USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 880 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 85 ASN :FLIP amide:sc= -1.84! F(o=-2.5,f=-0.63!) USER MOD Set 1.2: A 86 CYS SG : rot 19:sc= 1.21 USER MOD Set 2.1: A 80 ASN : amide:sc= 0 X(o=0,f=0.051) USER MOD Set 2.2: A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.0865 (180deg=0) USER MOD Single : A 2 SER OG : rot 53:sc= 1.2 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN :FLIP amide:sc=-0.00819 F(o=-0.71,f=-0.0082) USER MOD Single : A 28 GLN : amide:sc= 0.175 K(o=0.18,f=-6.8!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc=-0.00854 X(o=-0.0085,f=0) USER MOD Single : A 43 GLN : amide:sc= -3.47! C(o=-3.5!,f=-3.6!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= -0.594 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN :FLIP amide:sc= -1.12! F(o=-2.3,f=-1.1!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.42) USER MOD Single : A 64 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 171:sc= 1.06 USER MOD Single : A 70 ASN : amide:sc= -0.841! C(o=-0.84!,f=-4.5!) USER MOD Single : A 71 LYS NZ :NH3+ -144:sc= -0.33 (180deg=-0.738) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.01 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -2.6 K(o=-2.6,f=-3.6!) USER MOD Single : A 92 THR OG1 : rot 96:sc= 1.09 USER MOD Single : A 93 TYR OH : rot -151:sc= -0.445 USER MOD Single : A 101 ASN : amide:sc= 0.106 K(o=0.11,f=-3.9!) USER MOD Single : A 104 CYS SG : rot 56:sc= 0.0237 USER MOD Single : A 106 GLN : amide:sc= -0.51 K(o=-0.51,f=-6.5!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -1.11! C(o=-1.1!,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.828 -17.379 -1.047 1.00 0.00 N ATOM 2 CA GLY A 1 19.889 -17.076 0.371 1.00 0.00 C ATOM 3 C GLY A 1 18.518 -17.035 1.015 1.00 0.00 C ATOM 4 O GLY A 1 17.529 -17.450 0.412 1.00 0.00 O ATOM 0 H1 GLY A 1 20.415 -18.214 -1.249 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.843 -17.574 -1.318 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.183 -16.567 -1.591 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.501 -17.825 0.873 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.382 -16.115 0.513 1.00 0.00 H new ATOM 8 N SER A 2 18.458 -16.535 2.245 1.00 0.00 N ATOM 9 CA SER A 2 17.198 -16.446 2.974 1.00 0.00 C ATOM 10 C SER A 2 17.366 -15.629 4.252 1.00 0.00 C ATOM 11 O SER A 2 18.382 -15.732 4.939 1.00 0.00 O ATOM 12 CB SER A 2 16.682 -17.846 3.314 1.00 0.00 C ATOM 13 OG SER A 2 15.847 -18.346 2.285 1.00 0.00 O ATOM 0 H SER A 2 19.267 -16.185 2.758 1.00 0.00 H new ATOM 0 HA SER A 2 16.471 -15.943 2.335 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.525 -18.521 3.463 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.129 -17.815 4.253 1.00 0.00 H new ATOM 0 HG SER A 2 16.316 -18.288 1.426 1.00 0.00 H new ATOM 19 N SER A 3 16.361 -14.817 4.564 1.00 0.00 N ATOM 20 CA SER A 3 16.397 -13.979 5.756 1.00 0.00 C ATOM 21 C SER A 3 15.031 -13.356 6.024 1.00 0.00 C ATOM 22 O SER A 3 14.121 -13.451 5.202 1.00 0.00 O ATOM 23 CB SER A 3 17.450 -12.880 5.601 1.00 0.00 C ATOM 24 OG SER A 3 16.999 -11.861 4.726 1.00 0.00 O ATOM 0 H SER A 3 15.512 -14.722 4.007 1.00 0.00 H new ATOM 0 HA SER A 3 16.662 -14.609 6.605 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.679 -12.451 6.577 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.375 -13.310 5.217 1.00 0.00 H new ATOM 0 HG SER A 3 17.689 -11.170 4.645 1.00 0.00 H new ATOM 30 N GLY A 4 14.895 -12.717 7.183 1.00 0.00 N ATOM 31 CA GLY A 4 13.638 -12.087 7.540 1.00 0.00 C ATOM 32 C GLY A 4 13.669 -11.476 8.926 1.00 0.00 C ATOM 33 O GLY A 4 14.738 -11.297 9.510 1.00 0.00 O ATOM 0 H GLY A 4 15.634 -12.625 7.880 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.403 -11.312 6.810 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.838 -12.825 7.490 1.00 0.00 H new ATOM 37 N SER A 5 12.493 -11.152 9.455 1.00 0.00 N ATOM 38 CA SER A 5 12.390 -10.551 10.780 1.00 0.00 C ATOM 39 C SER A 5 10.932 -10.446 11.217 1.00 0.00 C ATOM 40 O SER A 5 10.019 -10.536 10.397 1.00 0.00 O ATOM 41 CB SER A 5 13.037 -9.165 10.786 1.00 0.00 C ATOM 42 OG SER A 5 13.241 -8.703 12.110 1.00 0.00 O ATOM 0 H SER A 5 11.598 -11.296 8.986 1.00 0.00 H new ATOM 0 HA SER A 5 12.917 -11.193 11.485 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.991 -9.203 10.260 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.403 -8.462 10.246 1.00 0.00 H new ATOM 0 HG SER A 5 13.657 -7.816 12.087 1.00 0.00 H new ATOM 48 N SER A 6 10.723 -10.257 12.516 1.00 0.00 N ATOM 49 CA SER A 6 9.376 -10.143 13.064 1.00 0.00 C ATOM 50 C SER A 6 9.341 -9.141 14.214 1.00 0.00 C ATOM 51 O SER A 6 10.360 -8.867 14.845 1.00 0.00 O ATOM 52 CB SER A 6 8.883 -11.509 13.547 1.00 0.00 C ATOM 53 OG SER A 6 7.469 -11.587 13.496 1.00 0.00 O ATOM 0 H SER A 6 11.468 -10.180 13.208 1.00 0.00 H new ATOM 0 HA SER A 6 8.717 -9.785 12.273 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.316 -12.295 12.929 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.224 -11.682 14.568 1.00 0.00 H new ATOM 0 HG SER A 6 7.179 -12.470 13.808 1.00 0.00 H new ATOM 59 N GLY A 7 8.157 -8.597 14.480 1.00 0.00 N ATOM 60 CA GLY A 7 8.009 -7.632 15.554 1.00 0.00 C ATOM 61 C GLY A 7 7.651 -6.250 15.044 1.00 0.00 C ATOM 62 O GLY A 7 6.962 -6.112 14.033 1.00 0.00 O ATOM 0 H GLY A 7 7.298 -8.807 13.971 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.236 -7.974 16.242 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.939 -7.578 16.121 1.00 0.00 H new ATOM 66 N HIS A 8 8.117 -5.222 15.747 1.00 0.00 N ATOM 67 CA HIS A 8 7.841 -3.843 15.361 1.00 0.00 C ATOM 68 C HIS A 8 8.841 -3.361 14.315 1.00 0.00 C ATOM 69 O HIS A 8 9.902 -2.838 14.652 1.00 0.00 O ATOM 70 CB HIS A 8 7.887 -2.929 16.586 1.00 0.00 C ATOM 71 CG HIS A 8 7.405 -1.538 16.313 1.00 0.00 C ATOM 72 ND1 HIS A 8 8.004 -0.416 16.846 1.00 0.00 N ATOM 73 CD2 HIS A 8 6.376 -1.089 15.557 1.00 0.00 C ATOM 74 CE1 HIS A 8 7.364 0.662 16.431 1.00 0.00 C ATOM 75 NE2 HIS A 8 6.372 0.281 15.647 1.00 0.00 N ATOM 0 H HIS A 8 8.688 -5.318 16.587 1.00 0.00 H new ATOM 0 HA HIS A 8 6.842 -3.807 14.927 1.00 0.00 H new ATOM 0 HB2 HIS A 8 7.280 -3.366 17.378 1.00 0.00 H new ATOM 0 HB3 HIS A 8 8.911 -2.884 16.957 1.00 0.00 H new ATOM 0 HD2 HIS A 8 5.686 -1.696 14.989 1.00 0.00 H new ATOM 0 HE1 HIS A 8 7.610 1.682 16.689 1.00 0.00 H new ATOM 0 HE2 HIS A 8 5.710 0.904 15.183 1.00 0.00 H new ATOM 83 N GLU A 9 8.495 -3.543 13.044 1.00 0.00 N ATOM 84 CA GLU A 9 9.364 -3.128 11.949 1.00 0.00 C ATOM 85 C GLU A 9 8.547 -2.557 10.793 1.00 0.00 C ATOM 86 O GLU A 9 7.764 -3.267 10.163 1.00 0.00 O ATOM 87 CB GLU A 9 10.204 -4.309 11.460 1.00 0.00 C ATOM 88 CG GLU A 9 11.531 -3.898 10.844 1.00 0.00 C ATOM 89 CD GLU A 9 12.255 -2.848 11.665 1.00 0.00 C ATOM 90 OE1 GLU A 9 12.722 -3.181 12.774 1.00 0.00 O ATOM 91 OE2 GLU A 9 12.354 -1.694 11.198 1.00 0.00 O ATOM 0 H GLU A 9 7.620 -3.975 12.748 1.00 0.00 H new ATOM 0 HA GLU A 9 10.029 -2.348 12.321 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.394 -4.980 12.297 1.00 0.00 H new ATOM 0 HB3 GLU A 9 9.630 -4.872 10.724 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.168 -4.777 10.742 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.357 -3.512 9.840 1.00 0.00 H new ATOM 98 N GLU A 10 8.737 -1.269 10.522 1.00 0.00 N ATOM 99 CA GLU A 10 8.017 -0.603 9.443 1.00 0.00 C ATOM 100 C GLU A 10 8.077 -1.426 8.159 1.00 0.00 C ATOM 101 O GLU A 10 8.974 -2.249 7.979 1.00 0.00 O ATOM 102 CB GLU A 10 8.600 0.790 9.196 1.00 0.00 C ATOM 103 CG GLU A 10 8.130 1.833 10.197 1.00 0.00 C ATOM 104 CD GLU A 10 6.657 1.699 10.530 1.00 0.00 C ATOM 105 OE1 GLU A 10 5.861 1.438 9.604 1.00 0.00 O ATOM 106 OE2 GLU A 10 6.300 1.856 11.716 1.00 0.00 O ATOM 0 H GLU A 10 9.382 -0.667 11.034 1.00 0.00 H new ATOM 0 HA GLU A 10 6.974 -0.505 9.743 1.00 0.00 H new ATOM 0 HB2 GLU A 10 9.688 0.731 9.230 1.00 0.00 H new ATOM 0 HB3 GLU A 10 8.330 1.115 8.191 1.00 0.00 H new ATOM 0 HG2 GLU A 10 8.715 1.743 11.112 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.319 2.828 9.795 1.00 0.00 H new ATOM 113 N GLU A 11 7.115 -1.197 7.271 1.00 0.00 N ATOM 114 CA GLU A 11 7.057 -1.918 6.005 1.00 0.00 C ATOM 115 C GLU A 11 7.831 -1.175 4.920 1.00 0.00 C ATOM 116 O GLU A 11 7.300 -0.895 3.846 1.00 0.00 O ATOM 117 CB GLU A 11 5.603 -2.111 5.568 1.00 0.00 C ATOM 118 CG GLU A 11 4.976 -3.393 6.090 1.00 0.00 C ATOM 119 CD GLU A 11 3.870 -3.909 5.190 1.00 0.00 C ATOM 120 OE1 GLU A 11 3.112 -3.079 4.647 1.00 0.00 O ATOM 121 OE2 GLU A 11 3.762 -5.143 5.030 1.00 0.00 O ATOM 0 H GLU A 11 6.365 -0.518 7.405 1.00 0.00 H new ATOM 0 HA GLU A 11 7.517 -2.895 6.152 1.00 0.00 H new ATOM 0 HB2 GLU A 11 5.013 -1.262 5.912 1.00 0.00 H new ATOM 0 HB3 GLU A 11 5.557 -2.111 4.479 1.00 0.00 H new ATOM 0 HG2 GLU A 11 5.747 -4.157 6.187 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.575 -3.217 7.088 1.00 0.00 H new ATOM 128 N GLU A 12 9.090 -0.860 5.210 1.00 0.00 N ATOM 129 CA GLU A 12 9.937 -0.148 4.260 1.00 0.00 C ATOM 130 C GLU A 12 9.297 1.173 3.844 1.00 0.00 C ATOM 131 O GLU A 12 9.319 1.545 2.670 1.00 0.00 O ATOM 132 CB GLU A 12 10.193 -1.014 3.024 1.00 0.00 C ATOM 133 CG GLU A 12 11.379 -1.952 3.174 1.00 0.00 C ATOM 134 CD GLU A 12 11.628 -2.780 1.928 1.00 0.00 C ATOM 135 OE1 GLU A 12 12.380 -2.314 1.047 1.00 0.00 O ATOM 136 OE2 GLU A 12 11.072 -3.895 1.835 1.00 0.00 O ATOM 0 H GLU A 12 9.545 -1.086 6.094 1.00 0.00 H new ATOM 0 HA GLU A 12 10.887 0.067 4.749 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.300 -1.602 2.811 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.360 -0.365 2.164 1.00 0.00 H new ATOM 0 HG2 GLU A 12 12.271 -1.370 3.403 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.207 -2.618 4.020 1.00 0.00 H new ATOM 143 N LEU A 13 8.728 1.879 4.815 1.00 0.00 N ATOM 144 CA LEU A 13 8.081 3.160 4.552 1.00 0.00 C ATOM 145 C LEU A 13 9.030 4.111 3.831 1.00 0.00 C ATOM 146 O LEU A 13 10.168 4.311 4.256 1.00 0.00 O ATOM 147 CB LEU A 13 7.605 3.792 5.861 1.00 0.00 C ATOM 148 CG LEU A 13 6.482 3.055 6.593 1.00 0.00 C ATOM 149 CD1 LEU A 13 6.030 3.845 7.811 1.00 0.00 C ATOM 150 CD2 LEU A 13 5.311 2.802 5.655 1.00 0.00 C ATOM 0 H LEU A 13 8.701 1.586 5.792 1.00 0.00 H new ATOM 0 HA LEU A 13 7.220 2.979 3.909 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.459 3.872 6.534 1.00 0.00 H new ATOM 0 HB3 LEU A 13 7.269 4.807 5.650 1.00 0.00 H new ATOM 0 HG LEU A 13 6.866 2.093 6.932 1.00 0.00 H new ATOM 0 HD11 LEU A 13 5.231 3.305 8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.870 3.975 8.493 1.00 0.00 H new ATOM 0 HD13 LEU A 13 5.664 4.822 7.496 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.521 2.277 6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 13 4.928 3.754 5.286 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.644 2.194 4.814 1.00 0.00 H new ATOM 162 N LYS A 14 8.554 4.698 2.738 1.00 0.00 N ATOM 163 CA LYS A 14 9.358 5.632 1.958 1.00 0.00 C ATOM 164 C LYS A 14 8.489 6.403 0.969 1.00 0.00 C ATOM 165 O LYS A 14 7.678 5.830 0.241 1.00 0.00 O ATOM 166 CB LYS A 14 10.462 4.884 1.209 1.00 0.00 C ATOM 167 CG LYS A 14 11.556 5.791 0.672 1.00 0.00 C ATOM 168 CD LYS A 14 12.594 6.103 1.737 1.00 0.00 C ATOM 169 CE LYS A 14 13.699 6.996 1.194 1.00 0.00 C ATOM 170 NZ LYS A 14 14.817 6.202 0.612 1.00 0.00 N ATOM 0 H LYS A 14 7.615 4.543 2.372 1.00 0.00 H new ATOM 0 HA LYS A 14 9.813 6.344 2.646 1.00 0.00 H new ATOM 0 HB2 LYS A 14 10.908 4.147 1.877 1.00 0.00 H new ATOM 0 HB3 LYS A 14 10.018 4.334 0.379 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.040 5.314 -0.180 1.00 0.00 H new ATOM 0 HG3 LYS A 14 11.115 6.719 0.309 1.00 0.00 H new ATOM 0 HD2 LYS A 14 12.112 6.592 2.584 1.00 0.00 H new ATOM 0 HD3 LYS A 14 13.026 5.174 2.109 1.00 0.00 H new ATOM 0 HE2 LYS A 14 13.289 7.659 0.432 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.081 7.629 1.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 15.550 6.846 0.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.225 5.588 1.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 14.457 5.617 -0.169 1.00 0.00 H new ATOM 184 N PRO A 15 8.663 7.732 0.939 1.00 0.00 N ATOM 185 CA PRO A 15 7.905 8.609 0.041 1.00 0.00 C ATOM 186 C PRO A 15 8.302 8.426 -1.420 1.00 0.00 C ATOM 187 O PRO A 15 9.440 8.083 -1.741 1.00 0.00 O ATOM 188 CB PRO A 15 8.275 10.015 0.523 1.00 0.00 C ATOM 189 CG PRO A 15 9.609 9.856 1.167 1.00 0.00 C ATOM 190 CD PRO A 15 9.613 8.482 1.778 1.00 0.00 C ATOM 0 HA PRO A 15 6.836 8.399 0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.318 10.720 -0.307 1.00 0.00 H new ATOM 0 HB3 PRO A 15 7.538 10.398 1.229 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.410 9.960 0.435 1.00 0.00 H new ATOM 0 HG3 PRO A 15 9.769 10.621 1.926 1.00 0.00 H new ATOM 0 HD2 PRO A 15 10.607 8.036 1.756 1.00 0.00 H new ATOM 0 HD3 PRO A 15 9.297 8.505 2.821 1.00 0.00 H new ATOM 198 N PRO A 16 7.343 8.660 -2.328 1.00 0.00 N ATOM 199 CA PRO A 16 7.570 8.527 -3.770 1.00 0.00 C ATOM 200 C PRO A 16 8.488 9.616 -4.315 1.00 0.00 C ATOM 201 O PRO A 16 8.607 10.691 -3.728 1.00 0.00 O ATOM 202 CB PRO A 16 6.166 8.665 -4.364 1.00 0.00 C ATOM 203 CG PRO A 16 5.406 9.459 -3.358 1.00 0.00 C ATOM 204 CD PRO A 16 5.964 9.072 -2.017 1.00 0.00 C ATOM 0 HA PRO A 16 8.063 7.588 -4.020 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.192 9.170 -5.329 1.00 0.00 H new ATOM 0 HB3 PRO A 16 5.707 7.690 -4.527 1.00 0.00 H new ATOM 0 HG2 PRO A 16 5.523 10.528 -3.535 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.339 9.241 -3.414 1.00 0.00 H new ATOM 0 HD2 PRO A 16 5.942 9.907 -1.316 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.395 8.261 -1.564 1.00 0.00 H new ATOM 212 N GLU A 17 9.135 9.329 -5.441 1.00 0.00 N ATOM 213 CA GLU A 17 10.043 10.286 -6.064 1.00 0.00 C ATOM 214 C GLU A 17 9.325 11.095 -7.140 1.00 0.00 C ATOM 215 O GLU A 17 9.537 12.301 -7.268 1.00 0.00 O ATOM 216 CB GLU A 17 11.244 9.560 -6.672 1.00 0.00 C ATOM 217 CG GLU A 17 10.862 8.384 -7.556 1.00 0.00 C ATOM 218 CD GLU A 17 12.048 7.804 -8.301 1.00 0.00 C ATOM 219 OE1 GLU A 17 12.943 8.582 -8.692 1.00 0.00 O ATOM 220 OE2 GLU A 17 12.082 6.570 -8.491 1.00 0.00 O ATOM 0 H GLU A 17 9.048 8.443 -5.939 1.00 0.00 H new ATOM 0 HA GLU A 17 10.394 10.971 -5.293 1.00 0.00 H new ATOM 0 HB2 GLU A 17 11.828 10.270 -7.258 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.888 9.205 -5.868 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.407 7.606 -6.943 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.108 8.705 -8.275 1.00 0.00 H new ATOM 227 N GLN A 18 8.477 10.423 -7.912 1.00 0.00 N ATOM 228 CA GLN A 18 7.730 11.079 -8.978 1.00 0.00 C ATOM 229 C GLN A 18 6.414 10.356 -9.245 1.00 0.00 C ATOM 230 O GLN A 18 6.353 9.128 -9.213 1.00 0.00 O ATOM 231 CB GLN A 18 8.566 11.131 -10.258 1.00 0.00 C ATOM 232 CG GLN A 18 8.924 9.760 -10.807 1.00 0.00 C ATOM 233 CD GLN A 18 9.081 9.758 -12.315 1.00 0.00 C ATOM 234 OE1 GLN A 18 10.065 10.272 -12.849 1.00 0.00 O ATOM 235 NE2 GLN A 18 8.111 9.177 -13.010 1.00 0.00 N ATOM 0 H GLN A 18 8.290 9.425 -7.819 1.00 0.00 H new ATOM 0 HA GLN A 18 7.506 12.096 -8.657 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.016 11.686 -11.019 1.00 0.00 H new ATOM 0 HB3 GLN A 18 9.484 11.685 -10.060 1.00 0.00 H new ATOM 0 HG2 GLN A 18 9.853 9.420 -10.348 1.00 0.00 H new ATOM 0 HG3 GLN A 18 8.150 9.046 -10.525 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.314 8.764 -12.526 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.163 9.144 -14.028 1.00 0.00 H new ATOM 244 N GLU A 19 5.364 11.127 -9.508 1.00 0.00 N ATOM 245 CA GLU A 19 4.049 10.559 -9.780 1.00 0.00 C ATOM 246 C GLU A 19 4.141 9.448 -10.822 1.00 0.00 C ATOM 247 O GLU A 19 4.791 9.604 -11.856 1.00 0.00 O ATOM 248 CB GLU A 19 3.088 11.647 -10.262 1.00 0.00 C ATOM 249 CG GLU A 19 1.677 11.144 -10.520 1.00 0.00 C ATOM 250 CD GLU A 19 0.715 12.260 -10.878 1.00 0.00 C ATOM 251 OE1 GLU A 19 0.815 13.345 -10.268 1.00 0.00 O ATOM 252 OE2 GLU A 19 -0.136 12.048 -11.766 1.00 0.00 O ATOM 0 H GLU A 19 5.398 12.146 -9.538 1.00 0.00 H new ATOM 0 HA GLU A 19 3.667 10.133 -8.852 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.050 12.442 -9.518 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.481 12.087 -11.179 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.698 10.414 -11.329 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.312 10.626 -9.633 1.00 0.00 H new ATOM 259 N ILE A 20 3.486 8.326 -10.542 1.00 0.00 N ATOM 260 CA ILE A 20 3.493 7.189 -11.454 1.00 0.00 C ATOM 261 C ILE A 20 2.197 7.119 -12.255 1.00 0.00 C ATOM 262 O ILE A 20 1.342 7.997 -12.148 1.00 0.00 O ATOM 263 CB ILE A 20 3.688 5.862 -10.698 1.00 0.00 C ATOM 264 CG1 ILE A 20 2.594 5.684 -9.644 1.00 0.00 C ATOM 265 CG2 ILE A 20 5.065 5.818 -10.053 1.00 0.00 C ATOM 266 CD1 ILE A 20 2.270 4.237 -9.348 1.00 0.00 C ATOM 0 H ILE A 20 2.944 8.180 -9.691 1.00 0.00 H new ATOM 0 HA ILE A 20 4.331 7.336 -12.135 1.00 0.00 H new ATOM 0 HB ILE A 20 3.615 5.041 -11.411 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.906 6.174 -8.722 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.689 6.189 -9.983 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.188 4.874 -9.522 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.831 5.903 -10.824 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.164 6.645 -9.350 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.486 4.187 -8.592 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.927 3.747 -10.259 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.163 3.732 -8.979 1.00 0.00 H new ATOM 278 N GLU A 21 2.060 6.068 -13.057 1.00 0.00 N ATOM 279 CA GLU A 21 0.867 5.883 -13.875 1.00 0.00 C ATOM 280 C GLU A 21 0.096 4.640 -13.441 1.00 0.00 C ATOM 281 O GLU A 21 0.653 3.543 -13.375 1.00 0.00 O ATOM 282 CB GLU A 21 1.248 5.769 -15.353 1.00 0.00 C ATOM 283 CG GLU A 21 1.930 4.458 -15.707 1.00 0.00 C ATOM 284 CD GLU A 21 2.651 4.517 -17.039 1.00 0.00 C ATOM 285 OE1 GLU A 21 2.036 4.969 -18.028 1.00 0.00 O ATOM 286 OE2 GLU A 21 3.831 4.111 -17.093 1.00 0.00 O ATOM 0 H GLU A 21 2.759 5.332 -13.158 1.00 0.00 H new ATOM 0 HA GLU A 21 0.226 6.754 -13.738 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.349 5.877 -15.960 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.910 6.595 -15.614 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.643 4.200 -14.923 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.186 3.662 -15.736 1.00 0.00 H new ATOM 293 N ILE A 22 -1.187 4.820 -13.145 1.00 0.00 N ATOM 294 CA ILE A 22 -2.034 3.713 -12.717 1.00 0.00 C ATOM 295 C ILE A 22 -3.182 3.491 -13.695 1.00 0.00 C ATOM 296 O ILE A 22 -3.699 4.438 -14.288 1.00 0.00 O ATOM 297 CB ILE A 22 -2.612 3.958 -11.311 1.00 0.00 C ATOM 298 CG1 ILE A 22 -1.487 4.004 -10.274 1.00 0.00 C ATOM 299 CG2 ILE A 22 -3.622 2.876 -10.958 1.00 0.00 C ATOM 300 CD1 ILE A 22 -0.766 2.685 -10.107 1.00 0.00 C ATOM 0 H ILE A 22 -1.662 5.721 -13.194 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.404 2.824 -12.692 1.00 0.00 H new ATOM 0 HB ILE A 22 -3.124 4.920 -11.307 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -0.767 4.769 -10.565 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.902 4.306 -9.313 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -4.022 3.063 -9.961 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -4.436 2.887 -11.683 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -3.133 1.902 -10.976 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.018 2.791 -9.357 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.474 1.921 -9.786 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.321 2.391 -11.058 1.00 0.00 H new ATOM 312 N ASP A 23 -3.578 2.233 -13.858 1.00 0.00 N ATOM 313 CA ASP A 23 -4.668 1.885 -14.762 1.00 0.00 C ATOM 314 C ASP A 23 -5.841 1.284 -13.993 1.00 0.00 C ATOM 315 O ASP A 23 -5.762 0.157 -13.504 1.00 0.00 O ATOM 316 CB ASP A 23 -4.182 0.901 -15.827 1.00 0.00 C ATOM 317 CG ASP A 23 -3.251 1.549 -16.832 1.00 0.00 C ATOM 318 OD1 ASP A 23 -3.410 2.760 -17.092 1.00 0.00 O ATOM 319 OD2 ASP A 23 -2.364 0.846 -17.360 1.00 0.00 O ATOM 0 H ASP A 23 -3.160 1.437 -13.376 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.007 2.798 -15.251 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.668 0.071 -15.343 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.042 0.482 -16.350 1.00 0.00 H new ATOM 324 N ARG A 24 -6.926 2.044 -13.890 1.00 0.00 N ATOM 325 CA ARG A 24 -8.114 1.587 -13.179 1.00 0.00 C ATOM 326 C ARG A 24 -8.793 0.446 -13.931 1.00 0.00 C ATOM 327 O ARG A 24 -9.794 -0.104 -13.474 1.00 0.00 O ATOM 328 CB ARG A 24 -9.098 2.743 -12.990 1.00 0.00 C ATOM 329 CG ARG A 24 -8.435 4.043 -12.565 1.00 0.00 C ATOM 330 CD ARG A 24 -9.338 4.855 -11.650 1.00 0.00 C ATOM 331 NE ARG A 24 -10.194 5.772 -12.398 1.00 0.00 N ATOM 332 CZ ARG A 24 -9.811 6.984 -12.785 1.00 0.00 C ATOM 333 NH1 ARG A 24 -8.594 7.422 -12.496 1.00 0.00 N ATOM 334 NH2 ARG A 24 -10.647 7.760 -13.463 1.00 0.00 N ATOM 0 H ARG A 24 -7.007 2.979 -14.290 1.00 0.00 H new ATOM 0 HA ARG A 24 -7.802 1.220 -12.201 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.636 2.908 -13.924 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -9.838 2.461 -12.241 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.498 3.824 -12.053 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -8.186 4.631 -13.448 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -9.958 4.180 -11.061 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.727 5.421 -10.947 1.00 0.00 H new ATOM 0 HE ARG A 24 -11.137 5.465 -12.636 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.949 6.828 -11.975 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.303 8.353 -12.794 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -11.584 7.426 -13.687 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.352 8.690 -13.760 1.00 0.00 H new ATOM 348 N ASN A 25 -8.240 0.095 -15.088 1.00 0.00 N ATOM 349 CA ASN A 25 -8.792 -0.980 -15.904 1.00 0.00 C ATOM 350 C ASN A 25 -7.737 -2.044 -16.189 1.00 0.00 C ATOM 351 O ASN A 25 -8.003 -3.028 -16.881 1.00 0.00 O ATOM 352 CB ASN A 25 -9.337 -0.421 -17.220 1.00 0.00 C ATOM 353 CG ASN A 25 -10.580 0.424 -17.019 1.00 0.00 C ATOM 354 OD1 ASN A 25 -10.419 1.567 -16.364 1.00 0.00 O flip ATOM 355 ND2 ASN A 25 -11.672 0.052 -17.449 1.00 0.00 N flip ATOM 0 H ASN A 25 -7.410 0.539 -15.481 1.00 0.00 H new ATOM 0 HA ASN A 25 -9.607 -1.442 -15.348 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -8.567 0.180 -17.703 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -9.567 -1.246 -17.894 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.749 -0.835 -17.947 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -12.500 0.631 -17.307 1.00 0.00 H new ATOM 362 N ILE A 26 -6.539 -1.841 -15.650 1.00 0.00 N ATOM 363 CA ILE A 26 -5.445 -2.784 -15.844 1.00 0.00 C ATOM 364 C ILE A 26 -4.644 -2.968 -14.560 1.00 0.00 C ATOM 365 O ILE A 26 -4.456 -2.024 -13.793 1.00 0.00 O ATOM 366 CB ILE A 26 -4.496 -2.321 -16.966 1.00 0.00 C ATOM 367 CG1 ILE A 26 -5.259 -2.185 -18.285 1.00 0.00 C ATOM 368 CG2 ILE A 26 -3.339 -3.297 -17.116 1.00 0.00 C ATOM 369 CD1 ILE A 26 -5.947 -0.847 -18.449 1.00 0.00 C ATOM 0 H ILE A 26 -6.302 -1.032 -15.076 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.894 -3.735 -16.128 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.091 -1.345 -16.700 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.566 -2.332 -19.113 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.004 -2.978 -18.348 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.677 -2.957 -17.912 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.783 -3.349 -16.180 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.726 -4.285 -17.364 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.468 -0.821 -19.406 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -6.665 -0.705 -17.641 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.204 -0.050 -18.418 1.00 0.00 H new ATOM 381 N ILE A 27 -4.172 -4.190 -14.334 1.00 0.00 N ATOM 382 CA ILE A 27 -3.389 -4.497 -13.144 1.00 0.00 C ATOM 383 C ILE A 27 -1.982 -4.953 -13.515 1.00 0.00 C ATOM 384 O ILE A 27 -1.789 -6.064 -14.009 1.00 0.00 O ATOM 385 CB ILE A 27 -4.062 -5.590 -12.293 1.00 0.00 C ATOM 386 CG1 ILE A 27 -5.481 -5.165 -11.907 1.00 0.00 C ATOM 387 CG2 ILE A 27 -3.234 -5.879 -11.050 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.214 -6.193 -11.075 1.00 0.00 C ATOM 0 H ILE A 27 -4.318 -4.983 -14.959 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.330 -3.579 -12.560 1.00 0.00 H new ATOM 0 HB ILE A 27 -4.124 -6.503 -12.885 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -5.433 -4.228 -11.352 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.052 -4.969 -12.814 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.723 -6.654 -10.459 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.242 -6.220 -11.345 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.143 -4.971 -10.454 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.212 -5.825 -10.838 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.294 -7.125 -11.635 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.665 -6.372 -10.151 1.00 0.00 H new ATOM 400 N GLN A 28 -1.002 -4.088 -13.272 1.00 0.00 N ATOM 401 CA GLN A 28 0.388 -4.403 -13.580 1.00 0.00 C ATOM 402 C GLN A 28 1.109 -4.944 -12.350 1.00 0.00 C ATOM 403 O GLN A 28 0.850 -4.511 -11.227 1.00 0.00 O ATOM 404 CB GLN A 28 1.110 -3.161 -14.105 1.00 0.00 C ATOM 405 CG GLN A 28 0.218 -2.237 -14.918 1.00 0.00 C ATOM 406 CD GLN A 28 -0.538 -1.247 -14.054 1.00 0.00 C ATOM 407 OE1 GLN A 28 -0.727 -1.467 -12.857 1.00 0.00 O ATOM 408 NE2 GLN A 28 -0.977 -0.149 -14.658 1.00 0.00 N ATOM 0 H GLN A 28 -1.145 -3.165 -12.863 1.00 0.00 H new ATOM 0 HA GLN A 28 0.398 -5.173 -14.351 1.00 0.00 H new ATOM 0 HB2 GLN A 28 1.521 -2.606 -13.262 1.00 0.00 H new ATOM 0 HB3 GLN A 28 1.953 -3.474 -14.722 1.00 0.00 H new ATOM 0 HG2 GLN A 28 0.827 -1.693 -15.640 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -0.494 -2.834 -15.488 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.798 -0.007 -15.652 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.493 0.553 -14.128 1.00 0.00 H new ATOM 417 N GLU A 29 2.014 -5.892 -12.569 1.00 0.00 N ATOM 418 CA GLU A 29 2.772 -6.492 -11.477 1.00 0.00 C ATOM 419 C GLU A 29 3.060 -5.465 -10.387 1.00 0.00 C ATOM 420 O GLU A 29 2.899 -5.744 -9.199 1.00 0.00 O ATOM 421 CB GLU A 29 4.084 -7.080 -12.000 1.00 0.00 C ATOM 422 CG GLU A 29 5.048 -6.035 -12.536 1.00 0.00 C ATOM 423 CD GLU A 29 6.191 -6.645 -13.324 1.00 0.00 C ATOM 424 OE1 GLU A 29 6.919 -7.487 -12.757 1.00 0.00 O ATOM 425 OE2 GLU A 29 6.358 -6.281 -14.507 1.00 0.00 O ATOM 0 H GLU A 29 2.240 -6.261 -13.492 1.00 0.00 H new ATOM 0 HA GLU A 29 2.170 -7.293 -11.047 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.571 -7.633 -11.196 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.862 -7.797 -12.791 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.504 -5.337 -13.173 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.452 -5.458 -11.704 1.00 0.00 H new ATOM 432 N GLU A 30 3.488 -4.276 -10.800 1.00 0.00 N ATOM 433 CA GLU A 30 3.800 -3.207 -9.858 1.00 0.00 C ATOM 434 C GLU A 30 2.825 -3.214 -8.684 1.00 0.00 C ATOM 435 O GLU A 30 3.235 -3.207 -7.524 1.00 0.00 O ATOM 436 CB GLU A 30 3.759 -1.849 -10.561 1.00 0.00 C ATOM 437 CG GLU A 30 5.088 -1.440 -11.174 1.00 0.00 C ATOM 438 CD GLU A 30 5.245 -1.925 -12.602 1.00 0.00 C ATOM 439 OE1 GLU A 30 4.404 -1.558 -13.449 1.00 0.00 O ATOM 440 OE2 GLU A 30 6.209 -2.671 -12.873 1.00 0.00 O ATOM 0 H GLU A 30 3.627 -4.029 -11.780 1.00 0.00 H new ATOM 0 HA GLU A 30 4.805 -3.379 -9.474 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.001 -1.877 -11.344 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.449 -1.088 -9.845 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.175 -0.354 -11.151 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.902 -1.838 -10.567 1.00 0.00 H new ATOM 447 N GLU A 31 1.533 -3.228 -8.996 1.00 0.00 N ATOM 448 CA GLU A 31 0.499 -3.234 -7.967 1.00 0.00 C ATOM 449 C GLU A 31 0.457 -4.579 -7.247 1.00 0.00 C ATOM 450 O GLU A 31 0.339 -4.637 -6.023 1.00 0.00 O ATOM 451 CB GLU A 31 -0.868 -2.931 -8.584 1.00 0.00 C ATOM 452 CG GLU A 31 -1.061 -1.468 -8.947 1.00 0.00 C ATOM 453 CD GLU A 31 0.133 -0.886 -9.679 1.00 0.00 C ATOM 454 OE1 GLU A 31 0.611 -1.526 -10.638 1.00 0.00 O ATOM 455 OE2 GLU A 31 0.589 0.210 -9.291 1.00 0.00 O ATOM 0 H GLU A 31 1.177 -3.235 -9.952 1.00 0.00 H new ATOM 0 HA GLU A 31 0.741 -2.459 -7.240 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.996 -3.539 -9.480 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.648 -3.229 -7.883 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.949 -1.366 -9.570 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.241 -0.893 -8.039 1.00 0.00 H new ATOM 462 N LYS A 32 0.554 -5.659 -8.016 1.00 0.00 N ATOM 463 CA LYS A 32 0.528 -7.004 -7.453 1.00 0.00 C ATOM 464 C LYS A 32 1.672 -7.202 -6.464 1.00 0.00 C ATOM 465 O LYS A 32 1.639 -8.114 -5.639 1.00 0.00 O ATOM 466 CB LYS A 32 0.617 -8.047 -8.569 1.00 0.00 C ATOM 467 CG LYS A 32 -0.395 -7.836 -9.682 1.00 0.00 C ATOM 468 CD LYS A 32 -0.221 -8.856 -10.795 1.00 0.00 C ATOM 469 CE LYS A 32 -1.335 -8.752 -11.825 1.00 0.00 C ATOM 470 NZ LYS A 32 -1.317 -9.895 -12.779 1.00 0.00 N ATOM 0 H LYS A 32 0.651 -5.629 -9.031 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.414 -7.130 -6.920 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.621 -8.027 -8.994 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.471 -9.039 -8.140 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.404 -7.908 -9.276 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.286 -6.831 -10.088 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.742 -8.704 -11.282 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -0.208 -9.860 -10.371 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.298 -8.719 -11.316 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.234 -7.817 -12.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -2.091 -9.787 -13.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.408 -9.912 -13.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.439 -10.786 -12.256 1.00 0.00 H new ATOM 484 N GLN A 33 2.682 -6.342 -6.554 1.00 0.00 N ATOM 485 CA GLN A 33 3.835 -6.424 -5.666 1.00 0.00 C ATOM 486 C GLN A 33 3.531 -5.779 -4.318 1.00 0.00 C ATOM 487 O GLN A 33 4.184 -6.073 -3.317 1.00 0.00 O ATOM 488 CB GLN A 33 5.048 -5.747 -6.307 1.00 0.00 C ATOM 489 CG GLN A 33 5.621 -6.517 -7.486 1.00 0.00 C ATOM 490 CD GLN A 33 6.545 -7.639 -7.057 1.00 0.00 C ATOM 491 OE1 GLN A 33 6.223 -8.818 -7.213 1.00 0.00 O ATOM 492 NE2 GLN A 33 7.702 -7.280 -6.513 1.00 0.00 N ATOM 0 H GLN A 33 2.725 -5.581 -7.232 1.00 0.00 H new ATOM 0 HA GLN A 33 4.061 -7.478 -5.501 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.763 -4.749 -6.639 1.00 0.00 H new ATOM 0 HB3 GLN A 33 5.825 -5.622 -5.553 1.00 0.00 H new ATOM 0 HG2 GLN A 33 4.804 -6.931 -8.077 1.00 0.00 H new ATOM 0 HG3 GLN A 33 6.166 -5.830 -8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 33 7.929 -6.292 -6.403 1.00 0.00 H new ATOM 0 HE22 GLN A 33 8.364 -7.993 -6.206 1.00 0.00 H new ATOM 501 N ALA A 34 2.537 -4.897 -4.301 1.00 0.00 N ATOM 502 CA ALA A 34 2.146 -4.211 -3.075 1.00 0.00 C ATOM 503 C ALA A 34 0.818 -4.744 -2.548 1.00 0.00 C ATOM 504 O ALA A 34 0.524 -4.635 -1.357 1.00 0.00 O ATOM 505 CB ALA A 34 2.057 -2.711 -3.315 1.00 0.00 C ATOM 0 H ALA A 34 1.988 -4.641 -5.122 1.00 0.00 H new ATOM 0 HA ALA A 34 2.910 -4.402 -2.321 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.764 -2.212 -2.391 1.00 0.00 H new ATOM 0 HB2 ALA A 34 3.028 -2.336 -3.638 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.315 -2.510 -4.087 1.00 0.00 H new ATOM 511 N ILE A 35 0.020 -5.320 -3.441 1.00 0.00 N ATOM 512 CA ILE A 35 -1.276 -5.870 -3.065 1.00 0.00 C ATOM 513 C ILE A 35 -1.405 -7.324 -3.505 1.00 0.00 C ATOM 514 O ILE A 35 -2.425 -7.744 -4.052 1.00 0.00 O ATOM 515 CB ILE A 35 -2.432 -5.055 -3.675 1.00 0.00 C ATOM 516 CG1 ILE A 35 -2.120 -3.559 -3.610 1.00 0.00 C ATOM 517 CG2 ILE A 35 -3.735 -5.362 -2.953 1.00 0.00 C ATOM 518 CD1 ILE A 35 -2.156 -2.994 -2.207 1.00 0.00 C ATOM 0 H ILE A 35 0.249 -5.418 -4.430 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.339 -5.816 -1.978 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.544 -5.338 -4.722 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.133 -3.383 -4.039 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.837 -3.019 -4.229 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.542 -4.778 -3.395 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.961 -6.424 -3.047 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.636 -5.104 -1.899 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.925 -1.929 -2.238 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.149 -3.138 -1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.419 -3.507 -1.589 1.00 0.00 H new ATOM 530 N PRO A 36 -0.348 -8.112 -3.261 1.00 0.00 N ATOM 531 CA PRO A 36 -0.320 -9.533 -3.623 1.00 0.00 C ATOM 532 C PRO A 36 -1.265 -10.368 -2.766 1.00 0.00 C ATOM 533 O PRO A 36 -1.417 -11.569 -2.985 1.00 0.00 O ATOM 534 CB PRO A 36 1.134 -9.935 -3.364 1.00 0.00 C ATOM 535 CG PRO A 36 1.618 -8.971 -2.337 1.00 0.00 C ATOM 536 CD PRO A 36 0.901 -7.678 -2.613 1.00 0.00 C ATOM 0 HA PRO A 36 -0.646 -9.699 -4.650 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.203 -10.962 -3.006 1.00 0.00 H new ATOM 0 HB3 PRO A 36 1.729 -9.875 -4.275 1.00 0.00 H new ATOM 0 HG2 PRO A 36 1.401 -9.331 -1.331 1.00 0.00 H new ATOM 0 HG3 PRO A 36 2.698 -8.840 -2.403 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.706 -7.123 -1.695 1.00 0.00 H new ATOM 0 HD3 PRO A 36 1.485 -7.025 -3.262 1.00 0.00 H new ATOM 544 N GLU A 37 -1.896 -9.724 -1.789 1.00 0.00 N ATOM 545 CA GLU A 37 -2.826 -10.409 -0.900 1.00 0.00 C ATOM 546 C GLU A 37 -4.165 -10.649 -1.592 1.00 0.00 C ATOM 547 O GLU A 37 -4.869 -11.612 -1.288 1.00 0.00 O ATOM 548 CB GLU A 37 -3.039 -9.594 0.378 1.00 0.00 C ATOM 549 CG GLU A 37 -3.156 -8.099 0.134 1.00 0.00 C ATOM 550 CD GLU A 37 -1.815 -7.393 0.185 1.00 0.00 C ATOM 551 OE1 GLU A 37 -0.778 -8.088 0.198 1.00 0.00 O ATOM 552 OE2 GLU A 37 -1.803 -6.144 0.212 1.00 0.00 O ATOM 0 H GLU A 37 -1.780 -8.730 -1.594 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.394 -11.375 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.943 -9.944 0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.208 -9.779 1.059 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.615 -7.928 -0.840 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -3.820 -7.664 0.881 1.00 0.00 H new ATOM 559 N PHE A 38 -4.509 -9.766 -2.523 1.00 0.00 N ATOM 560 CA PHE A 38 -5.764 -9.881 -3.258 1.00 0.00 C ATOM 561 C PHE A 38 -5.574 -10.695 -4.534 1.00 0.00 C ATOM 562 O PHE A 38 -6.521 -10.916 -5.290 1.00 0.00 O ATOM 563 CB PHE A 38 -6.306 -8.492 -3.602 1.00 0.00 C ATOM 564 CG PHE A 38 -7.146 -7.889 -2.512 1.00 0.00 C ATOM 565 CD1 PHE A 38 -8.315 -8.507 -2.100 1.00 0.00 C ATOM 566 CD2 PHE A 38 -6.767 -6.705 -1.901 1.00 0.00 C ATOM 567 CE1 PHE A 38 -9.091 -7.956 -1.097 1.00 0.00 C ATOM 568 CE2 PHE A 38 -7.538 -6.149 -0.898 1.00 0.00 C ATOM 569 CZ PHE A 38 -8.702 -6.775 -0.496 1.00 0.00 C ATOM 0 H PHE A 38 -3.937 -8.963 -2.787 1.00 0.00 H new ATOM 0 HA PHE A 38 -6.483 -10.398 -2.622 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -5.469 -7.827 -3.815 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -6.900 -8.558 -4.513 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -8.624 -9.430 -2.568 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -5.859 -6.211 -2.212 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.000 -8.448 -0.784 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -7.231 -5.226 -0.429 1.00 0.00 H new ATOM 0 HZ PHE A 38 -9.307 -6.342 0.287 1.00 0.00 H new ATOM 579 N PHE A 39 -4.344 -11.140 -4.768 1.00 0.00 N ATOM 580 CA PHE A 39 -4.029 -11.929 -5.953 1.00 0.00 C ATOM 581 C PHE A 39 -3.628 -13.351 -5.569 1.00 0.00 C ATOM 582 O PHE A 39 -3.045 -14.080 -6.371 1.00 0.00 O ATOM 583 CB PHE A 39 -2.902 -11.267 -6.748 1.00 0.00 C ATOM 584 CG PHE A 39 -3.246 -9.892 -7.244 1.00 0.00 C ATOM 585 CD1 PHE A 39 -4.166 -9.720 -8.266 1.00 0.00 C ATOM 586 CD2 PHE A 39 -2.649 -8.771 -6.690 1.00 0.00 C ATOM 587 CE1 PHE A 39 -4.486 -8.456 -8.724 1.00 0.00 C ATOM 588 CE2 PHE A 39 -2.965 -7.504 -7.144 1.00 0.00 C ATOM 589 CZ PHE A 39 -3.884 -7.347 -8.163 1.00 0.00 C ATOM 0 H PHE A 39 -3.549 -10.968 -4.153 1.00 0.00 H new ATOM 0 HA PHE A 39 -4.923 -11.977 -6.575 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.013 -11.206 -6.121 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -2.649 -11.899 -7.599 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -4.638 -10.584 -8.710 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.928 -8.888 -5.894 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.206 -8.336 -9.520 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.494 -6.638 -6.702 1.00 0.00 H new ATOM 0 HZ PHE A 39 -4.131 -6.358 -8.521 1.00 0.00 H new ATOM 599 N GLU A 40 -3.945 -13.736 -4.337 1.00 0.00 N ATOM 600 CA GLU A 40 -3.617 -15.070 -3.846 1.00 0.00 C ATOM 601 C GLU A 40 -4.385 -16.138 -4.619 1.00 0.00 C ATOM 602 O GLU A 40 -3.793 -16.971 -5.304 1.00 0.00 O ATOM 603 CB GLU A 40 -3.932 -15.179 -2.353 1.00 0.00 C ATOM 604 CG GLU A 40 -2.776 -14.770 -1.456 1.00 0.00 C ATOM 605 CD GLU A 40 -2.847 -15.412 -0.084 1.00 0.00 C ATOM 606 OE1 GLU A 40 -2.314 -16.530 0.076 1.00 0.00 O ATOM 607 OE2 GLU A 40 -3.435 -14.797 0.830 1.00 0.00 O ATOM 0 H GLU A 40 -4.428 -13.144 -3.661 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.550 -15.234 -3.998 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.796 -14.554 -2.126 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.213 -16.207 -2.124 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -1.836 -15.045 -1.934 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.772 -13.686 -1.346 1.00 0.00 H new ATOM 614 N GLY A 41 -5.710 -16.107 -4.502 1.00 0.00 N ATOM 615 CA GLY A 41 -6.538 -17.078 -5.194 1.00 0.00 C ATOM 616 C GLY A 41 -7.649 -17.620 -4.318 1.00 0.00 C ATOM 617 O GLY A 41 -8.480 -18.407 -4.773 1.00 0.00 O ATOM 0 H GLY A 41 -6.224 -15.428 -3.941 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.971 -16.615 -6.081 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.915 -17.904 -5.538 1.00 0.00 H new ATOM 621 N ARG A 42 -7.665 -17.201 -3.057 1.00 0.00 N ATOM 622 CA ARG A 42 -8.681 -17.653 -2.114 1.00 0.00 C ATOM 623 C ARG A 42 -10.004 -16.931 -2.353 1.00 0.00 C ATOM 624 O ARG A 42 -10.054 -15.927 -3.062 1.00 0.00 O ATOM 625 CB ARG A 42 -8.213 -17.420 -0.676 1.00 0.00 C ATOM 626 CG ARG A 42 -7.390 -16.154 -0.502 1.00 0.00 C ATOM 627 CD ARG A 42 -7.295 -15.749 0.961 1.00 0.00 C ATOM 628 NE ARG A 42 -6.623 -16.764 1.767 1.00 0.00 N ATOM 629 CZ ARG A 42 -6.626 -16.769 3.096 1.00 0.00 C ATOM 630 NH1 ARG A 42 -7.263 -15.816 3.764 1.00 0.00 N ATOM 631 NH2 ARG A 42 -5.992 -17.727 3.759 1.00 0.00 N ATOM 0 H ARG A 42 -6.986 -16.549 -2.665 1.00 0.00 H new ATOM 0 HA ARG A 42 -8.836 -18.721 -2.270 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -9.084 -17.370 -0.023 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.621 -18.276 -0.352 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.389 -16.311 -0.903 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.840 -15.344 -1.077 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.755 -14.806 1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.297 -15.577 1.355 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.124 -17.510 1.283 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -7.752 -15.078 3.258 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -7.264 -15.822 4.784 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.501 -18.461 3.249 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.995 -17.729 4.779 1.00 0.00 H new ATOM 645 N GLN A 43 -11.072 -17.451 -1.757 1.00 0.00 N ATOM 646 CA GLN A 43 -12.395 -16.857 -1.907 1.00 0.00 C ATOM 647 C GLN A 43 -12.480 -15.526 -1.167 1.00 0.00 C ATOM 648 O GLN A 43 -13.042 -14.557 -1.676 1.00 0.00 O ATOM 649 CB GLN A 43 -13.469 -17.813 -1.385 1.00 0.00 C ATOM 650 CG GLN A 43 -14.715 -17.108 -0.875 1.00 0.00 C ATOM 651 CD GLN A 43 -14.556 -16.594 0.542 1.00 0.00 C ATOM 652 OE1 GLN A 43 -14.024 -17.287 1.410 1.00 0.00 O ATOM 653 NE2 GLN A 43 -15.018 -15.373 0.785 1.00 0.00 N ATOM 0 H GLN A 43 -11.047 -18.282 -1.166 1.00 0.00 H new ATOM 0 HA GLN A 43 -12.566 -16.675 -2.968 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -13.751 -18.500 -2.183 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -13.047 -18.415 -0.580 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -14.952 -16.274 -1.536 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -15.559 -17.796 -0.915 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -15.452 -14.833 0.036 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -14.939 -14.975 1.721 1.00 0.00 H new ATOM 662 N ALA A 44 -11.919 -15.486 0.037 1.00 0.00 N ATOM 663 CA ALA A 44 -11.930 -14.274 0.846 1.00 0.00 C ATOM 664 C ALA A 44 -11.270 -13.115 0.107 1.00 0.00 C ATOM 665 O ALA A 44 -11.879 -12.064 -0.093 1.00 0.00 O ATOM 666 CB ALA A 44 -11.233 -14.520 2.175 1.00 0.00 C ATOM 0 H ALA A 44 -11.451 -16.280 0.474 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.969 -14.004 1.038 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -11.249 -13.606 2.769 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.750 -15.313 2.716 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -10.200 -14.818 1.995 1.00 0.00 H new ATOM 672 N LYS A 45 -10.019 -13.312 -0.297 1.00 0.00 N ATOM 673 CA LYS A 45 -9.275 -12.284 -1.015 1.00 0.00 C ATOM 674 C LYS A 45 -9.322 -12.529 -2.520 1.00 0.00 C ATOM 675 O LYS A 45 -8.901 -13.581 -3.002 1.00 0.00 O ATOM 676 CB LYS A 45 -7.821 -12.251 -0.538 1.00 0.00 C ATOM 677 CG LYS A 45 -7.678 -12.118 0.968 1.00 0.00 C ATOM 678 CD LYS A 45 -6.375 -11.434 1.346 1.00 0.00 C ATOM 679 CE LYS A 45 -5.232 -12.431 1.450 1.00 0.00 C ATOM 680 NZ LYS A 45 -5.102 -12.983 2.827 1.00 0.00 N ATOM 0 H LYS A 45 -9.499 -14.175 -0.139 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.741 -11.321 -0.807 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -7.320 -13.163 -0.863 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.309 -11.417 -1.018 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -8.518 -11.548 1.365 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.718 -13.106 1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.131 -10.676 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.497 -10.918 2.298 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -5.396 -13.247 0.746 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.299 -11.945 1.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.312 -13.659 2.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.920 -12.208 3.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.983 -13.469 3.091 1.00 0.00 H new ATOM 694 N THR A 46 -9.837 -11.551 -3.258 1.00 0.00 N ATOM 695 CA THR A 46 -9.939 -11.660 -4.708 1.00 0.00 C ATOM 696 C THR A 46 -9.437 -10.393 -5.391 1.00 0.00 C ATOM 697 O THR A 46 -9.541 -9.288 -4.858 1.00 0.00 O ATOM 698 CB THR A 46 -11.389 -11.928 -5.151 1.00 0.00 C ATOM 699 OG1 THR A 46 -12.164 -10.729 -5.044 1.00 0.00 O ATOM 700 CG2 THR A 46 -12.020 -13.023 -4.303 1.00 0.00 C ATOM 0 H THR A 46 -10.190 -10.674 -2.875 1.00 0.00 H new ATOM 0 HA THR A 46 -9.315 -12.502 -5.006 1.00 0.00 H new ATOM 0 HB THR A 46 -11.373 -12.258 -6.190 1.00 0.00 H new ATOM 0 HG1 THR A 46 -13.084 -10.908 -5.329 1.00 0.00 H new ATOM 0 HG21 THR A 46 -13.044 -13.195 -4.634 1.00 0.00 H new ATOM 0 HG22 THR A 46 -11.445 -13.943 -4.410 1.00 0.00 H new ATOM 0 HG23 THR A 46 -12.024 -12.717 -3.257 1.00 0.00 H new ATOM 708 N PRO A 47 -8.880 -10.553 -6.601 1.00 0.00 N ATOM 709 CA PRO A 47 -8.352 -9.432 -7.384 1.00 0.00 C ATOM 710 C PRO A 47 -9.456 -8.518 -7.905 1.00 0.00 C ATOM 711 O PRO A 47 -9.239 -7.325 -8.116 1.00 0.00 O ATOM 712 CB PRO A 47 -7.633 -10.119 -8.548 1.00 0.00 C ATOM 713 CG PRO A 47 -8.312 -11.437 -8.687 1.00 0.00 C ATOM 714 CD PRO A 47 -8.723 -11.841 -7.298 1.00 0.00 C ATOM 0 HA PRO A 47 -7.707 -8.787 -6.788 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -7.713 -9.534 -9.464 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.570 -10.241 -8.340 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -9.179 -11.362 -9.344 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -7.642 -12.176 -9.126 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -9.652 -12.411 -7.304 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -7.968 -12.467 -6.821 1.00 0.00 H new ATOM 722 N GLU A 48 -10.641 -9.086 -8.110 1.00 0.00 N ATOM 723 CA GLU A 48 -11.778 -8.321 -8.607 1.00 0.00 C ATOM 724 C GLU A 48 -12.341 -7.412 -7.518 1.00 0.00 C ATOM 725 O GLU A 48 -13.056 -6.452 -7.804 1.00 0.00 O ATOM 726 CB GLU A 48 -12.872 -9.263 -9.116 1.00 0.00 C ATOM 727 CG GLU A 48 -12.713 -9.646 -10.578 1.00 0.00 C ATOM 728 CD GLU A 48 -13.998 -10.174 -11.185 1.00 0.00 C ATOM 729 OE1 GLU A 48 -14.238 -11.396 -11.096 1.00 0.00 O ATOM 730 OE2 GLU A 48 -14.764 -9.365 -11.750 1.00 0.00 O ATOM 0 H GLU A 48 -10.838 -10.072 -7.940 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.431 -7.699 -9.432 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.871 -10.169 -8.510 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.843 -8.787 -8.977 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.379 -8.776 -11.143 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.934 -10.403 -10.669 1.00 0.00 H new ATOM 737 N ARG A 49 -12.013 -7.724 -6.268 1.00 0.00 N ATOM 738 CA ARG A 49 -12.486 -6.937 -5.135 1.00 0.00 C ATOM 739 C ARG A 49 -11.519 -5.800 -4.821 1.00 0.00 C ATOM 740 O ARG A 49 -11.912 -4.770 -4.272 1.00 0.00 O ATOM 741 CB ARG A 49 -12.658 -7.829 -3.904 1.00 0.00 C ATOM 742 CG ARG A 49 -13.151 -7.083 -2.676 1.00 0.00 C ATOM 743 CD ARG A 49 -12.966 -7.907 -1.411 1.00 0.00 C ATOM 744 NE ARG A 49 -13.608 -7.288 -0.255 1.00 0.00 N ATOM 745 CZ ARG A 49 -13.476 -7.738 0.988 1.00 0.00 C ATOM 746 NH1 ARG A 49 -12.728 -8.805 1.234 1.00 0.00 N ATOM 747 NH2 ARG A 49 -14.092 -7.120 1.987 1.00 0.00 N ATOM 0 H ARG A 49 -11.422 -8.516 -6.014 1.00 0.00 H new ATOM 0 HA ARG A 49 -13.451 -6.507 -5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.361 -8.628 -4.140 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -11.704 -8.302 -3.672 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.611 -6.141 -2.580 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -14.205 -6.835 -2.799 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -13.379 -8.904 -1.564 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -11.902 -8.030 -1.211 1.00 0.00 H new ATOM 0 HE ARG A 49 -14.190 -6.465 -0.410 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -12.252 -9.282 0.468 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -12.628 -9.149 2.189 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.668 -6.299 1.801 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -13.990 -7.466 2.941 1.00 0.00 H new ATOM 761 N TYR A 50 -10.252 -5.993 -5.173 1.00 0.00 N ATOM 762 CA TYR A 50 -9.228 -4.984 -4.926 1.00 0.00 C ATOM 763 C TYR A 50 -9.364 -3.820 -5.903 1.00 0.00 C ATOM 764 O TYR A 50 -9.072 -2.672 -5.563 1.00 0.00 O ATOM 765 CB TYR A 50 -7.835 -5.604 -5.044 1.00 0.00 C ATOM 766 CG TYR A 50 -6.757 -4.605 -5.399 1.00 0.00 C ATOM 767 CD1 TYR A 50 -6.187 -3.792 -4.428 1.00 0.00 C ATOM 768 CD2 TYR A 50 -6.307 -4.476 -6.708 1.00 0.00 C ATOM 769 CE1 TYR A 50 -5.203 -2.877 -4.749 1.00 0.00 C ATOM 770 CE2 TYR A 50 -5.321 -3.565 -7.038 1.00 0.00 C ATOM 771 CZ TYR A 50 -4.773 -2.768 -6.055 1.00 0.00 C ATOM 772 OH TYR A 50 -3.791 -1.860 -6.378 1.00 0.00 O ATOM 0 H TYR A 50 -9.910 -6.838 -5.630 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.365 -4.603 -3.914 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.578 -6.083 -4.099 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -7.858 -6.387 -5.802 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -6.519 -3.877 -3.404 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.735 -5.098 -7.480 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -4.773 -2.251 -3.982 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -4.982 -3.478 -8.060 1.00 0.00 H new ATOM 0 HH TYR A 50 -3.602 -1.910 -7.338 1.00 0.00 H new ATOM 782 N LEU A 51 -9.809 -4.124 -7.117 1.00 0.00 N ATOM 783 CA LEU A 51 -9.985 -3.103 -8.145 1.00 0.00 C ATOM 784 C LEU A 51 -11.176 -2.206 -7.823 1.00 0.00 C ATOM 785 O LEU A 51 -11.102 -0.985 -7.959 1.00 0.00 O ATOM 786 CB LEU A 51 -10.179 -3.758 -9.513 1.00 0.00 C ATOM 787 CG LEU A 51 -8.906 -4.033 -10.313 1.00 0.00 C ATOM 788 CD1 LEU A 51 -9.233 -4.778 -11.598 1.00 0.00 C ATOM 789 CD2 LEU A 51 -8.177 -2.732 -10.619 1.00 0.00 C ATOM 0 H LEU A 51 -10.055 -5.068 -7.414 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.086 -2.487 -8.169 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -10.705 -4.702 -9.370 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -10.828 -3.118 -10.111 1.00 0.00 H new ATOM 0 HG LEU A 51 -8.250 -4.661 -9.710 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.314 -4.965 -12.154 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -9.711 -5.728 -11.357 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.909 -4.176 -12.206 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.273 -2.947 -11.189 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -8.827 -2.079 -11.202 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.908 -2.237 -9.686 1.00 0.00 H new ATOM 801 N LYS A 52 -12.273 -2.820 -7.394 1.00 0.00 N ATOM 802 CA LYS A 52 -13.480 -2.078 -7.049 1.00 0.00 C ATOM 803 C LYS A 52 -13.179 -1.002 -6.011 1.00 0.00 C ATOM 804 O LYS A 52 -13.554 0.159 -6.181 1.00 0.00 O ATOM 805 CB LYS A 52 -14.553 -3.030 -6.515 1.00 0.00 C ATOM 806 CG LYS A 52 -15.789 -2.320 -5.990 1.00 0.00 C ATOM 807 CD LYS A 52 -16.722 -1.916 -7.120 1.00 0.00 C ATOM 808 CE LYS A 52 -18.160 -1.793 -6.638 1.00 0.00 C ATOM 809 NZ LYS A 52 -19.132 -1.902 -7.760 1.00 0.00 N ATOM 0 H LYS A 52 -12.351 -3.830 -7.277 1.00 0.00 H new ATOM 0 HA LYS A 52 -13.849 -1.593 -7.953 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -14.848 -3.715 -7.310 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -14.125 -3.635 -5.716 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -16.318 -2.973 -5.296 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -15.490 -1.434 -5.429 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -16.395 -0.965 -7.541 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -16.667 -2.654 -7.920 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -18.365 -2.572 -5.903 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -18.293 -0.836 -6.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -20.100 -1.813 -7.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -18.953 -1.144 -8.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -19.023 -2.825 -8.226 1.00 0.00 H new ATOM 823 N ILE A 53 -12.499 -1.393 -4.939 1.00 0.00 N ATOM 824 CA ILE A 53 -12.146 -0.461 -3.876 1.00 0.00 C ATOM 825 C ILE A 53 -11.159 0.590 -4.372 1.00 0.00 C ATOM 826 O ILE A 53 -11.377 1.790 -4.203 1.00 0.00 O ATOM 827 CB ILE A 53 -11.535 -1.192 -2.666 1.00 0.00 C ATOM 828 CG1 ILE A 53 -12.513 -2.238 -2.127 1.00 0.00 C ATOM 829 CG2 ILE A 53 -11.164 -0.195 -1.577 1.00 0.00 C ATOM 830 CD1 ILE A 53 -11.835 -3.394 -1.426 1.00 0.00 C ATOM 0 H ILE A 53 -12.181 -2.350 -4.784 1.00 0.00 H new ATOM 0 HA ILE A 53 -13.069 0.028 -3.566 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.628 -1.703 -2.989 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -13.202 -1.756 -1.433 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.111 -2.624 -2.953 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -10.733 -0.727 -0.728 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.436 0.516 -1.967 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -12.057 0.341 -1.255 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.589 -4.096 -1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -11.167 -3.901 -2.123 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -11.260 -3.019 -0.579 1.00 0.00 H new ATOM 842 N ARG A 54 -10.074 0.131 -4.987 1.00 0.00 N ATOM 843 CA ARG A 54 -9.053 1.032 -5.509 1.00 0.00 C ATOM 844 C ARG A 54 -9.670 2.069 -6.444 1.00 0.00 C ATOM 845 O ARG A 54 -9.605 3.269 -6.183 1.00 0.00 O ATOM 846 CB ARG A 54 -7.974 0.240 -6.250 1.00 0.00 C ATOM 847 CG ARG A 54 -6.750 1.066 -6.609 1.00 0.00 C ATOM 848 CD ARG A 54 -5.839 0.322 -7.573 1.00 0.00 C ATOM 849 NE ARG A 54 -6.498 0.047 -8.847 1.00 0.00 N ATOM 850 CZ ARG A 54 -5.845 -0.275 -9.958 1.00 0.00 C ATOM 851 NH1 ARG A 54 -4.522 -0.362 -9.951 1.00 0.00 N ATOM 852 NH2 ARG A 54 -6.515 -0.511 -11.079 1.00 0.00 N ATOM 0 H ARG A 54 -9.879 -0.859 -5.136 1.00 0.00 H new ATOM 0 HA ARG A 54 -8.598 1.552 -4.666 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.665 -0.602 -5.631 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.402 -0.175 -7.163 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -7.064 2.008 -7.058 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -6.198 1.313 -5.702 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -4.940 0.912 -7.750 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.521 -0.617 -7.120 1.00 0.00 H new ATOM 0 HE ARG A 54 -7.516 0.105 -8.886 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -4.004 -0.182 -9.091 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.023 -0.609 -10.805 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.533 -0.445 -11.088 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.012 -0.758 -11.931 1.00 0.00 H new ATOM 866 N ASN A 55 -10.266 1.596 -7.533 1.00 0.00 N ATOM 867 CA ASN A 55 -10.893 2.482 -8.507 1.00 0.00 C ATOM 868 C ASN A 55 -11.647 3.610 -7.809 1.00 0.00 C ATOM 869 O ASN A 55 -11.507 4.780 -8.168 1.00 0.00 O ATOM 870 CB ASN A 55 -11.849 1.694 -9.405 1.00 0.00 C ATOM 871 CG ASN A 55 -11.140 1.055 -10.583 1.00 0.00 C ATOM 872 OD1 ASN A 55 -10.011 0.408 -10.315 1.00 0.00 O flip ATOM 873 ND2 ASN A 55 -11.602 1.142 -11.721 1.00 0.00 N flip ATOM 0 H ASN A 55 -10.328 0.604 -7.763 1.00 0.00 H new ATOM 0 HA ASN A 55 -10.106 2.920 -9.122 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.341 0.919 -8.816 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -12.630 2.360 -9.772 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -12.473 1.649 -11.881 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -11.114 0.707 -12.504 1.00 0.00 H new ATOM 880 N TYR A 56 -12.446 3.251 -6.811 1.00 0.00 N ATOM 881 CA TYR A 56 -13.224 4.232 -6.064 1.00 0.00 C ATOM 882 C TYR A 56 -12.322 5.318 -5.487 1.00 0.00 C ATOM 883 O TYR A 56 -12.638 6.506 -5.558 1.00 0.00 O ATOM 884 CB TYR A 56 -14.001 3.548 -4.938 1.00 0.00 C ATOM 885 CG TYR A 56 -14.848 4.498 -4.122 1.00 0.00 C ATOM 886 CD1 TYR A 56 -14.273 5.322 -3.162 1.00 0.00 C ATOM 887 CD2 TYR A 56 -16.223 4.571 -4.309 1.00 0.00 C ATOM 888 CE1 TYR A 56 -15.043 6.192 -2.414 1.00 0.00 C ATOM 889 CE2 TYR A 56 -17.000 5.438 -3.567 1.00 0.00 C ATOM 890 CZ TYR A 56 -16.406 6.246 -2.620 1.00 0.00 C ATOM 891 OH TYR A 56 -17.177 7.111 -1.877 1.00 0.00 O ATOM 0 H TYR A 56 -12.572 2.288 -6.500 1.00 0.00 H new ATOM 0 HA TYR A 56 -13.929 4.698 -6.752 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -14.643 2.779 -5.367 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -13.297 3.043 -4.277 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -13.206 5.282 -2.998 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -16.692 3.938 -5.048 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -14.580 6.826 -1.672 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -18.067 5.483 -3.727 1.00 0.00 H new ATOM 0 HH TYR A 56 -18.115 7.026 -2.146 1.00 0.00 H new ATOM 901 N ILE A 57 -11.196 4.902 -4.916 1.00 0.00 N ATOM 902 CA ILE A 57 -10.246 5.838 -4.329 1.00 0.00 C ATOM 903 C ILE A 57 -9.690 6.791 -5.382 1.00 0.00 C ATOM 904 O ILE A 57 -9.833 8.009 -5.270 1.00 0.00 O ATOM 905 CB ILE A 57 -9.076 5.102 -3.650 1.00 0.00 C ATOM 906 CG1 ILE A 57 -9.562 4.373 -2.395 1.00 0.00 C ATOM 907 CG2 ILE A 57 -7.964 6.080 -3.304 1.00 0.00 C ATOM 908 CD1 ILE A 57 -8.472 3.605 -1.682 1.00 0.00 C ATOM 0 H ILE A 57 -10.920 3.922 -4.848 1.00 0.00 H new ATOM 0 HA ILE A 57 -10.790 6.409 -3.577 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.679 4.363 -4.346 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -9.993 5.100 -1.706 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.360 3.684 -2.671 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.144 5.544 -2.825 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -7.602 6.557 -4.215 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -8.347 6.841 -2.624 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.889 3.114 -0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.057 2.854 -2.354 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.684 4.292 -1.374 1.00 0.00 H new ATOM 920 N LEU A 58 -9.058 6.228 -6.405 1.00 0.00 N ATOM 921 CA LEU A 58 -8.481 7.027 -7.481 1.00 0.00 C ATOM 922 C LEU A 58 -9.483 8.058 -7.991 1.00 0.00 C ATOM 923 O LEU A 58 -9.139 9.220 -8.205 1.00 0.00 O ATOM 924 CB LEU A 58 -8.032 6.123 -8.630 1.00 0.00 C ATOM 925 CG LEU A 58 -6.620 5.548 -8.519 1.00 0.00 C ATOM 926 CD1 LEU A 58 -6.396 4.474 -9.573 1.00 0.00 C ATOM 927 CD2 LEU A 58 -5.582 6.653 -8.653 1.00 0.00 C ATOM 0 H LEU A 58 -8.932 5.222 -6.513 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.615 7.556 -7.083 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.735 5.294 -8.709 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -8.100 6.689 -9.559 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.511 5.091 -7.535 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.385 4.076 -9.478 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -7.117 3.669 -9.431 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.524 4.906 -10.566 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.583 6.225 -8.571 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -5.691 7.139 -9.623 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.728 7.387 -7.861 1.00 0.00 H new ATOM 939 N ASP A 59 -10.725 7.624 -8.182 1.00 0.00 N ATOM 940 CA ASP A 59 -11.778 8.509 -8.663 1.00 0.00 C ATOM 941 C ASP A 59 -11.925 9.724 -7.753 1.00 0.00 C ATOM 942 O ASP A 59 -11.842 10.865 -8.208 1.00 0.00 O ATOM 943 CB ASP A 59 -13.107 7.756 -8.748 1.00 0.00 C ATOM 944 CG ASP A 59 -14.027 8.323 -9.812 1.00 0.00 C ATOM 945 OD1 ASP A 59 -14.808 9.242 -9.492 1.00 0.00 O ATOM 946 OD2 ASP A 59 -13.965 7.846 -10.965 1.00 0.00 O ATOM 0 H ASP A 59 -11.026 6.665 -8.011 1.00 0.00 H new ATOM 0 HA ASP A 59 -11.501 8.855 -9.659 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -12.913 6.705 -8.962 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.607 7.797 -7.780 1.00 0.00 H new ATOM 951 N GLN A 60 -12.146 9.471 -6.467 1.00 0.00 N ATOM 952 CA GLN A 60 -12.307 10.545 -5.494 1.00 0.00 C ATOM 953 C GLN A 60 -11.061 11.424 -5.443 1.00 0.00 C ATOM 954 O GLN A 60 -11.156 12.649 -5.369 1.00 0.00 O ATOM 955 CB GLN A 60 -12.595 9.967 -4.108 1.00 0.00 C ATOM 956 CG GLN A 60 -13.865 9.133 -4.049 1.00 0.00 C ATOM 957 CD GLN A 60 -15.067 9.858 -4.620 1.00 0.00 C ATOM 958 OE1 GLN A 60 -15.351 10.998 -4.252 1.00 0.00 O ATOM 959 NE2 GLN A 60 -15.780 9.200 -5.527 1.00 0.00 N ATOM 0 H GLN A 60 -12.218 8.532 -6.075 1.00 0.00 H new ATOM 0 HA GLN A 60 -13.151 11.160 -5.805 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -11.751 9.351 -3.798 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -12.673 10.785 -3.391 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -13.711 8.204 -4.599 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -14.068 8.861 -3.013 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -15.508 8.256 -5.803 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -16.599 9.638 -5.948 1.00 0.00 H new ATOM 968 N TRP A 61 -9.895 10.790 -5.482 1.00 0.00 N ATOM 969 CA TRP A 61 -8.629 11.515 -5.439 1.00 0.00 C ATOM 970 C TRP A 61 -8.658 12.716 -6.377 1.00 0.00 C ATOM 971 O TRP A 61 -8.423 13.848 -5.956 1.00 0.00 O ATOM 972 CB TRP A 61 -7.473 10.586 -5.814 1.00 0.00 C ATOM 973 CG TRP A 61 -6.327 11.299 -6.466 1.00 0.00 C ATOM 974 CD1 TRP A 61 -5.740 10.988 -7.659 1.00 0.00 C ATOM 975 CD2 TRP A 61 -5.629 12.441 -5.959 1.00 0.00 C ATOM 976 NE1 TRP A 61 -4.718 11.868 -7.924 1.00 0.00 N ATOM 977 CE2 TRP A 61 -4.630 12.770 -6.897 1.00 0.00 C ATOM 978 CE3 TRP A 61 -5.751 13.220 -4.805 1.00 0.00 C ATOM 979 CZ2 TRP A 61 -3.761 13.841 -6.714 1.00 0.00 C ATOM 980 CZ3 TRP A 61 -4.887 14.283 -4.624 1.00 0.00 C ATOM 981 CH2 TRP A 61 -3.903 14.587 -5.575 1.00 0.00 C ATOM 0 H TRP A 61 -9.799 9.776 -5.543 1.00 0.00 H new ATOM 0 HA TRP A 61 -8.480 11.876 -4.422 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.115 10.082 -4.916 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -7.841 9.813 -6.488 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -6.035 10.171 -8.300 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.122 11.852 -8.751 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.507 12.995 -4.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -3.001 14.076 -7.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -4.971 14.890 -3.735 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -3.244 15.426 -5.406 1.00 0.00 H new ATOM 992 N GLU A 62 -8.949 12.462 -7.649 1.00 0.00 N ATOM 993 CA GLU A 62 -9.007 13.525 -8.646 1.00 0.00 C ATOM 994 C GLU A 62 -10.198 14.444 -8.391 1.00 0.00 C ATOM 995 O GLU A 62 -10.131 15.647 -8.645 1.00 0.00 O ATOM 996 CB GLU A 62 -9.100 12.930 -10.052 1.00 0.00 C ATOM 997 CG GLU A 62 -8.386 11.597 -10.198 1.00 0.00 C ATOM 998 CD GLU A 62 -7.911 11.341 -11.616 1.00 0.00 C ATOM 999 OE1 GLU A 62 -8.768 11.169 -12.507 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -6.682 11.314 -11.833 1.00 0.00 O ATOM 0 H GLU A 62 -9.148 11.530 -8.013 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.093 14.113 -8.568 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.150 12.800 -10.314 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.679 13.638 -10.766 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.531 11.571 -9.522 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.057 10.794 -9.893 1.00 0.00 H new ATOM 1007 N ILE A 63 -11.285 13.870 -7.888 1.00 0.00 N ATOM 1008 CA ILE A 63 -12.490 14.637 -7.598 1.00 0.00 C ATOM 1009 C ILE A 63 -12.198 15.770 -6.620 1.00 0.00 C ATOM 1010 O ILE A 63 -12.942 16.749 -6.548 1.00 0.00 O ATOM 1011 CB ILE A 63 -13.600 13.743 -7.015 1.00 0.00 C ATOM 1012 CG1 ILE A 63 -14.189 12.847 -8.106 1.00 0.00 C ATOM 1013 CG2 ILE A 63 -14.687 14.596 -6.378 1.00 0.00 C ATOM 1014 CD1 ILE A 63 -15.005 11.693 -7.565 1.00 0.00 C ATOM 0 H ILE A 63 -11.356 12.876 -7.673 1.00 0.00 H new ATOM 0 HA ILE A 63 -12.833 15.056 -8.544 1.00 0.00 H new ATOM 0 HB ILE A 63 -13.166 13.107 -6.244 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.818 13.451 -8.761 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -13.378 12.453 -8.718 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -15.464 13.950 -5.970 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -14.256 15.195 -5.576 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -15.120 15.255 -7.131 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -15.391 11.100 -8.394 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -14.375 11.066 -6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -15.837 12.080 -6.977 1.00 0.00 H new ATOM 1026 N CYS A 64 -11.110 15.631 -5.871 1.00 0.00 N ATOM 1027 CA CYS A 64 -10.718 16.644 -4.897 1.00 0.00 C ATOM 1028 C CYS A 64 -9.414 17.318 -5.308 1.00 0.00 C ATOM 1029 O CYS A 64 -9.211 18.506 -5.059 1.00 0.00 O ATOM 1030 CB CYS A 64 -10.567 16.016 -3.510 1.00 0.00 C ATOM 1031 SG CYS A 64 -12.106 15.939 -2.563 1.00 0.00 S ATOM 0 H CYS A 64 -10.484 14.827 -5.919 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.501 17.401 -4.862 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -10.170 15.007 -3.621 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -9.832 16.587 -2.943 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.877 15.391 -1.407 1.00 0.00 H new ATOM 1037 N LYS A 65 -8.530 16.551 -5.938 1.00 0.00 N ATOM 1038 CA LYS A 65 -7.244 17.072 -6.384 1.00 0.00 C ATOM 1039 C LYS A 65 -7.390 18.490 -6.928 1.00 0.00 C ATOM 1040 O LYS A 65 -8.457 18.897 -7.388 1.00 0.00 O ATOM 1041 CB LYS A 65 -6.646 16.161 -7.459 1.00 0.00 C ATOM 1042 CG LYS A 65 -7.033 16.555 -8.874 1.00 0.00 C ATOM 1043 CD LYS A 65 -6.364 15.662 -9.904 1.00 0.00 C ATOM 1044 CE LYS A 65 -4.932 16.098 -10.174 1.00 0.00 C ATOM 1045 NZ LYS A 65 -4.473 15.689 -11.531 1.00 0.00 N ATOM 0 H LYS A 65 -8.682 15.565 -6.151 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.574 17.099 -5.525 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.560 16.174 -7.371 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.968 15.136 -7.275 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.115 16.494 -8.986 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.752 17.593 -9.053 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.371 14.630 -9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -6.934 15.686 -10.833 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.858 17.181 -10.077 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -4.273 15.665 -9.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -3.493 16.005 -11.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.519 14.653 -11.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.086 16.123 -12.250 1.00 0.00 H new ATOM 1059 N PRO A 66 -6.294 19.260 -6.876 1.00 0.00 N ATOM 1060 CA PRO A 66 -5.018 18.787 -6.330 1.00 0.00 C ATOM 1061 C PRO A 66 -5.071 18.592 -4.819 1.00 0.00 C ATOM 1062 O PRO A 66 -4.169 17.999 -4.227 1.00 0.00 O ATOM 1063 CB PRO A 66 -4.040 19.908 -6.691 1.00 0.00 C ATOM 1064 CG PRO A 66 -4.889 21.126 -6.816 1.00 0.00 C ATOM 1065 CD PRO A 66 -6.215 20.654 -7.346 1.00 0.00 C ATOM 0 HA PRO A 66 -4.738 17.813 -6.732 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -3.279 20.033 -5.920 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.517 19.692 -7.623 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.008 21.620 -5.851 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -4.434 21.851 -7.491 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.039 21.255 -6.961 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -6.258 20.714 -8.433 1.00 0.00 H new ATOM 1073 N LYS A 67 -6.134 19.094 -4.199 1.00 0.00 N ATOM 1074 CA LYS A 67 -6.307 18.973 -2.756 1.00 0.00 C ATOM 1075 C LYS A 67 -6.071 17.538 -2.298 1.00 0.00 C ATOM 1076 O LYS A 67 -6.428 16.587 -2.995 1.00 0.00 O ATOM 1077 CB LYS A 67 -7.711 19.426 -2.350 1.00 0.00 C ATOM 1078 CG LYS A 67 -7.848 20.932 -2.210 1.00 0.00 C ATOM 1079 CD LYS A 67 -7.557 21.643 -3.522 1.00 0.00 C ATOM 1080 CE LYS A 67 -7.907 23.121 -3.444 1.00 0.00 C ATOM 1081 NZ LYS A 67 -7.166 23.920 -4.459 1.00 0.00 N ATOM 0 H LYS A 67 -6.889 19.589 -4.674 1.00 0.00 H new ATOM 0 HA LYS A 67 -5.571 19.615 -2.272 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.427 19.072 -3.092 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.975 18.956 -1.403 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.857 21.177 -1.878 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.164 21.291 -1.441 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.502 21.530 -3.772 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -8.126 21.175 -4.325 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.979 23.249 -3.593 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.677 23.497 -2.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.432 24.922 -4.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.143 23.819 -4.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.405 23.578 -5.412 1.00 0.00 H new ATOM 1095 N TYR A 68 -5.470 17.388 -1.123 1.00 0.00 N ATOM 1096 CA TYR A 68 -5.187 16.068 -0.572 1.00 0.00 C ATOM 1097 C TYR A 68 -6.479 15.310 -0.280 1.00 0.00 C ATOM 1098 O TYR A 68 -7.530 15.913 -0.062 1.00 0.00 O ATOM 1099 CB TYR A 68 -4.356 16.193 0.706 1.00 0.00 C ATOM 1100 CG TYR A 68 -4.082 14.868 1.382 1.00 0.00 C ATOM 1101 CD1 TYR A 68 -5.018 14.295 2.235 1.00 0.00 C ATOM 1102 CD2 TYR A 68 -2.888 14.191 1.169 1.00 0.00 C ATOM 1103 CE1 TYR A 68 -4.772 13.086 2.856 1.00 0.00 C ATOM 1104 CE2 TYR A 68 -2.635 12.980 1.784 1.00 0.00 C ATOM 1105 CZ TYR A 68 -3.579 12.432 2.627 1.00 0.00 C ATOM 1106 OH TYR A 68 -3.330 11.227 3.243 1.00 0.00 O ATOM 0 H TYR A 68 -5.169 18.164 -0.534 1.00 0.00 H new ATOM 0 HA TYR A 68 -4.618 15.507 -1.314 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -3.407 16.672 0.467 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -4.876 16.847 1.405 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -5.953 14.804 2.415 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -2.145 14.618 0.512 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.509 12.655 3.517 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -1.703 12.465 1.605 1.00 0.00 H new ATOM 0 HH TYR A 68 -2.516 10.831 2.869 1.00 0.00 H new ATOM 1116 N LEU A 69 -6.392 13.985 -0.277 1.00 0.00 N ATOM 1117 CA LEU A 69 -7.553 13.142 -0.011 1.00 0.00 C ATOM 1118 C LEU A 69 -7.252 12.134 1.093 1.00 0.00 C ATOM 1119 O LEU A 69 -6.248 11.425 1.043 1.00 0.00 O ATOM 1120 CB LEU A 69 -7.978 12.410 -1.285 1.00 0.00 C ATOM 1121 CG LEU A 69 -8.938 11.235 -1.094 1.00 0.00 C ATOM 1122 CD1 LEU A 69 -10.381 11.710 -1.151 1.00 0.00 C ATOM 1123 CD2 LEU A 69 -8.685 10.164 -2.146 1.00 0.00 C ATOM 0 H LEU A 69 -5.530 13.470 -0.456 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.369 13.783 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.446 13.131 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.082 12.044 -1.786 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.759 10.800 -0.111 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.050 10.860 -1.013 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.555 12.440 -0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.574 12.170 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.377 9.335 -1.995 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.836 10.587 -3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.661 9.802 -2.058 1.00 0.00 H new ATOM 1135 N ASN A 70 -8.131 12.074 2.088 1.00 0.00 N ATOM 1136 CA ASN A 70 -7.961 11.151 3.204 1.00 0.00 C ATOM 1137 C ASN A 70 -8.824 9.906 3.017 1.00 0.00 C ATOM 1138 O ASN A 70 -9.940 9.983 2.502 1.00 0.00 O ATOM 1139 CB ASN A 70 -8.318 11.840 4.522 1.00 0.00 C ATOM 1140 CG ASN A 70 -7.984 13.319 4.510 1.00 0.00 C ATOM 1141 OD1 ASN A 70 -8.439 14.062 3.641 1.00 0.00 O ATOM 1142 ND2 ASN A 70 -7.185 13.753 5.479 1.00 0.00 N ATOM 0 H ASN A 70 -8.968 12.654 2.144 1.00 0.00 H new ATOM 0 HA ASN A 70 -6.915 10.845 3.234 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -9.382 11.712 4.719 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -7.782 11.356 5.339 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -6.926 14.738 5.523 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -6.831 13.101 6.179 1.00 0.00 H new ATOM 1149 N LYS A 71 -8.300 8.761 3.440 1.00 0.00 N ATOM 1150 CA LYS A 71 -9.021 7.499 3.322 1.00 0.00 C ATOM 1151 C LYS A 71 -10.325 7.542 4.113 1.00 0.00 C ATOM 1152 O LYS A 71 -11.216 6.718 3.907 1.00 0.00 O ATOM 1153 CB LYS A 71 -8.150 6.342 3.815 1.00 0.00 C ATOM 1154 CG LYS A 71 -7.907 6.360 5.314 1.00 0.00 C ATOM 1155 CD LYS A 71 -6.976 5.238 5.742 1.00 0.00 C ATOM 1156 CE LYS A 71 -7.177 4.873 7.205 1.00 0.00 C ATOM 1157 NZ LYS A 71 -8.473 4.175 7.429 1.00 0.00 N ATOM 0 H LYS A 71 -7.378 8.681 3.868 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.260 7.342 2.270 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.625 5.399 3.544 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -7.190 6.375 3.299 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.478 7.320 5.602 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.858 6.265 5.839 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.152 4.361 5.120 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -5.941 5.541 5.580 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.358 4.234 7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.141 5.777 7.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.869 4.464 8.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.138 4.426 6.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.318 3.147 7.427 1.00 0.00 H new ATOM 1171 N THR A 72 -10.430 8.509 5.020 1.00 0.00 N ATOM 1172 CA THR A 72 -11.624 8.659 5.841 1.00 0.00 C ATOM 1173 C THR A 72 -12.842 8.993 4.987 1.00 0.00 C ATOM 1174 O THR A 72 -13.981 8.783 5.403 1.00 0.00 O ATOM 1175 CB THR A 72 -11.440 9.759 6.904 1.00 0.00 C ATOM 1176 OG1 THR A 72 -10.087 9.767 7.372 1.00 0.00 O ATOM 1177 CG2 THR A 72 -12.387 9.544 8.075 1.00 0.00 C ATOM 0 H THR A 72 -9.702 9.199 5.204 1.00 0.00 H new ATOM 0 HA THR A 72 -11.785 7.704 6.340 1.00 0.00 H new ATOM 0 HB THR A 72 -11.670 10.720 6.444 1.00 0.00 H new ATOM 0 HG1 THR A 72 -9.978 10.470 8.046 1.00 0.00 H new ATOM 0 HG21 THR A 72 -12.239 10.333 8.812 1.00 0.00 H new ATOM 0 HG22 THR A 72 -13.417 9.569 7.719 1.00 0.00 H new ATOM 0 HG23 THR A 72 -12.185 8.576 8.533 1.00 0.00 H new ATOM 1185 N SER A 73 -12.593 9.513 3.789 1.00 0.00 N ATOM 1186 CA SER A 73 -13.670 9.879 2.876 1.00 0.00 C ATOM 1187 C SER A 73 -14.215 8.648 2.158 1.00 0.00 C ATOM 1188 O SER A 73 -15.375 8.617 1.748 1.00 0.00 O ATOM 1189 CB SER A 73 -13.175 10.903 1.853 1.00 0.00 C ATOM 1190 OG SER A 73 -12.602 12.029 2.495 1.00 0.00 O ATOM 0 H SER A 73 -11.656 9.690 3.428 1.00 0.00 H new ATOM 0 HA SER A 73 -14.475 10.322 3.462 1.00 0.00 H new ATOM 0 HB2 SER A 73 -12.437 10.440 1.198 1.00 0.00 H new ATOM 0 HB3 SER A 73 -14.005 11.223 1.223 1.00 0.00 H new ATOM 0 HG SER A 73 -12.292 12.668 1.820 1.00 0.00 H new ATOM 1196 N VAL A 74 -13.368 7.635 2.008 1.00 0.00 N ATOM 1197 CA VAL A 74 -13.763 6.400 1.341 1.00 0.00 C ATOM 1198 C VAL A 74 -13.969 5.273 2.346 1.00 0.00 C ATOM 1199 O VAL A 74 -14.348 4.161 1.979 1.00 0.00 O ATOM 1200 CB VAL A 74 -12.712 5.962 0.304 1.00 0.00 C ATOM 1201 CG1 VAL A 74 -12.175 7.166 -0.454 1.00 0.00 C ATOM 1202 CG2 VAL A 74 -11.582 5.200 0.980 1.00 0.00 C ATOM 0 H VAL A 74 -12.403 7.645 2.339 1.00 0.00 H new ATOM 0 HA VAL A 74 -14.704 6.604 0.831 1.00 0.00 H new ATOM 0 HB VAL A 74 -13.191 5.296 -0.413 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -11.434 6.837 -1.182 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -12.994 7.666 -0.971 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -11.711 7.860 0.247 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -10.848 4.898 0.232 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -11.103 5.841 1.720 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -11.984 4.314 1.472 1.00 0.00 H new ATOM 1212 N ARG A 75 -13.718 5.569 3.618 1.00 0.00 N ATOM 1213 CA ARG A 75 -13.875 4.580 4.677 1.00 0.00 C ATOM 1214 C ARG A 75 -15.302 4.040 4.710 1.00 0.00 C ATOM 1215 O ARG A 75 -15.543 2.844 4.548 1.00 0.00 O ATOM 1216 CB ARG A 75 -13.519 5.193 6.033 1.00 0.00 C ATOM 1217 CG ARG A 75 -12.075 4.961 6.446 1.00 0.00 C ATOM 1218 CD ARG A 75 -11.876 5.198 7.935 1.00 0.00 C ATOM 1219 NE ARG A 75 -12.725 4.328 8.745 1.00 0.00 N ATOM 1220 CZ ARG A 75 -12.770 4.375 10.072 1.00 0.00 C ATOM 1221 NH1 ARG A 75 -12.020 5.245 10.734 1.00 0.00 N ATOM 1222 NH2 ARG A 75 -13.568 3.550 10.739 1.00 0.00 N ATOM 0 H ARG A 75 -13.405 6.485 3.939 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.196 3.752 4.470 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -13.710 6.266 5.999 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -14.177 4.776 6.795 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -11.784 3.941 6.197 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -11.422 5.626 5.880 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -10.831 5.027 8.193 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -12.096 6.240 8.169 1.00 0.00 H new ATOM 0 HE ARG A 75 -13.315 3.648 8.266 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -11.406 5.881 10.225 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -12.057 5.279 11.753 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -14.147 2.880 10.233 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -13.602 3.586 11.758 1.00 0.00 H new ATOM 1236 N PRO A 76 -16.271 4.942 4.924 1.00 0.00 N ATOM 1237 CA PRO A 76 -17.691 4.581 4.983 1.00 0.00 C ATOM 1238 C PRO A 76 -18.241 4.168 3.622 1.00 0.00 C ATOM 1239 O PRO A 76 -19.333 3.611 3.526 1.00 0.00 O ATOM 1240 CB PRO A 76 -18.365 5.868 5.465 1.00 0.00 C ATOM 1241 CG PRO A 76 -17.444 6.959 5.042 1.00 0.00 C ATOM 1242 CD PRO A 76 -16.056 6.385 5.125 1.00 0.00 C ATOM 0 HA PRO A 76 -17.867 3.723 5.632 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -19.352 5.989 5.020 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -18.502 5.862 6.546 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -17.670 7.289 4.028 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -17.546 7.829 5.691 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -15.402 6.804 4.361 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -15.593 6.592 6.090 1.00 0.00 H new ATOM 1250 N GLY A 77 -17.475 4.445 2.571 1.00 0.00 N ATOM 1251 CA GLY A 77 -17.903 4.095 1.229 1.00 0.00 C ATOM 1252 C GLY A 77 -17.442 2.712 0.815 1.00 0.00 C ATOM 1253 O GLY A 77 -16.368 2.262 1.217 1.00 0.00 O ATOM 0 H GLY A 77 -16.566 4.905 2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -18.991 4.144 1.174 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -17.515 4.830 0.524 1.00 0.00 H new ATOM 1257 N LEU A 78 -18.254 2.035 0.011 1.00 0.00 N ATOM 1258 CA LEU A 78 -17.924 0.693 -0.457 1.00 0.00 C ATOM 1259 C LEU A 78 -17.935 -0.304 0.698 1.00 0.00 C ATOM 1260 O LEU A 78 -17.047 -1.148 0.813 1.00 0.00 O ATOM 1261 CB LEU A 78 -16.552 0.691 -1.134 1.00 0.00 C ATOM 1262 CG LEU A 78 -16.310 1.794 -2.164 1.00 0.00 C ATOM 1263 CD1 LEU A 78 -14.888 1.723 -2.699 1.00 0.00 C ATOM 1264 CD2 LEU A 78 -17.315 1.691 -3.302 1.00 0.00 C ATOM 0 H LEU A 78 -19.146 2.393 -0.331 1.00 0.00 H new ATOM 0 HA LEU A 78 -18.680 0.391 -1.181 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -15.788 0.770 -0.361 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -16.412 -0.273 -1.624 1.00 0.00 H new ATOM 0 HG LEU A 78 -16.444 2.758 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.735 2.516 -3.431 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.183 1.847 -1.877 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.726 0.755 -3.173 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.128 2.484 -4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -17.213 0.722 -3.791 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -18.325 1.793 -2.906 1.00 0.00 H new ATOM 1276 N LYS A 79 -18.949 -0.202 1.550 1.00 0.00 N ATOM 1277 CA LYS A 79 -19.081 -1.096 2.694 1.00 0.00 C ATOM 1278 C LYS A 79 -19.160 -2.551 2.242 1.00 0.00 C ATOM 1279 O LYS A 79 -18.531 -3.429 2.831 1.00 0.00 O ATOM 1280 CB LYS A 79 -20.325 -0.736 3.509 1.00 0.00 C ATOM 1281 CG LYS A 79 -20.276 0.658 4.110 1.00 0.00 C ATOM 1282 CD LYS A 79 -21.669 1.246 4.268 1.00 0.00 C ATOM 1283 CE LYS A 79 -22.419 0.599 5.422 1.00 0.00 C ATOM 1284 NZ LYS A 79 -23.784 1.170 5.587 1.00 0.00 N ATOM 0 H LYS A 79 -19.692 0.492 1.470 1.00 0.00 H new ATOM 0 HA LYS A 79 -18.197 -0.976 3.320 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -21.204 -0.816 2.869 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -20.447 -1.464 4.311 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -19.784 0.619 5.082 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -19.675 1.309 3.474 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -21.595 2.320 4.438 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -22.231 1.107 3.344 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -22.493 -0.475 5.250 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -21.854 0.736 6.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -24.262 0.702 6.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -23.713 2.190 5.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -24.332 1.017 4.716 1.00 0.00 H new ATOM 1298 N ASN A 80 -19.935 -2.798 1.191 1.00 0.00 N ATOM 1299 CA ASN A 80 -20.095 -4.146 0.659 1.00 0.00 C ATOM 1300 C ASN A 80 -18.765 -4.690 0.148 1.00 0.00 C ATOM 1301 O ASN A 80 -18.341 -5.782 0.529 1.00 0.00 O ATOM 1302 CB ASN A 80 -21.129 -4.153 -0.468 1.00 0.00 C ATOM 1303 CG ASN A 80 -21.449 -5.554 -0.952 1.00 0.00 C ATOM 1304 OD1 ASN A 80 -21.829 -6.422 -0.166 1.00 0.00 O ATOM 1305 ND2 ASN A 80 -21.296 -5.781 -2.251 1.00 0.00 N ATOM 0 H ASN A 80 -20.462 -2.082 0.691 1.00 0.00 H new ATOM 0 HA ASN A 80 -20.444 -4.789 1.467 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -22.044 -3.674 -0.120 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -20.756 -3.560 -1.303 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -21.496 -6.705 -2.634 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -20.979 -5.032 -2.866 1.00 0.00 H new ATOM 1312 N CYS A 81 -18.111 -3.922 -0.717 1.00 0.00 N ATOM 1313 CA CYS A 81 -16.829 -4.327 -1.281 1.00 0.00 C ATOM 1314 C CYS A 81 -15.688 -3.516 -0.676 1.00 0.00 C ATOM 1315 O CYS A 81 -15.265 -2.506 -1.237 1.00 0.00 O ATOM 1316 CB CYS A 81 -16.841 -4.158 -2.801 1.00 0.00 C ATOM 1317 SG CYS A 81 -18.082 -5.165 -3.646 1.00 0.00 S ATOM 0 H CYS A 81 -18.448 -3.016 -1.043 1.00 0.00 H new ATOM 0 HA CYS A 81 -16.670 -5.378 -1.041 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -17.018 -3.109 -3.038 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -15.856 -4.411 -3.192 1.00 0.00 H new ATOM 0 HG CYS A 81 -18.016 -4.951 -4.927 1.00 0.00 H new ATOM 1323 N GLY A 82 -15.195 -3.964 0.474 1.00 0.00 N ATOM 1324 CA GLY A 82 -14.109 -3.267 1.138 1.00 0.00 C ATOM 1325 C GLY A 82 -14.369 -3.063 2.617 1.00 0.00 C ATOM 1326 O GLY A 82 -15.520 -2.987 3.048 1.00 0.00 O ATOM 0 H GLY A 82 -15.528 -4.798 0.958 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.186 -3.832 1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.958 -2.298 0.662 1.00 0.00 H new ATOM 1330 N ASP A 83 -13.297 -2.976 3.398 1.00 0.00 N ATOM 1331 CA ASP A 83 -13.414 -2.781 4.838 1.00 0.00 C ATOM 1332 C ASP A 83 -12.346 -1.817 5.345 1.00 0.00 C ATOM 1333 O ASP A 83 -11.293 -1.661 4.727 1.00 0.00 O ATOM 1334 CB ASP A 83 -13.297 -4.121 5.567 1.00 0.00 C ATOM 1335 CG ASP A 83 -14.537 -4.978 5.406 1.00 0.00 C ATOM 1336 OD1 ASP A 83 -15.530 -4.727 6.122 1.00 0.00 O ATOM 1337 OD2 ASP A 83 -14.516 -5.899 4.563 1.00 0.00 O ATOM 0 H ASP A 83 -12.338 -3.038 3.057 1.00 0.00 H new ATOM 0 HA ASP A 83 -14.394 -2.349 5.043 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -12.432 -4.664 5.187 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -13.119 -3.940 6.627 1.00 0.00 H new ATOM 1342 N VAL A 84 -12.626 -1.172 6.473 1.00 0.00 N ATOM 1343 CA VAL A 84 -11.689 -0.223 7.063 1.00 0.00 C ATOM 1344 C VAL A 84 -10.264 -0.763 7.026 1.00 0.00 C ATOM 1345 O VAL A 84 -9.301 0.002 6.988 1.00 0.00 O ATOM 1346 CB VAL A 84 -12.065 0.104 8.520 1.00 0.00 C ATOM 1347 CG1 VAL A 84 -12.379 -1.169 9.290 1.00 0.00 C ATOM 1348 CG2 VAL A 84 -10.947 0.884 9.196 1.00 0.00 C ATOM 0 H VAL A 84 -13.494 -1.289 6.996 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.744 0.689 6.468 1.00 0.00 H new ATOM 0 HB VAL A 84 -12.960 0.726 8.515 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.642 -0.917 10.317 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -13.215 -1.684 8.817 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -11.505 -1.820 9.289 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -11.229 1.107 10.225 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.034 0.289 9.191 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -10.776 1.816 8.657 1.00 0.00 H new ATOM 1358 N ASN A 85 -10.137 -2.086 7.038 1.00 0.00 N ATOM 1359 CA ASN A 85 -8.829 -2.729 7.006 1.00 0.00 C ATOM 1360 C ASN A 85 -8.274 -2.764 5.585 1.00 0.00 C ATOM 1361 O ASN A 85 -7.173 -2.277 5.325 1.00 0.00 O ATOM 1362 CB ASN A 85 -8.922 -4.150 7.564 1.00 0.00 C ATOM 1363 CG ASN A 85 -10.274 -4.786 7.303 1.00 0.00 C ATOM 1364 OD1 ASN A 85 -10.336 -5.652 6.298 1.00 0.00 O flip ATOM 1365 ND2 ASN A 85 -11.250 -4.502 7.997 1.00 0.00 N flip ATOM 0 H ASN A 85 -10.924 -2.734 7.070 1.00 0.00 H new ATOM 0 HA ASN A 85 -8.150 -2.145 7.628 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -8.142 -4.765 7.116 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -8.735 -4.129 8.638 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -11.156 -3.831 8.759 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -12.153 -4.938 7.810 1.00 0.00 H new ATOM 1372 N CYS A 86 -9.044 -3.341 4.670 1.00 0.00 N ATOM 1373 CA CYS A 86 -8.630 -3.440 3.275 1.00 0.00 C ATOM 1374 C CYS A 86 -8.324 -2.061 2.699 1.00 0.00 C ATOM 1375 O CYS A 86 -7.412 -1.905 1.888 1.00 0.00 O ATOM 1376 CB CYS A 86 -9.719 -4.122 2.445 1.00 0.00 C ATOM 1377 SG CYS A 86 -10.451 -5.573 3.238 1.00 0.00 S ATOM 0 H CYS A 86 -9.958 -3.747 4.869 1.00 0.00 H new ATOM 0 HA CYS A 86 -7.722 -4.041 3.234 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -10.507 -3.399 2.235 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.297 -4.420 1.485 1.00 0.00 H new ATOM 0 HG CYS A 86 -10.198 -5.544 4.513 1.00 0.00 H new ATOM 1383 N ILE A 87 -9.094 -1.065 3.123 1.00 0.00 N ATOM 1384 CA ILE A 87 -8.906 0.301 2.650 1.00 0.00 C ATOM 1385 C ILE A 87 -7.468 0.763 2.863 1.00 0.00 C ATOM 1386 O ILE A 87 -6.716 0.948 1.907 1.00 0.00 O ATOM 1387 CB ILE A 87 -9.858 1.280 3.361 1.00 0.00 C ATOM 1388 CG1 ILE A 87 -11.314 0.925 3.051 1.00 0.00 C ATOM 1389 CG2 ILE A 87 -9.556 2.711 2.943 1.00 0.00 C ATOM 1390 CD1 ILE A 87 -12.282 1.341 4.136 1.00 0.00 C ATOM 0 H ILE A 87 -9.854 -1.178 3.793 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.131 0.299 1.583 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.704 1.196 4.437 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -11.604 1.401 2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.392 -0.151 2.899 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -10.237 3.391 3.454 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.529 2.959 3.209 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.685 2.810 1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.295 1.058 3.848 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -12.018 0.844 5.070 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.233 2.421 4.273 1.00 0.00 H new ATOM 1402 N GLY A 88 -7.092 0.945 4.125 1.00 0.00 N ATOM 1403 CA GLY A 88 -5.744 1.382 4.441 1.00 0.00 C ATOM 1404 C GLY A 88 -4.705 0.769 3.524 1.00 0.00 C ATOM 1405 O GLY A 88 -3.818 1.463 3.028 1.00 0.00 O ATOM 0 H GLY A 88 -7.696 0.798 4.934 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.692 2.468 4.369 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.513 1.119 5.473 1.00 0.00 H new ATOM 1409 N ARG A 89 -4.814 -0.536 3.299 1.00 0.00 N ATOM 1410 CA ARG A 89 -3.874 -1.244 2.438 1.00 0.00 C ATOM 1411 C ARG A 89 -3.811 -0.598 1.057 1.00 0.00 C ATOM 1412 O ARG A 89 -2.755 -0.131 0.627 1.00 0.00 O ATOM 1413 CB ARG A 89 -4.277 -2.714 2.307 1.00 0.00 C ATOM 1414 CG ARG A 89 -4.011 -3.532 3.560 1.00 0.00 C ATOM 1415 CD ARG A 89 -2.611 -4.124 3.553 1.00 0.00 C ATOM 1416 NE ARG A 89 -2.232 -4.651 4.861 1.00 0.00 N ATOM 1417 CZ ARG A 89 -1.935 -3.884 5.904 1.00 0.00 C ATOM 1418 NH1 ARG A 89 -1.974 -2.563 5.792 1.00 0.00 N ATOM 1419 NH2 ARG A 89 -1.600 -4.437 7.062 1.00 0.00 N ATOM 0 H ARG A 89 -5.544 -1.125 3.701 1.00 0.00 H new ATOM 0 HA ARG A 89 -2.886 -1.185 2.894 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -5.338 -2.771 2.065 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.735 -3.158 1.472 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -4.136 -2.902 4.440 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -4.746 -4.334 3.635 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.559 -4.922 2.812 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.896 -3.359 3.249 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.193 -5.663 4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.233 -2.134 4.903 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.746 -1.976 6.594 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.570 -5.453 7.152 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.372 -3.847 7.862 1.00 0.00 H new ATOM 1433 N ILE A 90 -4.946 -0.576 0.367 1.00 0.00 N ATOM 1434 CA ILE A 90 -5.019 0.012 -0.965 1.00 0.00 C ATOM 1435 C ILE A 90 -4.722 1.507 -0.922 1.00 0.00 C ATOM 1436 O ILE A 90 -3.793 1.986 -1.573 1.00 0.00 O ATOM 1437 CB ILE A 90 -6.404 -0.207 -1.602 1.00 0.00 C ATOM 1438 CG1 ILE A 90 -6.771 -1.692 -1.578 1.00 0.00 C ATOM 1439 CG2 ILE A 90 -6.421 0.325 -3.027 1.00 0.00 C ATOM 1440 CD1 ILE A 90 -8.198 -1.968 -1.997 1.00 0.00 C ATOM 0 H ILE A 90 -5.828 -0.959 0.708 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.266 -0.489 -1.573 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.146 0.341 -1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.095 -2.236 -2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.615 -2.081 -0.572 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -7.406 0.163 -3.464 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.198 1.392 -3.020 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.671 -0.198 -3.620 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -8.388 -3.041 -1.956 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -8.881 -1.452 -1.322 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -8.354 -1.610 -3.015 1.00 0.00 H new ATOM 1452 N HIS A 91 -5.517 2.241 -0.149 1.00 0.00 N ATOM 1453 CA HIS A 91 -5.338 3.683 -0.019 1.00 0.00 C ATOM 1454 C HIS A 91 -3.875 4.027 0.242 1.00 0.00 C ATOM 1455 O HIS A 91 -3.246 4.745 -0.537 1.00 0.00 O ATOM 1456 CB HIS A 91 -6.212 4.226 1.112 1.00 0.00 C ATOM 1457 CG HIS A 91 -6.413 5.709 1.054 1.00 0.00 C ATOM 1458 ND1 HIS A 91 -5.497 6.613 1.548 1.00 0.00 N ATOM 1459 CD2 HIS A 91 -7.433 6.445 0.555 1.00 0.00 C ATOM 1460 CE1 HIS A 91 -5.945 7.840 1.357 1.00 0.00 C ATOM 1461 NE2 HIS A 91 -7.118 7.766 0.755 1.00 0.00 N ATOM 0 H HIS A 91 -6.291 1.861 0.396 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.640 4.149 -0.957 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.184 3.734 1.077 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.758 3.966 2.068 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.328 6.064 0.087 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -5.438 8.750 1.644 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -7.696 8.561 0.483 1.00 0.00 H new ATOM 1469 N THR A 92 -3.338 3.512 1.344 1.00 0.00 N ATOM 1470 CA THR A 92 -1.950 3.767 1.708 1.00 0.00 C ATOM 1471 C THR A 92 -1.018 3.529 0.526 1.00 0.00 C ATOM 1472 O THR A 92 -0.424 4.466 -0.008 1.00 0.00 O ATOM 1473 CB THR A 92 -1.506 2.877 2.885 1.00 0.00 C ATOM 1474 OG1 THR A 92 -2.318 3.143 4.034 1.00 0.00 O ATOM 1475 CG2 THR A 92 -0.043 3.119 3.224 1.00 0.00 C ATOM 0 H THR A 92 -3.843 2.916 2.000 1.00 0.00 H new ATOM 0 HA THR A 92 -1.889 4.813 2.009 1.00 0.00 H new ATOM 0 HB THR A 92 -1.626 1.835 2.590 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.051 2.494 4.074 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.248 2.480 4.058 1.00 0.00 H new ATOM 0 HG22 THR A 92 0.575 2.887 2.356 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.098 4.164 3.501 1.00 0.00 H new ATOM 1483 N TYR A 93 -0.895 2.270 0.120 1.00 0.00 N ATOM 1484 CA TYR A 93 -0.034 1.909 -0.999 1.00 0.00 C ATOM 1485 C TYR A 93 -0.061 2.987 -2.078 1.00 0.00 C ATOM 1486 O TYR A 93 0.935 3.672 -2.315 1.00 0.00 O ATOM 1487 CB TYR A 93 -0.468 0.567 -1.592 1.00 0.00 C ATOM 1488 CG TYR A 93 0.190 0.248 -2.915 1.00 0.00 C ATOM 1489 CD1 TYR A 93 1.574 0.172 -3.025 1.00 0.00 C ATOM 1490 CD2 TYR A 93 -0.570 0.024 -4.056 1.00 0.00 C ATOM 1491 CE1 TYR A 93 2.180 -0.118 -4.232 1.00 0.00 C ATOM 1492 CE2 TYR A 93 0.027 -0.269 -5.267 1.00 0.00 C ATOM 1493 CZ TYR A 93 1.402 -0.338 -5.350 1.00 0.00 C ATOM 1494 OH TYR A 93 2.001 -0.628 -6.555 1.00 0.00 O ATOM 0 H TYR A 93 -1.381 1.483 0.549 1.00 0.00 H new ATOM 0 HA TYR A 93 0.986 1.821 -0.625 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.238 -0.226 -0.881 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.550 0.571 -1.726 1.00 0.00 H new ATOM 0 HD1 TYR A 93 2.186 0.343 -2.152 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -1.647 0.080 -3.995 1.00 0.00 H new ATOM 0 HE1 TYR A 93 3.256 -0.172 -4.300 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -0.579 -0.443 -6.144 1.00 0.00 H new ATOM 0 HH TYR A 93 1.432 -0.312 -7.288 1.00 0.00 H new ATOM 1504 N LEU A 94 -1.210 3.132 -2.730 1.00 0.00 N ATOM 1505 CA LEU A 94 -1.370 4.127 -3.785 1.00 0.00 C ATOM 1506 C LEU A 94 -0.726 5.451 -3.387 1.00 0.00 C ATOM 1507 O LEU A 94 -0.188 6.168 -4.230 1.00 0.00 O ATOM 1508 CB LEU A 94 -2.854 4.340 -4.090 1.00 0.00 C ATOM 1509 CG LEU A 94 -3.634 3.100 -4.528 1.00 0.00 C ATOM 1510 CD1 LEU A 94 -5.091 3.210 -4.105 1.00 0.00 C ATOM 1511 CD2 LEU A 94 -3.527 2.906 -6.034 1.00 0.00 C ATOM 0 H LEU A 94 -2.044 2.574 -2.547 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.870 3.756 -4.680 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.332 4.750 -3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.939 5.093 -4.873 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.199 2.229 -4.038 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.631 2.319 -4.425 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.149 3.300 -3.020 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.538 4.090 -4.566 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.088 2.019 -6.327 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.936 3.779 -6.543 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.480 2.781 -6.311 1.00 0.00 H new ATOM 1523 N GLU A 95 -0.782 5.767 -2.097 1.00 0.00 N ATOM 1524 CA GLU A 95 -0.202 7.004 -1.588 1.00 0.00 C ATOM 1525 C GLU A 95 1.319 6.902 -1.514 1.00 0.00 C ATOM 1526 O GLU A 95 2.029 7.889 -1.713 1.00 0.00 O ATOM 1527 CB GLU A 95 -0.770 7.328 -0.204 1.00 0.00 C ATOM 1528 CG GLU A 95 -0.409 8.718 0.291 1.00 0.00 C ATOM 1529 CD GLU A 95 -1.413 9.260 1.290 1.00 0.00 C ATOM 1530 OE1 GLU A 95 -2.585 8.832 1.247 1.00 0.00 O ATOM 1531 OE2 GLU A 95 -1.025 10.113 2.116 1.00 0.00 O ATOM 0 H GLU A 95 -1.223 5.184 -1.386 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.462 7.807 -2.277 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.855 7.233 -0.234 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.405 6.591 0.511 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.578 8.690 0.752 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.345 9.397 -0.559 1.00 0.00 H new ATOM 1538 N LEU A 96 1.812 5.703 -1.227 1.00 0.00 N ATOM 1539 CA LEU A 96 3.249 5.470 -1.126 1.00 0.00 C ATOM 1540 C LEU A 96 3.900 5.484 -2.505 1.00 0.00 C ATOM 1541 O LEU A 96 5.045 5.913 -2.658 1.00 0.00 O ATOM 1542 CB LEU A 96 3.522 4.134 -0.434 1.00 0.00 C ATOM 1543 CG LEU A 96 2.696 3.847 0.820 1.00 0.00 C ATOM 1544 CD1 LEU A 96 3.018 2.464 1.366 1.00 0.00 C ATOM 1545 CD2 LEU A 96 2.945 4.911 1.878 1.00 0.00 C ATOM 0 H LEU A 96 1.238 4.876 -1.060 1.00 0.00 H new ATOM 0 HA LEU A 96 3.682 6.274 -0.531 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.346 3.333 -1.152 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.578 4.095 -0.166 1.00 0.00 H new ATOM 0 HG LEU A 96 1.640 3.872 0.550 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.421 2.277 2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.788 1.712 0.611 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.077 2.411 1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.349 4.690 2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.002 4.918 2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.663 5.888 1.485 1.00 0.00 H new ATOM 1557 N ILE A 97 3.164 5.014 -3.507 1.00 0.00 N ATOM 1558 CA ILE A 97 3.670 4.976 -4.873 1.00 0.00 C ATOM 1559 C ILE A 97 3.512 6.330 -5.556 1.00 0.00 C ATOM 1560 O ILE A 97 4.140 6.599 -6.579 1.00 0.00 O ATOM 1561 CB ILE A 97 2.948 3.904 -5.711 1.00 0.00 C ATOM 1562 CG1 ILE A 97 1.436 3.983 -5.487 1.00 0.00 C ATOM 1563 CG2 ILE A 97 3.469 2.518 -5.360 1.00 0.00 C ATOM 1564 CD1 ILE A 97 0.635 3.168 -6.477 1.00 0.00 C ATOM 0 H ILE A 97 2.216 4.654 -3.398 1.00 0.00 H new ATOM 0 HA ILE A 97 4.729 4.725 -4.810 1.00 0.00 H new ATOM 0 HB ILE A 97 3.150 4.091 -6.766 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.208 3.640 -4.478 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.122 5.025 -5.548 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.949 1.771 -5.960 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.538 2.469 -5.565 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.293 2.320 -4.303 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.428 3.271 -6.258 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.833 3.525 -7.487 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.921 2.119 -6.400 1.00 0.00 H new ATOM 1576 N GLY A 98 2.668 7.182 -4.981 1.00 0.00 N ATOM 1577 CA GLY A 98 2.443 8.500 -5.547 1.00 0.00 C ATOM 1578 C GLY A 98 1.146 8.582 -6.327 1.00 0.00 C ATOM 1579 O GLY A 98 0.581 9.663 -6.492 1.00 0.00 O ATOM 0 H GLY A 98 2.136 6.983 -4.134 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.429 9.239 -4.746 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.275 8.757 -6.203 1.00 0.00 H new ATOM 1583 N ALA A 99 0.674 7.438 -6.809 1.00 0.00 N ATOM 1584 CA ALA A 99 -0.565 7.385 -7.575 1.00 0.00 C ATOM 1585 C ALA A 99 -1.569 8.414 -7.067 1.00 0.00 C ATOM 1586 O ALA A 99 -2.230 9.092 -7.854 1.00 0.00 O ATOM 1587 CB ALA A 99 -1.163 5.987 -7.517 1.00 0.00 C ATOM 0 H ALA A 99 1.131 6.535 -6.683 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.332 7.625 -8.612 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -2.088 5.963 -8.093 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.456 5.271 -7.935 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -1.375 5.724 -6.480 1.00 0.00 H new ATOM 1593 N ILE A 100 -1.680 8.523 -5.747 1.00 0.00 N ATOM 1594 CA ILE A 100 -2.604 9.469 -5.134 1.00 0.00 C ATOM 1595 C ILE A 100 -1.888 10.363 -4.127 1.00 0.00 C ATOM 1596 O ILE A 100 -0.842 9.998 -3.593 1.00 0.00 O ATOM 1597 CB ILE A 100 -3.765 8.745 -4.428 1.00 0.00 C ATOM 1598 CG1 ILE A 100 -3.223 7.695 -3.455 1.00 0.00 C ATOM 1599 CG2 ILE A 100 -4.689 8.101 -5.451 1.00 0.00 C ATOM 1600 CD1 ILE A 100 -4.277 7.128 -2.530 1.00 0.00 C ATOM 0 H ILE A 100 -1.142 7.968 -5.082 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.007 10.084 -5.939 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.339 9.477 -3.860 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.775 6.881 -4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.428 8.141 -2.857 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.504 7.593 -4.936 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.097 8.870 -6.107 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.128 7.378 -6.044 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.822 6.391 -1.869 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.709 7.932 -1.934 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.061 6.652 -3.120 1.00 0.00 H new ATOM 1612 N ASN A 101 -2.462 11.534 -3.871 1.00 0.00 N ATOM 1613 CA ASN A 101 -1.879 12.480 -2.926 1.00 0.00 C ATOM 1614 C ASN A 101 -0.362 12.540 -3.081 1.00 0.00 C ATOM 1615 O ASN A 101 0.374 12.521 -2.095 1.00 0.00 O ATOM 1616 CB ASN A 101 -2.241 12.089 -1.492 1.00 0.00 C ATOM 1617 CG ASN A 101 -3.687 11.649 -1.360 1.00 0.00 C ATOM 1618 OD1 ASN A 101 -4.584 12.239 -1.963 1.00 0.00 O ATOM 1619 ND2 ASN A 101 -3.919 10.609 -0.568 1.00 0.00 N ATOM 0 H ASN A 101 -3.330 11.851 -4.304 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.288 13.467 -3.141 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -1.587 11.282 -1.162 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.060 12.936 -0.831 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.872 10.268 -0.440 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -3.144 10.151 -0.088 1.00 0.00 H new ATOM 1626 N PHE A 102 0.097 12.611 -4.326 1.00 0.00 N ATOM 1627 CA PHE A 102 1.526 12.674 -4.611 1.00 0.00 C ATOM 1628 C PHE A 102 2.158 13.900 -3.960 1.00 0.00 C ATOM 1629 O PHE A 102 1.620 15.004 -4.038 1.00 0.00 O ATOM 1630 CB PHE A 102 1.765 12.704 -6.122 1.00 0.00 C ATOM 1631 CG PHE A 102 3.194 12.975 -6.497 1.00 0.00 C ATOM 1632 CD1 PHE A 102 4.162 11.996 -6.344 1.00 0.00 C ATOM 1633 CD2 PHE A 102 3.569 14.210 -7.002 1.00 0.00 C ATOM 1634 CE1 PHE A 102 5.478 12.242 -6.689 1.00 0.00 C ATOM 1635 CE2 PHE A 102 4.883 14.461 -7.349 1.00 0.00 C ATOM 1636 CZ PHE A 102 5.839 13.477 -7.191 1.00 0.00 C ATOM 0 H PHE A 102 -0.499 12.626 -5.153 1.00 0.00 H new ATOM 0 HA PHE A 102 1.994 11.782 -4.194 1.00 0.00 H new ATOM 0 HB2 PHE A 102 1.460 11.749 -6.549 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.129 13.469 -6.567 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.885 11.029 -5.951 1.00 0.00 H new ATOM 0 HD2 PHE A 102 2.826 14.984 -7.126 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.223 11.470 -6.566 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.162 15.427 -7.744 1.00 0.00 H new ATOM 0 HZ PHE A 102 6.867 13.673 -7.459 1.00 0.00 H new ATOM 1646 N GLY A 103 3.303 13.698 -3.316 1.00 0.00 N ATOM 1647 CA GLY A 103 3.990 14.795 -2.660 1.00 0.00 C ATOM 1648 C GLY A 103 3.032 15.760 -1.990 1.00 0.00 C ATOM 1649 O GLY A 103 2.742 16.831 -2.526 1.00 0.00 O ATOM 0 H GLY A 103 3.768 12.793 -3.237 1.00 0.00 H new ATOM 0 HA2 GLY A 103 4.678 14.395 -1.915 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.591 15.334 -3.393 1.00 0.00 H new ATOM 1653 N CYS A 104 2.538 15.381 -0.816 1.00 0.00 N ATOM 1654 CA CYS A 104 1.605 16.220 -0.073 1.00 0.00 C ATOM 1655 C CYS A 104 2.037 16.356 1.384 1.00 0.00 C ATOM 1656 O CYS A 104 2.212 15.360 2.084 1.00 0.00 O ATOM 1657 CB CYS A 104 0.193 15.637 -0.146 1.00 0.00 C ATOM 1658 SG CYS A 104 -0.739 16.141 -1.611 1.00 0.00 S ATOM 0 H CYS A 104 2.768 14.499 -0.359 1.00 0.00 H new ATOM 0 HA CYS A 104 1.605 17.211 -0.527 1.00 0.00 H new ATOM 0 HB2 CYS A 104 0.259 14.549 -0.127 1.00 0.00 H new ATOM 0 HB3 CYS A 104 -0.359 15.938 0.744 1.00 0.00 H new ATOM 0 HG CYS A 104 -0.069 15.829 -2.680 1.00 0.00 H new ATOM 1664 N GLU A 105 2.209 17.596 1.831 1.00 0.00 N ATOM 1665 CA GLU A 105 2.624 17.861 3.204 1.00 0.00 C ATOM 1666 C GLU A 105 1.852 16.983 4.185 1.00 0.00 C ATOM 1667 O GLU A 105 2.380 16.584 5.223 1.00 0.00 O ATOM 1668 CB GLU A 105 2.411 19.337 3.548 1.00 0.00 C ATOM 1669 CG GLU A 105 0.969 19.794 3.406 1.00 0.00 C ATOM 1670 CD GLU A 105 0.760 21.221 3.874 1.00 0.00 C ATOM 1671 OE1 GLU A 105 1.742 21.993 3.878 1.00 0.00 O ATOM 1672 OE2 GLU A 105 -0.384 21.565 4.237 1.00 0.00 O ATOM 0 H GLU A 105 2.068 18.432 1.264 1.00 0.00 H new ATOM 0 HA GLU A 105 3.685 17.624 3.288 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.740 19.514 4.572 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.042 19.947 2.901 1.00 0.00 H new ATOM 0 HG2 GLU A 105 0.666 19.710 2.362 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.323 19.129 3.980 1.00 0.00 H new ATOM 1679 N GLN A 106 0.601 16.686 3.847 1.00 0.00 N ATOM 1680 CA GLN A 106 -0.243 15.856 4.698 1.00 0.00 C ATOM 1681 C GLN A 106 -0.257 14.412 4.208 1.00 0.00 C ATOM 1682 O GLN A 106 -1.316 13.794 4.098 1.00 0.00 O ATOM 1683 CB GLN A 106 -1.668 16.410 4.733 1.00 0.00 C ATOM 1684 CG GLN A 106 -2.280 16.604 3.355 1.00 0.00 C ATOM 1685 CD GLN A 106 -1.952 17.958 2.757 1.00 0.00 C ATOM 1686 OE1 GLN A 106 -1.081 18.074 1.895 1.00 0.00 O ATOM 1687 NE2 GLN A 106 -2.651 18.991 3.212 1.00 0.00 N ATOM 0 H GLN A 106 0.150 17.008 2.990 1.00 0.00 H new ATOM 0 HA GLN A 106 0.171 15.874 5.706 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -2.298 15.732 5.309 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -1.665 17.365 5.258 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -1.921 15.820 2.688 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -3.362 16.494 3.423 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -3.364 18.849 3.927 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -2.475 19.927 2.846 1.00 0.00 H new ATOM 1696 N ALA A 107 0.925 13.880 3.916 1.00 0.00 N ATOM 1697 CA ALA A 107 1.048 12.508 3.439 1.00 0.00 C ATOM 1698 C ALA A 107 1.296 11.545 4.596 1.00 0.00 C ATOM 1699 O ALA A 107 1.900 11.912 5.604 1.00 0.00 O ATOM 1700 CB ALA A 107 2.168 12.404 2.415 1.00 0.00 C ATOM 0 H ALA A 107 1.811 14.378 4.001 1.00 0.00 H new ATOM 0 HA ALA A 107 0.108 12.229 2.963 1.00 0.00 H new ATOM 0 HB1 ALA A 107 2.249 11.374 2.067 1.00 0.00 H new ATOM 0 HB2 ALA A 107 1.950 13.056 1.569 1.00 0.00 H new ATOM 0 HB3 ALA A 107 3.109 12.707 2.873 1.00 0.00 H new ATOM 1706 N VAL A 108 0.825 10.312 4.444 1.00 0.00 N ATOM 1707 CA VAL A 108 0.996 9.296 5.476 1.00 0.00 C ATOM 1708 C VAL A 108 2.472 9.011 5.728 1.00 0.00 C ATOM 1709 O VAL A 108 2.853 8.560 6.809 1.00 0.00 O ATOM 1710 CB VAL A 108 0.289 7.982 5.093 1.00 0.00 C ATOM 1711 CG1 VAL A 108 0.764 7.497 3.732 1.00 0.00 C ATOM 1712 CG2 VAL A 108 0.523 6.921 6.158 1.00 0.00 C ATOM 0 H VAL A 108 0.322 9.992 3.616 1.00 0.00 H new ATOM 0 HA VAL A 108 0.545 9.691 6.386 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.783 8.171 5.031 1.00 0.00 H new ATOM 0 HG11 VAL A 108 0.254 6.568 3.478 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.540 8.252 2.978 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.840 7.323 3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.016 6.000 5.871 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.592 6.732 6.255 1.00 0.00 H new ATOM 0 HG23 VAL A 108 0.128 7.270 7.112 1.00 0.00 H new ATOM 1722 N TYR A 109 3.300 9.278 4.724 1.00 0.00 N ATOM 1723 CA TYR A 109 4.735 9.048 4.835 1.00 0.00 C ATOM 1724 C TYR A 109 5.443 10.283 5.384 1.00 0.00 C ATOM 1725 O TYR A 109 6.403 10.174 6.146 1.00 0.00 O ATOM 1726 CB TYR A 109 5.321 8.675 3.472 1.00 0.00 C ATOM 1727 CG TYR A 109 4.764 9.494 2.329 1.00 0.00 C ATOM 1728 CD1 TYR A 109 5.269 10.757 2.044 1.00 0.00 C ATOM 1729 CD2 TYR A 109 3.734 9.006 1.536 1.00 0.00 C ATOM 1730 CE1 TYR A 109 4.764 11.510 1.002 1.00 0.00 C ATOM 1731 CE2 TYR A 109 3.223 9.751 0.490 1.00 0.00 C ATOM 1732 CZ TYR A 109 3.741 11.002 0.228 1.00 0.00 C ATOM 1733 OH TYR A 109 3.234 11.748 -0.812 1.00 0.00 O ATOM 0 H TYR A 109 3.002 9.654 3.824 1.00 0.00 H new ATOM 0 HA TYR A 109 4.892 8.222 5.529 1.00 0.00 H new ATOM 0 HB2 TYR A 109 6.403 8.801 3.504 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.128 7.620 3.279 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.070 11.157 2.648 1.00 0.00 H new ATOM 0 HD2 TYR A 109 3.325 8.027 1.740 1.00 0.00 H new ATOM 0 HE1 TYR A 109 5.167 12.490 0.794 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.423 9.356 -0.118 1.00 0.00 H new ATOM 0 HH TYR A 109 2.520 11.246 -1.257 1.00 0.00 H new ATOM 1743 N ASN A 110 4.961 11.457 4.991 1.00 0.00 N ATOM 1744 CA ASN A 110 5.547 12.714 5.444 1.00 0.00 C ATOM 1745 C ASN A 110 5.533 12.804 6.967 1.00 0.00 C ATOM 1746 O ASN A 110 6.522 13.196 7.585 1.00 0.00 O ATOM 1747 CB ASN A 110 4.787 13.899 4.845 1.00 0.00 C ATOM 1748 CG ASN A 110 5.346 14.325 3.501 1.00 0.00 C ATOM 1749 OD1 ASN A 110 6.414 13.872 3.089 1.00 0.00 O ATOM 1750 ND2 ASN A 110 4.625 15.201 2.811 1.00 0.00 N ATOM 0 H ASN A 110 4.167 11.565 4.360 1.00 0.00 H new ATOM 0 HA ASN A 110 6.583 12.746 5.106 1.00 0.00 H new ATOM 0 HB2 ASN A 110 3.736 13.633 4.730 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.829 14.741 5.536 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.951 15.525 1.900 1.00 0.00 H new ATOM 0 HD22 ASN A 110 3.745 15.550 3.192 1.00 0.00 H new ATOM 1757 N ARG A 111 4.404 12.436 7.565 1.00 0.00 N ATOM 1758 CA ARG A 111 4.261 12.476 9.015 1.00 0.00 C ATOM 1759 C ARG A 111 4.670 11.144 9.639 1.00 0.00 C ATOM 1760 O ARG A 111 4.994 11.076 10.824 1.00 0.00 O ATOM 1761 CB ARG A 111 2.817 12.808 9.398 1.00 0.00 C ATOM 1762 CG ARG A 111 1.814 11.752 8.963 1.00 0.00 C ATOM 1763 CD ARG A 111 0.391 12.157 9.316 1.00 0.00 C ATOM 1764 NE ARG A 111 -0.583 11.606 8.378 1.00 0.00 N ATOM 1765 CZ ARG A 111 -1.896 11.635 8.581 1.00 0.00 C ATOM 1766 NH1 ARG A 111 -2.388 12.185 9.682 1.00 0.00 N ATOM 1767 NH2 ARG A 111 -2.719 11.113 7.680 1.00 0.00 N ATOM 0 H ARG A 111 3.576 12.107 7.068 1.00 0.00 H new ATOM 0 HA ARG A 111 4.920 13.255 9.398 1.00 0.00 H new ATOM 0 HB2 ARG A 111 2.756 12.932 10.479 1.00 0.00 H new ATOM 0 HB3 ARG A 111 2.542 13.764 8.952 1.00 0.00 H new ATOM 0 HG2 ARG A 111 1.893 11.595 7.887 1.00 0.00 H new ATOM 0 HG3 ARG A 111 2.053 10.802 9.442 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.156 11.816 10.324 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.314 13.244 9.321 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.237 11.176 7.521 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.758 12.588 10.376 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.396 12.206 9.835 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -2.344 10.689 6.831 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.727 11.135 7.836 1.00 0.00 H new TER 1781 ARG A 111