 0.739 -3.722 1.00 1.97 H new ATOM 0 HE1 PHE A 147 -23.436 0.150 -7.575 1.00 2.08 H new ATOM 0 HE2 PHE A 147 -27.175 1.412 -5.966 1.00 2.58 H new ATOM 0 HZ PHE A 147 -25.677 1.116 -7.898 1.00 2.64 H new ATOM 2280 N LYS A 148 -26.246 -2.557 -2.198 1.00 1.33 N ATOM 2281 CA LYS A 148 -27.594 -3.048 -2.436 1.00 1.75 C ATOM 2282 C LYS A 148 -28.443 -2.830 -1.193 1.00 1.97 C ATOM 2283 O LYS A 148 -28.657 -3.754 -0.407 1.00 2.44 O ATOM 2284 CB LYS A 148 -27.579 -4.534 -2.816 1.00 2.02 C ATOM 2285 CG LYS A 148 -28.918 -5.054 -3.320 1.00 2.73 C ATOM 2286 CD LYS A 148 -28.824 -6.506 -3.759 1.00 2.77 C ATOM 2287 CE LYS A 148 -27.802 -6.689 -4.869 1.00 3.02 C ATOM 2288 NZ LYS A 148 -27.649 -8.114 -5.255 1.00 3.72 N ATOM 0 H LYS A 148 -26.071 -2.270 -1.235 1.00 1.33 H new ATOM 0 HA LYS A 148 -28.024 -2.493 -3.270 1.00 1.75 H new ATOM 0 HB2 LYS A 148 -26.825 -4.695 -3.586 1.00 2.02 H new ATOM 0 HB3 LYS A 148 -27.277 -5.118 -1.947 1.00 2.02 H new ATOM 0 HG2 LYS A 148 -29.666 -4.959 -2.533 1.00 2.73 H new ATOM 0 HG3 LYS A 148 -29.256 -4.441 -4.156 1.00 2.73 H new ATOM 0 HD2 LYS A 148 -28.551 -7.128 -2.906 1.00 2.77 H new ATOM 0 HD3 LYS A 148 -29.801 -6.847 -4.103 1.00 2.77 H new ATOM 0 HE2 LYS A 148 -28.105 -6.108 -5.740 1.00 3.02 H new ATOM 0 HE3 LYS A 148 -26.839 -6.296 -4.543 1.00 3.02 H new ATOM 0 HZ1 LYS A 148 -26.943 -8.194 -6.014 1.00 3.72 H new ATOM 0 HZ2 LYS A 148 -27.335 -8.665 -4.431 1.00 3.72 H new ATOM 0 HZ3 LYS A 148 -28.562 -8.483 -5.591 1.00 3.72 H new ATOM 2302 N ASP A 149 -28.857 -1.580 -0.991 1.00 2.18 N ATOM 2303 CA ASP A 149 -29.704 -1.189 0.145 1.00 2.45 C ATOM 2304 C ASP A 149 -28.939 -1.275 1.465 1.00 2.12 C ATOM 2305 O ASP A 149 -29.507 -1.066 2.536 1.00 2.33 O ATOM 2306 CB ASP A 149 -30.972 -2.050 0.230 1.00 3.03 C ATOM 2307 CG ASP A 149 -31.807 -1.999 -1.033 1.00 3.79 C ATOM 2308 OD1 ASP A 149 -32.335 -0.912 -1.355 1.00 4.19 O ATOM 2309 OD2 ASP A 149 -31.932 -3.039 -1.713 1.00 4.28 O ATOM 0 H ASP A 149 -28.616 -0.805 -1.609 1.00 2.18 H new ATOM 0 HA ASP A 149 -29.998 -0.154 -0.027 1.00 2.45 H new ATOM 0 HB2 ASP A 149 -30.690 -3.084 0.431 1.00 3.03 H new ATOM 0 HB3 ASP A 149 -31.577 -1.715 1.073 1.00 3.03 H new ATOM 2314 N PHE A 150 -27.650 -1.578 1.381 1.00 1.79 N ATOM 2315 CA PHE A 150 -26.805 -1.660 2.566 1.00 1.84 C ATOM 2316 C PHE A 150 -26.273 -0.272 2.887 1.00 1.69 C ATOM 2317 O PHE A 150 -26.161 0.122 4.048 1.00 1.94 O ATOM 2318 CB PHE A 150 -25.641 -2.629 2.334 1.00 1.85 C ATOM 2319 CG PHE A 150 -26.065 -3.992 1.859 1.00 2.15 C ATOM 2320 CD1 PHE A 150 -26.977 -4.742 2.584 1.00 2.53 C ATOM 2321 CD2 PHE A 150 -25.541 -4.526 0.693 1.00 2.26 C ATOM 2322 CE1 PHE A 150 -27.361 -5.997 2.150 1.00 2.86 C ATOM 2323 CE2 PHE A 150 -25.922 -5.780 0.256 1.00 2.62 C ATOM 2324 CZ PHE A 150 -26.834 -6.516 0.986 1.00 2.86 C ATOM 0 H PHE A 150 -27.166 -1.771 0.504 1.00 1.79 H new ATOM 0 HA PHE A 150 -27.394 -2.034 3.403 1.00 1.84 H new ATOM 0 HB2 PHE A 150 -24.961 -2.195 1.601 1.00 1.85 H new ATOM 0 HB3 PHE A 150 -25.081 -2.737 3.263 1.00 1.85 H new ATOM 0 HD1 PHE A 150 -27.392 -4.342 3.497 1.00 2.53 H new ATOM 0 HD2 PHE A 150 -24.826 -3.955 0.119 1.00 2.26 H new ATOM 0 HE1 PHE A 150 -28.074 -6.571 2.723 1.00 2.86 H new ATOM 0 HE2 PHE A 150 -25.507 -6.184 -0.656 1.00 2.62 H new ATOM 0 HZ PHE A 150 -27.134 -7.496 0.646 1.00 2.86 H new ATOM 2334 N PHE A 151 -25.952 0.452 1.827 1.00 1.50 N ATOM 2335 CA PHE A 151 -25.531 1.838 1.908 1.00 1.73 C ATOM 2336 C PHE A 151 -25.814 2.515 0.577 1.00 2.71 C ATOM 2337 O PHE A 151 -25.547 1.888 -0.469 1.00 3.26 O ATOM 2338 CB PHE A 151 -24.047 1.972 2.286 1.00 1.19 C ATOM 2339 CG PHE A 151 -23.142 0.908 1.721 1.00 1.74 C ATOM 2340 CD1 PHE A 151 -22.702 0.983 0.408 1.00 2.13 C ATOM 2341 CD2 PHE A 151 -22.750 -0.173 2.492 1.00 2.68 C ATOM 2342 CE1 PHE A 151 -21.885 0.003 -0.122 1.00 3.18 C ATOM 2343 CE2 PHE A 151 -21.936 -1.158 1.967 1.00 3.78 C ATOM 2344 CZ PHE A 151 -21.442 -1.040 0.698 1.00 3.96 C ATOM 2345 OXT PHE A 151 -26.332 3.648 0.578 1.00 3.44 O ATOM 0 H PHE A 151 -25.977 0.087 0.875 1.00 1.50 H new ATOM 0 HA PHE A 151 -26.097 2.327 2.701 1.00 1.73 H new ATOM 0 HB2 PHE A 151 -23.690 2.946 1.951 1.00 1.19 H new ATOM 0 HB3 PHE A 151 -23.963 1.958 3.373 1.00 1.19 H new ATOM 0 HD1 PHE A 151 -23.002 1.818 -0.208 1.00 2.13 H new ATOM 0 HD2 PHE A 151 -23.085 -0.247 3.516 1.00 2.68 H new ATOM 0 HE1 PHE A 151 -21.591 0.042 -1.160 1.00 3.18 H new ATOM 0 HE2 PHE A 151 -21.689 -2.025 2.562 1.00 3.78 H new ATOM 0 HZ PHE A 151 -20.714 -1.748 0.331 1.00 3.96 H new TER 2355 PHE A 151