USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 849 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 44 TYR OH : rot 128:sc= 0.166 USER MOD Set 1.2: B 105 A O2' : rot 80:sc= 1.13 USER MOD Set 2.1: A 65 LYS NZ :NH3+ -146:sc= 0.0279 (180deg=-1.51!) USER MOD Set 2.2: A 72 MET CE :methyl 168:sc= -1.67 (180deg=-1.22) USER MOD Set 2.3: A 89 MET CE :methyl 176:sc= -2.17 (180deg=-1.3) USER MOD Set 3.1: A 36 LYS NZ :NH3+ -109:sc= 1.84 (180deg=-0.293) USER MOD Set 3.2: A 37 TYR OH : rot 180:sc= 0 USER MOD Set 3.3: A 75 MET CE :methyl 167:sc= -2.08 (180deg=-2.31!) USER MOD Set 4.1: A 26 SER OG : rot 180:sc= 0.122 USER MOD Set 4.2: A 29 THR OG1 : rot 87:sc= 0.128 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 132:sc= 0.0892 (180deg=-0.113) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 39:sc= 0.455 USER MOD Single : A 13 MET CE :methyl 170:sc= -0.0954 (180deg=-0.411) USER MOD Single : A 14 THR OG1 : rot 100:sc= -0.0912 USER MOD Single : A 15 SER OG : rot 14:sc= 1.95 USER MOD Single : A 17 LYS NZ :NH3+ -156:sc= 1.92 (180deg=1.28) USER MOD Single : A 20 ASN : amide:sc= -1.58 X(o=-1.6,f=-1.3) USER MOD Single : A 22 THR OG1 : rot -105:sc= 0.0825 USER MOD Single : A 23 TYR OH : rot 9:sc= 0.879 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.787 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 63 HIS :FLIP no HD1:sc= -0.9 F(o=-3.5!,f=-0.9) USER MOD Single : A 88 GLN : amide:sc= 0.417 K(o=0.42,f=-4.3!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 45:sc= 0.397 USER MOD Single : A 99 HIS : no HD1:sc= -0.392 X(o=-0.39,f=-0.41) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 80:sc= 0.787 USER MOD Single : B 102 U O2' : rot 155:sc= 0.396 USER MOD Single : B 102 U O5' : rot 180:sc= 0 USER MOD Single : B 103 G O2' : rot -17:sc= -0.566 USER MOD Single : B 104 G O2' : rot -61:sc= 0.0176 USER MOD Single : B 106 G O2' : rot 69:sc= 1.19 USER MOD Single : B 107 U O2' : rot -160:sc= -1.2 USER MOD Single : B 107 U O3' : rot 180:sc= -1.95 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.606 14.020 10.509 1.00 0.00 N ATOM 2 CA MET A 1 -13.960 14.816 9.447 1.00 0.00 C ATOM 3 C MET A 1 -13.676 13.962 8.219 1.00 0.00 C ATOM 4 O MET A 1 -13.716 12.734 8.291 1.00 0.00 O ATOM 5 CB MET A 1 -12.678 15.487 9.961 1.00 0.00 C ATOM 6 CG MET A 1 -11.616 14.458 10.347 1.00 0.00 C ATOM 7 SD MET A 1 -10.086 15.204 10.965 1.00 0.00 S ATOM 8 CE MET A 1 -9.139 13.690 11.268 1.00 0.00 C ATOM 0 H1 MET A 1 -14.124 14.193 11.414 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.605 14.296 10.591 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.545 13.009 10.271 1.00 0.00 H new ATOM 0 HA MET A 1 -14.653 15.604 9.153 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.280 16.149 9.192 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.914 16.108 10.825 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.023 13.795 11.111 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.386 13.841 9.479 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.154 13.949 11.657 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.665 13.071 11.995 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.027 13.138 10.335 1.00 0.00 H new ATOM 18 N SER A 2 -13.386 14.608 7.089 1.00 0.00 N ATOM 19 CA SER A 2 -13.087 13.931 5.837 1.00 0.00 C ATOM 20 C SER A 2 -12.126 14.761 4.991 1.00 0.00 C ATOM 21 O SER A 2 -11.791 15.890 5.340 1.00 0.00 O ATOM 22 CB SER A 2 -14.394 13.701 5.081 1.00 0.00 C ATOM 23 OG SER A 2 -14.964 14.937 4.709 1.00 0.00 O ATOM 0 H SER A 2 -13.353 15.625 7.022 1.00 0.00 H new ATOM 0 HA SER A 2 -12.607 12.975 6.047 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.208 13.096 4.194 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.091 13.144 5.706 1.00 0.00 H new ATOM 0 HG SER A 2 -15.800 14.779 4.224 1.00 0.00 H new ATOM 29 N TYR A 3 -11.682 14.190 3.870 1.00 0.00 N ATOM 30 CA TYR A 3 -10.767 14.840 2.941 1.00 0.00 C ATOM 31 C TYR A 3 -11.388 16.112 2.367 1.00 0.00 C ATOM 32 O TYR A 3 -10.740 17.155 2.303 1.00 0.00 O ATOM 33 CB TYR A 3 -10.474 13.854 1.806 1.00 0.00 C ATOM 34 CG TYR A 3 -9.627 12.679 2.239 1.00 0.00 C ATOM 35 CD1 TYR A 3 -10.236 11.523 2.746 1.00 0.00 C ATOM 36 CD2 TYR A 3 -8.229 12.752 2.133 1.00 0.00 C ATOM 37 CE1 TYR A 3 -9.444 10.434 3.153 1.00 0.00 C ATOM 38 CE2 TYR A 3 -7.436 11.668 2.534 1.00 0.00 C ATOM 39 CZ TYR A 3 -8.041 10.504 3.045 1.00 0.00 C ATOM 40 OH TYR A 3 -7.262 9.457 3.436 1.00 0.00 O ATOM 0 H TYR A 3 -11.954 13.250 3.581 1.00 0.00 H new ATOM 0 HA TYR A 3 -9.851 15.119 3.462 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -11.417 13.484 1.403 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -9.966 14.381 0.998 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -11.312 11.468 2.824 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -7.764 13.645 1.742 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -9.911 9.544 3.548 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -6.361 11.726 2.451 1.00 0.00 H new ATOM 0 HH TYR A 3 -7.693 8.615 3.180 1.00 0.00 H new ATOM 50 N GLY A 4 -12.649 16.009 1.951 1.00 0.00 N ATOM 51 CA GLY A 4 -13.388 17.094 1.343 1.00 0.00 C ATOM 52 C GLY A 4 -13.034 17.214 -0.129 1.00 0.00 C ATOM 53 O GLY A 4 -13.840 16.855 -0.984 1.00 0.00 O ATOM 0 H GLY A 4 -13.189 15.148 2.033 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.458 16.921 1.453 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.162 18.029 1.856 1.00 0.00 H new ATOM 57 N ARG A 5 -11.836 17.720 -0.428 1.00 0.00 N ATOM 58 CA ARG A 5 -11.414 18.021 -1.798 1.00 0.00 C ATOM 59 C ARG A 5 -9.980 18.565 -1.871 1.00 0.00 C ATOM 60 O ARG A 5 -9.760 19.618 -2.465 1.00 0.00 O ATOM 61 CB ARG A 5 -12.403 18.970 -2.474 1.00 0.00 C ATOM 62 CG ARG A 5 -12.817 20.121 -1.568 1.00 0.00 C ATOM 63 CD ARG A 5 -13.834 20.944 -2.326 1.00 0.00 C ATOM 64 NE ARG A 5 -13.227 21.703 -3.421 1.00 0.00 N ATOM 65 CZ ARG A 5 -13.940 22.426 -4.287 1.00 0.00 C ATOM 66 NH1 ARG A 5 -15.264 22.495 -4.176 1.00 0.00 N ATOM 67 NH2 ARG A 5 -13.329 23.087 -5.268 1.00 0.00 N ATOM 0 H ARG A 5 -11.129 17.933 0.275 1.00 0.00 H new ATOM 0 HA ARG A 5 -11.412 17.078 -2.344 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -11.954 19.370 -3.383 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -13.289 18.412 -2.775 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -13.243 19.744 -0.638 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -11.953 20.729 -1.300 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -14.605 20.286 -2.726 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -14.327 21.632 -1.639 1.00 0.00 H new ATOM 0 HE ARG A 5 -12.213 21.678 -3.527 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -15.740 21.994 -3.426 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -15.803 23.049 -4.841 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -12.314 23.041 -5.359 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.876 23.639 -5.929 1.00 0.00 H new ATOM 81 N PRO A 6 -8.991 17.878 -1.282 1.00 0.00 N ATOM 82 CA PRO A 6 -7.620 18.355 -1.250 1.00 0.00 C ATOM 83 C PRO A 6 -6.948 18.156 -2.613 1.00 0.00 C ATOM 84 O PRO A 6 -7.150 17.125 -3.251 1.00 0.00 O ATOM 85 CB PRO A 6 -6.943 17.491 -0.186 1.00 0.00 C ATOM 86 CG PRO A 6 -7.685 16.158 -0.300 1.00 0.00 C ATOM 87 CD PRO A 6 -9.114 16.592 -0.615 1.00 0.00 C ATOM 0 HA PRO A 6 -7.555 19.420 -1.026 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -5.876 17.377 -0.378 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.043 17.924 0.809 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -7.270 15.530 -1.088 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -7.631 15.585 0.625 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -9.613 15.864 -1.255 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -9.708 16.677 0.295 1.00 0.00 H new ATOM 95 N PRO A 7 -6.149 19.134 -3.063 1.00 0.00 N ATOM 96 CA PRO A 7 -5.336 19.022 -4.262 1.00 0.00 C ATOM 97 C PRO A 7 -4.058 18.230 -3.960 1.00 0.00 C ATOM 98 O PRO A 7 -3.223 18.681 -3.172 1.00 0.00 O ATOM 99 CB PRO A 7 -5.007 20.470 -4.627 1.00 0.00 C ATOM 100 CG PRO A 7 -4.936 21.171 -3.270 1.00 0.00 C ATOM 101 CD PRO A 7 -5.990 20.442 -2.442 1.00 0.00 C ATOM 0 HA PRO A 7 -5.842 18.497 -5.072 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -4.063 20.544 -5.167 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -5.774 20.908 -5.266 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -3.945 21.086 -2.825 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -5.157 22.235 -3.355 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -5.673 20.346 -1.403 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -6.932 20.990 -2.438 1.00 0.00 H new ATOM 109 N PRO A 8 -3.890 17.054 -4.573 1.00 0.00 N ATOM 110 CA PRO A 8 -2.722 16.213 -4.400 1.00 0.00 C ATOM 111 C PRO A 8 -1.596 16.657 -5.337 1.00 0.00 C ATOM 112 O PRO A 8 -1.653 17.734 -5.926 1.00 0.00 O ATOM 113 CB PRO A 8 -3.225 14.820 -4.769 1.00 0.00 C ATOM 114 CG PRO A 8 -4.182 15.119 -5.922 1.00 0.00 C ATOM 115 CD PRO A 8 -4.836 16.426 -5.478 1.00 0.00 C ATOM 0 HA PRO A 8 -2.308 16.257 -3.393 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.412 14.161 -5.075 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.732 14.335 -3.934 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.654 15.231 -6.869 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -4.915 14.324 -6.058 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.045 17.069 -6.333 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.787 16.238 -4.980 1.00 0.00 H new ATOM 123 N ASP A 9 -0.569 15.816 -5.477 1.00 0.00 N ATOM 124 CA ASP A 9 0.597 16.077 -6.312 1.00 0.00 C ATOM 125 C ASP A 9 0.913 14.858 -7.188 1.00 0.00 C ATOM 126 O ASP A 9 2.065 14.624 -7.547 1.00 0.00 O ATOM 127 CB ASP A 9 1.786 16.473 -5.428 1.00 0.00 C ATOM 128 CG ASP A 9 2.311 15.307 -4.592 1.00 0.00 C ATOM 129 OD1 ASP A 9 1.476 14.562 -4.031 1.00 0.00 O ATOM 130 OD2 ASP A 9 3.554 15.169 -4.519 1.00 0.00 O ATOM 0 H ASP A 9 -0.528 14.915 -5.001 1.00 0.00 H new ATOM 0 HA ASP A 9 0.386 16.909 -6.984 1.00 0.00 H new ATOM 0 HB2 ASP A 9 2.590 16.855 -6.057 1.00 0.00 H new ATOM 0 HB3 ASP A 9 1.487 17.285 -4.765 1.00 0.00 H new ATOM 135 N VAL A 10 -0.125 14.083 -7.520 1.00 0.00 N ATOM 136 CA VAL A 10 -0.028 12.845 -8.291 1.00 0.00 C ATOM 137 C VAL A 10 0.696 13.015 -9.622 1.00 0.00 C ATOM 138 O VAL A 10 1.144 12.035 -10.209 1.00 0.00 O ATOM 139 CB VAL A 10 -1.436 12.288 -8.548 1.00 0.00 C ATOM 140 CG1 VAL A 10 -2.210 12.158 -7.239 1.00 0.00 C ATOM 141 CG2 VAL A 10 -2.237 13.205 -9.475 1.00 0.00 C ATOM 0 H VAL A 10 -1.082 14.309 -7.250 1.00 0.00 H new ATOM 0 HA VAL A 10 0.564 12.151 -7.694 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.309 11.311 -9.015 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.205 11.762 -7.442 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.680 11.481 -6.569 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -2.299 13.138 -6.770 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.229 12.782 -9.637 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.332 14.190 -9.019 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.721 13.296 -10.431 1.00 0.00 H new ATOM 151 N GLU A 11 0.817 14.254 -10.104 1.00 0.00 N ATOM 152 CA GLU A 11 1.438 14.556 -11.379 1.00 0.00 C ATOM 153 C GLU A 11 2.964 14.500 -11.298 1.00 0.00 C ATOM 154 O GLU A 11 3.649 14.818 -12.272 1.00 0.00 O ATOM 155 CB GLU A 11 0.988 15.939 -11.843 1.00 0.00 C ATOM 156 CG GLU A 11 -0.533 15.979 -11.915 1.00 0.00 C ATOM 157 CD GLU A 11 -1.024 17.320 -12.455 1.00 0.00 C ATOM 158 OE1 GLU A 11 -1.192 18.251 -11.635 1.00 0.00 O ATOM 159 OE2 GLU A 11 -1.229 17.406 -13.690 1.00 0.00 O ATOM 0 H GLU A 11 0.480 15.079 -9.608 1.00 0.00 H new ATOM 0 HA GLU A 11 1.123 13.800 -12.098 1.00 0.00 H new ATOM 0 HB2 GLU A 11 1.351 16.702 -11.154 1.00 0.00 H new ATOM 0 HB3 GLU A 11 1.415 16.164 -12.820 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.891 15.173 -12.555 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -0.951 15.808 -10.923 1.00 0.00 H new ATOM 166 N GLY A 12 3.505 14.103 -10.143 1.00 0.00 N ATOM 167 CA GLY A 12 4.943 14.039 -9.940 1.00 0.00 C ATOM 168 C GLY A 12 5.334 13.007 -8.888 1.00 0.00 C ATOM 169 O GLY A 12 6.458 13.058 -8.391 1.00 0.00 O ATOM 0 H GLY A 12 2.957 13.820 -9.331 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.430 13.795 -10.884 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.309 15.020 -9.637 1.00 0.00 H new ATOM 173 N MET A 13 4.438 12.080 -8.537 1.00 0.00 N ATOM 174 CA MET A 13 4.779 11.046 -7.561 1.00 0.00 C ATOM 175 C MET A 13 4.223 9.666 -7.919 1.00 0.00 C ATOM 176 O MET A 13 3.374 9.528 -8.796 1.00 0.00 O ATOM 177 CB MET A 13 4.412 11.520 -6.148 1.00 0.00 C ATOM 178 CG MET A 13 2.924 11.781 -5.925 1.00 0.00 C ATOM 179 SD MET A 13 1.915 10.292 -5.739 1.00 0.00 S ATOM 180 CE MET A 13 0.563 10.995 -4.767 1.00 0.00 C ATOM 0 H MET A 13 3.489 12.025 -8.907 1.00 0.00 H new ATOM 0 HA MET A 13 5.859 10.898 -7.586 1.00 0.00 H new ATOM 0 HB2 MET A 13 4.746 10.771 -5.431 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.963 12.435 -5.933 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.807 12.397 -5.033 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.541 12.360 -6.765 1.00 0.00 H new ATOM 0 HE1 MET A 13 -0.251 10.273 -4.700 1.00 0.00 H new ATOM 0 HE2 MET A 13 0.920 11.232 -3.765 1.00 0.00 H new ATOM 0 HE3 MET A 13 0.203 11.904 -5.249 1.00 0.00 H new ATOM 190 N THR A 14 4.732 8.648 -7.213 1.00 0.00 N ATOM 191 CA THR A 14 4.570 7.229 -7.527 1.00 0.00 C ATOM 192 C THR A 14 3.127 6.698 -7.530 1.00 0.00 C ATOM 193 O THR A 14 2.847 5.737 -8.245 1.00 0.00 O ATOM 194 CB THR A 14 5.463 6.451 -6.557 1.00 0.00 C ATOM 195 OG1 THR A 14 6.810 6.725 -6.875 1.00 0.00 O ATOM 196 CG2 THR A 14 5.257 4.942 -6.651 1.00 0.00 C ATOM 0 H THR A 14 5.291 8.801 -6.373 1.00 0.00 H new ATOM 0 HA THR A 14 4.870 7.086 -8.565 1.00 0.00 H new ATOM 0 HB THR A 14 5.203 6.766 -5.546 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.161 7.399 -6.257 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.915 4.440 -5.942 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.220 4.701 -6.417 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.489 4.605 -7.662 1.00 0.00 H new ATOM 203 N SER A 15 2.216 7.297 -6.757 1.00 0.00 N ATOM 204 CA SER A 15 0.812 6.878 -6.662 1.00 0.00 C ATOM 205 C SER A 15 0.619 5.360 -6.537 1.00 0.00 C ATOM 206 O SER A 15 -0.313 4.812 -7.120 1.00 0.00 O ATOM 207 CB SER A 15 0.029 7.428 -7.852 1.00 0.00 C ATOM 208 OG SER A 15 -0.027 8.838 -7.800 1.00 0.00 O ATOM 0 H SER A 15 2.436 8.101 -6.169 1.00 0.00 H new ATOM 0 HA SER A 15 0.425 7.296 -5.733 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.500 7.111 -8.782 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.981 7.018 -7.851 1.00 0.00 H new ATOM 0 HG SER A 15 0.622 9.167 -7.144 1.00 0.00 H new ATOM 214 N LEU A 16 1.484 4.667 -5.786 1.00 0.00 N ATOM 215 CA LEU A 16 1.402 3.209 -5.650 1.00 0.00 C ATOM 216 C LEU A 16 0.078 2.823 -4.991 1.00 0.00 C ATOM 217 O LEU A 16 -0.302 3.410 -3.980 1.00 0.00 O ATOM 218 CB LEU A 16 2.648 2.729 -4.892 1.00 0.00 C ATOM 219 CG LEU A 16 2.680 1.301 -4.322 1.00 0.00 C ATOM 220 CD1 LEU A 16 1.792 1.136 -3.094 1.00 0.00 C ATOM 221 CD2 LEU A 16 2.336 0.252 -5.372 1.00 0.00 C ATOM 0 H LEU A 16 2.249 5.094 -5.263 1.00 0.00 H new ATOM 0 HA LEU A 16 1.401 2.710 -6.619 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.500 2.832 -5.564 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.811 3.416 -4.062 1.00 0.00 H new ATOM 0 HG LEU A 16 3.710 1.137 -4.006 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.854 0.109 -2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.126 1.815 -2.310 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.760 1.366 -3.358 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.372 -0.740 -4.921 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.334 0.439 -5.758 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.056 0.305 -6.189 1.00 0.00 H new ATOM 233 N LYS A 17 -0.618 1.834 -5.563 1.00 0.00 N ATOM 234 CA LYS A 17 -1.980 1.477 -5.175 1.00 0.00 C ATOM 235 C LYS A 17 -2.022 0.296 -4.206 1.00 0.00 C ATOM 236 O LYS A 17 -1.171 -0.588 -4.254 1.00 0.00 O ATOM 237 CB LYS A 17 -2.765 1.126 -6.448 1.00 0.00 C ATOM 238 CG LYS A 17 -4.154 0.562 -6.131 1.00 0.00 C ATOM 239 CD LYS A 17 -4.840 0.002 -7.373 1.00 0.00 C ATOM 240 CE LYS A 17 -6.062 -0.793 -6.916 1.00 0.00 C ATOM 241 NZ LYS A 17 -6.584 -1.677 -7.975 1.00 0.00 N ATOM 0 H LYS A 17 -0.244 1.255 -6.315 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.423 2.328 -4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.869 2.017 -7.067 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.202 0.397 -7.031 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.064 -0.224 -5.381 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.774 1.347 -5.697 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.138 0.810 -8.041 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -4.156 -0.637 -7.931 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -5.798 -1.391 -6.044 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.845 -0.103 -6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.589 -1.875 -7.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -6.481 -1.211 -8.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -6.050 -2.570 -7.976 1.00 0.00 H new ATOM 255 N VAL A 18 -3.032 0.298 -3.332 1.00 0.00 N ATOM 256 CA VAL A 18 -3.392 -0.852 -2.496 1.00 0.00 C ATOM 257 C VAL A 18 -4.879 -1.144 -2.693 1.00 0.00 C ATOM 258 O VAL A 18 -5.659 -0.220 -2.924 1.00 0.00 O ATOM 259 CB VAL A 18 -3.167 -0.557 -1.010 1.00 0.00 C ATOM 260 CG1 VAL A 18 -3.638 -1.742 -0.161 1.00 0.00 C ATOM 261 CG2 VAL A 18 -1.697 -0.265 -0.713 1.00 0.00 C ATOM 0 H VAL A 18 -3.632 1.110 -3.183 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.768 -1.697 -2.788 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.748 0.330 -0.756 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.474 -1.522 0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.700 -1.914 -0.334 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.076 -2.634 -0.438 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.574 -0.060 0.351 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.092 -1.129 -0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.375 0.602 -1.289 1.00 0.00 H new ATOM 271 N ASP A 19 -5.258 -2.424 -2.597 1.00 0.00 N ATOM 272 CA ASP A 19 -6.640 -2.892 -2.663 1.00 0.00 C ATOM 273 C ASP A 19 -6.787 -4.235 -1.937 1.00 0.00 C ATOM 274 O ASP A 19 -5.817 -4.726 -1.357 1.00 0.00 O ATOM 275 CB ASP A 19 -7.073 -3.008 -4.131 1.00 0.00 C ATOM 276 CG ASP A 19 -6.265 -4.022 -4.935 1.00 0.00 C ATOM 277 OD1 ASP A 19 -5.220 -3.618 -5.493 1.00 0.00 O ATOM 278 OD2 ASP A 19 -6.706 -5.192 -4.987 1.00 0.00 O ATOM 0 H ASP A 19 -4.588 -3.182 -2.467 1.00 0.00 H new ATOM 0 HA ASP A 19 -7.288 -2.172 -2.163 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.126 -3.286 -4.168 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -6.984 -2.030 -4.604 1.00 0.00 H new ATOM 283 N ASN A 20 -7.995 -4.823 -1.971 1.00 0.00 N ATOM 284 CA ASN A 20 -8.287 -6.182 -1.502 1.00 0.00 C ATOM 285 C ASN A 20 -8.569 -6.259 -0.001 1.00 0.00 C ATOM 286 O ASN A 20 -8.152 -7.203 0.667 1.00 0.00 O ATOM 287 CB ASN A 20 -7.166 -7.118 -1.933 1.00 0.00 C ATOM 288 CG ASN A 20 -7.561 -8.575 -1.971 1.00 0.00 C ATOM 289 OD1 ASN A 20 -8.676 -8.922 -2.351 1.00 0.00 O ATOM 290 ND2 ASN A 20 -6.640 -9.442 -1.574 1.00 0.00 N ATOM 0 H ASN A 20 -8.819 -4.347 -2.338 1.00 0.00 H new ATOM 0 HA ASN A 20 -9.216 -6.505 -1.971 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -6.819 -6.821 -2.923 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.324 -6.998 -1.251 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.845 -10.441 -1.577 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.726 -9.110 -1.266 1.00 0.00 H new ATOM 297 N LEU A 21 -9.276 -5.259 0.532 1.00 0.00 N ATOM 298 CA LEU A 21 -9.647 -5.189 1.931 1.00 0.00 C ATOM 299 C LEU A 21 -10.482 -6.412 2.283 1.00 0.00 C ATOM 300 O LEU A 21 -11.347 -6.829 1.516 1.00 0.00 O ATOM 301 CB LEU A 21 -10.488 -3.926 2.162 1.00 0.00 C ATOM 302 CG LEU A 21 -9.706 -2.604 2.171 1.00 0.00 C ATOM 303 CD1 LEU A 21 -9.297 -2.276 3.600 1.00 0.00 C ATOM 304 CD2 LEU A 21 -8.443 -2.617 1.303 1.00 0.00 C ATOM 0 H LEU A 21 -9.609 -4.465 -0.015 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.752 -5.158 2.553 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -11.251 -3.871 1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -11.009 -4.026 3.114 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.376 -1.854 1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -8.741 -1.338 3.613 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -10.188 -2.179 4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.668 -3.076 3.991 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.949 -1.647 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.765 -3.392 1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.715 -2.821 0.267 1.00 0.00 H new ATOM 316 N THR A 22 -10.214 -6.988 3.448 1.00 0.00 N ATOM 317 CA THR A 22 -10.984 -8.111 3.949 1.00 0.00 C ATOM 318 C THR A 22 -12.282 -7.607 4.578 1.00 0.00 C ATOM 319 O THR A 22 -12.431 -6.412 4.832 1.00 0.00 O ATOM 320 CB THR A 22 -10.127 -8.885 4.957 1.00 0.00 C ATOM 321 OG1 THR A 22 -8.826 -9.042 4.433 1.00 0.00 O ATOM 322 CG2 THR A 22 -10.694 -10.272 5.238 1.00 0.00 C ATOM 0 H THR A 22 -9.460 -6.689 4.067 1.00 0.00 H new ATOM 0 HA THR A 22 -11.254 -8.784 3.135 1.00 0.00 H new ATOM 0 HB THR A 22 -10.117 -8.317 5.887 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.705 -9.966 4.129 1.00 0.00 H new ATOM 0 HG21 THR A 22 -10.057 -10.787 5.957 1.00 0.00 H new ATOM 0 HG22 THR A 22 -11.700 -10.178 5.647 1.00 0.00 H new ATOM 0 HG23 THR A 22 -10.731 -10.845 4.311 1.00 0.00 H new ATOM 329 N TYR A 23 -13.225 -8.517 4.828 1.00 0.00 N ATOM 330 CA TYR A 23 -14.525 -8.218 5.436 1.00 0.00 C ATOM 331 C TYR A 23 -14.417 -7.667 6.861 1.00 0.00 C ATOM 332 O TYR A 23 -15.435 -7.482 7.531 1.00 0.00 O ATOM 333 CB TYR A 23 -15.355 -9.502 5.438 1.00 0.00 C ATOM 334 CG TYR A 23 -14.706 -10.630 6.210 1.00 0.00 C ATOM 335 CD1 TYR A 23 -13.810 -11.498 5.565 1.00 0.00 C ATOM 336 CD2 TYR A 23 -14.992 -10.807 7.572 1.00 0.00 C ATOM 337 CE1 TYR A 23 -13.198 -12.538 6.278 1.00 0.00 C ATOM 338 CE2 TYR A 23 -14.376 -11.839 8.295 1.00 0.00 C ATOM 339 CZ TYR A 23 -13.471 -12.708 7.649 1.00 0.00 C ATOM 340 OH TYR A 23 -12.864 -13.710 8.346 1.00 0.00 O ATOM 0 H TYR A 23 -13.104 -9.506 4.609 1.00 0.00 H new ATOM 0 HA TYR A 23 -14.999 -7.435 4.844 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -16.335 -9.293 5.868 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -15.520 -9.822 4.409 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -13.592 -11.364 4.516 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -15.689 -10.146 8.066 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -12.517 -13.209 5.776 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -14.594 -11.968 9.345 1.00 0.00 H new ATOM 0 HH TYR A 23 -12.169 -14.120 7.790 1.00 0.00 H new ATOM 350 N ARG A 24 -13.196 -7.406 7.333 1.00 0.00 N ATOM 351 CA ARG A 24 -12.900 -6.983 8.697 1.00 0.00 C ATOM 352 C ARG A 24 -11.904 -5.824 8.716 1.00 0.00 C ATOM 353 O ARG A 24 -11.254 -5.585 9.732 1.00 0.00 O ATOM 354 CB ARG A 24 -12.377 -8.197 9.463 1.00 0.00 C ATOM 355 CG ARG A 24 -11.103 -8.733 8.804 1.00 0.00 C ATOM 356 CD ARG A 24 -10.831 -10.130 9.356 1.00 0.00 C ATOM 357 NE ARG A 24 -9.681 -10.762 8.704 1.00 0.00 N ATOM 358 CZ ARG A 24 -9.202 -11.962 9.047 1.00 0.00 C ATOM 359 NH1 ARG A 24 -9.742 -12.653 10.048 1.00 0.00 N ATOM 360 NH2 ARG A 24 -8.173 -12.481 8.386 1.00 0.00 N ATOM 0 H ARG A 24 -12.360 -7.487 6.754 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.804 -6.610 9.179 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -12.171 -7.922 10.497 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -13.138 -8.977 9.486 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.222 -8.769 7.721 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.261 -8.072 9.011 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -10.650 -10.067 10.429 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -11.714 -10.753 9.217 1.00 0.00 H new ATOM 0 HE ARG A 24 -9.220 -10.258 7.946 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -10.532 -12.268 10.565 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.365 -13.567 10.298 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -7.748 -11.964 7.616 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -7.808 -13.397 8.648 1.00 0.00 H new ATOM 374 N THR A 25 -11.783 -5.113 7.592 1.00 0.00 N ATOM 375 CA THR A 25 -10.843 -4.000 7.455 1.00 0.00 C ATOM 376 C THR A 25 -11.580 -2.722 7.039 1.00 0.00 C ATOM 377 O THR A 25 -12.730 -2.777 6.602 1.00 0.00 O ATOM 378 CB THR A 25 -9.746 -4.372 6.446 1.00 0.00 C ATOM 379 OG1 THR A 25 -9.358 -5.714 6.635 1.00 0.00 O ATOM 380 CG2 THR A 25 -8.501 -3.504 6.638 1.00 0.00 C ATOM 0 H THR A 25 -12.334 -5.293 6.753 1.00 0.00 H new ATOM 0 HA THR A 25 -10.371 -3.805 8.418 1.00 0.00 H new ATOM 0 HB THR A 25 -10.155 -4.217 5.447 1.00 0.00 H new ATOM 0 HG1 THR A 25 -8.660 -5.947 5.988 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.742 -3.790 5.910 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.763 -2.456 6.496 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.110 -3.647 7.645 1.00 0.00 H new ATOM 387 N SER A 26 -10.913 -1.575 7.175 1.00 0.00 N ATOM 388 CA SER A 26 -11.490 -0.257 6.916 1.00 0.00 C ATOM 389 C SER A 26 -10.392 0.690 6.427 1.00 0.00 C ATOM 390 O SER A 26 -9.210 0.372 6.567 1.00 0.00 O ATOM 391 CB SER A 26 -12.095 0.251 8.226 1.00 0.00 C ATOM 392 OG SER A 26 -11.067 0.471 9.171 1.00 0.00 O ATOM 0 H SER A 26 -9.939 -1.536 7.474 1.00 0.00 H new ATOM 0 HA SER A 26 -12.261 -0.310 6.148 1.00 0.00 H new ATOM 0 HB2 SER A 26 -12.644 1.176 8.050 1.00 0.00 H new ATOM 0 HB3 SER A 26 -12.809 -0.475 8.614 1.00 0.00 H new ATOM 0 HG SER A 26 -11.457 0.798 10.009 1.00 0.00 H new ATOM 398 N PRO A 27 -10.741 1.852 5.856 1.00 0.00 N ATOM 399 CA PRO A 27 -9.754 2.776 5.321 1.00 0.00 C ATOM 400 C PRO A 27 -8.957 3.460 6.428 1.00 0.00 C ATOM 401 O PRO A 27 -7.830 3.887 6.210 1.00 0.00 O ATOM 402 CB PRO A 27 -10.557 3.791 4.513 1.00 0.00 C ATOM 403 CG PRO A 27 -11.924 3.796 5.191 1.00 0.00 C ATOM 404 CD PRO A 27 -12.089 2.357 5.668 1.00 0.00 C ATOM 0 HA PRO A 27 -9.014 2.258 4.710 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -10.095 4.778 4.538 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -10.631 3.500 3.465 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.958 4.501 6.022 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -12.715 4.082 4.498 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -12.657 2.315 6.597 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.632 1.761 4.935 1.00 0.00 H new ATOM 412 N ASP A 28 -9.530 3.568 7.626 1.00 0.00 N ATOM 413 CA ASP A 28 -8.804 4.155 8.743 1.00 0.00 C ATOM 414 C ASP A 28 -7.667 3.234 9.155 1.00 0.00 C ATOM 415 O ASP A 28 -6.601 3.695 9.565 1.00 0.00 O ATOM 416 CB ASP A 28 -9.737 4.363 9.933 1.00 0.00 C ATOM 417 CG ASP A 28 -9.054 5.177 11.030 1.00 0.00 C ATOM 418 OD1 ASP A 28 -8.848 6.389 10.799 1.00 0.00 O ATOM 419 OD2 ASP A 28 -8.749 4.580 12.087 1.00 0.00 O ATOM 0 H ASP A 28 -10.478 3.262 7.843 1.00 0.00 H new ATOM 0 HA ASP A 28 -8.404 5.119 8.430 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -10.641 4.875 9.605 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -10.045 3.396 10.331 1.00 0.00 H new ATOM 424 N THR A 29 -7.888 1.921 9.038 1.00 0.00 N ATOM 425 CA THR A 29 -6.856 0.947 9.333 1.00 0.00 C ATOM 426 C THR A 29 -5.855 0.927 8.187 1.00 0.00 C ATOM 427 O THR A 29 -4.653 0.894 8.415 1.00 0.00 O ATOM 428 CB THR A 29 -7.481 -0.434 9.520 1.00 0.00 C ATOM 429 OG1 THR A 29 -8.380 -0.412 10.607 1.00 0.00 O ATOM 430 CG2 THR A 29 -6.385 -1.456 9.813 1.00 0.00 C ATOM 0 H THR A 29 -8.776 1.517 8.740 1.00 0.00 H new ATOM 0 HA THR A 29 -6.343 1.218 10.256 1.00 0.00 H new ATOM 0 HB THR A 29 -8.013 -0.706 8.608 1.00 0.00 H new ATOM 0 HG1 THR A 29 -9.265 -0.130 10.294 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.832 -2.441 9.946 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.683 -1.486 8.980 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.856 -1.172 10.723 1.00 0.00 H new ATOM 437 N LEU A 30 -6.330 0.952 6.941 1.00 0.00 N ATOM 438 CA LEU A 30 -5.437 0.946 5.796 1.00 0.00 C ATOM 439 C LEU A 30 -4.449 2.107 5.864 1.00 0.00 C ATOM 440 O LEU A 30 -3.378 2.046 5.268 1.00 0.00 O ATOM 441 CB LEU A 30 -6.271 1.005 4.512 1.00 0.00 C ATOM 442 CG LEU A 30 -6.032 -0.193 3.589 1.00 0.00 C ATOM 443 CD1 LEU A 30 -4.633 -0.160 2.993 1.00 0.00 C ATOM 444 CD2 LEU A 30 -6.193 -1.519 4.335 1.00 0.00 C ATOM 0 H LEU A 30 -7.322 0.976 6.706 1.00 0.00 H new ATOM 0 HA LEU A 30 -4.851 0.027 5.802 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.328 1.050 4.774 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -6.036 1.924 3.974 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.778 -0.122 2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.494 -1.024 2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.506 0.755 2.414 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.895 -0.187 3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.016 -2.347 3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.474 -1.566 5.153 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -7.204 -1.590 4.736 1.00 0.00 H new ATOM 456 N ARG A 31 -4.803 3.172 6.593 1.00 0.00 N ATOM 457 CA ARG A 31 -3.937 4.332 6.718 1.00 0.00 C ATOM 458 C ARG A 31 -2.870 4.058 7.760 1.00 0.00 C ATOM 459 O ARG A 31 -1.686 4.166 7.457 1.00 0.00 O ATOM 460 CB ARG A 31 -4.770 5.543 7.137 1.00 0.00 C ATOM 461 CG ARG A 31 -3.887 6.779 7.379 1.00 0.00 C ATOM 462 CD ARG A 31 -3.056 7.148 6.146 1.00 0.00 C ATOM 463 NE ARG A 31 -2.167 8.277 6.425 1.00 0.00 N ATOM 464 CZ ARG A 31 -1.961 9.316 5.612 1.00 0.00 C ATOM 465 NH1 ARG A 31 -2.608 9.421 4.454 1.00 0.00 N ATOM 466 NH2 ARG A 31 -1.098 10.260 5.966 1.00 0.00 N ATOM 0 H ARG A 31 -5.684 3.247 7.102 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.458 4.536 5.760 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -5.505 5.766 6.363 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -5.325 5.308 8.045 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.517 7.624 7.657 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.221 6.588 8.220 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.467 6.287 5.831 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.720 7.400 5.319 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.664 8.269 7.312 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.274 8.701 4.175 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.438 10.222 3.846 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.599 10.188 6.853 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.934 11.057 5.352 1.00 0.00 H new ATOM 480 N ARG A 32 -3.266 3.698 8.986 1.00 0.00 N ATOM 481 CA ARG A 32 -2.293 3.457 10.047 1.00 0.00 C ATOM 482 C ARG A 32 -1.358 2.308 9.670 1.00 0.00 C ATOM 483 O ARG A 32 -0.210 2.266 10.108 1.00 0.00 O ATOM 484 CB ARG A 32 -3.025 3.156 11.357 1.00 0.00 C ATOM 485 CG ARG A 32 -3.344 1.664 11.430 1.00 0.00 C ATOM 486 CD ARG A 32 -4.178 1.312 12.642 1.00 0.00 C ATOM 487 NE ARG A 32 -3.460 1.562 13.896 1.00 0.00 N ATOM 488 CZ ARG A 32 -4.016 1.469 15.107 1.00 0.00 C ATOM 489 NH1 ARG A 32 -5.295 1.124 15.249 1.00 0.00 N ATOM 490 NH2 ARG A 32 -3.292 1.723 16.192 1.00 0.00 N ATOM 0 H ARG A 32 -4.240 3.570 9.262 1.00 0.00 H new ATOM 0 HA ARG A 32 -1.684 4.351 10.181 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.408 3.449 12.207 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.944 3.739 11.415 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.876 1.364 10.527 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -2.413 1.097 11.455 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -5.099 1.895 12.630 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -4.465 0.262 12.592 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.476 1.823 13.840 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.864 0.926 14.426 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -5.705 1.057 16.181 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.312 1.989 16.100 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.717 1.652 17.117 1.00 0.00 H new ATOM 504 N VAL A 33 -1.861 1.372 8.855 1.00 0.00 N ATOM 505 CA VAL A 33 -1.152 0.151 8.524 1.00 0.00 C ATOM 506 C VAL A 33 -0.110 0.386 7.434 1.00 0.00 C ATOM 507 O VAL A 33 0.938 -0.257 7.440 1.00 0.00 O ATOM 508 CB VAL A 33 -2.169 -0.902 8.071 1.00 0.00 C ATOM 509 CG1 VAL A 33 -1.493 -2.126 7.466 1.00 0.00 C ATOM 510 CG2 VAL A 33 -2.982 -1.373 9.270 1.00 0.00 C ATOM 0 H VAL A 33 -2.776 1.450 8.410 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.620 -0.199 9.409 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.801 -0.434 7.316 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.252 -2.846 7.159 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.905 -1.826 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.838 -2.583 8.207 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.705 -2.122 8.948 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.315 -1.809 10.013 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.509 -0.525 9.708 1.00 0.00 H new ATOM 520 N PHE A 34 -0.383 1.302 6.499 1.00 0.00 N ATOM 521 CA PHE A 34 0.529 1.606 5.408 1.00 0.00 C ATOM 522 C PHE A 34 1.288 2.915 5.637 1.00 0.00 C ATOM 523 O PHE A 34 2.224 3.225 4.903 1.00 0.00 O ATOM 524 CB PHE A 34 -0.258 1.622 4.095 1.00 0.00 C ATOM 525 CG PHE A 34 -0.437 0.239 3.500 1.00 0.00 C ATOM 526 CD1 PHE A 34 -1.459 -0.602 3.960 1.00 0.00 C ATOM 527 CD2 PHE A 34 0.423 -0.209 2.486 1.00 0.00 C ATOM 528 CE1 PHE A 34 -1.626 -1.878 3.399 1.00 0.00 C ATOM 529 CE2 PHE A 34 0.259 -1.483 1.928 1.00 0.00 C ATOM 530 CZ PHE A 34 -0.768 -2.318 2.380 1.00 0.00 C ATOM 0 H PHE A 34 -1.244 1.849 6.483 1.00 0.00 H new ATOM 0 HA PHE A 34 1.292 0.829 5.358 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -1.238 2.067 4.269 1.00 0.00 H new ATOM 0 HB3 PHE A 34 0.258 2.258 3.375 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -2.119 -0.268 4.747 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.217 0.433 2.133 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -2.417 -2.523 3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 34 0.926 -1.821 1.148 1.00 0.00 H new ATOM 0 HZ PHE A 34 -0.900 -3.298 1.946 1.00 0.00 H new ATOM 540 N GLU A 35 0.908 3.690 6.656 1.00 0.00 N ATOM 541 CA GLU A 35 1.609 4.921 6.997 1.00 0.00 C ATOM 542 C GLU A 35 2.933 4.621 7.703 1.00 0.00 C ATOM 543 O GLU A 35 3.845 5.445 7.667 1.00 0.00 O ATOM 544 CB GLU A 35 0.693 5.775 7.879 1.00 0.00 C ATOM 545 CG GLU A 35 1.390 7.033 8.399 1.00 0.00 C ATOM 546 CD GLU A 35 0.395 7.973 9.073 1.00 0.00 C ATOM 547 OE1 GLU A 35 -0.194 8.801 8.344 1.00 0.00 O ATOM 548 OE2 GLU A 35 0.232 7.860 10.308 1.00 0.00 O ATOM 0 H GLU A 35 0.113 3.481 7.260 1.00 0.00 H new ATOM 0 HA GLU A 35 1.851 5.469 6.086 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -0.191 6.062 7.309 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.348 5.179 8.724 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.169 6.754 9.108 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.880 7.549 7.573 1.00 0.00 H new ATOM 555 N LYS A 36 3.058 3.453 8.346 1.00 0.00 N ATOM 556 CA LYS A 36 4.274 3.102 9.077 1.00 0.00 C ATOM 557 C LYS A 36 5.454 2.838 8.141 1.00 0.00 C ATOM 558 O LYS A 36 6.608 2.939 8.556 1.00 0.00 O ATOM 559 CB LYS A 36 4.018 1.888 9.973 1.00 0.00 C ATOM 560 CG LYS A 36 3.739 0.613 9.175 1.00 0.00 C ATOM 561 CD LYS A 36 3.341 -0.502 10.139 1.00 0.00 C ATOM 562 CE LYS A 36 3.114 -1.817 9.399 1.00 0.00 C ATOM 563 NZ LYS A 36 4.376 -2.364 8.859 1.00 0.00 N ATOM 0 H LYS A 36 2.331 2.738 8.373 1.00 0.00 H new ATOM 0 HA LYS A 36 4.542 3.957 9.698 1.00 0.00 H new ATOM 0 HB2 LYS A 36 4.883 1.727 10.616 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.170 2.096 10.626 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.942 0.788 8.453 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.624 0.323 8.609 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.121 -0.634 10.889 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.432 -0.219 10.671 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.663 -2.543 10.076 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.407 -1.659 8.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.378 -2.274 7.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.180 -1.836 9.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.459 -3.367 9.120 1.00 0.00 H new ATOM 577 N TYR A 37 5.169 2.500 6.882 1.00 0.00 N ATOM 578 CA TYR A 37 6.204 2.299 5.875 1.00 0.00 C ATOM 579 C TYR A 37 6.827 3.627 5.454 1.00 0.00 C ATOM 580 O TYR A 37 7.908 3.644 4.873 1.00 0.00 O ATOM 581 CB TYR A 37 5.617 1.568 4.667 1.00 0.00 C ATOM 582 CG TYR A 37 5.205 0.150 4.997 1.00 0.00 C ATOM 583 CD1 TYR A 37 3.981 -0.099 5.633 1.00 0.00 C ATOM 584 CD2 TYR A 37 6.060 -0.913 4.672 1.00 0.00 C ATOM 585 CE1 TYR A 37 3.619 -1.413 5.962 1.00 0.00 C ATOM 586 CE2 TYR A 37 5.706 -2.228 4.999 1.00 0.00 C ATOM 587 CZ TYR A 37 4.485 -2.483 5.653 1.00 0.00 C ATOM 588 OH TYR A 37 4.144 -3.759 5.990 1.00 0.00 O ATOM 0 H TYR A 37 4.220 2.359 6.537 1.00 0.00 H new ATOM 0 HA TYR A 37 6.995 1.687 6.308 1.00 0.00 H new ATOM 0 HB2 TYR A 37 4.752 2.118 4.297 1.00 0.00 H new ATOM 0 HB3 TYR A 37 6.352 1.552 3.862 1.00 0.00 H new ATOM 0 HD1 TYR A 37 3.318 0.720 5.869 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.995 -0.717 4.168 1.00 0.00 H new ATOM 0 HE1 TYR A 37 2.676 -1.606 6.452 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.368 -3.045 4.750 1.00 0.00 H new ATOM 0 HH TYR A 37 4.852 -4.373 5.703 1.00 0.00 H new ATOM 598 N GLY A 38 6.149 4.743 5.745 1.00 0.00 N ATOM 599 CA GLY A 38 6.711 6.065 5.505 1.00 0.00 C ATOM 600 C GLY A 38 5.628 7.135 5.523 1.00 0.00 C ATOM 601 O GLY A 38 5.499 7.869 6.503 1.00 0.00 O ATOM 0 H GLY A 38 5.211 4.751 6.147 1.00 0.00 H new ATOM 0 HA2 GLY A 38 7.459 6.288 6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.222 6.077 4.542 1.00 0.00 H new ATOM 605 N ARG A 39 4.851 7.217 4.438 1.00 0.00 N ATOM 606 CA ARG A 39 3.719 8.128 4.325 1.00 0.00 C ATOM 607 C ARG A 39 2.821 7.719 3.166 1.00 0.00 C ATOM 608 O ARG A 39 3.233 6.965 2.287 1.00 0.00 O ATOM 609 CB ARG A 39 4.213 9.569 4.140 1.00 0.00 C ATOM 610 CG ARG A 39 5.241 9.698 3.012 1.00 0.00 C ATOM 611 CD ARG A 39 5.594 11.170 2.789 1.00 0.00 C ATOM 612 NE ARG A 39 6.323 11.725 3.937 1.00 0.00 N ATOM 613 CZ ARG A 39 7.636 11.581 4.135 1.00 0.00 C ATOM 614 NH1 ARG A 39 8.384 10.894 3.274 1.00 0.00 N ATOM 615 NH2 ARG A 39 8.210 12.123 5.201 1.00 0.00 N ATOM 0 H ARG A 39 4.996 6.644 3.607 1.00 0.00 H new ATOM 0 HA ARG A 39 3.137 8.076 5.245 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.362 10.216 3.927 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.656 9.920 5.072 1.00 0.00 H new ATOM 0 HG2 ARG A 39 6.140 9.134 3.262 1.00 0.00 H new ATOM 0 HG3 ARG A 39 4.841 9.269 2.094 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.201 11.268 1.889 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.682 11.744 2.623 1.00 0.00 H new ATOM 0 HE ARG A 39 5.792 12.255 4.628 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.955 10.470 2.451 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.386 10.792 3.437 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.649 12.650 5.870 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.213 12.013 5.352 1.00 0.00 H new ATOM 629 N VAL A 40 1.591 8.232 3.179 1.00 0.00 N ATOM 630 CA VAL A 40 0.580 7.932 2.180 1.00 0.00 C ATOM 631 C VAL A 40 -0.103 9.243 1.807 1.00 0.00 C ATOM 632 O VAL A 40 -0.292 10.108 2.664 1.00 0.00 O ATOM 633 CB VAL A 40 -0.424 6.924 2.761 1.00 0.00 C ATOM 634 CG1 VAL A 40 -1.491 6.554 1.729 1.00 0.00 C ATOM 635 CG2 VAL A 40 0.279 5.638 3.192 1.00 0.00 C ATOM 0 H VAL A 40 1.269 8.879 3.899 1.00 0.00 H new ATOM 0 HA VAL A 40 1.020 7.486 1.288 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.889 7.402 3.623 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.188 5.839 2.167 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.032 7.451 1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.014 6.108 0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.454 4.942 3.600 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.770 5.185 2.330 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.024 5.868 3.954 1.00 0.00 H new ATOM 645 N GLY A 41 -0.477 9.405 0.537 1.00 0.00 N ATOM 646 CA GLY A 41 -1.067 10.646 0.062 1.00 0.00 C ATOM 647 C GLY A 41 -2.587 10.581 0.104 1.00 0.00 C ATOM 648 O GLY A 41 -3.245 11.614 0.188 1.00 0.00 O ATOM 0 H GLY A 41 -0.379 8.686 -0.180 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -0.718 11.476 0.676 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -0.736 10.843 -0.958 1.00 0.00 H new ATOM 652 N ASP A 42 -3.145 9.370 0.052 1.00 0.00 N ATOM 653 CA ASP A 42 -4.581 9.188 0.145 1.00 0.00 C ATOM 654 C ASP A 42 -4.929 7.745 0.493 1.00 0.00 C ATOM 655 O ASP A 42 -4.207 6.815 0.136 1.00 0.00 O ATOM 656 CB ASP A 42 -5.208 9.539 -1.207 1.00 0.00 C ATOM 657 CG ASP A 42 -6.729 9.484 -1.168 1.00 0.00 C ATOM 658 OD1 ASP A 42 -7.292 9.801 -0.102 1.00 0.00 O ATOM 659 OD2 ASP A 42 -7.314 9.125 -2.214 1.00 0.00 O ATOM 0 H ASP A 42 -2.617 8.504 -0.054 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.967 9.836 0.932 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.890 10.538 -1.504 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.841 8.848 -1.966 1.00 0.00 H new ATOM 664 N VAL A 43 -6.051 7.579 1.199 1.00 0.00 N ATOM 665 CA VAL A 43 -6.660 6.291 1.501 1.00 0.00 C ATOM 666 C VAL A 43 -8.156 6.494 1.337 1.00 0.00 C ATOM 667 O VAL A 43 -8.768 7.240 2.098 1.00 0.00 O ATOM 668 CB VAL A 43 -6.339 5.826 2.925 1.00 0.00 C ATOM 669 CG1 VAL A 43 -7.062 4.509 3.192 1.00 0.00 C ATOM 670 CG2 VAL A 43 -4.841 5.643 3.136 1.00 0.00 C ATOM 0 H VAL A 43 -6.573 8.365 1.586 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.273 5.518 0.837 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.678 6.594 3.621 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.839 4.170 4.204 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -8.137 4.656 3.087 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.727 3.758 2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -4.655 5.313 4.158 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -4.464 4.895 2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -4.331 6.590 2.962 1.00 0.00 H new ATOM 680 N TYR A 44 -8.744 5.836 0.339 1.00 0.00 N ATOM 681 CA TYR A 44 -10.098 6.138 -0.076 1.00 0.00 C ATOM 682 C TYR A 44 -10.807 4.874 -0.552 1.00 0.00 C ATOM 683 O TYR A 44 -10.166 3.880 -0.893 1.00 0.00 O ATOM 684 CB TYR A 44 -9.939 7.186 -1.174 1.00 0.00 C ATOM 685 CG TYR A 44 -11.193 7.642 -1.873 1.00 0.00 C ATOM 686 CD1 TYR A 44 -12.175 8.377 -1.192 1.00 0.00 C ATOM 687 CD2 TYR A 44 -11.349 7.334 -3.228 1.00 0.00 C ATOM 688 CE1 TYR A 44 -13.326 8.797 -1.871 1.00 0.00 C ATOM 689 CE2 TYR A 44 -12.482 7.777 -3.923 1.00 0.00 C ATOM 690 CZ TYR A 44 -13.482 8.501 -3.242 1.00 0.00 C ATOM 691 OH TYR A 44 -14.598 8.925 -3.894 1.00 0.00 O ATOM 0 H TYR A 44 -8.296 5.090 -0.193 1.00 0.00 H new ATOM 0 HA TYR A 44 -10.722 6.519 0.733 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -9.457 8.061 -0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -9.258 6.788 -1.926 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -12.044 8.618 -0.147 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -10.595 6.754 -3.739 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -14.093 9.347 -1.346 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -12.589 7.565 -4.977 1.00 0.00 H new ATOM 0 HH TYR A 44 -14.339 9.407 -4.707 1.00 0.00 H new ATOM 701 N ILE A 45 -12.139 4.916 -0.578 1.00 0.00 N ATOM 702 CA ILE A 45 -12.958 3.746 -0.879 1.00 0.00 C ATOM 703 C ILE A 45 -13.978 4.063 -1.966 1.00 0.00 C ATOM 704 O ILE A 45 -15.082 4.529 -1.672 1.00 0.00 O ATOM 705 CB ILE A 45 -13.605 3.216 0.410 1.00 0.00 C ATOM 706 CG1 ILE A 45 -12.472 2.807 1.351 1.00 0.00 C ATOM 707 CG2 ILE A 45 -14.533 2.027 0.132 1.00 0.00 C ATOM 708 CD1 ILE A 45 -12.859 1.741 2.372 1.00 0.00 C ATOM 0 H ILE A 45 -12.678 5.761 -0.391 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.326 2.952 -1.276 1.00 0.00 H new ATOM 0 HB ILE A 45 -14.225 3.992 0.860 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -11.637 2.438 0.756 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -12.119 3.691 1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.971 1.681 1.068 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.327 2.336 -0.548 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -13.961 1.218 -0.322 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -11.998 1.509 2.999 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.673 2.112 2.995 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.183 0.839 1.852 1.00 0.00 H new ATOM 720 N PRO A 46 -13.608 3.811 -3.229 1.00 0.00 N ATOM 721 CA PRO A 46 -14.495 3.918 -4.372 1.00 0.00 C ATOM 722 C PRO A 46 -15.806 3.187 -4.120 1.00 0.00 C ATOM 723 O PRO A 46 -15.812 2.063 -3.621 1.00 0.00 O ATOM 724 CB PRO A 46 -13.726 3.300 -5.536 1.00 0.00 C ATOM 725 CG PRO A 46 -12.279 3.576 -5.156 1.00 0.00 C ATOM 726 CD PRO A 46 -12.287 3.385 -3.643 1.00 0.00 C ATOM 0 HA PRO A 46 -14.769 4.953 -4.578 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -13.924 2.232 -5.632 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -13.991 3.760 -6.488 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -11.593 2.886 -5.647 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.972 4.584 -5.435 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -12.103 2.345 -3.374 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -11.510 3.981 -3.164 1.00 0.00 H new ATOM 734 N ARG A 47 -16.913 3.839 -4.470 1.00 0.00 N ATOM 735 CA ARG A 47 -18.247 3.323 -4.222 1.00 0.00 C ATOM 736 C ARG A 47 -19.242 4.109 -5.065 1.00 0.00 C ATOM 737 O ARG A 47 -18.911 5.178 -5.571 1.00 0.00 O ATOM 738 CB ARG A 47 -18.562 3.486 -2.732 1.00 0.00 C ATOM 739 CG ARG A 47 -18.531 4.962 -2.318 1.00 0.00 C ATOM 740 CD ARG A 47 -18.563 5.091 -0.800 1.00 0.00 C ATOM 741 NE ARG A 47 -18.599 6.499 -0.389 1.00 0.00 N ATOM 742 CZ ARG A 47 -17.542 7.316 -0.382 1.00 0.00 C ATOM 743 NH1 ARG A 47 -16.340 6.889 -0.752 1.00 0.00 N ATOM 744 NH2 ARG A 47 -17.685 8.580 0.005 1.00 0.00 N ATOM 0 H ARG A 47 -16.904 4.746 -4.937 1.00 0.00 H new ATOM 0 HA ARG A 47 -18.312 2.268 -4.490 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -19.544 3.066 -2.517 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -17.839 2.924 -2.141 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -17.632 5.437 -2.710 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -19.383 5.485 -2.751 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -19.437 4.572 -0.406 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -17.685 4.607 -0.372 1.00 0.00 H new ATOM 0 HE ARG A 47 -19.495 6.881 -0.087 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -16.211 5.922 -1.049 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -15.545 7.529 -0.740 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -18.600 8.924 0.296 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -16.879 9.206 0.011 1.00 0.00 H new ATOM 758 N ASP A 48 -20.462 3.593 -5.218 1.00 0.00 N ATOM 759 CA ASP A 48 -21.505 4.347 -5.889 1.00 0.00 C ATOM 760 C ASP A 48 -21.876 5.513 -4.982 1.00 0.00 C ATOM 761 O ASP A 48 -22.353 5.316 -3.866 1.00 0.00 O ATOM 762 CB ASP A 48 -22.694 3.443 -6.207 1.00 0.00 C ATOM 763 CG ASP A 48 -22.340 2.338 -7.211 1.00 0.00 C ATOM 764 OD1 ASP A 48 -21.197 2.347 -7.723 1.00 0.00 O ATOM 765 OD2 ASP A 48 -23.221 1.487 -7.459 1.00 0.00 O ATOM 0 H ASP A 48 -20.744 2.669 -4.890 1.00 0.00 H new ATOM 0 HA ASP A 48 -21.163 4.737 -6.847 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -23.058 2.989 -5.285 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -23.508 4.047 -6.608 1.00 0.00 H new ATOM 770 N ARG A 49 -21.651 6.728 -5.483 1.00 0.00 N ATOM 771 CA ARG A 49 -21.714 7.973 -4.721 1.00 0.00 C ATOM 772 C ARG A 49 -23.114 8.364 -4.231 1.00 0.00 C ATOM 773 O ARG A 49 -23.337 9.515 -3.862 1.00 0.00 O ATOM 774 CB ARG A 49 -21.049 9.052 -5.574 1.00 0.00 C ATOM 775 CG ARG A 49 -21.867 9.483 -6.791 1.00 0.00 C ATOM 776 CD ARG A 49 -20.974 10.320 -7.706 1.00 0.00 C ATOM 777 NE ARG A 49 -20.464 11.518 -7.034 1.00 0.00 N ATOM 778 CZ ARG A 49 -21.130 12.668 -6.917 1.00 0.00 C ATOM 779 NH1 ARG A 49 -22.351 12.806 -7.431 1.00 0.00 N ATOM 780 NH2 ARG A 49 -20.570 13.693 -6.282 1.00 0.00 N ATOM 0 H ARG A 49 -21.412 6.876 -6.463 1.00 0.00 H new ATOM 0 HA ARG A 49 -21.178 7.838 -3.782 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -20.859 9.926 -4.951 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -20.080 8.685 -5.913 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -22.242 8.609 -7.324 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -22.736 10.062 -6.477 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -20.136 9.713 -8.048 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -21.537 10.614 -8.592 1.00 0.00 H new ATOM 0 HE ARG A 49 -19.531 11.469 -6.625 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -22.789 12.026 -7.922 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -22.848 13.691 -7.334 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -19.635 13.598 -5.887 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -21.076 14.574 -6.190 1.00 0.00 H new ATOM 794 N TYR A 50 -24.052 7.415 -4.230 1.00 0.00 N ATOM 795 CA TYR A 50 -25.439 7.618 -3.822 1.00 0.00 C ATOM 796 C TYR A 50 -26.032 6.368 -3.160 1.00 0.00 C ATOM 797 O TYR A 50 -27.177 6.412 -2.712 1.00 0.00 O ATOM 798 CB TYR A 50 -26.249 7.994 -5.067 1.00 0.00 C ATOM 799 CG TYR A 50 -25.868 7.100 -6.217 1.00 0.00 C ATOM 800 CD1 TYR A 50 -24.761 7.441 -7.002 1.00 0.00 C ATOM 801 CD2 TYR A 50 -26.576 5.922 -6.469 1.00 0.00 C ATOM 802 CE1 TYR A 50 -24.304 6.574 -7.995 1.00 0.00 C ATOM 803 CE2 TYR A 50 -26.135 5.051 -7.473 1.00 0.00 C ATOM 804 CZ TYR A 50 -25.000 5.375 -8.248 1.00 0.00 C ATOM 805 OH TYR A 50 -24.576 4.529 -9.230 1.00 0.00 O ATOM 0 H TYR A 50 -23.860 6.457 -4.522 1.00 0.00 H new ATOM 0 HA TYR A 50 -25.478 8.415 -3.079 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -27.315 7.900 -4.860 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -26.066 9.036 -5.329 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -24.257 8.382 -6.838 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -27.458 5.685 -5.893 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -23.422 6.820 -8.567 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -26.665 4.128 -7.655 1.00 0.00 H new ATOM 0 HH TYR A 50 -25.169 3.750 -9.269 1.00 0.00 H new ATOM 815 N THR A 51 -25.281 5.260 -3.087 1.00 0.00 N ATOM 816 CA THR A 51 -25.696 4.078 -2.332 1.00 0.00 C ATOM 817 C THR A 51 -24.638 3.710 -1.299 1.00 0.00 C ATOM 818 O THR A 51 -24.940 3.075 -0.288 1.00 0.00 O ATOM 819 CB THR A 51 -25.937 2.864 -3.230 1.00 0.00 C ATOM 820 OG1 THR A 51 -24.718 2.454 -3.796 1.00 0.00 O ATOM 821 CG2 THR A 51 -26.913 3.164 -4.357 1.00 0.00 C ATOM 0 H THR A 51 -24.376 5.162 -3.547 1.00 0.00 H new ATOM 0 HA THR A 51 -26.636 4.338 -1.845 1.00 0.00 H new ATOM 0 HB THR A 51 -26.367 2.080 -2.606 1.00 0.00 H new ATOM 0 HG1 THR A 51 -24.870 1.675 -4.371 1.00 0.00 H new ATOM 0 HG21 THR A 51 -27.051 2.271 -4.966 1.00 0.00 H new ATOM 0 HG22 THR A 51 -27.872 3.468 -3.937 1.00 0.00 H new ATOM 0 HG23 THR A 51 -26.517 3.968 -4.977 1.00 0.00 H new ATOM 828 N LYS A 52 -23.389 4.115 -1.562 1.00 0.00 N ATOM 829 CA LYS A 52 -22.238 3.954 -0.690 1.00 0.00 C ATOM 830 C LYS A 52 -22.073 2.521 -0.169 1.00 0.00 C ATOM 831 O LYS A 52 -21.495 2.319 0.896 1.00 0.00 O ATOM 832 CB LYS A 52 -22.304 4.976 0.451 1.00 0.00 C ATOM 833 CG LYS A 52 -22.619 6.391 -0.047 1.00 0.00 C ATOM 834 CD LYS A 52 -24.035 6.809 0.356 1.00 0.00 C ATOM 835 CE LYS A 52 -24.317 8.230 -0.127 1.00 0.00 C ATOM 836 NZ LYS A 52 -25.681 8.659 0.237 1.00 0.00 N ATOM 0 H LYS A 52 -23.151 4.586 -2.435 1.00 0.00 H new ATOM 0 HA LYS A 52 -21.345 4.147 -1.284 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -23.066 4.668 1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -21.352 4.985 0.982 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -21.896 7.095 0.365 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -22.519 6.430 -1.132 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -24.762 6.119 -0.072 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -24.144 6.756 1.439 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -23.590 8.915 0.308 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -24.194 8.280 -1.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -25.843 9.628 -0.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -26.374 8.018 -0.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -25.788 8.634 1.271 1.00 0.00 H new ATOM 850 N GLU A 53 -22.575 1.532 -0.913 1.00 0.00 N ATOM 851 CA GLU A 53 -22.524 0.127 -0.521 1.00 0.00 C ATOM 852 C GLU A 53 -21.110 -0.468 -0.582 1.00 0.00 C ATOM 853 O GLU A 53 -20.951 -1.671 -0.381 1.00 0.00 O ATOM 854 CB GLU A 53 -23.509 -0.671 -1.384 1.00 0.00 C ATOM 855 CG GLU A 53 -23.224 -0.533 -2.881 1.00 0.00 C ATOM 856 CD GLU A 53 -24.177 -1.407 -3.692 1.00 0.00 C ATOM 857 OE1 GLU A 53 -25.310 -0.939 -3.951 1.00 0.00 O ATOM 858 OE2 GLU A 53 -23.767 -2.535 -4.051 1.00 0.00 O ATOM 0 H GLU A 53 -23.032 1.689 -1.812 1.00 0.00 H new ATOM 0 HA GLU A 53 -22.817 0.061 0.527 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.462 -1.723 -1.104 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -24.524 -0.332 -1.178 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.332 0.509 -3.183 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -22.193 -0.820 -3.088 1.00 0.00 H new ATOM 865 N SER A 54 -20.090 0.358 -0.856 1.00 0.00 N ATOM 866 CA SER A 54 -18.695 -0.058 -0.952 1.00 0.00 C ATOM 867 C SER A 54 -18.472 -1.126 -2.025 1.00 0.00 C ATOM 868 O SER A 54 -19.402 -1.525 -2.727 1.00 0.00 O ATOM 869 CB SER A 54 -18.191 -0.518 0.416 1.00 0.00 C ATOM 870 OG SER A 54 -18.343 0.526 1.356 1.00 0.00 O ATOM 0 H SER A 54 -20.222 1.356 -1.020 1.00 0.00 H new ATOM 0 HA SER A 54 -18.112 0.807 -1.267 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.747 -1.397 0.742 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.143 -0.810 0.349 1.00 0.00 H new ATOM 0 HG SER A 54 -18.021 0.227 2.232 1.00 0.00 H new ATOM 876 N ARG A 55 -17.221 -1.593 -2.154 1.00 0.00 N ATOM 877 CA ARG A 55 -16.840 -2.548 -3.196 1.00 0.00 C ATOM 878 C ARG A 55 -15.838 -3.602 -2.719 1.00 0.00 C ATOM 879 O ARG A 55 -15.444 -4.464 -3.506 1.00 0.00 O ATOM 880 CB ARG A 55 -16.271 -1.788 -4.395 1.00 0.00 C ATOM 881 CG ARG A 55 -17.310 -0.851 -5.013 1.00 0.00 C ATOM 882 CD ARG A 55 -16.727 -0.146 -6.231 1.00 0.00 C ATOM 883 NE ARG A 55 -17.725 0.731 -6.852 1.00 0.00 N ATOM 884 CZ ARG A 55 -17.432 1.814 -7.577 1.00 0.00 C ATOM 885 NH1 ARG A 55 -16.170 2.167 -7.802 1.00 0.00 N ATOM 886 NH2 ARG A 55 -18.414 2.553 -8.077 1.00 0.00 N ATOM 0 H ARG A 55 -16.452 -1.319 -1.542 1.00 0.00 H new ATOM 0 HA ARG A 55 -17.742 -3.090 -3.478 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -15.401 -1.211 -4.081 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -15.928 -2.498 -5.147 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -18.195 -1.418 -5.301 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -17.629 -0.114 -4.276 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.856 0.439 -5.936 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -16.385 -0.885 -6.955 1.00 0.00 H new ATOM 0 HE ARG A 55 -18.709 0.498 -6.721 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.408 1.608 -7.419 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.964 2.997 -8.358 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.385 2.293 -7.907 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.197 3.381 -8.631 1.00 0.00 H new ATOM 900 N GLY A 56 -15.416 -3.565 -1.450 1.00 0.00 N ATOM 901 CA GLY A 56 -14.547 -4.600 -0.895 1.00 0.00 C ATOM 902 C GLY A 56 -13.061 -4.257 -0.983 1.00 0.00 C ATOM 903 O GLY A 56 -12.217 -5.141 -0.847 1.00 0.00 O ATOM 0 H GLY A 56 -15.664 -2.828 -0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.813 -4.765 0.149 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -14.728 -5.537 -1.422 1.00 0.00 H new ATOM 907 N PHE A 57 -12.717 -2.989 -1.205 1.00 0.00 N ATOM 908 CA PHE A 57 -11.335 -2.544 -1.266 1.00 0.00 C ATOM 909 C PHE A 57 -11.244 -1.069 -0.888 1.00 0.00 C ATOM 910 O PHE A 57 -12.261 -0.387 -0.780 1.00 0.00 O ATOM 911 CB PHE A 57 -10.776 -2.776 -2.671 1.00 0.00 C ATOM 912 CG PHE A 57 -11.407 -1.958 -3.774 1.00 0.00 C ATOM 913 CD1 PHE A 57 -12.576 -2.407 -4.411 1.00 0.00 C ATOM 914 CD2 PHE A 57 -10.816 -0.752 -4.172 1.00 0.00 C ATOM 915 CE1 PHE A 57 -13.135 -1.658 -5.455 1.00 0.00 C ATOM 916 CE2 PHE A 57 -11.376 -0.005 -5.218 1.00 0.00 C ATOM 917 CZ PHE A 57 -12.543 -0.454 -5.851 1.00 0.00 C ATOM 0 H PHE A 57 -13.396 -2.242 -1.348 1.00 0.00 H new ATOM 0 HA PHE A 57 -10.741 -3.119 -0.556 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.707 -2.566 -2.655 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -10.890 -3.832 -2.917 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -13.043 -3.328 -4.096 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.927 -0.397 -3.672 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -14.025 -2.011 -5.955 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -10.909 0.915 -5.536 1.00 0.00 H new ATOM 0 HZ PHE A 57 -12.985 0.130 -6.645 1.00 0.00 H new ATOM 927 N ALA A 58 -10.018 -0.584 -0.694 1.00 0.00 N ATOM 928 CA ALA A 58 -9.755 0.804 -0.364 1.00 0.00 C ATOM 929 C ALA A 58 -8.533 1.244 -1.158 1.00 0.00 C ATOM 930 O ALA A 58 -7.402 1.008 -0.740 1.00 0.00 O ATOM 931 CB ALA A 58 -9.546 0.957 1.148 1.00 0.00 C ATOM 0 H ALA A 58 -9.175 -1.155 -0.764 1.00 0.00 H new ATOM 0 HA ALA A 58 -10.601 1.438 -0.628 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.349 2.003 1.384 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.442 0.628 1.674 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.698 0.349 1.461 1.00 0.00 H new ATOM 937 N PHE A 59 -8.773 1.888 -2.303 1.00 0.00 N ATOM 938 CA PHE A 59 -7.706 2.368 -3.160 1.00 0.00 C ATOM 939 C PHE A 59 -6.920 3.412 -2.373 1.00 0.00 C ATOM 940 O PHE A 59 -7.456 4.464 -2.020 1.00 0.00 O ATOM 941 CB PHE A 59 -8.302 2.937 -4.456 1.00 0.00 C ATOM 942 CG PHE A 59 -7.324 3.720 -5.316 1.00 0.00 C ATOM 943 CD1 PHE A 59 -7.114 5.075 -5.035 1.00 0.00 C ATOM 944 CD2 PHE A 59 -6.636 3.124 -6.386 1.00 0.00 C ATOM 945 CE1 PHE A 59 -6.198 5.819 -5.787 1.00 0.00 C ATOM 946 CE2 PHE A 59 -5.697 3.864 -7.122 1.00 0.00 C ATOM 947 CZ PHE A 59 -5.464 5.207 -6.814 1.00 0.00 C ATOM 0 H PHE A 59 -9.710 2.087 -2.654 1.00 0.00 H new ATOM 0 HA PHE A 59 -7.030 1.564 -3.452 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -8.705 2.114 -5.046 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -9.140 3.586 -4.200 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -7.662 5.549 -4.234 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.830 2.093 -6.643 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -6.056 6.869 -5.576 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.153 3.394 -7.928 1.00 0.00 H new ATOM 0 HZ PHE A 59 -4.724 5.770 -7.363 1.00 0.00 H new ATOM 957 N VAL A 60 -5.645 3.123 -2.096 1.00 0.00 N ATOM 958 CA VAL A 60 -4.776 4.101 -1.449 1.00 0.00 C ATOM 959 C VAL A 60 -3.648 4.439 -2.406 1.00 0.00 C ATOM 960 O VAL A 60 -3.423 3.694 -3.360 1.00 0.00 O ATOM 961 CB VAL A 60 -4.220 3.617 -0.101 1.00 0.00 C ATOM 962 CG1 VAL A 60 -5.226 2.740 0.630 1.00 0.00 C ATOM 963 CG2 VAL A 60 -2.887 2.876 -0.229 1.00 0.00 C ATOM 0 H VAL A 60 -5.199 2.230 -2.308 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.369 4.987 -1.221 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.036 4.520 0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.802 2.414 1.580 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.137 3.309 0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.460 1.868 0.019 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.549 2.561 0.758 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.017 2.000 -0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.144 3.538 -0.672 1.00 0.00 H new ATOM 973 N ARG A 61 -2.954 5.549 -2.151 1.00 0.00 N ATOM 974 CA ARG A 61 -1.900 6.009 -3.036 1.00 0.00 C ATOM 975 C ARG A 61 -0.706 6.523 -2.229 1.00 0.00 C ATOM 976 O ARG A 61 -0.859 7.392 -1.372 1.00 0.00 O ATOM 977 CB ARG A 61 -2.495 7.049 -4.005 1.00 0.00 C ATOM 978 CG ARG A 61 -2.406 8.484 -3.480 1.00 0.00 C ATOM 979 CD ARG A 61 -3.163 9.428 -4.416 1.00 0.00 C ATOM 980 NE ARG A 61 -2.671 9.300 -5.792 1.00 0.00 N ATOM 981 CZ ARG A 61 -3.450 9.101 -6.855 1.00 0.00 C ATOM 982 NH1 ARG A 61 -4.774 9.068 -6.732 1.00 0.00 N ATOM 983 NH2 ARG A 61 -2.907 8.939 -8.055 1.00 0.00 N ATOM 0 H ARG A 61 -3.108 6.142 -1.336 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.507 5.189 -3.637 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -1.974 6.986 -4.960 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.540 6.803 -4.195 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -2.826 8.540 -2.476 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -1.362 8.790 -3.407 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.229 9.203 -4.383 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -3.044 10.457 -4.076 1.00 0.00 H new ATOM 0 HE ARG A 61 -1.665 9.368 -5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -5.204 9.196 -5.816 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -5.359 8.915 -7.554 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -1.893 8.967 -8.164 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -3.503 8.787 -8.868 1.00 0.00 H new ATOM 997 N PHE A 62 0.489 5.984 -2.502 1.00 0.00 N ATOM 998 CA PHE A 62 1.738 6.435 -1.890 1.00 0.00 C ATOM 999 C PHE A 62 2.439 7.418 -2.809 1.00 0.00 C ATOM 1000 O PHE A 62 2.184 7.426 -4.014 1.00 0.00 O ATOM 1001 CB PHE A 62 2.696 5.266 -1.696 1.00 0.00 C ATOM 1002 CG PHE A 62 2.489 4.430 -0.452 1.00 0.00 C ATOM 1003 CD1 PHE A 62 1.391 3.567 -0.351 1.00 0.00 C ATOM 1004 CD2 PHE A 62 3.421 4.516 0.588 1.00 0.00 C ATOM 1005 CE1 PHE A 62 1.241 2.764 0.789 1.00 0.00 C ATOM 1006 CE2 PHE A 62 3.270 3.718 1.729 1.00 0.00 C ATOM 1007 CZ PHE A 62 2.187 2.833 1.823 1.00 0.00 C ATOM 0 H PHE A 62 0.613 5.215 -3.161 1.00 0.00 H new ATOM 0 HA PHE A 62 1.486 6.891 -0.933 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.618 4.612 -2.565 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.714 5.656 -1.681 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.663 3.520 -1.147 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.256 5.197 0.511 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.398 2.093 0.871 1.00 0.00 H new ATOM 0 HE2 PHE A 62 3.986 3.784 2.535 1.00 0.00 H new ATOM 0 HZ PHE A 62 2.080 2.203 2.693 1.00 0.00 H new ATOM 1017 N HIS A 63 3.327 8.236 -2.234 1.00 0.00 N ATOM 1018 CA HIS A 63 4.088 9.219 -2.983 1.00 0.00 C ATOM 1019 C HIS A 63 5.580 8.917 -2.985 1.00 0.00 C ATOM 1020 O HIS A 63 6.271 9.233 -3.950 1.00 0.00 O ATOM 1021 CB HIS A 63 3.843 10.638 -2.455 1.00 0.00 C ATOM 1022 CG HIS A 63 3.199 10.793 -1.091 1.00 0.00 C ATOM 1023 ND1 HIS A 63 3.413 10.051 0.040 1.00 0.00 N flip ATOM 1024 CD2 HIS A 63 2.263 11.789 -0.808 1.00 0.00 C flip ATOM 1025 CE1 HIS A 63 2.609 10.595 1.016 1.00 0.00 C flip ATOM 1026 NE2 HIS A 63 1.945 11.633 0.483 1.00 0.00 N flip ATOM 0 H HIS A 63 3.532 8.228 -1.235 1.00 0.00 H new ATOM 0 HA HIS A 63 3.733 9.160 -4.012 1.00 0.00 H new ATOM 0 HB2 HIS A 63 4.802 11.155 -2.431 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.218 11.160 -3.180 1.00 0.00 H new ATOM 0 HD2 HIS A 63 1.875 12.532 -1.490 1.00 0.00 H new ATOM 0 HE1 HIS A 63 2.527 10.247 2.035 1.00 0.00 H new ATOM 0 HE2 HIS A 63 1.287 12.223 0.993 1.00 0.00 H new ATOM 1034 N ASP A 64 6.083 8.302 -1.914 1.00 0.00 N ATOM 1035 CA ASP A 64 7.476 7.899 -1.848 1.00 0.00 C ATOM 1036 C ASP A 64 7.676 6.629 -2.660 1.00 0.00 C ATOM 1037 O ASP A 64 7.074 5.602 -2.367 1.00 0.00 O ATOM 1038 CB ASP A 64 7.848 7.645 -0.391 1.00 0.00 C ATOM 1039 CG ASP A 64 8.353 8.918 0.273 1.00 0.00 C ATOM 1040 OD1 ASP A 64 9.545 9.240 0.067 1.00 0.00 O ATOM 1041 OD2 ASP A 64 7.549 9.557 0.984 1.00 0.00 O ATOM 0 H ASP A 64 5.539 8.074 -1.081 1.00 0.00 H new ATOM 0 HA ASP A 64 8.111 8.686 -2.256 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.979 7.269 0.149 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.616 6.873 -0.337 1.00 0.00 H new ATOM 1046 N LYS A 65 8.530 6.694 -3.689 1.00 0.00 N ATOM 1047 CA LYS A 65 8.813 5.546 -4.541 1.00 0.00 C ATOM 1048 C LYS A 65 9.427 4.413 -3.729 1.00 0.00 C ATOM 1049 O LYS A 65 9.023 3.265 -3.885 1.00 0.00 O ATOM 1050 CB LYS A 65 9.771 6.001 -5.647 1.00 0.00 C ATOM 1051 CG LYS A 65 10.291 4.871 -6.544 1.00 0.00 C ATOM 1052 CD LYS A 65 9.200 4.287 -7.445 1.00 0.00 C ATOM 1053 CE LYS A 65 8.488 3.092 -6.823 1.00 0.00 C ATOM 1054 NZ LYS A 65 9.395 1.930 -6.730 1.00 0.00 N ATOM 0 H LYS A 65 9.038 7.540 -3.948 1.00 0.00 H new ATOM 0 HA LYS A 65 7.889 5.169 -4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.263 6.737 -6.270 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.622 6.504 -5.188 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.105 5.248 -7.163 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.705 4.079 -5.921 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.468 5.063 -7.668 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.644 3.985 -8.394 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.125 3.356 -5.830 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.616 2.831 -7.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.852 1.054 -6.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.130 2.004 -7.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.842 1.913 -5.791 1.00 0.00 H new ATOM 1068 N ARG A 66 10.395 4.725 -2.866 1.00 0.00 N ATOM 1069 CA ARG A 66 11.077 3.702 -2.086 1.00 0.00 C ATOM 1070 C ARG A 66 10.155 3.035 -1.063 1.00 0.00 C ATOM 1071 O ARG A 66 10.352 1.872 -0.719 1.00 0.00 O ATOM 1072 CB ARG A 66 12.336 4.271 -1.422 1.00 0.00 C ATOM 1073 CG ARG A 66 12.078 5.304 -0.319 1.00 0.00 C ATOM 1074 CD ARG A 66 11.590 6.664 -0.830 1.00 0.00 C ATOM 1075 NE ARG A 66 12.529 7.237 -1.804 1.00 0.00 N ATOM 1076 CZ ARG A 66 12.508 8.508 -2.219 1.00 0.00 C ATOM 1077 NH1 ARG A 66 11.610 9.367 -1.744 1.00 0.00 N ATOM 1078 NH2 ARG A 66 13.394 8.927 -3.117 1.00 0.00 N ATOM 0 H ARG A 66 10.721 5.676 -2.693 1.00 0.00 H new ATOM 0 HA ARG A 66 11.383 2.920 -2.780 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.910 3.446 -0.999 1.00 0.00 H new ATOM 0 HB3 ARG A 66 12.958 4.730 -2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.338 4.902 0.373 1.00 0.00 H new ATOM 0 HG3 ARG A 66 12.998 5.451 0.248 1.00 0.00 H new ATOM 0 HD2 ARG A 66 10.609 6.551 -1.291 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.471 7.349 0.010 1.00 0.00 H new ATOM 0 HE ARG A 66 13.246 6.623 -2.190 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.925 9.059 -1.054 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.606 10.333 -2.070 1.00 0.00 H new ATOM 0 HH21 ARG A 66 14.089 8.279 -3.489 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.379 9.896 -3.434 1.00 0.00 H new ATOM 1092 N ASP A 67 9.147 3.762 -0.576 1.00 0.00 N ATOM 1093 CA ASP A 67 8.239 3.220 0.423 1.00 0.00 C ATOM 1094 C ASP A 67 7.042 2.556 -0.254 1.00 0.00 C ATOM 1095 O ASP A 67 6.288 1.829 0.391 1.00 0.00 O ATOM 1096 CB ASP A 67 7.769 4.331 1.359 1.00 0.00 C ATOM 1097 CG ASP A 67 8.933 4.969 2.121 1.00 0.00 C ATOM 1098 OD1 ASP A 67 9.886 4.234 2.461 1.00 0.00 O ATOM 1099 OD2 ASP A 67 8.857 6.196 2.356 1.00 0.00 O ATOM 0 H ASP A 67 8.944 4.721 -0.858 1.00 0.00 H new ATOM 0 HA ASP A 67 8.768 2.467 1.008 1.00 0.00 H new ATOM 0 HB2 ASP A 67 7.251 5.097 0.782 1.00 0.00 H new ATOM 0 HB3 ASP A 67 7.049 3.926 2.070 1.00 0.00 H new ATOM 1104 N ALA A 68 6.865 2.804 -1.554 1.00 0.00 N ATOM 1105 CA ALA A 68 5.800 2.212 -2.330 1.00 0.00 C ATOM 1106 C ALA A 68 6.187 0.782 -2.696 1.00 0.00 C ATOM 1107 O ALA A 68 5.367 -0.130 -2.620 1.00 0.00 O ATOM 1108 CB ALA A 68 5.638 3.068 -3.582 1.00 0.00 C ATOM 0 H ALA A 68 7.467 3.428 -2.091 1.00 0.00 H new ATOM 0 HA ALA A 68 4.862 2.176 -1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.841 2.658 -4.202 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.386 4.089 -3.295 1.00 0.00 H new ATOM 0 HB3 ALA A 68 6.571 3.070 -4.145 1.00 0.00 H new ATOM 1114 N GLU A 69 7.446 0.590 -3.095 1.00 0.00 N ATOM 1115 CA GLU A 69 7.940 -0.737 -3.427 1.00 0.00 C ATOM 1116 C GLU A 69 8.235 -1.534 -2.158 1.00 0.00 C ATOM 1117 O GLU A 69 8.207 -2.759 -2.192 1.00 0.00 O ATOM 1118 CB GLU A 69 9.180 -0.632 -4.318 1.00 0.00 C ATOM 1119 CG GLU A 69 10.289 0.191 -3.664 1.00 0.00 C ATOM 1120 CD GLU A 69 11.547 0.204 -4.524 1.00 0.00 C ATOM 1121 OE1 GLU A 69 12.392 -0.699 -4.341 1.00 0.00 O ATOM 1122 OE2 GLU A 69 11.652 1.126 -5.369 1.00 0.00 O ATOM 0 H GLU A 69 8.135 1.336 -3.194 1.00 0.00 H new ATOM 0 HA GLU A 69 7.168 -1.271 -3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.553 -1.632 -4.539 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.905 -0.177 -5.270 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.943 1.212 -3.507 1.00 0.00 H new ATOM 0 HG3 GLU A 69 10.521 -0.222 -2.682 1.00 0.00 H new ATOM 1129 N ASP A 70 8.520 -0.863 -1.033 1.00 0.00 N ATOM 1130 CA ASP A 70 8.773 -1.583 0.204 1.00 0.00 C ATOM 1131 C ASP A 70 7.471 -2.129 0.785 1.00 0.00 C ATOM 1132 O ASP A 70 7.415 -3.297 1.164 1.00 0.00 O ATOM 1133 CB ASP A 70 9.452 -0.648 1.204 1.00 0.00 C ATOM 1134 CG ASP A 70 9.864 -1.392 2.471 1.00 0.00 C ATOM 1135 OD1 ASP A 70 10.687 -2.328 2.349 1.00 0.00 O ATOM 1136 OD2 ASP A 70 9.355 -1.020 3.553 1.00 0.00 O ATOM 0 H ASP A 70 8.578 0.153 -0.962 1.00 0.00 H new ATOM 0 HA ASP A 70 9.430 -2.428 -0.003 1.00 0.00 H new ATOM 0 HB2 ASP A 70 10.331 -0.196 0.743 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.774 0.165 1.462 1.00 0.00 H new ATOM 1141 N ALA A 71 6.421 -1.303 0.856 1.00 0.00 N ATOM 1142 CA ALA A 71 5.147 -1.744 1.398 1.00 0.00 C ATOM 1143 C ALA A 71 4.555 -2.862 0.542 1.00 0.00 C ATOM 1144 O ALA A 71 3.866 -3.747 1.048 1.00 0.00 O ATOM 1145 CB ALA A 71 4.192 -0.550 1.459 1.00 0.00 C ATOM 0 H ALA A 71 6.436 -0.332 0.545 1.00 0.00 H new ATOM 0 HA ALA A 71 5.299 -2.140 2.402 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.233 -0.872 1.865 1.00 0.00 H new ATOM 0 HB2 ALA A 71 4.616 0.223 2.100 1.00 0.00 H new ATOM 0 HB3 ALA A 71 4.046 -0.149 0.456 1.00 0.00 H new ATOM 1151 N MET A 72 4.827 -2.822 -0.766 1.00 0.00 N ATOM 1152 CA MET A 72 4.392 -3.854 -1.692 1.00 0.00 C ATOM 1153 C MET A 72 5.217 -5.121 -1.500 1.00 0.00 C ATOM 1154 O MET A 72 4.674 -6.222 -1.505 1.00 0.00 O ATOM 1155 CB MET A 72 4.581 -3.294 -3.099 1.00 0.00 C ATOM 1156 CG MET A 72 4.552 -4.351 -4.194 1.00 0.00 C ATOM 1157 SD MET A 72 4.379 -3.662 -5.864 1.00 0.00 S ATOM 1158 CE MET A 72 5.536 -2.271 -5.765 1.00 0.00 C ATOM 0 H MET A 72 5.356 -2.069 -1.206 1.00 0.00 H new ATOM 0 HA MET A 72 3.349 -4.120 -1.520 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.799 -2.560 -3.295 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.533 -2.765 -3.144 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.469 -4.938 -4.145 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.725 -5.036 -4.005 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.711 -1.872 -6.764 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.114 -1.491 -5.131 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.480 -2.612 -5.340 1.00 0.00 H new ATOM 1168 N ASP A 73 6.530 -4.976 -1.322 1.00 0.00 N ATOM 1169 CA ASP A 73 7.408 -6.122 -1.172 1.00 0.00 C ATOM 1170 C ASP A 73 7.400 -6.653 0.265 1.00 0.00 C ATOM 1171 O ASP A 73 8.138 -7.584 0.578 1.00 0.00 O ATOM 1172 CB ASP A 73 8.825 -5.729 -1.607 1.00 0.00 C ATOM 1173 CG ASP A 73 9.764 -6.933 -1.664 1.00 0.00 C ATOM 1174 OD1 ASP A 73 9.409 -7.911 -2.363 1.00 0.00 O ATOM 1175 OD2 ASP A 73 10.832 -6.874 -1.011 1.00 0.00 O ATOM 0 H ASP A 73 7.003 -4.073 -1.279 1.00 0.00 H new ATOM 0 HA ASP A 73 7.046 -6.929 -1.808 1.00 0.00 H new ATOM 0 HB2 ASP A 73 8.784 -5.255 -2.588 1.00 0.00 H new ATOM 0 HB3 ASP A 73 9.225 -4.990 -0.912 1.00 0.00 H new ATOM 1180 N ALA A 74 6.575 -6.069 1.145 1.00 0.00 N ATOM 1181 CA ALA A 74 6.560 -6.432 2.555 1.00 0.00 C ATOM 1182 C ALA A 74 5.157 -6.734 3.076 1.00 0.00 C ATOM 1183 O ALA A 74 5.022 -7.166 4.219 1.00 0.00 O ATOM 1184 CB ALA A 74 7.157 -5.278 3.343 1.00 0.00 C ATOM 0 H ALA A 74 5.908 -5.339 0.895 1.00 0.00 H new ATOM 0 HA ALA A 74 7.141 -7.346 2.677 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.158 -5.524 4.405 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.180 -5.101 3.011 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.562 -4.379 3.179 1.00 0.00 H new ATOM 1190 N MET A 75 4.115 -6.514 2.269 1.00 0.00 N ATOM 1191 CA MET A 75 2.763 -6.815 2.715 1.00 0.00 C ATOM 1192 C MET A 75 1.878 -7.454 1.647 1.00 0.00 C ATOM 1193 O MET A 75 0.947 -8.179 1.999 1.00 0.00 O ATOM 1194 CB MET A 75 2.092 -5.533 3.200 1.00 0.00 C ATOM 1195 CG MET A 75 1.121 -5.885 4.324 1.00 0.00 C ATOM 1196 SD MET A 75 -0.051 -4.572 4.751 1.00 0.00 S ATOM 1197 CE MET A 75 1.103 -3.242 5.164 1.00 0.00 C ATOM 0 H MET A 75 4.184 -6.136 1.324 1.00 0.00 H new ATOM 0 HA MET A 75 2.868 -7.547 3.516 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.841 -4.825 3.555 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.561 -5.050 2.379 1.00 0.00 H new ATOM 0 HG2 MET A 75 0.560 -6.774 4.036 1.00 0.00 H new ATOM 0 HG3 MET A 75 1.695 -6.144 5.214 1.00 0.00 H new ATOM 0 HE1 MET A 75 0.562 -2.298 5.226 1.00 0.00 H new ATOM 0 HE2 MET A 75 1.574 -3.454 6.124 1.00 0.00 H new ATOM 0 HE3 MET A 75 1.869 -3.172 4.391 1.00 0.00 H new ATOM 1207 N ASP A 76 2.132 -7.216 0.355 1.00 0.00 N ATOM 1208 CA ASP A 76 1.287 -7.825 -0.659 1.00 0.00 C ATOM 1209 C ASP A 76 1.375 -9.352 -0.593 1.00 0.00 C ATOM 1210 O ASP A 76 2.461 -9.919 -0.483 1.00 0.00 O ATOM 1211 CB ASP A 76 1.719 -7.331 -2.037 1.00 0.00 C ATOM 1212 CG ASP A 76 1.015 -8.086 -3.158 1.00 0.00 C ATOM 1213 OD1 ASP A 76 -0.166 -7.767 -3.415 1.00 0.00 O ATOM 1214 OD2 ASP A 76 1.661 -8.977 -3.751 1.00 0.00 O ATOM 0 H ASP A 76 2.888 -6.628 0.003 1.00 0.00 H new ATOM 0 HA ASP A 76 0.251 -7.539 -0.477 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.503 -6.266 -2.125 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.798 -7.447 -2.143 1.00 0.00 H new ATOM 1219 N GLY A 77 0.213 -10.005 -0.661 1.00 0.00 N ATOM 1220 CA GLY A 77 0.127 -11.460 -0.692 1.00 0.00 C ATOM 1221 C GLY A 77 0.357 -12.103 0.672 1.00 0.00 C ATOM 1222 O GLY A 77 0.472 -13.325 0.757 1.00 0.00 O ATOM 0 H GLY A 77 -0.693 -9.537 -0.696 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.855 -11.752 -1.063 1.00 0.00 H new ATOM 0 HA3 GLY A 77 0.862 -11.846 -1.398 1.00 0.00 H new ATOM 1226 N ALA A 78 0.428 -11.304 1.744 1.00 0.00 N ATOM 1227 CA ALA A 78 0.665 -11.809 3.089 1.00 0.00 C ATOM 1228 C ALA A 78 -0.627 -12.335 3.715 1.00 0.00 C ATOM 1229 O ALA A 78 -0.833 -12.232 4.924 1.00 0.00 O ATOM 1230 CB ALA A 78 1.280 -10.694 3.936 1.00 0.00 C ATOM 0 H ALA A 78 0.322 -10.291 1.696 1.00 0.00 H new ATOM 0 HA ALA A 78 1.359 -12.648 3.044 1.00 0.00 H new ATOM 0 HB1 ALA A 78 1.461 -11.062 4.946 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.223 -10.377 3.491 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.595 -9.847 3.976 1.00 0.00 H new ATOM 1236 N VAL A 79 -1.503 -12.898 2.880 1.00 0.00 N ATOM 1237 CA VAL A 79 -2.836 -13.329 3.269 1.00 0.00 C ATOM 1238 C VAL A 79 -2.803 -14.539 4.192 1.00 0.00 C ATOM 1239 O VAL A 79 -1.786 -15.225 4.313 1.00 0.00 O ATOM 1240 CB VAL A 79 -3.657 -13.640 2.016 1.00 0.00 C ATOM 1241 CG1 VAL A 79 -5.104 -14.025 2.268 1.00 0.00 C ATOM 1242 CG2 VAL A 79 -3.554 -12.498 1.001 1.00 0.00 C ATOM 0 H VAL A 79 -1.296 -13.068 1.896 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.302 -12.516 3.826 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.205 -14.540 1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -5.598 -14.225 1.317 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.140 -14.919 2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.615 -13.208 2.777 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.146 -12.741 0.118 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -3.931 -11.578 1.448 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -2.512 -12.360 0.713 1.00 0.00 H new ATOM 1252 N LEU A 80 -3.940 -14.794 4.843 1.00 0.00 N ATOM 1253 CA LEU A 80 -4.077 -15.891 5.791 1.00 0.00 C ATOM 1254 C LEU A 80 -5.535 -16.319 5.993 1.00 0.00 C ATOM 1255 O LEU A 80 -5.811 -17.106 6.896 1.00 0.00 O ATOM 1256 CB LEU A 80 -3.401 -15.511 7.116 1.00 0.00 C ATOM 1257 CG LEU A 80 -3.611 -14.053 7.546 1.00 0.00 C ATOM 1258 CD1 LEU A 80 -5.082 -13.655 7.577 1.00 0.00 C ATOM 1259 CD2 LEU A 80 -3.023 -13.854 8.939 1.00 0.00 C ATOM 0 H LEU A 80 -4.790 -14.243 4.724 1.00 0.00 H new ATOM 0 HA LEU A 80 -3.573 -16.764 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -3.778 -16.166 7.902 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.331 -15.700 7.030 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.112 -13.423 6.809 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.171 -12.614 7.888 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.512 -13.775 6.583 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.616 -14.291 8.283 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.169 -12.820 9.251 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.522 -14.519 9.643 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.957 -14.080 8.920 1.00 0.00 H new ATOM 1271 N ASP A 81 -6.476 -15.828 5.179 1.00 0.00 N ATOM 1272 CA ASP A 81 -7.877 -16.209 5.328 1.00 0.00 C ATOM 1273 C ASP A 81 -8.653 -16.194 4.004 1.00 0.00 C ATOM 1274 O ASP A 81 -9.863 -16.414 4.000 1.00 0.00 O ATOM 1275 CB ASP A 81 -8.529 -15.280 6.354 1.00 0.00 C ATOM 1276 CG ASP A 81 -9.900 -15.788 6.790 1.00 0.00 C ATOM 1277 OD1 ASP A 81 -9.985 -16.984 7.146 1.00 0.00 O ATOM 1278 OD2 ASP A 81 -10.851 -14.977 6.761 1.00 0.00 O ATOM 0 H ASP A 81 -6.292 -15.173 4.419 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.910 -17.242 5.674 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.881 -15.190 7.226 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.630 -14.282 5.928 1.00 0.00 H new ATOM 1283 N GLY A 82 -7.980 -15.936 2.880 1.00 0.00 N ATOM 1284 CA GLY A 82 -8.614 -15.940 1.562 1.00 0.00 C ATOM 1285 C GLY A 82 -8.280 -14.681 0.763 1.00 0.00 C ATOM 1286 O GLY A 82 -8.400 -14.674 -0.462 1.00 0.00 O ATOM 0 H GLY A 82 -6.984 -15.719 2.859 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -8.289 -16.819 1.006 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.695 -16.019 1.680 1.00 0.00 H new ATOM 1290 N ARG A 83 -7.861 -13.626 1.464 1.00 0.00 N ATOM 1291 CA ARG A 83 -7.414 -12.356 0.916 1.00 0.00 C ATOM 1292 C ARG A 83 -6.928 -11.522 2.090 1.00 0.00 C ATOM 1293 O ARG A 83 -7.502 -11.599 3.175 1.00 0.00 O ATOM 1294 CB ARG A 83 -8.541 -11.626 0.180 1.00 0.00 C ATOM 1295 CG ARG A 83 -9.682 -11.213 1.101 1.00 0.00 C ATOM 1296 CD ARG A 83 -10.380 -9.994 0.524 1.00 0.00 C ATOM 1297 NE ARG A 83 -11.027 -10.273 -0.762 1.00 0.00 N ATOM 1298 CZ ARG A 83 -11.713 -9.364 -1.458 1.00 0.00 C ATOM 1299 NH1 ARG A 83 -11.872 -8.129 -0.986 1.00 0.00 N ATOM 1300 NH2 ARG A 83 -12.246 -9.687 -2.634 1.00 0.00 N ATOM 0 H ARG A 83 -7.825 -13.641 2.483 1.00 0.00 H new ATOM 0 HA ARG A 83 -6.623 -12.522 0.185 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -8.135 -10.739 -0.307 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -8.932 -12.271 -0.607 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.391 -12.034 1.211 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -9.298 -10.989 2.096 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -11.127 -9.638 1.233 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -9.654 -9.191 0.395 1.00 0.00 H new ATOM 0 HE ARG A 83 -10.948 -11.215 -1.146 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -11.468 -7.871 -0.086 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -12.398 -7.441 -1.525 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -12.130 -10.630 -3.004 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -12.770 -8.991 -3.165 1.00 0.00 H new ATOM 1314 N GLU A 84 -5.878 -10.735 1.901 1.00 0.00 N ATOM 1315 CA GLU A 84 -5.513 -9.745 2.898 1.00 0.00 C ATOM 1316 C GLU A 84 -5.039 -8.471 2.206 1.00 0.00 C ATOM 1317 O GLU A 84 -5.483 -7.385 2.569 1.00 0.00 O ATOM 1318 CB GLU A 84 -4.433 -10.231 3.870 1.00 0.00 C ATOM 1319 CG GLU A 84 -4.920 -11.291 4.855 1.00 0.00 C ATOM 1320 CD GLU A 84 -6.049 -10.775 5.753 1.00 0.00 C ATOM 1321 OE1 GLU A 84 -6.012 -9.573 6.108 1.00 0.00 O ATOM 1322 OE2 GLU A 84 -6.943 -11.586 6.083 1.00 0.00 O ATOM 0 H GLU A 84 -5.274 -10.763 1.080 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.408 -9.553 3.490 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -3.599 -10.637 3.298 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.051 -9.377 4.430 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -5.268 -12.164 4.303 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -4.086 -11.618 5.476 1.00 0.00 H new ATOM 1329 N LEU A 85 -4.148 -8.605 1.213 1.00 0.00 N ATOM 1330 CA LEU A 85 -3.604 -7.463 0.494 1.00 0.00 C ATOM 1331 C LEU A 85 -3.475 -7.733 -0.994 1.00 0.00 C ATOM 1332 O LEU A 85 -3.432 -8.878 -1.444 1.00 0.00 O ATOM 1333 CB LEU A 85 -2.172 -7.139 0.961 1.00 0.00 C ATOM 1334 CG LEU A 85 -1.971 -6.529 2.350 1.00 0.00 C ATOM 1335 CD1 LEU A 85 -2.901 -5.341 2.564 1.00 0.00 C ATOM 1336 CD2 LEU A 85 -2.139 -7.580 3.438 1.00 0.00 C ATOM 0 H LEU A 85 -3.791 -9.506 0.893 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.299 -6.647 0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.594 -8.062 0.919 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.734 -6.455 0.234 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.948 -6.157 2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.738 -4.926 3.559 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.695 -4.578 1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.937 -5.669 2.473 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.991 -7.119 4.415 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.142 -8.002 3.384 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.404 -8.372 3.295 1.00 0.00 H new ATOM 1348 N ARG A 86 -3.409 -6.616 -1.720 1.00 0.00 N ATOM 1349 CA ARG A 86 -3.059 -6.519 -3.118 1.00 0.00 C ATOM 1350 C ARG A 86 -2.459 -5.135 -3.291 1.00 0.00 C ATOM 1351 O ARG A 86 -3.151 -4.134 -3.121 1.00 0.00 O ATOM 1352 CB ARG A 86 -4.308 -6.678 -3.978 1.00 0.00 C ATOM 1353 CG ARG A 86 -4.578 -8.143 -4.326 1.00 0.00 C ATOM 1354 CD ARG A 86 -3.430 -8.783 -5.115 1.00 0.00 C ATOM 1355 NE ARG A 86 -3.228 -8.112 -6.405 1.00 0.00 N ATOM 1356 CZ ARG A 86 -2.076 -7.579 -6.829 1.00 0.00 C ATOM 1357 NH1 ARG A 86 -0.980 -7.585 -6.071 1.00 0.00 N ATOM 1358 NH2 ARG A 86 -2.015 -7.028 -8.037 1.00 0.00 N ATOM 0 H ARG A 86 -3.613 -5.704 -1.312 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.359 -7.297 -3.423 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.168 -6.266 -3.449 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.192 -6.102 -4.896 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.741 -8.707 -3.407 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.497 -8.211 -4.909 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.512 -8.733 -4.530 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.645 -9.838 -5.282 1.00 0.00 H new ATOM 0 HE ARG A 86 -4.032 -8.047 -7.030 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.005 -8.003 -5.141 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.116 -7.171 -6.421 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.842 -7.014 -8.633 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.141 -6.620 -8.368 1.00 0.00 H new ATOM 1372 N VAL A 87 -1.168 -5.076 -3.618 1.00 0.00 N ATOM 1373 CA VAL A 87 -0.467 -3.810 -3.741 1.00 0.00 C ATOM 1374 C VAL A 87 0.413 -3.844 -4.982 1.00 0.00 C ATOM 1375 O VAL A 87 1.211 -4.760 -5.154 1.00 0.00 O ATOM 1376 CB VAL A 87 0.399 -3.581 -2.497 1.00 0.00 C ATOM 1377 CG1 VAL A 87 0.991 -2.177 -2.492 1.00 0.00 C ATOM 1378 CG2 VAL A 87 -0.380 -3.824 -1.204 1.00 0.00 C ATOM 0 H VAL A 87 -0.590 -5.896 -3.802 1.00 0.00 H new ATOM 0 HA VAL A 87 -1.188 -2.997 -3.829 1.00 0.00 H new ATOM 0 HB VAL A 87 1.211 -4.307 -2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.601 -2.042 -1.598 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.611 -2.040 -3.378 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.186 -1.443 -2.496 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.272 -3.650 -0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.229 -3.142 -1.157 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.739 -4.853 -1.184 1.00 0.00 H new ATOM 1388 N GLN A 88 0.258 -2.835 -5.840 1.00 0.00 N ATOM 1389 CA GLN A 88 1.035 -2.701 -7.057 1.00 0.00 C ATOM 1390 C GLN A 88 0.827 -1.303 -7.626 1.00 0.00 C ATOM 1391 O GLN A 88 -0.094 -0.587 -7.240 1.00 0.00 O ATOM 1392 CB GLN A 88 0.580 -3.757 -8.068 1.00 0.00 C ATOM 1393 CG GLN A 88 1.671 -4.110 -9.082 1.00 0.00 C ATOM 1394 CD GLN A 88 1.226 -5.254 -9.986 1.00 0.00 C ATOM 1395 OE1 GLN A 88 0.289 -5.986 -9.665 1.00 0.00 O ATOM 1396 NE2 GLN A 88 1.893 -5.420 -11.125 1.00 0.00 N ATOM 0 H GLN A 88 -0.419 -2.084 -5.702 1.00 0.00 H new ATOM 0 HA GLN A 88 2.094 -2.849 -6.845 1.00 0.00 H new ATOM 0 HB2 GLN A 88 0.279 -4.659 -7.535 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -0.299 -3.392 -8.598 1.00 0.00 H new ATOM 0 HG2 GLN A 88 1.908 -3.235 -9.687 1.00 0.00 H new ATOM 0 HG3 GLN A 88 2.584 -4.391 -8.557 1.00 0.00 H new ATOM 0 HE21 GLN A 88 2.664 -4.795 -11.360 1.00 0.00 H new ATOM 0 HE22 GLN A 88 1.633 -6.172 -11.763 1.00 0.00 H new ATOM 1405 N MET A 89 1.697 -0.927 -8.555 1.00 0.00 N ATOM 1406 CA MET A 89 1.747 0.416 -9.101 1.00 0.00 C ATOM 1407 C MET A 89 0.464 0.726 -9.867 1.00 0.00 C ATOM 1408 O MET A 89 -0.085 -0.142 -10.544 1.00 0.00 O ATOM 1409 CB MET A 89 2.992 0.507 -9.974 1.00 0.00 C ATOM 1410 CG MET A 89 4.209 0.306 -9.066 1.00 0.00 C ATOM 1411 SD MET A 89 4.649 1.783 -8.122 1.00 0.00 S ATOM 1412 CE MET A 89 5.811 1.043 -6.950 1.00 0.00 C ATOM 0 H MET A 89 2.394 -1.556 -8.953 1.00 0.00 H new ATOM 0 HA MET A 89 1.812 1.165 -8.312 1.00 0.00 H new ATOM 0 HB2 MET A 89 2.968 -0.252 -10.756 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.041 1.476 -10.472 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.006 -0.512 -8.374 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.062 0.005 -9.674 1.00 0.00 H new ATOM 0 HE1 MET A 89 6.244 1.824 -6.325 1.00 0.00 H new ATOM 0 HE2 MET A 89 5.285 0.325 -6.321 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.605 0.534 -7.497 1.00 0.00 H new ATOM 1422 N ALA A 90 -0.005 1.972 -9.751 1.00 0.00 N ATOM 1423 CA ALA A 90 -1.232 2.423 -10.391 1.00 0.00 C ATOM 1424 C ALA A 90 -1.114 2.391 -11.918 1.00 0.00 C ATOM 1425 O ALA A 90 -0.021 2.240 -12.467 1.00 0.00 O ATOM 1426 CB ALA A 90 -1.556 3.836 -9.901 1.00 0.00 C ATOM 0 H ALA A 90 0.463 2.696 -9.206 1.00 0.00 H new ATOM 0 HA ALA A 90 -2.042 1.745 -10.120 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -2.474 4.184 -10.375 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.688 3.825 -8.819 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.737 4.508 -10.160 1.00 0.00 H new ATOM 1432 N ARG A 91 -2.255 2.541 -12.602 1.00 0.00 N ATOM 1433 CA ARG A 91 -2.322 2.544 -14.062 1.00 0.00 C ATOM 1434 C ARG A 91 -3.296 3.609 -14.563 1.00 0.00 C ATOM 1435 O ARG A 91 -3.366 3.867 -15.765 1.00 0.00 O ATOM 1436 CB ARG A 91 -2.732 1.142 -14.524 1.00 0.00 C ATOM 1437 CG ARG A 91 -2.619 0.954 -16.041 1.00 0.00 C ATOM 1438 CD ARG A 91 -2.981 -0.484 -16.424 1.00 0.00 C ATOM 1439 NE ARG A 91 -2.051 -1.456 -15.833 1.00 0.00 N ATOM 1440 CZ ARG A 91 -2.237 -2.778 -15.866 1.00 0.00 C ATOM 1441 NH1 ARG A 91 -3.308 -3.304 -16.459 1.00 0.00 N ATOM 1442 NH2 ARG A 91 -1.345 -3.590 -15.304 1.00 0.00 N ATOM 0 H ARG A 91 -3.162 2.664 -12.151 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.347 2.794 -14.481 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.105 0.403 -14.024 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -3.760 0.950 -14.215 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.282 1.652 -16.552 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -1.604 1.181 -16.368 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.996 -0.704 -16.093 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -2.971 -0.585 -17.509 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.214 -1.100 -15.370 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.000 -2.695 -16.896 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.436 -4.316 -16.476 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -0.519 -3.203 -14.848 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -1.487 -4.600 -15.329 1.00 0.00 H new ATOM 1456 N TYR A 92 -4.043 4.236 -13.650 1.00 0.00 N ATOM 1457 CA TYR A 92 -4.988 5.286 -14.001 1.00 0.00 C ATOM 1458 C TYR A 92 -4.946 6.402 -12.958 1.00 0.00 C ATOM 1459 O TYR A 92 -4.271 6.264 -11.941 1.00 0.00 O ATOM 1460 CB TYR A 92 -6.402 4.717 -14.162 1.00 0.00 C ATOM 1461 CG TYR A 92 -6.476 3.349 -14.800 1.00 0.00 C ATOM 1462 CD1 TYR A 92 -6.313 3.198 -16.187 1.00 0.00 C ATOM 1463 CD2 TYR A 92 -6.714 2.226 -13.995 1.00 0.00 C ATOM 1464 CE1 TYR A 92 -6.384 1.924 -16.764 1.00 0.00 C ATOM 1465 CE2 TYR A 92 -6.787 0.947 -14.567 1.00 0.00 C ATOM 1466 CZ TYR A 92 -6.621 0.789 -15.958 1.00 0.00 C ATOM 1467 OH TYR A 92 -6.694 -0.451 -16.519 1.00 0.00 O ATOM 0 H TYR A 92 -4.006 4.027 -12.652 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.699 5.711 -14.962 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -6.871 4.668 -13.179 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -6.990 5.412 -14.761 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.133 4.063 -16.808 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.842 2.346 -12.929 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -6.257 1.809 -17.830 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.970 0.085 -13.943 1.00 0.00 H new ATOM 0 HH TYR A 92 -6.861 -1.117 -15.820 1.00 0.00 H new ATOM 1477 N GLY A 93 -5.659 7.504 -13.199 1.00 0.00 N ATOM 1478 CA GLY A 93 -5.593 8.684 -12.346 1.00 0.00 C ATOM 1479 C GLY A 93 -6.925 9.003 -11.672 1.00 0.00 C ATOM 1480 O GLY A 93 -7.933 8.341 -11.925 1.00 0.00 O ATOM 0 H GLY A 93 -6.296 7.600 -13.990 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.832 8.531 -11.581 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.279 9.541 -12.942 1.00 0.00 H new ATOM 1484 N ARG A 94 -6.912 10.021 -10.803 1.00 0.00 N ATOM 1485 CA ARG A 94 -8.081 10.458 -10.051 1.00 0.00 C ATOM 1486 C ARG A 94 -9.189 10.898 -11.009 1.00 0.00 C ATOM 1487 O ARG A 94 -8.889 11.505 -12.039 1.00 0.00 O ATOM 1488 CB ARG A 94 -7.650 11.603 -9.126 1.00 0.00 C ATOM 1489 CG ARG A 94 -8.770 12.007 -8.168 1.00 0.00 C ATOM 1490 CD ARG A 94 -8.288 13.098 -7.212 1.00 0.00 C ATOM 1491 NE ARG A 94 -9.352 13.475 -6.272 1.00 0.00 N ATOM 1492 CZ ARG A 94 -9.209 14.384 -5.306 1.00 0.00 C ATOM 1493 NH1 ARG A 94 -8.054 15.024 -5.131 1.00 0.00 N ATOM 1494 NH2 ARG A 94 -10.230 14.662 -4.502 1.00 0.00 N ATOM 0 H ARG A 94 -6.074 10.568 -10.604 1.00 0.00 H new ATOM 0 HA ARG A 94 -8.480 9.641 -9.451 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -6.774 11.298 -8.554 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -7.356 12.464 -9.726 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -9.630 12.365 -8.734 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -9.102 11.138 -7.600 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -7.417 12.745 -6.660 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -7.972 13.973 -7.781 1.00 0.00 H new ATOM 0 HE ARG A 94 -10.257 13.013 -6.364 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -7.262 14.822 -5.741 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -7.962 15.716 -4.387 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -11.121 14.181 -4.624 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -10.123 15.357 -3.763 1.00 0.00 H new ATOM 1508 N PRO A 95 -10.461 10.608 -10.696 1.00 0.00 N ATOM 1509 CA PRO A 95 -11.592 10.953 -11.545 1.00 0.00 C ATOM 1510 C PRO A 95 -11.606 12.425 -11.972 1.00 0.00 C ATOM 1511 O PRO A 95 -11.471 13.306 -11.122 1.00 0.00 O ATOM 1512 CB PRO A 95 -12.828 10.647 -10.699 1.00 0.00 C ATOM 1513 CG PRO A 95 -12.361 9.538 -9.762 1.00 0.00 C ATOM 1514 CD PRO A 95 -10.900 9.902 -9.506 1.00 0.00 C ATOM 0 HA PRO A 95 -11.548 10.386 -12.475 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -13.161 11.525 -10.145 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -13.666 10.323 -11.317 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -12.940 9.518 -8.839 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -12.458 8.554 -10.220 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.801 10.528 -8.619 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -10.298 9.010 -9.335 1.00 0.00 H new ATOM 1522 N PRO A 96 -11.773 12.705 -13.273 1.00 0.00 N ATOM 1523 CA PRO A 96 -12.027 14.048 -13.761 1.00 0.00 C ATOM 1524 C PRO A 96 -13.484 14.418 -13.488 1.00 0.00 C ATOM 1525 O PRO A 96 -13.823 15.594 -13.371 1.00 0.00 O ATOM 1526 CB PRO A 96 -11.779 13.977 -15.263 1.00 0.00 C ATOM 1527 CG PRO A 96 -12.147 12.534 -15.609 1.00 0.00 C ATOM 1528 CD PRO A 96 -11.744 11.749 -14.360 1.00 0.00 C ATOM 0 HA PRO A 96 -11.396 14.795 -13.279 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -12.396 14.692 -15.807 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -10.741 14.199 -15.511 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -13.211 12.432 -15.820 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.612 12.185 -16.492 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -12.433 10.925 -14.176 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.751 11.315 -14.474 1.00 0.00 H new ATOM 1536 N ASP A 97 -14.336 13.395 -13.386 1.00 0.00 N ATOM 1537 CA ASP A 97 -15.747 13.512 -13.067 1.00 0.00 C ATOM 1538 C ASP A 97 -16.219 12.156 -12.548 1.00 0.00 C ATOM 1539 O ASP A 97 -15.549 11.149 -12.780 1.00 0.00 O ATOM 1540 CB ASP A 97 -16.516 13.906 -14.329 1.00 0.00 C ATOM 1541 CG ASP A 97 -17.990 14.152 -14.027 1.00 0.00 C ATOM 1542 OD1 ASP A 97 -18.268 14.930 -13.087 1.00 0.00 O ATOM 1543 OD2 ASP A 97 -18.827 13.557 -14.741 1.00 0.00 O ATOM 0 H ASP A 97 -14.043 12.429 -13.530 1.00 0.00 H new ATOM 0 HA ASP A 97 -15.919 14.276 -12.309 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -16.076 14.806 -14.759 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -16.422 13.117 -15.075 1.00 0.00 H new ATOM 1548 N SER A 98 -17.356 12.114 -11.852 1.00 0.00 N ATOM 1549 CA SER A 98 -17.847 10.876 -11.268 1.00 0.00 C ATOM 1550 C SER A 98 -18.365 9.903 -12.326 1.00 0.00 C ATOM 1551 O SER A 98 -19.548 9.922 -12.671 1.00 0.00 O ATOM 1552 CB SER A 98 -18.914 11.159 -10.212 1.00 0.00 C ATOM 1553 OG SER A 98 -19.974 11.922 -10.754 1.00 0.00 O ATOM 0 H SER A 98 -17.950 12.925 -11.682 1.00 0.00 H new ATOM 0 HA SER A 98 -17.000 10.392 -10.781 1.00 0.00 H new ATOM 0 HB2 SER A 98 -19.301 10.218 -9.820 1.00 0.00 H new ATOM 0 HB3 SER A 98 -18.468 11.694 -9.373 1.00 0.00 H new ATOM 0 HG SER A 98 -20.232 11.552 -11.624 1.00 0.00 H new ATOM 1559 N HIS A 99 -17.468 9.055 -12.840 1.00 0.00 N ATOM 1560 CA HIS A 99 -17.778 8.018 -13.816 1.00 0.00 C ATOM 1561 C HIS A 99 -18.547 8.566 -15.025 1.00 0.00 C ATOM 1562 O HIS A 99 -19.266 7.825 -15.696 1.00 0.00 O ATOM 1563 CB HIS A 99 -18.504 6.874 -13.105 1.00 0.00 C ATOM 1564 CG HIS A 99 -18.677 5.647 -13.956 1.00 0.00 C ATOM 1565 ND1 HIS A 99 -17.650 4.974 -14.620 1.00 0.00 N ATOM 1566 CD2 HIS A 99 -19.864 5.012 -14.199 1.00 0.00 C ATOM 1567 CE1 HIS A 99 -18.243 3.944 -15.245 1.00 0.00 C ATOM 1568 NE2 HIS A 99 -19.569 3.942 -15.014 1.00 0.00 N ATOM 0 H HIS A 99 -16.482 9.076 -12.579 1.00 0.00 H new ATOM 0 HA HIS A 99 -16.851 7.628 -14.237 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -17.949 6.606 -12.206 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -19.485 7.223 -12.782 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -20.838 5.294 -13.826 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -17.726 3.215 -15.851 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -20.239 3.265 -15.379 1.00 0.00 H new ATOM 1576 N HIS A 100 -18.400 9.867 -15.299 1.00 0.00 N ATOM 1577 CA HIS A 100 -19.091 10.554 -16.386 1.00 0.00 C ATOM 1578 C HIS A 100 -20.602 10.301 -16.372 1.00 0.00 C ATOM 1579 O HIS A 100 -21.245 10.321 -17.423 1.00 0.00 O ATOM 1580 CB HIS A 100 -18.440 10.181 -17.724 1.00 0.00 C ATOM 1581 CG HIS A 100 -16.968 10.493 -17.768 1.00 0.00 C ATOM 1582 ND1 HIS A 100 -16.412 11.750 -18.016 1.00 0.00 N ATOM 1583 CD2 HIS A 100 -15.964 9.588 -17.570 1.00 0.00 C ATOM 1584 CE1 HIS A 100 -15.085 11.569 -17.954 1.00 0.00 C ATOM 1585 NE2 HIS A 100 -14.785 10.284 -17.693 1.00 0.00 N ATOM 0 H HIS A 100 -17.787 10.479 -14.760 1.00 0.00 H new ATOM 0 HA HIS A 100 -18.983 11.629 -16.241 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -18.586 9.117 -17.909 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -18.944 10.716 -18.529 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -16.075 8.535 -17.359 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -14.354 12.351 -18.095 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -13.847 9.894 -17.602 1.00 0.00 H new ATOM 1593 N SER A 101 -21.165 10.057 -15.183 1.00 0.00 N ATOM 1594 CA SER A 101 -22.586 9.780 -14.999 1.00 0.00 C ATOM 1595 C SER A 101 -23.457 10.857 -15.643 1.00 0.00 C ATOM 1596 O SER A 101 -23.217 12.052 -15.354 1.00 0.00 O ATOM 1597 CB SER A 101 -22.909 9.658 -13.513 1.00 0.00 C ATOM 1598 OG SER A 101 -22.114 8.647 -12.927 1.00 0.00 O ATOM 1599 OXT SER A 101 -24.362 10.478 -16.418 1.00 0.00 O ATOM 0 H SER A 101 -20.635 10.047 -14.312 1.00 0.00 H new ATOM 0 HA SER A 101 -22.808 8.835 -15.494 1.00 0.00 H new ATOM 0 HB2 SER A 101 -22.728 10.610 -13.014 1.00 0.00 H new ATOM 0 HB3 SER A 101 -23.965 9.424 -13.380 1.00 0.00 H new ATOM 0 HG SER A 101 -21.216 8.998 -12.752 1.00 0.00 H new TER 1605 SER A 101 ATOM 1606 O5' U B 102 -10.585 -3.907 -12.896 1.00 0.00 O ATOM 1607 C5' U B 102 -11.250 -4.502 -11.800 1.00 0.00 C ATOM 1608 C4' U B 102 -11.264 -3.534 -10.616 1.00 0.00 C ATOM 1609 O4' U B 102 -12.125 -2.449 -10.918 1.00 0.00 O ATOM 1610 C3' U B 102 -11.846 -4.236 -9.384 1.00 0.00 C ATOM 1611 O3' U B 102 -11.377 -3.676 -8.170 1.00 0.00 O ATOM 1612 C2' U B 102 -13.322 -3.916 -9.547 1.00 0.00 C ATOM 1613 O2' U B 102 -14.046 -4.056 -8.338 1.00 0.00 O ATOM 1614 C1' U B 102 -13.206 -2.468 -10.008 1.00 0.00 C ATOM 1615 N1 U B 102 -14.498 -1.969 -10.533 1.00 0.00 N ATOM 1616 C2 U B 102 -14.696 -1.794 -11.903 1.00 0.00 C ATOM 1617 O2 U B 102 -13.855 -2.075 -12.758 1.00 0.00 O ATOM 1618 N3 U B 102 -15.919 -1.272 -12.283 1.00 0.00 N ATOM 1619 C4 U B 102 -16.962 -0.948 -11.435 1.00 0.00 C ATOM 1620 O4 U B 102 -18.009 -0.490 -11.885 1.00 0.00 O ATOM 1621 C5 U B 102 -16.690 -1.194 -10.037 1.00 0.00 C ATOM 1622 C6 U B 102 -15.495 -1.688 -9.639 1.00 0.00 C ATOM 0 H5' U B 102 -10.750 -5.428 -11.518 1.00 0.00 H new ATOM 0 H5'' U B 102 -12.270 -4.763 -12.080 1.00 0.00 H new ATOM 0 H4' U B 102 -10.246 -3.195 -10.425 1.00 0.00 H new ATOM 0 H3' U B 102 -11.587 -5.293 -9.330 1.00 0.00 H new ATOM 0 H2' U B 102 -13.872 -4.572 -10.222 1.00 0.00 H new ATOM 0 HO2' U B 102 -14.845 -3.490 -8.368 1.00 0.00 H new ATOM 0 HO5' U B 102 -10.577 -4.531 -13.652 1.00 0.00 H new ATOM 0 H1' U B 102 -12.993 -1.770 -9.198 1.00 0.00 H new ATOM 0 H3 U B 102 -16.065 -1.111 -13.280 1.00 0.00 H new ATOM 0 H5 U B 102 -17.451 -0.981 -9.300 1.00 0.00 H new ATOM 0 H6 U B 102 -15.323 -1.865 -8.588 1.00 0.00 H new ATOM 1634 P G B 103 -9.806 -3.549 -7.836 1.00 0.00 P ATOM 1635 OP1 G B 103 -9.071 -4.578 -8.607 1.00 0.00 O ATOM 1636 OP2 G B 103 -9.642 -3.474 -6.370 1.00 0.00 O ATOM 1637 O5' G B 103 -9.457 -2.108 -8.454 1.00 0.00 O ATOM 1638 C5' G B 103 -10.010 -0.934 -7.888 1.00 0.00 C ATOM 1639 C4' G B 103 -9.618 0.291 -8.707 1.00 0.00 C ATOM 1640 O4' G B 103 -8.219 0.436 -8.721 1.00 0.00 O ATOM 1641 C3' G B 103 -9.999 0.156 -10.175 1.00 0.00 C ATOM 1642 O3' G B 103 -11.351 0.429 -10.550 1.00 0.00 O ATOM 1643 C2' G B 103 -8.932 0.957 -10.918 1.00 0.00 C ATOM 1644 O2' G B 103 -9.395 2.156 -11.494 1.00 0.00 O ATOM 1645 C1' G B 103 -7.910 1.261 -9.821 1.00 0.00 C ATOM 1646 N9 G B 103 -6.544 1.003 -10.310 1.00 0.00 N ATOM 1647 C8 G B 103 -5.509 1.890 -10.395 1.00 0.00 C ATOM 1648 N7 G B 103 -4.418 1.389 -10.900 1.00 0.00 N ATOM 1649 C5 G B 103 -4.746 0.058 -11.158 1.00 0.00 C ATOM 1650 C6 G B 103 -3.964 -1.005 -11.701 1.00 0.00 C ATOM 1651 O6 G B 103 -2.793 -0.984 -12.073 1.00 0.00 O ATOM 1652 N1 G B 103 -4.677 -2.186 -11.792 1.00 0.00 N ATOM 1653 C2 G B 103 -5.982 -2.344 -11.393 1.00 0.00 C ATOM 1654 N2 G B 103 -6.516 -3.553 -11.546 1.00 0.00 N ATOM 1655 N3 G B 103 -6.724 -1.359 -10.878 1.00 0.00 N ATOM 1656 C4 G B 103 -6.047 -0.186 -10.790 1.00 0.00 C ATOM 0 H5' G B 103 -9.661 -0.819 -6.862 1.00 0.00 H new ATOM 0 H5'' G B 103 -11.096 -1.019 -7.848 1.00 0.00 H new ATOM 0 H4' G B 103 -10.136 1.130 -8.242 1.00 0.00 H new ATOM 0 H3' G B 103 -10.003 -0.897 -10.457 1.00 0.00 H new ATOM 0 H2' G B 103 -8.547 0.394 -11.769 1.00 0.00 H new ATOM 0 HO2' G B 103 -10.373 2.135 -11.551 1.00 0.00 H new ATOM 0 H1' G B 103 -7.953 2.310 -9.528 1.00 0.00 H new ATOM 0 H8 G B 103 -5.588 2.917 -10.072 1.00 0.00 H new ATOM 0 H1 G B 103 -4.200 -2.998 -12.183 1.00 0.00 H new ATOM 0 H21 G B 103 -7.482 -3.723 -11.265 1.00 0.00 H new ATOM 0 H22 G B 103 -5.960 -4.310 -11.944 1.00 0.00 H new ATOM 1668 P G B 104 -12.322 1.549 -9.877 1.00 0.00 P ATOM 1669 OP1 G B 104 -12.184 1.490 -8.406 1.00 0.00 O ATOM 1670 OP2 G B 104 -13.665 1.350 -10.470 1.00 0.00 O ATOM 1671 O5' G B 104 -11.788 2.978 -10.397 1.00 0.00 O ATOM 1672 C5' G B 104 -10.793 3.702 -9.700 1.00 0.00 C ATOM 1673 C4' G B 104 -11.381 4.550 -8.577 1.00 0.00 C ATOM 1674 O4' G B 104 -10.501 4.622 -7.462 1.00 0.00 O ATOM 1675 C3' G B 104 -11.584 5.996 -9.017 1.00 0.00 C ATOM 1676 O3' G B 104 -12.636 6.244 -9.943 1.00 0.00 O ATOM 1677 C2' G B 104 -11.620 6.699 -7.666 1.00 0.00 C ATOM 1678 O2' G B 104 -12.828 6.472 -6.970 1.00 0.00 O ATOM 1679 C1' G B 104 -10.486 5.959 -6.961 1.00 0.00 C ATOM 1680 N9 G B 104 -9.211 6.648 -7.276 1.00 0.00 N ATOM 1681 C8 G B 104 -8.673 7.740 -6.645 1.00 0.00 C ATOM 1682 N7 G B 104 -7.567 8.180 -7.182 1.00 0.00 N ATOM 1683 C5 G B 104 -7.321 7.279 -8.218 1.00 0.00 C ATOM 1684 C6 G B 104 -6.227 7.199 -9.127 1.00 0.00 C ATOM 1685 O6 G B 104 -5.257 7.944 -9.232 1.00 0.00 O ATOM 1686 N1 G B 104 -6.335 6.107 -9.974 1.00 0.00 N ATOM 1687 C2 G B 104 -7.396 5.239 -9.991 1.00 0.00 C ATOM 1688 N2 G B 104 -7.393 4.284 -10.915 1.00 0.00 N ATOM 1689 N3 G B 104 -8.416 5.302 -9.142 1.00 0.00 N ATOM 1690 C4 G B 104 -8.319 6.334 -8.273 1.00 0.00 C ATOM 0 H5' G B 104 -10.258 4.346 -10.398 1.00 0.00 H new ATOM 0 H5'' G B 104 -10.063 3.007 -9.285 1.00 0.00 H new ATOM 0 H4' G B 104 -12.324 4.070 -8.316 1.00 0.00 H new ATOM 0 H3' G B 104 -10.802 6.384 -9.669 1.00 0.00 H new ATOM 0 H2' G B 104 -11.533 7.783 -7.732 1.00 0.00 H new ATOM 0 HO2' G B 104 -13.578 6.827 -7.492 1.00 0.00 H new ATOM 0 H1' G B 104 -10.598 5.945 -5.877 1.00 0.00 H new ATOM 0 H8 G B 104 -9.126 8.197 -5.778 1.00 0.00 H new ATOM 0 H1 G B 104 -5.572 5.938 -10.630 1.00 0.00 H new ATOM 0 H21 G B 104 -8.164 3.617 -10.962 1.00 0.00 H new ATOM 0 H22 G B 104 -6.620 4.218 -11.577 1.00 0.00 H new ATOM 1702 P A B 105 -14.199 5.909 -9.693 1.00 0.00 P ATOM 1703 OP1 A B 105 -14.331 4.722 -8.826 1.00 0.00 O ATOM 1704 OP2 A B 105 -14.868 5.913 -11.015 1.00 0.00 O ATOM 1705 O5' A B 105 -14.739 7.187 -8.870 1.00 0.00 O ATOM 1706 C5' A B 105 -15.318 8.288 -9.541 1.00 0.00 C ATOM 1707 C4' A B 105 -15.835 9.361 -8.573 1.00 0.00 C ATOM 1708 O4' A B 105 -17.250 9.376 -8.628 1.00 0.00 O ATOM 1709 C3' A B 105 -15.514 9.075 -7.107 1.00 0.00 C ATOM 1710 O3' A B 105 -15.399 10.264 -6.331 1.00 0.00 O ATOM 1711 C2' A B 105 -16.673 8.174 -6.673 1.00 0.00 C ATOM 1712 O2' A B 105 -17.164 8.512 -5.392 1.00 0.00 O ATOM 1713 C1' A B 105 -17.750 8.398 -7.742 1.00 0.00 C ATOM 1714 N9 A B 105 -18.113 7.160 -8.464 1.00 0.00 N ATOM 1715 C8 A B 105 -17.376 6.022 -8.583 1.00 0.00 C ATOM 1716 N7 A B 105 -17.929 5.074 -9.284 1.00 0.00 N ATOM 1717 C5 A B 105 -19.155 5.626 -9.641 1.00 0.00 C ATOM 1718 C6 A B 105 -20.254 5.129 -10.373 1.00 0.00 C ATOM 1719 N6 A B 105 -20.286 3.919 -10.934 1.00 0.00 N ATOM 1720 N1 A B 105 -21.331 5.909 -10.517 1.00 0.00 N ATOM 1721 C2 A B 105 -21.313 7.118 -9.975 1.00 0.00 C ATOM 1722 N3 A B 105 -20.352 7.711 -9.280 1.00 0.00 N ATOM 1723 C4 A B 105 -19.280 6.898 -9.144 1.00 0.00 C ATOM 0 H5' A B 105 -16.141 7.938 -10.163 1.00 0.00 H new ATOM 0 H5'' A B 105 -14.580 8.731 -10.209 1.00 0.00 H new ATOM 0 H4' A B 105 -15.355 10.290 -8.881 1.00 0.00 H new ATOM 0 H3' A B 105 -14.543 8.601 -6.963 1.00 0.00 H new ATOM 0 H2' A B 105 -16.360 7.133 -6.594 1.00 0.00 H new ATOM 0 HO2' A B 105 -17.765 9.283 -5.465 1.00 0.00 H new ATOM 0 H1' A B 105 -18.673 8.728 -7.265 1.00 0.00 H new ATOM 0 H8 A B 105 -16.402 5.913 -8.129 1.00 0.00 H new ATOM 0 H61 A B 105 -21.112 3.618 -11.451 1.00 0.00 H new ATOM 0 H62 A B 105 -19.484 3.295 -10.846 1.00 0.00 H new ATOM 0 H2 A B 105 -22.209 7.704 -10.120 1.00 0.00 H new ATOM 1735 P G B 106 -16.495 11.449 -6.307 1.00 0.00 P ATOM 1736 OP1 G B 106 -17.861 10.879 -6.263 1.00 0.00 O ATOM 1737 OP2 G B 106 -16.140 12.437 -7.351 1.00 0.00 O ATOM 1738 O5' G B 106 -16.221 12.115 -4.866 1.00 0.00 O ATOM 1739 C5' G B 106 -16.778 11.543 -3.700 1.00 0.00 C ATOM 1740 C4' G B 106 -16.344 12.259 -2.415 1.00 0.00 C ATOM 1741 O4' G B 106 -15.008 11.913 -2.061 1.00 0.00 O ATOM 1742 C3' G B 106 -16.372 13.784 -2.542 1.00 0.00 C ATOM 1743 O3' G B 106 -16.541 14.369 -1.261 1.00 0.00 O ATOM 1744 C2' G B 106 -14.984 14.032 -3.121 1.00 0.00 C ATOM 1745 O2' G B 106 -14.515 15.347 -2.932 1.00 0.00 O ATOM 1746 C1' G B 106 -14.131 12.961 -2.449 1.00 0.00 C ATOM 1747 N9 G B 106 -13.096 12.436 -3.362 1.00 0.00 N ATOM 1748 C8 G B 106 -13.061 12.428 -4.733 1.00 0.00 C ATOM 1749 N7 G B 106 -11.977 11.892 -5.228 1.00 0.00 N ATOM 1750 C5 G B 106 -11.249 11.507 -4.103 1.00 0.00 C ATOM 1751 C6 G B 106 -9.978 10.868 -3.996 1.00 0.00 C ATOM 1752 O6 G B 106 -9.227 10.496 -4.896 1.00 0.00 O ATOM 1753 N1 G B 106 -9.606 10.670 -2.675 1.00 0.00 N ATOM 1754 C2 G B 106 -10.345 11.064 -1.586 1.00 0.00 C ATOM 1755 N2 G B 106 -9.829 10.824 -0.386 1.00 0.00 N ATOM 1756 N3 G B 106 -11.532 11.666 -1.670 1.00 0.00 N ATOM 1757 C4 G B 106 -11.922 11.850 -2.957 1.00 0.00 C ATOM 0 H5' G B 106 -16.486 10.494 -3.641 1.00 0.00 H new ATOM 0 H5'' G B 106 -17.865 11.568 -3.774 1.00 0.00 H new ATOM 0 H4' G B 106 -17.060 11.937 -1.659 1.00 0.00 H new ATOM 0 H3' G B 106 -17.177 14.203 -3.145 1.00 0.00 H new ATOM 0 H2' G B 106 -14.963 13.954 -4.208 1.00 0.00 H new ATOM 0 HO2' G B 106 -14.338 15.497 -1.980 1.00 0.00 H new ATOM 0 H1' G B 106 -13.612 13.388 -1.591 1.00 0.00 H new ATOM 0 H8 G B 106 -13.855 12.827 -5.346 1.00 0.00 H new ATOM 0 H1 G B 106 -8.719 10.198 -2.499 1.00 0.00 H new ATOM 0 H21 G B 106 -10.340 11.098 0.453 1.00 0.00 H new ATOM 0 H22 G B 106 -8.922 10.366 -0.303 1.00 0.00 H new ATOM 1769 P U B 107 -17.969 14.301 -0.499 1.00 0.00 P ATOM 1770 OP1 U B 107 -18.133 12.939 0.053 1.00 0.00 O ATOM 1771 OP2 U B 107 -19.005 14.831 -1.416 1.00 0.00 O ATOM 1772 O5' U B 107 -17.835 15.304 0.760 1.00 0.00 O ATOM 1773 C5' U B 107 -17.940 16.709 0.627 1.00 0.00 C ATOM 1774 C4' U B 107 -16.718 17.272 -0.095 1.00 0.00 C ATOM 1775 O4' U B 107 -16.879 17.127 -1.498 1.00 0.00 O ATOM 1776 C3' U B 107 -16.519 18.770 0.191 1.00 0.00 C ATOM 1777 O3' U B 107 -15.171 19.072 0.453 1.00 0.00 O ATOM 1778 C2' U B 107 -16.958 19.381 -1.124 1.00 0.00 C ATOM 1779 O2' U B 107 -16.479 20.692 -1.339 1.00 0.00 O ATOM 1780 C1' U B 107 -16.451 18.328 -2.098 1.00 0.00 C ATOM 1781 N1 U B 107 -16.981 18.473 -3.473 1.00 0.00 N ATOM 1782 C2 U B 107 -18.358 18.459 -3.680 1.00 0.00 C ATOM 1783 O2 U B 107 -19.179 18.304 -2.777 1.00 0.00 O ATOM 1784 N3 U B 107 -18.779 18.633 -4.989 1.00 0.00 N ATOM 1785 C4 U B 107 -17.959 18.809 -6.091 1.00 0.00 C ATOM 1786 O4 U B 107 -18.442 18.964 -7.209 1.00 0.00 O ATOM 1787 C5 U B 107 -16.548 18.792 -5.786 1.00 0.00 C ATOM 1788 C6 U B 107 -16.113 18.619 -4.517 1.00 0.00 C ATOM 0 H5' U B 107 -18.031 17.167 1.612 1.00 0.00 H new ATOM 0 H5'' U B 107 -18.845 16.961 0.073 1.00 0.00 H new ATOM 0 H4' U B 107 -15.853 16.717 0.268 1.00 0.00 H new ATOM 0 H3' U B 107 -17.063 19.129 1.065 1.00 0.00 H new ATOM 0 H2' U B 107 -18.029 19.567 -1.208 1.00 0.00 H new ATOM 0 HO2' U B 107 -17.032 21.135 -2.016 1.00 0.00 H new ATOM 0 HO3' U B 107 -15.079 20.032 0.629 1.00 0.00 H new ATOM 0 H1' U B 107 -15.373 18.395 -2.247 1.00 0.00 H new ATOM 0 H3 U B 107 -19.785 18.631 -5.156 1.00 0.00 H new ATOM 0 H5 U B 107 -15.830 18.919 -6.582 1.00 0.00 H new ATOM 0 H6 U B 107 -15.051 18.596 -4.324 1.00 0.00 H new TER 1800 U B 107