USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 764 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 14 HIS : no HE2:sc= 1.16 K(o=1.8,f=-2.8!) USER MOD Set 1.2: A 87 GLN : amide:sc= 0.678 K(o=1.8,f=0.83) USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.126 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0.0538 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0192) USER MOD Single : A 18 MET CE :methyl 165:sc= -0.988 (180deg=-1.39) USER MOD Single : A 20 SER OG : rot -27:sc= 0.0934 USER MOD Single : A 34 GLN : amide:sc= -1.71 X(o=-1.7,f=-2) USER MOD Single : A 44 MET CE :methyl 160:sc= -0.111 (180deg=-0.79) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS : no HD1:sc= -0.0628 X(o=-0.063,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.00837 USER MOD Single : A 72 HIS : no HD1:sc= -0.78 X(o=-0.78,f=-0.93) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl -174:sc= -0.201 (180deg=-0.291) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 85 ASN : amide:sc= 0.221 K(o=0.22,f=-1.4!) USER MOD Single : A 89 ASN : amide:sc= 0.0326 K(o=0.033,f=-4.5!) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.118 -1.404 23.893 1.00 0.00 N ATOM 2 CA GLY A 1 -0.944 -2.417 23.939 1.00 0.00 C ATOM 3 C GLY A 1 -0.904 -3.308 22.711 1.00 0.00 C ATOM 4 O GLY A 1 0.003 -3.196 21.885 1.00 0.00 O ATOM 0 H1 GLY A 1 0.703 -1.475 24.750 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.712 -1.562 23.054 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.308 -0.457 23.842 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.832 -3.025 24.837 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.915 -1.927 24.005 1.00 0.00 H new ATOM 8 N SER A 2 -1.902 -4.179 22.575 1.00 0.00 N ATOM 9 CA SER A 2 -1.955 -5.251 21.586 1.00 0.00 C ATOM 10 C SER A 2 -3.239 -5.271 20.756 1.00 0.00 C ATOM 11 O SER A 2 -3.295 -6.019 19.773 1.00 0.00 O ATOM 12 CB SER A 2 -1.788 -6.578 22.331 1.00 0.00 C ATOM 13 OG SER A 2 -0.449 -6.696 22.767 1.00 0.00 O ATOM 0 H SER A 2 -2.727 -4.155 23.174 1.00 0.00 H new ATOM 0 HA SER A 2 -1.152 -5.083 20.868 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.466 -6.619 23.183 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.046 -7.412 21.678 1.00 0.00 H new ATOM 0 HG SER A 2 -0.335 -7.543 23.247 1.00 0.00 H new ATOM 19 N SER A 3 -4.250 -4.468 21.119 1.00 0.00 N ATOM 20 CA SER A 3 -5.585 -4.524 20.535 1.00 0.00 C ATOM 21 C SER A 3 -6.159 -5.955 20.643 1.00 0.00 C ATOM 22 O SER A 3 -5.600 -6.808 21.338 1.00 0.00 O ATOM 23 CB SER A 3 -5.484 -3.912 19.126 1.00 0.00 C ATOM 24 OG SER A 3 -6.660 -3.983 18.348 1.00 0.00 O ATOM 0 H SER A 3 -4.154 -3.752 21.839 1.00 0.00 H new ATOM 0 HA SER A 3 -6.324 -3.931 21.074 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.196 -2.865 19.223 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.681 -4.415 18.587 1.00 0.00 H new ATOM 0 HG SER A 3 -6.500 -3.569 17.474 1.00 0.00 H new ATOM 30 N GLY A 4 -7.314 -6.207 20.032 1.00 0.00 N ATOM 31 CA GLY A 4 -8.016 -7.478 20.077 1.00 0.00 C ATOM 32 C GLY A 4 -8.790 -7.662 18.782 1.00 0.00 C ATOM 33 O GLY A 4 -9.439 -6.723 18.313 1.00 0.00 O ATOM 0 H GLY A 4 -7.800 -5.505 19.474 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.307 -8.295 20.211 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.696 -7.503 20.929 1.00 0.00 H new ATOM 37 N SER A 5 -8.711 -8.856 18.201 1.00 0.00 N ATOM 38 CA SER A 5 -9.310 -9.206 16.924 1.00 0.00 C ATOM 39 C SER A 5 -10.823 -9.315 17.095 1.00 0.00 C ATOM 40 O SER A 5 -11.289 -10.007 18.007 1.00 0.00 O ATOM 41 CB SER A 5 -8.691 -10.531 16.450 1.00 0.00 C ATOM 42 OG SER A 5 -8.501 -10.552 15.048 1.00 0.00 O ATOM 0 H SER A 5 -8.207 -9.634 18.627 1.00 0.00 H new ATOM 0 HA SER A 5 -9.115 -8.442 16.171 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.734 -10.684 16.949 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.338 -11.359 16.741 1.00 0.00 H new ATOM 0 HG SER A 5 -8.104 -11.409 14.784 1.00 0.00 H new ATOM 48 N SER A 6 -11.607 -8.661 16.238 1.00 0.00 N ATOM 49 CA SER A 6 -13.054 -8.803 16.229 1.00 0.00 C ATOM 50 C SER A 6 -13.574 -8.516 14.824 1.00 0.00 C ATOM 51 O SER A 6 -13.271 -7.463 14.263 1.00 0.00 O ATOM 52 CB SER A 6 -13.655 -7.831 17.256 1.00 0.00 C ATOM 53 OG SER A 6 -15.051 -8.030 17.390 1.00 0.00 O ATOM 0 H SER A 6 -11.251 -8.018 15.531 1.00 0.00 H new ATOM 0 HA SER A 6 -13.345 -9.818 16.501 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.170 -7.972 18.222 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.459 -6.804 16.948 1.00 0.00 H new ATOM 0 HG SER A 6 -15.409 -7.401 18.050 1.00 0.00 H new ATOM 59 N GLY A 7 -14.373 -9.434 14.272 1.00 0.00 N ATOM 60 CA GLY A 7 -15.384 -9.216 13.235 1.00 0.00 C ATOM 61 C GLY A 7 -14.846 -8.981 11.831 1.00 0.00 C ATOM 62 O GLY A 7 -15.519 -9.296 10.848 1.00 0.00 O ATOM 0 H GLY A 7 -14.327 -10.412 14.557 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.046 -10.081 13.211 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.992 -8.357 13.520 1.00 0.00 H new ATOM 66 N TYR A 8 -13.620 -8.497 11.706 1.00 0.00 N ATOM 67 CA TYR A 8 -12.852 -8.434 10.485 1.00 0.00 C ATOM 68 C TYR A 8 -11.439 -8.846 10.817 1.00 0.00 C ATOM 69 O TYR A 8 -10.997 -8.801 11.973 1.00 0.00 O ATOM 70 CB TYR A 8 -12.897 -7.025 9.871 1.00 0.00 C ATOM 71 CG TYR A 8 -12.038 -6.015 10.563 1.00 0.00 C ATOM 72 CD1 TYR A 8 -12.434 -5.521 11.808 1.00 0.00 C ATOM 73 CD2 TYR A 8 -10.857 -5.581 9.951 1.00 0.00 C ATOM 74 CE1 TYR A 8 -11.618 -4.591 12.473 1.00 0.00 C ATOM 75 CE2 TYR A 8 -10.065 -4.606 10.571 1.00 0.00 C ATOM 76 CZ TYR A 8 -10.430 -4.131 11.853 1.00 0.00 C ATOM 77 OH TYR A 8 -9.615 -3.264 12.500 1.00 0.00 O ATOM 0 H TYR A 8 -13.110 -8.117 12.504 1.00 0.00 H new ATOM 0 HA TYR A 8 -13.273 -9.107 9.738 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -12.591 -7.088 8.827 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -13.928 -6.672 9.880 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -13.360 -5.851 12.256 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -10.556 -5.998 9.001 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -11.895 -4.228 13.452 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -9.186 -4.221 10.076 1.00 0.00 H new ATOM 0 HH TYR A 8 -8.845 -3.053 11.932 1.00 0.00 H new ATOM 87 N LYS A 9 -10.712 -9.206 9.774 1.00 0.00 N ATOM 88 CA LYS A 9 -9.290 -9.414 9.855 1.00 0.00 C ATOM 89 C LYS A 9 -8.668 -8.494 8.839 1.00 0.00 C ATOM 90 O LYS A 9 -9.213 -8.322 7.744 1.00 0.00 O ATOM 91 CB LYS A 9 -8.929 -10.892 9.694 1.00 0.00 C ATOM 92 CG LYS A 9 -9.128 -11.527 8.312 1.00 0.00 C ATOM 93 CD LYS A 9 -10.585 -11.898 8.017 1.00 0.00 C ATOM 94 CE LYS A 9 -10.678 -12.747 6.748 1.00 0.00 C ATOM 95 NZ LYS A 9 -10.258 -14.143 6.968 1.00 0.00 N ATOM 0 H LYS A 9 -11.101 -9.361 8.844 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.892 -9.167 10.839 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.882 -11.014 9.972 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.518 -11.462 10.413 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.775 -10.834 7.548 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.511 -12.423 8.240 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -11.004 -12.447 8.860 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -11.180 -10.992 7.900 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -11.704 -12.734 6.381 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -10.056 -12.302 5.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -10.451 -14.702 6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -9.240 -14.170 7.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -10.787 -14.542 7.770 1.00 0.00 H new ATOM 109 N GLU A 10 -7.575 -7.878 9.245 1.00 0.00 N ATOM 110 CA GLU A 10 -6.589 -7.317 8.354 1.00 0.00 C ATOM 111 C GLU A 10 -5.664 -8.461 7.969 1.00 0.00 C ATOM 112 O GLU A 10 -5.421 -9.375 8.765 1.00 0.00 O ATOM 113 CB GLU A 10 -5.828 -6.224 9.106 1.00 0.00 C ATOM 114 CG GLU A 10 -6.442 -4.847 8.863 1.00 0.00 C ATOM 115 CD GLU A 10 -6.081 -3.837 9.961 1.00 0.00 C ATOM 116 OE1 GLU A 10 -4.969 -3.934 10.529 1.00 0.00 O ATOM 117 OE2 GLU A 10 -6.925 -2.968 10.279 1.00 0.00 O ATOM 0 H GLU A 10 -7.346 -7.753 10.231 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.029 -6.872 7.461 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.835 -6.443 10.174 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.785 -6.220 8.788 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.103 -4.467 7.899 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.526 -4.942 8.804 1.00 0.00 H new ATOM 124 N LEU A 11 -5.187 -8.408 6.736 1.00 0.00 N ATOM 125 CA LEU A 11 -4.245 -9.319 6.128 1.00 0.00 C ATOM 126 C LEU A 11 -3.105 -8.470 5.581 1.00 0.00 C ATOM 127 O LEU A 11 -3.333 -7.587 4.752 1.00 0.00 O ATOM 128 CB LEU A 11 -4.854 -10.106 4.962 1.00 0.00 C ATOM 129 CG LEU A 11 -6.221 -10.788 5.091 1.00 0.00 C ATOM 130 CD1 LEU A 11 -6.277 -11.823 6.215 1.00 0.00 C ATOM 131 CD2 LEU A 11 -7.426 -9.844 5.156 1.00 0.00 C ATOM 0 H LEU A 11 -5.472 -7.671 6.091 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.923 -10.042 6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.918 -9.422 4.116 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.136 -10.881 4.692 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.315 -11.314 4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -7.272 -12.267 6.251 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.538 -12.602 6.029 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -6.061 -11.338 7.167 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -8.342 -10.428 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.328 -9.188 6.021 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -7.467 -9.243 4.247 1.00 0.00 H new ATOM 143 N ASP A 12 -1.895 -8.740 6.040 1.00 0.00 N ATOM 144 CA ASP A 12 -0.667 -8.111 5.573 1.00 0.00 C ATOM 145 C ASP A 12 -0.211 -8.787 4.295 1.00 0.00 C ATOM 146 O ASP A 12 -0.210 -10.021 4.190 1.00 0.00 O ATOM 147 CB ASP A 12 0.443 -8.185 6.641 1.00 0.00 C ATOM 148 CG ASP A 12 0.730 -9.606 7.138 1.00 0.00 C ATOM 149 OD1 ASP A 12 -0.062 -10.086 7.987 1.00 0.00 O ATOM 150 OD2 ASP A 12 1.701 -10.244 6.671 1.00 0.00 O ATOM 0 H ASP A 12 -1.733 -9.428 6.775 1.00 0.00 H new ATOM 0 HA ASP A 12 -0.869 -7.058 5.379 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.359 -7.762 6.229 1.00 0.00 H new ATOM 0 HB3 ASP A 12 0.159 -7.564 7.490 1.00 0.00 H new ATOM 155 N VAL A 13 0.182 -7.985 3.309 1.00 0.00 N ATOM 156 CA VAL A 13 0.762 -8.480 2.067 1.00 0.00 C ATOM 157 C VAL A 13 2.007 -7.660 1.724 1.00 0.00 C ATOM 158 O VAL A 13 1.922 -6.523 1.262 1.00 0.00 O ATOM 159 CB VAL A 13 -0.303 -8.460 0.956 1.00 0.00 C ATOM 160 CG1 VAL A 13 0.313 -9.002 -0.344 1.00 0.00 C ATOM 161 CG2 VAL A 13 -1.545 -9.288 1.328 1.00 0.00 C ATOM 0 H VAL A 13 0.106 -6.969 3.351 1.00 0.00 H new ATOM 0 HA VAL A 13 1.084 -9.516 2.176 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.629 -7.429 0.821 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.437 -8.990 -1.135 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.157 -8.377 -0.635 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.657 -10.024 -0.185 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.269 -9.244 0.514 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.254 -10.324 1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.994 -8.883 2.235 1.00 0.00 H new ATOM 171 N HIS A 14 3.179 -8.276 1.886 1.00 0.00 N ATOM 172 CA HIS A 14 4.466 -7.657 1.615 1.00 0.00 C ATOM 173 C HIS A 14 4.960 -8.127 0.244 1.00 0.00 C ATOM 174 O HIS A 14 5.132 -9.330 0.027 1.00 0.00 O ATOM 175 CB HIS A 14 5.417 -8.005 2.769 1.00 0.00 C ATOM 176 CG HIS A 14 6.786 -7.374 2.707 1.00 0.00 C ATOM 177 ND1 HIS A 14 7.195 -6.287 1.964 1.00 0.00 N ATOM 178 CD2 HIS A 14 7.858 -7.785 3.445 1.00 0.00 C ATOM 179 CE1 HIS A 14 8.497 -6.081 2.228 1.00 0.00 C ATOM 180 NE2 HIS A 14 8.952 -6.988 3.104 1.00 0.00 N ATOM 0 H HIS A 14 3.256 -9.238 2.216 1.00 0.00 H new ATOM 0 HA HIS A 14 4.402 -6.570 1.567 1.00 0.00 H new ATOM 0 HB2 HIS A 14 4.944 -7.710 3.706 1.00 0.00 H new ATOM 0 HB3 HIS A 14 5.538 -9.088 2.801 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.615 -5.739 1.329 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.860 -8.588 4.168 1.00 0.00 H new ATOM 0 HE1 HIS A 14 9.094 -5.293 1.794 1.00 0.00 H new ATOM 188 N LEU A 15 5.190 -7.196 -0.689 1.00 0.00 N ATOM 189 CA LEU A 15 5.682 -7.465 -2.043 1.00 0.00 C ATOM 190 C LEU A 15 6.962 -6.673 -2.270 1.00 0.00 C ATOM 191 O LEU A 15 6.971 -5.446 -2.166 1.00 0.00 O ATOM 192 CB LEU A 15 4.649 -7.033 -3.101 1.00 0.00 C ATOM 193 CG LEU A 15 3.454 -7.981 -3.271 1.00 0.00 C ATOM 194 CD1 LEU A 15 2.376 -7.290 -4.121 1.00 0.00 C ATOM 195 CD2 LEU A 15 3.846 -9.291 -3.958 1.00 0.00 C ATOM 0 H LEU A 15 5.033 -6.203 -0.516 1.00 0.00 H new ATOM 0 HA LEU A 15 5.862 -8.536 -2.139 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.274 -6.044 -2.837 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.155 -6.936 -4.062 1.00 0.00 H new ATOM 0 HG LEU A 15 3.081 -8.217 -2.274 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.525 -7.960 -4.244 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.050 -6.377 -3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.788 -7.042 -5.099 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.967 -9.928 -4.055 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.250 -9.076 -4.947 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.601 -9.803 -3.361 1.00 0.00 H new ATOM 207 N ARG A 16 8.049 -7.346 -2.633 1.00 0.00 N ATOM 208 CA ARG A 16 9.268 -6.680 -3.096 1.00 0.00 C ATOM 209 C ARG A 16 9.061 -6.150 -4.523 1.00 0.00 C ATOM 210 O ARG A 16 8.244 -6.689 -5.281 1.00 0.00 O ATOM 211 CB ARG A 16 10.466 -7.641 -2.955 1.00 0.00 C ATOM 212 CG ARG A 16 10.728 -7.921 -1.459 1.00 0.00 C ATOM 213 CD ARG A 16 11.989 -8.756 -1.195 1.00 0.00 C ATOM 214 NE ARG A 16 11.779 -10.186 -1.474 1.00 0.00 N ATOM 215 CZ ARG A 16 11.440 -11.149 -0.608 1.00 0.00 C ATOM 216 NH1 ARG A 16 11.286 -10.904 0.688 1.00 0.00 N ATOM 217 NH2 ARG A 16 11.255 -12.384 -1.053 1.00 0.00 N ATOM 0 H ARG A 16 8.113 -8.364 -2.616 1.00 0.00 H new ATOM 0 HA ARG A 16 9.494 -5.811 -2.478 1.00 0.00 H new ATOM 0 HB2 ARG A 16 10.261 -8.574 -3.480 1.00 0.00 H new ATOM 0 HB3 ARG A 16 11.352 -7.204 -3.415 1.00 0.00 H new ATOM 0 HG2 ARG A 16 10.816 -6.971 -0.931 1.00 0.00 H new ATOM 0 HG3 ARG A 16 9.866 -8.440 -1.040 1.00 0.00 H new ATOM 0 HD2 ARG A 16 12.805 -8.383 -1.814 1.00 0.00 H new ATOM 0 HD3 ARG A 16 12.294 -8.631 -0.156 1.00 0.00 H new ATOM 0 HE ARG A 16 11.907 -10.478 -2.443 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.427 -9.960 1.049 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.027 -11.659 1.323 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.371 -12.591 -2.045 1.00 0.00 H new ATOM 0 HH22 ARG A 16 10.997 -13.127 -0.403 1.00 0.00 H new ATOM 231 N ARG A 17 9.783 -5.093 -4.909 1.00 0.00 N ATOM 232 CA ARG A 17 9.857 -4.558 -6.270 1.00 0.00 C ATOM 233 C ARG A 17 11.192 -5.036 -6.817 1.00 0.00 C ATOM 234 O ARG A 17 12.231 -4.597 -6.336 1.00 0.00 O ATOM 235 CB ARG A 17 9.822 -3.012 -6.276 1.00 0.00 C ATOM 236 CG ARG A 17 10.085 -2.399 -7.668 1.00 0.00 C ATOM 237 CD ARG A 17 10.774 -1.030 -7.629 1.00 0.00 C ATOM 238 NE ARG A 17 11.760 -0.914 -8.716 1.00 0.00 N ATOM 239 CZ ARG A 17 12.722 0.001 -8.862 1.00 0.00 C ATOM 240 NH1 ARG A 17 12.830 1.023 -8.019 1.00 0.00 N ATOM 241 NH2 ARG A 17 13.572 -0.133 -9.873 1.00 0.00 N ATOM 0 H ARG A 17 10.357 -4.565 -4.251 1.00 0.00 H new ATOM 0 HA ARG A 17 9.009 -4.895 -6.866 1.00 0.00 H new ATOM 0 HB2 ARG A 17 8.849 -2.676 -5.917 1.00 0.00 H new ATOM 0 HB3 ARG A 17 10.567 -2.636 -5.575 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.701 -3.088 -8.246 1.00 0.00 H new ATOM 0 HG3 ARG A 17 9.136 -2.301 -8.195 1.00 0.00 H new ATOM 0 HD2 ARG A 17 10.029 -0.239 -7.721 1.00 0.00 H new ATOM 0 HD3 ARG A 17 11.268 -0.893 -6.667 1.00 0.00 H new ATOM 0 HE ARG A 17 11.701 -1.621 -9.449 1.00 0.00 H new ATOM 0 HH11 ARG A 17 12.172 1.118 -7.245 1.00 0.00 H new ATOM 0 HH12 ARG A 17 13.571 1.712 -8.146 1.00 0.00 H new ATOM 0 HH21 ARG A 17 13.481 -0.920 -10.515 1.00 0.00 H new ATOM 0 HH22 ARG A 17 14.316 0.551 -10.008 1.00 0.00 H new ATOM 255 N MET A 18 11.179 -5.888 -7.835 1.00 0.00 N ATOM 256 CA MET A 18 12.378 -6.238 -8.577 1.00 0.00 C ATOM 257 C MET A 18 11.990 -6.369 -10.040 1.00 0.00 C ATOM 258 O MET A 18 12.342 -5.505 -10.847 1.00 0.00 O ATOM 259 CB MET A 18 13.009 -7.519 -8.010 1.00 0.00 C ATOM 260 CG MET A 18 14.099 -7.262 -6.964 1.00 0.00 C ATOM 261 SD MET A 18 15.785 -7.093 -7.622 1.00 0.00 S ATOM 262 CE MET A 18 15.692 -5.530 -8.517 1.00 0.00 C ATOM 0 H MET A 18 10.335 -6.355 -8.167 1.00 0.00 H new ATOM 0 HA MET A 18 13.141 -5.465 -8.482 1.00 0.00 H new ATOM 0 HB2 MET A 18 12.226 -8.131 -7.562 1.00 0.00 H new ATOM 0 HB3 MET A 18 13.435 -8.097 -8.830 1.00 0.00 H new ATOM 0 HG2 MET A 18 13.848 -6.353 -6.417 1.00 0.00 H new ATOM 0 HG3 MET A 18 14.088 -8.080 -6.244 1.00 0.00 H new ATOM 0 HE1 MET A 18 16.699 -5.177 -8.738 1.00 0.00 H new ATOM 0 HE2 MET A 18 15.146 -5.676 -9.449 1.00 0.00 H new ATOM 0 HE3 MET A 18 15.174 -4.791 -7.906 1.00 0.00 H new ATOM 272 N GLU A 19 11.215 -7.401 -10.368 1.00 0.00 N ATOM 273 CA GLU A 19 10.725 -7.699 -11.702 1.00 0.00 C ATOM 274 C GLU A 19 9.784 -6.594 -12.190 1.00 0.00 C ATOM 275 O GLU A 19 10.143 -5.838 -13.096 1.00 0.00 O ATOM 276 CB GLU A 19 10.020 -9.073 -11.697 1.00 0.00 C ATOM 277 CG GLU A 19 10.861 -10.186 -12.316 1.00 0.00 C ATOM 278 CD GLU A 19 12.213 -10.370 -11.639 1.00 0.00 C ATOM 279 OE1 GLU A 19 12.257 -10.750 -10.448 1.00 0.00 O ATOM 280 OE2 GLU A 19 13.242 -10.178 -12.319 1.00 0.00 O ATOM 0 H GLU A 19 10.900 -8.080 -9.675 1.00 0.00 H new ATOM 0 HA GLU A 19 11.566 -7.742 -12.394 1.00 0.00 H new ATOM 0 HB2 GLU A 19 9.772 -9.343 -10.670 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.079 -8.993 -12.241 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.306 -11.123 -12.263 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.019 -9.968 -13.372 1.00 0.00 H new ATOM 287 N SER A 20 8.563 -6.545 -11.650 1.00 0.00 N ATOM 288 CA SER A 20 7.383 -6.083 -12.382 1.00 0.00 C ATOM 289 C SER A 20 6.613 -4.956 -11.665 1.00 0.00 C ATOM 290 O SER A 20 5.631 -4.442 -12.211 1.00 0.00 O ATOM 291 CB SER A 20 6.592 -7.354 -12.752 1.00 0.00 C ATOM 292 OG SER A 20 5.453 -7.139 -13.564 1.00 0.00 O ATOM 0 H SER A 20 8.366 -6.826 -10.689 1.00 0.00 H new ATOM 0 HA SER A 20 7.645 -5.563 -13.304 1.00 0.00 H new ATOM 0 HB2 SER A 20 7.262 -8.042 -13.268 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.275 -7.846 -11.832 1.00 0.00 H new ATOM 0 HG SER A 20 5.107 -6.235 -13.410 1.00 0.00 H new ATOM 298 N GLY A 21 7.094 -4.492 -10.506 1.00 0.00 N ATOM 299 CA GLY A 21 6.631 -3.266 -9.864 1.00 0.00 C ATOM 300 C GLY A 21 5.198 -3.385 -9.349 1.00 0.00 C ATOM 301 O GLY A 21 4.345 -2.580 -9.721 1.00 0.00 O ATOM 0 H GLY A 21 7.828 -4.969 -9.983 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.294 -3.021 -9.034 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.692 -2.442 -10.574 1.00 0.00 H new ATOM 305 N PHE A 22 4.952 -4.369 -8.477 1.00 0.00 N ATOM 306 CA PHE A 22 3.691 -4.662 -7.793 1.00 0.00 C ATOM 307 C PHE A 22 2.480 -4.674 -8.743 1.00 0.00 C ATOM 308 O PHE A 22 1.703 -3.717 -8.818 1.00 0.00 O ATOM 309 CB PHE A 22 3.471 -3.780 -6.543 1.00 0.00 C ATOM 310 CG PHE A 22 4.669 -3.058 -5.948 1.00 0.00 C ATOM 311 CD1 PHE A 22 5.619 -3.765 -5.191 1.00 0.00 C ATOM 312 CD2 PHE A 22 4.785 -1.659 -6.076 1.00 0.00 C ATOM 313 CE1 PHE A 22 6.639 -3.070 -4.522 1.00 0.00 C ATOM 314 CE2 PHE A 22 5.798 -0.962 -5.392 1.00 0.00 C ATOM 315 CZ PHE A 22 6.713 -1.667 -4.591 1.00 0.00 C ATOM 0 H PHE A 22 5.684 -5.029 -8.213 1.00 0.00 H new ATOM 0 HA PHE A 22 3.782 -5.684 -7.424 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.722 -3.029 -6.794 1.00 0.00 H new ATOM 0 HB3 PHE A 22 3.042 -4.410 -5.764 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.564 -4.842 -5.124 1.00 0.00 H new ATOM 0 HD2 PHE A 22 4.092 -1.118 -6.703 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.373 -3.617 -3.949 1.00 0.00 H new ATOM 0 HE2 PHE A 22 5.872 0.112 -5.482 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.468 -1.135 -4.032 1.00 0.00 H new ATOM 325 N GLY A 23 2.290 -5.791 -9.451 1.00 0.00 N ATOM 326 CA GLY A 23 1.176 -6.003 -10.367 1.00 0.00 C ATOM 327 C GLY A 23 -0.136 -6.250 -9.649 1.00 0.00 C ATOM 328 O GLY A 23 -0.633 -7.373 -9.626 1.00 0.00 O ATOM 0 H GLY A 23 2.924 -6.589 -9.399 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.073 -5.132 -11.014 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.398 -6.854 -11.011 1.00 0.00 H new ATOM 332 N PHE A 24 -0.702 -5.177 -9.122 1.00 0.00 N ATOM 333 CA PHE A 24 -2.095 -5.012 -8.758 1.00 0.00 C ATOM 334 C PHE A 24 -2.564 -3.717 -9.436 1.00 0.00 C ATOM 335 O PHE A 24 -1.765 -3.023 -10.079 1.00 0.00 O ATOM 336 CB PHE A 24 -2.253 -5.022 -7.227 1.00 0.00 C ATOM 337 CG PHE A 24 -1.563 -3.914 -6.441 1.00 0.00 C ATOM 338 CD1 PHE A 24 -2.242 -2.706 -6.182 1.00 0.00 C ATOM 339 CD2 PHE A 24 -0.288 -4.125 -5.871 1.00 0.00 C ATOM 340 CE1 PHE A 24 -1.648 -1.711 -5.395 1.00 0.00 C ATOM 341 CE2 PHE A 24 0.295 -3.137 -5.055 1.00 0.00 C ATOM 342 CZ PHE A 24 -0.385 -1.929 -4.841 1.00 0.00 C ATOM 0 H PHE A 24 -0.157 -4.338 -8.924 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.723 -5.834 -9.101 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.318 -4.983 -6.999 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.882 -5.978 -6.857 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.228 -2.546 -6.594 1.00 0.00 H new ATOM 0 HD2 PHE A 24 0.241 -5.047 -6.062 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -2.165 -0.779 -5.218 1.00 0.00 H new ATOM 0 HE2 PHE A 24 1.258 -3.308 -4.597 1.00 0.00 H new ATOM 0 HZ PHE A 24 0.074 -1.158 -4.240 1.00 0.00 H new ATOM 352 N ARG A 25 -3.848 -3.389 -9.327 1.00 0.00 N ATOM 353 CA ARG A 25 -4.327 -2.019 -9.481 1.00 0.00 C ATOM 354 C ARG A 25 -5.065 -1.663 -8.201 1.00 0.00 C ATOM 355 O ARG A 25 -5.465 -2.565 -7.470 1.00 0.00 O ATOM 356 CB ARG A 25 -5.169 -1.850 -10.758 1.00 0.00 C ATOM 357 CG ARG A 25 -5.334 -0.362 -11.111 1.00 0.00 C ATOM 358 CD ARG A 25 -5.907 -0.136 -12.507 1.00 0.00 C ATOM 359 NE ARG A 25 -6.160 1.296 -12.740 1.00 0.00 N ATOM 360 CZ ARG A 25 -6.036 1.961 -13.894 1.00 0.00 C ATOM 361 NH1 ARG A 25 -5.488 1.387 -14.963 1.00 0.00 N ATOM 362 NH2 ARG A 25 -6.473 3.206 -13.973 1.00 0.00 N ATOM 0 H ARG A 25 -4.586 -4.065 -9.129 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.501 -1.322 -9.619 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.691 -2.374 -11.586 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -6.149 -2.305 -10.616 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.987 0.109 -10.376 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.365 0.132 -11.039 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.212 -0.514 -13.257 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.834 -0.697 -12.620 1.00 0.00 H new ATOM 0 HE ARG A 25 -6.463 1.841 -11.933 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -5.154 0.425 -14.910 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -5.402 1.910 -15.835 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.899 3.649 -13.159 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -6.384 3.723 -14.848 1.00 0.00 H new ATOM 376 N ILE A 26 -5.284 -0.382 -7.947 1.00 0.00 N ATOM 377 CA ILE A 26 -6.060 0.167 -6.841 1.00 0.00 C ATOM 378 C ILE A 26 -7.130 1.026 -7.495 1.00 0.00 C ATOM 379 O ILE A 26 -6.797 1.827 -8.372 1.00 0.00 O ATOM 380 CB ILE A 26 -5.178 0.969 -5.848 1.00 0.00 C ATOM 381 CG1 ILE A 26 -3.804 1.385 -6.420 1.00 0.00 C ATOM 382 CG2 ILE A 26 -4.994 0.128 -4.584 1.00 0.00 C ATOM 383 CD1 ILE A 26 -2.977 2.308 -5.525 1.00 0.00 C ATOM 0 H ILE A 26 -4.901 0.350 -8.545 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.502 -0.620 -6.229 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.695 1.904 -5.633 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.224 0.484 -6.620 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.962 1.881 -7.378 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -4.376 0.673 -3.871 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.967 -0.077 -4.138 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.507 -0.813 -4.841 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.032 2.541 -6.016 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.529 3.230 -5.345 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.779 1.812 -4.575 1.00 0.00 H new ATOM 395 N LEU A 27 -8.393 0.790 -7.140 1.00 0.00 N ATOM 396 CA LEU A 27 -9.564 1.486 -7.660 1.00 0.00 C ATOM 397 C LEU A 27 -10.453 1.841 -6.463 1.00 0.00 C ATOM 398 O LEU A 27 -10.055 1.635 -5.313 1.00 0.00 O ATOM 399 CB LEU A 27 -10.290 0.647 -8.740 1.00 0.00 C ATOM 400 CG LEU A 27 -9.463 0.431 -10.030 1.00 0.00 C ATOM 401 CD1 LEU A 27 -10.087 -0.562 -11.018 1.00 0.00 C ATOM 402 CD2 LEU A 27 -9.267 1.723 -10.807 1.00 0.00 C ATOM 0 H LEU A 27 -8.636 0.077 -6.452 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.277 2.404 -8.173 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.547 -0.325 -8.319 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.227 1.140 -8.999 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.519 0.034 -9.656 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.445 -0.656 -11.894 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.191 -1.535 -10.539 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.069 -0.202 -11.325 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.681 1.523 -11.704 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.238 2.128 -11.091 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.741 2.446 -10.184 1.00 0.00 H new ATOM 414 N GLY A 28 -11.618 2.440 -6.709 1.00 0.00 N ATOM 415 CA GLY A 28 -12.421 2.993 -5.628 1.00 0.00 C ATOM 416 C GLY A 28 -11.661 4.155 -4.988 1.00 0.00 C ATOM 417 O GLY A 28 -10.819 4.792 -5.632 1.00 0.00 O ATOM 0 H GLY A 28 -12.021 2.552 -7.639 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -13.382 3.337 -6.011 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -12.631 2.225 -4.884 1.00 0.00 H new ATOM 421 N GLY A 29 -11.967 4.471 -3.734 1.00 0.00 N ATOM 422 CA GLY A 29 -11.596 5.704 -3.097 1.00 0.00 C ATOM 423 C GLY A 29 -12.217 6.820 -3.912 1.00 0.00 C ATOM 424 O GLY A 29 -13.411 7.059 -3.924 1.00 0.00 O ATOM 0 H GLY A 29 -12.497 3.848 -3.124 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.954 5.731 -2.068 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -10.512 5.809 -3.060 1.00 0.00 H new ATOM 428 N ASP A 30 -11.356 7.472 -4.651 1.00 0.00 N ATOM 429 CA ASP A 30 -11.516 8.739 -5.356 1.00 0.00 C ATOM 430 C ASP A 30 -11.750 9.869 -4.364 1.00 0.00 C ATOM 431 O ASP A 30 -11.003 10.852 -4.382 1.00 0.00 O ATOM 432 CB ASP A 30 -12.635 8.714 -6.413 1.00 0.00 C ATOM 433 CG ASP A 30 -12.187 9.547 -7.608 1.00 0.00 C ATOM 434 OD1 ASP A 30 -12.016 10.778 -7.469 1.00 0.00 O ATOM 435 OD2 ASP A 30 -11.876 8.982 -8.680 1.00 0.00 O ATOM 0 H ASP A 30 -10.420 7.094 -4.795 1.00 0.00 H new ATOM 0 HA ASP A 30 -10.586 8.911 -5.897 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -12.842 7.689 -6.721 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.559 9.115 -5.996 1.00 0.00 H new ATOM 440 N GLU A 31 -12.735 9.710 -3.473 1.00 0.00 N ATOM 441 CA GLU A 31 -13.160 10.705 -2.510 1.00 0.00 C ATOM 442 C GLU A 31 -12.573 10.409 -1.123 1.00 0.00 C ATOM 443 O GLU A 31 -12.118 9.292 -0.870 1.00 0.00 O ATOM 444 CB GLU A 31 -14.694 10.738 -2.487 1.00 0.00 C ATOM 445 CG GLU A 31 -15.264 11.731 -3.498 1.00 0.00 C ATOM 446 CD GLU A 31 -15.391 11.172 -4.908 1.00 0.00 C ATOM 447 OE1 GLU A 31 -16.308 10.348 -5.126 1.00 0.00 O ATOM 448 OE2 GLU A 31 -14.699 11.680 -5.822 1.00 0.00 O ATOM 0 H GLU A 31 -13.273 8.846 -3.409 1.00 0.00 H new ATOM 0 HA GLU A 31 -12.789 11.688 -2.801 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -15.081 9.742 -2.701 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.035 11.004 -1.487 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -16.247 12.057 -3.157 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.626 12.614 -3.524 1.00 0.00 H new ATOM 455 N PRO A 32 -12.538 11.415 -0.230 1.00 0.00 N ATOM 456 CA PRO A 32 -11.831 11.362 1.042 1.00 0.00 C ATOM 457 C PRO A 32 -12.506 10.405 2.019 1.00 0.00 C ATOM 458 O PRO A 32 -13.449 10.759 2.734 1.00 0.00 O ATOM 459 CB PRO A 32 -11.779 12.809 1.539 1.00 0.00 C ATOM 460 CG PRO A 32 -12.996 13.465 0.885 1.00 0.00 C ATOM 461 CD PRO A 32 -13.065 12.752 -0.459 1.00 0.00 C ATOM 0 HA PRO A 32 -10.822 10.962 0.938 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -11.833 12.860 2.626 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -10.852 13.300 1.243 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -13.903 13.316 1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -12.865 14.541 0.769 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -14.090 12.710 -0.826 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -12.478 13.279 -1.211 1.00 0.00 H new ATOM 469 N GLY A 33 -11.995 9.180 2.059 1.00 0.00 N ATOM 470 CA GLY A 33 -12.459 8.129 2.936 1.00 0.00 C ATOM 471 C GLY A 33 -13.470 7.204 2.275 1.00 0.00 C ATOM 472 O GLY A 33 -14.192 6.514 2.997 1.00 0.00 O ATOM 0 H GLY A 33 -11.222 8.889 1.460 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.605 7.542 3.274 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.909 8.576 3.822 1.00 0.00 H new ATOM 476 N GLN A 34 -13.536 7.174 0.942 1.00 0.00 N ATOM 477 CA GLN A 34 -14.226 6.113 0.228 1.00 0.00 C ATOM 478 C GLN A 34 -13.481 4.776 0.450 1.00 0.00 C ATOM 479 O GLN A 34 -12.310 4.779 0.858 1.00 0.00 O ATOM 480 CB GLN A 34 -14.305 6.512 -1.261 1.00 0.00 C ATOM 481 CG GLN A 34 -15.680 7.066 -1.663 1.00 0.00 C ATOM 482 CD GLN A 34 -16.095 6.730 -3.095 1.00 0.00 C ATOM 483 OE1 GLN A 34 -16.335 5.566 -3.398 1.00 0.00 O ATOM 484 NE2 GLN A 34 -16.250 7.688 -4.000 1.00 0.00 N ATOM 0 H GLN A 34 -13.115 7.880 0.338 1.00 0.00 H new ATOM 0 HA GLN A 34 -15.242 5.974 0.598 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -13.542 7.262 -1.471 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -14.076 5.642 -1.877 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -16.432 6.675 -0.977 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -15.672 8.149 -1.543 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -16.052 8.658 -3.755 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.567 7.454 -4.941 1.00 0.00 H new ATOM 493 N PRO A 35 -14.132 3.628 0.194 1.00 0.00 N ATOM 494 CA PRO A 35 -13.483 2.328 0.251 1.00 0.00 C ATOM 495 C PRO A 35 -12.535 2.189 -0.931 1.00 0.00 C ATOM 496 O PRO A 35 -12.923 2.440 -2.072 1.00 0.00 O ATOM 497 CB PRO A 35 -14.588 1.281 0.169 1.00 0.00 C ATOM 498 CG PRO A 35 -15.805 2.020 -0.396 1.00 0.00 C ATOM 499 CD PRO A 35 -15.496 3.515 -0.292 1.00 0.00 C ATOM 0 HA PRO A 35 -12.906 2.206 1.167 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.297 0.452 -0.476 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -14.805 0.860 1.151 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.986 1.733 -1.432 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.705 1.770 0.166 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.602 4.000 -1.262 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.191 4.007 0.388 1.00 0.00 H new ATOM 507 N ILE A 36 -11.317 1.742 -0.658 1.00 0.00 N ATOM 508 CA ILE A 36 -10.252 1.601 -1.635 1.00 0.00 C ATOM 509 C ILE A 36 -10.073 0.110 -1.844 1.00 0.00 C ATOM 510 O ILE A 36 -9.356 -0.564 -1.105 1.00 0.00 O ATOM 511 CB ILE A 36 -8.989 2.377 -1.193 1.00 0.00 C ATOM 512 CG1 ILE A 36 -9.332 3.880 -1.224 1.00 0.00 C ATOM 513 CG2 ILE A 36 -7.815 2.075 -2.142 1.00 0.00 C ATOM 514 CD1 ILE A 36 -8.255 4.829 -0.703 1.00 0.00 C ATOM 0 H ILE A 36 -11.036 1.459 0.281 1.00 0.00 H new ATOM 0 HA ILE A 36 -10.488 2.053 -2.599 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.688 2.076 -0.190 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.564 4.157 -2.252 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -10.238 4.037 -0.639 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.934 2.628 -1.818 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.599 1.007 -2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -8.080 2.376 -3.156 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.610 5.857 -0.775 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -8.035 4.593 0.338 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.350 4.715 -1.300 1.00 0.00 H new ATOM 526 N LEU A 37 -10.804 -0.423 -2.811 1.00 0.00 N ATOM 527 CA LEU A 37 -10.773 -1.827 -3.191 1.00 0.00 C ATOM 528 C LEU A 37 -9.674 -2.078 -4.219 1.00 0.00 C ATOM 529 O LEU A 37 -9.414 -1.246 -5.090 1.00 0.00 O ATOM 530 CB LEU A 37 -12.138 -2.288 -3.724 1.00 0.00 C ATOM 531 CG LEU A 37 -13.331 -2.012 -2.789 1.00 0.00 C ATOM 532 CD1 LEU A 37 -14.518 -2.900 -3.182 1.00 0.00 C ATOM 533 CD2 LEU A 37 -13.012 -2.282 -1.315 1.00 0.00 C ATOM 0 H LEU A 37 -11.456 0.127 -3.371 1.00 0.00 H new ATOM 0 HA LEU A 37 -10.551 -2.414 -2.300 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.323 -1.796 -4.679 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.091 -3.359 -3.921 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.567 -0.954 -2.901 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.358 -2.700 -2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.809 -2.684 -4.210 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -14.231 -3.948 -3.099 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -13.892 -2.069 -0.707 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -12.729 -3.327 -1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.189 -1.642 -0.998 1.00 0.00 H new ATOM 545 N ILE A 38 -9.037 -3.249 -4.128 1.00 0.00 N ATOM 546 CA ILE A 38 -7.938 -3.649 -4.985 1.00 0.00 C ATOM 547 C ILE A 38 -8.543 -3.699 -6.392 1.00 0.00 C ATOM 548 O ILE A 38 -9.391 -4.543 -6.710 1.00 0.00 O ATOM 549 CB ILE A 38 -7.318 -4.981 -4.513 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.476 -4.755 -3.238 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.471 -5.675 -5.597 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.133 -4.027 -3.421 1.00 0.00 C ATOM 0 H ILE A 38 -9.284 -3.957 -3.436 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.098 -2.955 -4.961 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.149 -5.651 -4.293 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.078 -4.187 -2.528 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.278 -5.726 -2.783 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -6.064 -6.605 -5.201 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.096 -5.892 -6.463 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.653 -5.019 -5.895 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.637 -3.930 -2.455 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.499 -4.599 -4.098 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.310 -3.036 -3.839 1.00 0.00 H new ATOM 564 N GLY A 39 -8.154 -2.727 -7.206 1.00 0.00 N ATOM 565 CA GLY A 39 -8.590 -2.489 -8.562 1.00 0.00 C ATOM 566 C GLY A 39 -8.483 -3.728 -9.424 1.00 0.00 C ATOM 567 O GLY A 39 -9.374 -4.018 -10.226 1.00 0.00 O ATOM 0 H GLY A 39 -7.470 -2.033 -6.904 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.623 -2.143 -8.554 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.990 -1.691 -9.000 1.00 0.00 H new ATOM 571 N ALA A 40 -7.365 -4.438 -9.310 1.00 0.00 N ATOM 572 CA ALA A 40 -7.143 -5.695 -9.989 1.00 0.00 C ATOM 573 C ALA A 40 -6.010 -6.442 -9.318 1.00 0.00 C ATOM 574 O ALA A 40 -5.146 -5.835 -8.688 1.00 0.00 O ATOM 575 CB ALA A 40 -6.783 -5.417 -11.452 1.00 0.00 C ATOM 0 H ALA A 40 -6.578 -4.144 -8.731 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.047 -6.302 -9.943 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.614 -6.361 -11.971 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.601 -4.880 -11.932 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.877 -4.812 -11.495 1.00 0.00 H new ATOM 581 N VAL A 41 -5.964 -7.740 -9.575 1.00 0.00 N ATOM 582 CA VAL A 41 -4.802 -8.583 -9.377 1.00 0.00 C ATOM 583 C VAL A 41 -4.431 -8.999 -10.788 1.00 0.00 C ATOM 584 O VAL A 41 -5.258 -9.567 -11.509 1.00 0.00 O ATOM 585 CB VAL A 41 -5.161 -9.731 -8.420 1.00 0.00 C ATOM 586 CG1 VAL A 41 -4.101 -10.836 -8.356 1.00 0.00 C ATOM 587 CG2 VAL A 41 -5.383 -9.107 -7.035 1.00 0.00 C ATOM 0 H VAL A 41 -6.767 -8.252 -9.941 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.947 -8.108 -8.897 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.058 -10.228 -8.789 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.424 -11.611 -7.661 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -3.968 -11.270 -9.347 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.156 -10.414 -8.015 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.641 -9.889 -6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.471 -8.606 -6.711 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.195 -8.382 -7.089 1.00 0.00 H new ATOM 597 N ILE A 42 -3.251 -8.575 -11.236 1.00 0.00 N ATOM 598 CA ILE A 42 -2.806 -8.845 -12.587 1.00 0.00 C ATOM 599 C ILE A 42 -2.594 -10.355 -12.673 1.00 0.00 C ATOM 600 O ILE A 42 -1.810 -10.902 -11.895 1.00 0.00 O ATOM 601 CB ILE A 42 -1.554 -8.009 -12.912 1.00 0.00 C ATOM 602 CG1 ILE A 42 -1.790 -6.489 -12.729 1.00 0.00 C ATOM 603 CG2 ILE A 42 -1.034 -8.314 -14.324 1.00 0.00 C ATOM 604 CD1 ILE A 42 -2.969 -5.882 -13.499 1.00 0.00 C ATOM 0 H ILE A 42 -2.588 -8.041 -10.674 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.536 -8.551 -13.341 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.790 -8.301 -12.192 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.938 -6.292 -11.667 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.882 -5.965 -13.026 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.150 -7.709 -14.525 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.775 -9.370 -14.396 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -1.808 -8.080 -15.055 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -3.030 -4.814 -13.289 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.822 -6.034 -14.568 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.895 -6.366 -13.188 1.00 0.00 H new ATOM 616 N ALA A 43 -3.307 -11.010 -13.596 1.00 0.00 N ATOM 617 CA ALA A 43 -3.438 -12.466 -13.649 1.00 0.00 C ATOM 618 C ALA A 43 -2.107 -13.206 -13.807 1.00 0.00 C ATOM 619 O ALA A 43 -2.008 -14.384 -13.493 1.00 0.00 O ATOM 620 CB ALA A 43 -4.359 -12.845 -14.813 1.00 0.00 C ATOM 0 H ALA A 43 -3.817 -10.533 -14.339 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.853 -12.773 -12.689 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.461 -13.929 -14.858 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.340 -12.394 -14.662 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.932 -12.481 -15.748 1.00 0.00 H new ATOM 626 N MET A 44 -1.089 -12.514 -14.311 1.00 0.00 N ATOM 627 CA MET A 44 0.251 -13.029 -14.549 1.00 0.00 C ATOM 628 C MET A 44 1.256 -12.085 -13.882 1.00 0.00 C ATOM 629 O MET A 44 2.319 -11.809 -14.443 1.00 0.00 O ATOM 630 CB MET A 44 0.458 -13.163 -16.068 1.00 0.00 C ATOM 631 CG MET A 44 -0.412 -14.233 -16.738 1.00 0.00 C ATOM 632 SD MET A 44 0.304 -15.900 -16.741 1.00 0.00 S ATOM 633 CE MET A 44 -0.379 -16.586 -15.207 1.00 0.00 C ATOM 0 H MET A 44 -1.183 -11.534 -14.576 1.00 0.00 H new ATOM 0 HA MET A 44 0.397 -14.018 -14.114 1.00 0.00 H new ATOM 0 HB2 MET A 44 0.252 -12.200 -16.536 1.00 0.00 H new ATOM 0 HB3 MET A 44 1.506 -13.393 -16.260 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.376 -14.267 -16.231 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.604 -13.933 -17.768 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.333 -17.674 -15.243 1.00 0.00 H new ATOM 0 HE2 MET A 44 0.201 -16.226 -14.357 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.417 -16.270 -15.098 1.00 0.00 H new ATOM 643 N GLY A 45 0.886 -11.475 -12.754 1.00 0.00 N ATOM 644 CA GLY A 45 1.654 -10.444 -12.078 1.00 0.00 C ATOM 645 C GLY A 45 2.175 -10.922 -10.729 1.00 0.00 C ATOM 646 O GLY A 45 1.868 -12.020 -10.260 1.00 0.00 O ATOM 0 H GLY A 45 0.013 -11.697 -12.275 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.493 -10.144 -12.706 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.031 -9.561 -11.935 1.00 0.00 H new ATOM 650 N SER A 46 2.950 -10.050 -10.080 1.00 0.00 N ATOM 651 CA SER A 46 3.557 -10.322 -8.780 1.00 0.00 C ATOM 652 C SER A 46 2.518 -10.571 -7.681 1.00 0.00 C ATOM 653 O SER A 46 2.843 -11.227 -6.700 1.00 0.00 O ATOM 654 CB SER A 46 4.422 -9.131 -8.345 1.00 0.00 C ATOM 655 OG SER A 46 5.263 -8.626 -9.373 1.00 0.00 O ATOM 0 H SER A 46 3.175 -9.126 -10.448 1.00 0.00 H new ATOM 0 HA SER A 46 4.155 -11.225 -8.904 1.00 0.00 H new ATOM 0 HB2 SER A 46 3.771 -8.330 -7.995 1.00 0.00 H new ATOM 0 HB3 SER A 46 5.039 -9.432 -7.499 1.00 0.00 H new ATOM 0 HG SER A 46 5.783 -7.870 -9.029 1.00 0.00 H new ATOM 661 N ALA A 47 1.299 -10.038 -7.813 1.00 0.00 N ATOM 662 CA ALA A 47 0.247 -10.279 -6.841 1.00 0.00 C ATOM 663 C ALA A 47 -0.220 -11.735 -6.943 1.00 0.00 C ATOM 664 O ALA A 47 -0.165 -12.451 -5.944 1.00 0.00 O ATOM 665 CB ALA A 47 -0.890 -9.280 -7.065 1.00 0.00 C ATOM 0 H ALA A 47 1.024 -9.436 -8.589 1.00 0.00 H new ATOM 0 HA ALA A 47 0.619 -10.128 -5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.681 -9.459 -6.336 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.511 -8.265 -6.947 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.290 -9.403 -8.072 1.00 0.00 H new ATOM 671 N ASP A 48 -0.605 -12.172 -8.150 1.00 0.00 N ATOM 672 CA ASP A 48 -1.047 -13.541 -8.435 1.00 0.00 C ATOM 673 C ASP A 48 0.003 -14.572 -8.023 1.00 0.00 C ATOM 674 O ASP A 48 -0.344 -15.557 -7.376 1.00 0.00 O ATOM 675 CB ASP A 48 -1.383 -13.700 -9.926 1.00 0.00 C ATOM 676 CG ASP A 48 -1.567 -15.173 -10.323 1.00 0.00 C ATOM 677 OD1 ASP A 48 -2.672 -15.723 -10.102 1.00 0.00 O ATOM 678 OD2 ASP A 48 -0.601 -15.759 -10.860 1.00 0.00 O ATOM 0 H ASP A 48 -0.617 -11.569 -8.972 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.945 -13.722 -7.844 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.295 -13.147 -10.153 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.586 -13.260 -10.526 1.00 0.00 H new ATOM 683 N ARG A 49 1.278 -14.349 -8.377 1.00 0.00 N ATOM 684 CA ARG A 49 2.348 -15.306 -8.072 1.00 0.00 C ATOM 685 C ARG A 49 2.661 -15.363 -6.574 1.00 0.00 C ATOM 686 O ARG A 49 3.140 -16.387 -6.086 1.00 0.00 O ATOM 687 CB ARG A 49 3.605 -15.026 -8.925 1.00 0.00 C ATOM 688 CG ARG A 49 4.322 -13.704 -8.668 1.00 0.00 C ATOM 689 CD ARG A 49 5.778 -13.862 -8.203 1.00 0.00 C ATOM 690 NE ARG A 49 6.686 -14.095 -9.337 1.00 0.00 N ATOM 691 CZ ARG A 49 8.020 -14.120 -9.293 1.00 0.00 C ATOM 692 NH1 ARG A 49 8.681 -14.179 -8.146 1.00 0.00 N ATOM 693 NH2 ARG A 49 8.710 -14.081 -10.424 1.00 0.00 N ATOM 0 H ARG A 49 1.591 -13.515 -8.874 1.00 0.00 H new ATOM 0 HA ARG A 49 1.988 -16.298 -8.344 1.00 0.00 H new ATOM 0 HB2 ARG A 49 4.315 -15.837 -8.762 1.00 0.00 H new ATOM 0 HB3 ARG A 49 3.318 -15.060 -9.976 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.306 -13.110 -9.582 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.769 -13.144 -7.914 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.088 -12.966 -7.666 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.849 -14.694 -7.503 1.00 0.00 H new ATOM 0 HE ARG A 49 6.253 -14.253 -10.247 1.00 0.00 H new ATOM 0 HH11 ARG A 49 8.170 -14.207 -7.264 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.701 -14.197 -8.145 1.00 0.00 H new ATOM 0 HH21 ARG A 49 8.221 -14.032 -11.318 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.730 -14.100 -10.400 1.00 0.00 H new ATOM 707 N ASP A 50 2.445 -14.274 -5.835 1.00 0.00 N ATOM 708 CA ASP A 50 2.576 -14.241 -4.376 1.00 0.00 C ATOM 709 C ASP A 50 1.415 -14.994 -3.724 1.00 0.00 C ATOM 710 O ASP A 50 1.637 -15.783 -2.806 1.00 0.00 O ATOM 711 CB ASP A 50 2.680 -12.786 -3.918 1.00 0.00 C ATOM 712 CG ASP A 50 2.611 -12.603 -2.402 1.00 0.00 C ATOM 713 OD1 ASP A 50 3.383 -13.245 -1.651 1.00 0.00 O ATOM 714 OD2 ASP A 50 1.802 -11.746 -1.990 1.00 0.00 O ATOM 0 H ASP A 50 2.170 -13.378 -6.237 1.00 0.00 H new ATOM 0 HA ASP A 50 3.487 -14.751 -4.061 1.00 0.00 H new ATOM 0 HB2 ASP A 50 3.619 -12.368 -4.281 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.876 -12.213 -4.379 1.00 0.00 H new ATOM 719 N GLY A 51 0.204 -14.843 -4.265 1.00 0.00 N ATOM 720 CA GLY A 51 -0.955 -15.624 -3.862 1.00 0.00 C ATOM 721 C GLY A 51 -1.615 -15.061 -2.607 1.00 0.00 C ATOM 722 O GLY A 51 -2.069 -15.835 -1.760 1.00 0.00 O ATOM 0 H GLY A 51 0.004 -14.167 -5.002 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.680 -15.643 -4.676 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.652 -16.655 -3.681 1.00 0.00 H new ATOM 726 N ARG A 52 -1.638 -13.730 -2.451 1.00 0.00 N ATOM 727 CA ARG A 52 -2.187 -13.064 -1.272 1.00 0.00 C ATOM 728 C ARG A 52 -3.260 -12.068 -1.669 1.00 0.00 C ATOM 729 O ARG A 52 -4.429 -12.284 -1.338 1.00 0.00 O ATOM 730 CB ARG A 52 -1.091 -12.430 -0.410 1.00 0.00 C ATOM 731 CG ARG A 52 -0.023 -13.439 0.027 1.00 0.00 C ATOM 732 CD ARG A 52 0.906 -12.903 1.137 1.00 0.00 C ATOM 733 NE ARG A 52 0.211 -12.496 2.378 1.00 0.00 N ATOM 734 CZ ARG A 52 -0.663 -13.197 3.111 1.00 0.00 C ATOM 735 NH1 ARG A 52 -0.920 -14.468 2.818 1.00 0.00 N ATOM 736 NH2 ARG A 52 -1.274 -12.595 4.125 1.00 0.00 N ATOM 0 H ARG A 52 -1.271 -13.083 -3.149 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.660 -13.822 -0.648 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.616 -11.624 -0.969 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.544 -11.981 0.474 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.513 -14.346 0.380 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.579 -13.718 -0.838 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.639 -13.672 1.382 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.459 -12.048 0.748 1.00 0.00 H new ATOM 0 HE ARG A 52 0.426 -11.559 2.720 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -0.450 -14.915 2.031 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.587 -14.996 3.381 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -1.074 -11.617 4.333 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -1.943 -13.111 4.696 1.00 0.00 H new ATOM 750 N LEU A 53 -2.885 -10.987 -2.354 1.00 0.00 N ATOM 751 CA LEU A 53 -3.834 -9.988 -2.819 1.00 0.00 C ATOM 752 C LEU A 53 -4.898 -10.663 -3.659 1.00 0.00 C ATOM 753 O LEU A 53 -4.578 -11.463 -4.540 1.00 0.00 O ATOM 754 CB LEU A 53 -3.150 -8.939 -3.704 1.00 0.00 C ATOM 755 CG LEU A 53 -2.551 -7.746 -2.959 1.00 0.00 C ATOM 756 CD1 LEU A 53 -1.809 -6.872 -3.976 1.00 0.00 C ATOM 757 CD2 LEU A 53 -3.641 -6.919 -2.284 1.00 0.00 C ATOM 0 H LEU A 53 -1.916 -10.784 -2.599 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.262 -9.503 -1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.358 -9.427 -4.271 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.877 -8.568 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.873 -8.108 -2.186 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.372 -6.013 -3.467 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.018 -7.455 -4.448 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.508 -6.526 -4.737 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.188 -6.077 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.335 -6.547 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.180 -7.541 -1.570 1.00 0.00 H new ATOM 769 N HIS A 54 -6.142 -10.258 -3.443 1.00 0.00 N ATOM 770 CA HIS A 54 -7.282 -10.694 -4.226 1.00 0.00 C ATOM 771 C HIS A 54 -8.027 -9.486 -4.794 1.00 0.00 C ATOM 772 O HIS A 54 -8.013 -8.399 -4.204 1.00 0.00 O ATOM 773 CB HIS A 54 -8.185 -11.613 -3.393 1.00 0.00 C ATOM 774 CG HIS A 54 -8.104 -13.041 -3.853 1.00 0.00 C ATOM 775 ND1 HIS A 54 -9.167 -13.829 -4.221 1.00 0.00 N ATOM 776 CD2 HIS A 54 -6.958 -13.769 -4.028 1.00 0.00 C ATOM 777 CE1 HIS A 54 -8.670 -15.011 -4.609 1.00 0.00 C ATOM 778 NE2 HIS A 54 -7.329 -15.027 -4.505 1.00 0.00 N ATOM 0 H HIS A 54 -6.388 -9.603 -2.701 1.00 0.00 H new ATOM 0 HA HIS A 54 -6.936 -11.282 -5.076 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -7.896 -11.552 -2.344 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -9.217 -11.267 -3.460 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -5.951 -13.432 -3.833 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -9.267 -15.841 -4.959 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -6.707 -15.804 -4.730 1.00 0.00 H new ATOM 786 N PRO A 55 -8.657 -9.643 -5.972 1.00 0.00 N ATOM 787 CA PRO A 55 -9.439 -8.585 -6.580 1.00 0.00 C ATOM 788 C PRO A 55 -10.548 -8.131 -5.632 1.00 0.00 C ATOM 789 O PRO A 55 -11.286 -8.952 -5.080 1.00 0.00 O ATOM 790 CB PRO A 55 -9.999 -9.156 -7.884 1.00 0.00 C ATOM 791 CG PRO A 55 -9.145 -10.388 -8.168 1.00 0.00 C ATOM 792 CD PRO A 55 -8.679 -10.842 -6.797 1.00 0.00 C ATOM 0 HA PRO A 55 -8.834 -7.702 -6.785 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -11.052 -9.420 -7.781 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -9.930 -8.431 -8.695 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.721 -11.165 -8.670 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.302 -10.148 -8.816 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -9.354 -11.591 -6.382 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -7.691 -11.299 -6.851 1.00 0.00 H new ATOM 800 N GLY A 56 -10.671 -6.816 -5.463 1.00 0.00 N ATOM 801 CA GLY A 56 -11.716 -6.211 -4.663 1.00 0.00 C ATOM 802 C GLY A 56 -11.456 -6.285 -3.159 1.00 0.00 C ATOM 803 O GLY A 56 -12.372 -5.965 -2.399 1.00 0.00 O ATOM 0 H GLY A 56 -10.036 -6.139 -5.886 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.825 -5.166 -4.953 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.663 -6.704 -4.884 1.00 0.00 H new ATOM 807 N ASP A 57 -10.283 -6.734 -2.702 1.00 0.00 N ATOM 808 CA ASP A 57 -9.926 -6.676 -1.280 1.00 0.00 C ATOM 809 C ASP A 57 -9.823 -5.209 -0.872 1.00 0.00 C ATOM 810 O ASP A 57 -9.384 -4.379 -1.662 1.00 0.00 O ATOM 811 CB ASP A 57 -8.592 -7.381 -0.994 1.00 0.00 C ATOM 812 CG ASP A 57 -8.655 -8.905 -1.013 1.00 0.00 C ATOM 813 OD1 ASP A 57 -9.774 -9.473 -1.054 1.00 0.00 O ATOM 814 OD2 ASP A 57 -7.574 -9.525 -0.926 1.00 0.00 O ATOM 0 H ASP A 57 -9.563 -7.143 -3.297 1.00 0.00 H new ATOM 0 HA ASP A 57 -10.697 -7.191 -0.706 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.859 -7.053 -1.731 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -8.229 -7.059 -0.018 1.00 0.00 H new ATOM 819 N GLU A 58 -10.243 -4.852 0.335 1.00 0.00 N ATOM 820 CA GLU A 58 -10.283 -3.466 0.785 1.00 0.00 C ATOM 821 C GLU A 58 -8.949 -3.128 1.446 1.00 0.00 C ATOM 822 O GLU A 58 -8.509 -3.858 2.326 1.00 0.00 O ATOM 823 CB GLU A 58 -11.465 -3.333 1.744 1.00 0.00 C ATOM 824 CG GLU A 58 -11.981 -1.895 1.894 1.00 0.00 C ATOM 825 CD GLU A 58 -13.412 -1.876 2.449 1.00 0.00 C ATOM 826 OE1 GLU A 58 -14.321 -2.516 1.857 1.00 0.00 O ATOM 827 OE2 GLU A 58 -13.649 -1.265 3.516 1.00 0.00 O ATOM 0 H GLU A 58 -10.568 -5.520 1.034 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.423 -2.764 -0.037 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.279 -3.967 1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.170 -3.708 2.724 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.322 -1.337 2.559 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.956 -1.394 0.926 1.00 0.00 H new ATOM 834 N LEU A 59 -8.281 -2.069 1.000 1.00 0.00 N ATOM 835 CA LEU A 59 -6.990 -1.625 1.530 1.00 0.00 C ATOM 836 C LEU A 59 -7.204 -0.814 2.806 1.00 0.00 C ATOM 837 O LEU A 59 -8.245 -0.177 2.986 1.00 0.00 O ATOM 838 CB LEU A 59 -6.192 -0.796 0.494 1.00 0.00 C ATOM 839 CG LEU A 59 -5.124 -1.578 -0.307 1.00 0.00 C ATOM 840 CD1 LEU A 59 -4.366 -0.622 -1.225 1.00 0.00 C ATOM 841 CD2 LEU A 59 -4.029 -2.185 0.581 1.00 0.00 C ATOM 0 H LEU A 59 -8.627 -1.480 0.243 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.401 -2.513 1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.896 -0.353 -0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.701 0.026 1.014 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.675 -2.358 -0.832 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.615 -1.177 -1.787 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.064 -0.152 -1.918 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.877 0.146 -0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.311 -2.720 -0.041 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.518 -1.390 1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.480 -2.877 1.292 1.00 0.00 H new ATOM 853 N VAL A 60 -6.183 -0.801 3.659 1.00 0.00 N ATOM 854 CA VAL A 60 -6.153 -0.077 4.926 1.00 0.00 C ATOM 855 C VAL A 60 -4.860 0.724 5.003 1.00 0.00 C ATOM 856 O VAL A 60 -4.905 1.931 5.249 1.00 0.00 O ATOM 857 CB VAL A 60 -6.256 -1.038 6.132 1.00 0.00 C ATOM 858 CG1 VAL A 60 -6.671 -0.271 7.396 1.00 0.00 C ATOM 859 CG2 VAL A 60 -7.247 -2.180 5.905 1.00 0.00 C ATOM 0 H VAL A 60 -5.320 -1.315 3.479 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.013 0.591 4.968 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.265 -1.474 6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.739 -0.963 8.236 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.928 0.496 7.617 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.641 0.199 7.234 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.274 -2.819 6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -8.240 -1.769 5.724 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.934 -2.767 5.041 1.00 0.00 H new ATOM 869 N TYR A 61 -3.722 0.064 4.770 1.00 0.00 N ATOM 870 CA TYR A 61 -2.400 0.639 4.932 1.00 0.00 C ATOM 871 C TYR A 61 -1.565 0.346 3.711 1.00 0.00 C ATOM 872 O TYR A 61 -1.715 -0.692 3.061 1.00 0.00 O ATOM 873 CB TYR A 61 -1.691 0.040 6.139 1.00 0.00 C ATOM 874 CG TYR A 61 -2.231 0.471 7.473 1.00 0.00 C ATOM 875 CD1 TYR A 61 -1.794 1.688 8.014 1.00 0.00 C ATOM 876 CD2 TYR A 61 -3.126 -0.346 8.185 1.00 0.00 C ATOM 877 CE1 TYR A 61 -2.217 2.085 9.289 1.00 0.00 C ATOM 878 CE2 TYR A 61 -3.570 0.050 9.457 1.00 0.00 C ATOM 879 CZ TYR A 61 -3.113 1.271 10.013 1.00 0.00 C ATOM 880 OH TYR A 61 -3.532 1.702 11.232 1.00 0.00 O ATOM 0 H TYR A 61 -3.703 -0.907 4.457 1.00 0.00 H new ATOM 0 HA TYR A 61 -2.518 1.713 5.072 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.751 -1.046 6.074 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -0.635 0.305 6.089 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -1.129 2.322 7.446 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -3.471 -1.275 7.755 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.859 3.010 9.716 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.257 -0.574 10.010 1.00 0.00 H new ATOM 0 HH TYR A 61 -4.147 1.044 11.618 1.00 0.00 H new ATOM 890 N VAL A 62 -0.672 1.283 3.438 1.00 0.00 N ATOM 891 CA VAL A 62 0.114 1.369 2.238 1.00 0.00 C ATOM 892 C VAL A 62 1.480 1.849 2.706 1.00 0.00 C ATOM 893 O VAL A 62 1.630 2.996 3.121 1.00 0.00 O ATOM 894 CB VAL A 62 -0.628 2.296 1.249 1.00 0.00 C ATOM 895 CG1 VAL A 62 0.219 2.844 0.097 1.00 0.00 C ATOM 896 CG2 VAL A 62 -1.833 1.528 0.669 1.00 0.00 C ATOM 0 H VAL A 62 -0.472 2.042 4.090 1.00 0.00 H new ATOM 0 HA VAL A 62 0.255 0.437 1.690 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.926 3.171 1.827 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.397 3.482 -0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.048 3.426 0.500 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.610 2.015 -0.493 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.369 2.168 -0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.481 0.637 0.150 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.502 1.236 1.478 1.00 0.00 H new ATOM 906 N ASP A 63 2.447 0.929 2.724 1.00 0.00 N ATOM 907 CA ASP A 63 3.814 1.117 3.217 1.00 0.00 C ATOM 908 C ASP A 63 3.870 1.641 4.662 1.00 0.00 C ATOM 909 O ASP A 63 4.868 2.215 5.106 1.00 0.00 O ATOM 910 CB ASP A 63 4.656 1.920 2.206 1.00 0.00 C ATOM 911 CG ASP A 63 6.137 1.516 2.242 1.00 0.00 C ATOM 912 OD1 ASP A 63 6.403 0.290 2.183 1.00 0.00 O ATOM 913 OD2 ASP A 63 7.049 2.374 2.251 1.00 0.00 O ATOM 0 H ASP A 63 2.290 -0.017 2.377 1.00 0.00 H new ATOM 0 HA ASP A 63 4.283 0.136 3.288 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.262 1.765 1.202 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.565 2.984 2.423 1.00 0.00 H new ATOM 918 N GLY A 64 2.792 1.411 5.419 1.00 0.00 N ATOM 919 CA GLY A 64 2.608 1.779 6.818 1.00 0.00 C ATOM 920 C GLY A 64 1.734 3.021 7.000 1.00 0.00 C ATOM 921 O GLY A 64 1.264 3.285 8.107 1.00 0.00 O ATOM 0 H GLY A 64 1.975 0.932 5.042 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.156 0.943 7.351 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.583 1.958 7.272 1.00 0.00 H new ATOM 925 N ILE A 65 1.467 3.787 5.942 1.00 0.00 N ATOM 926 CA ILE A 65 0.608 4.956 5.985 1.00 0.00 C ATOM 927 C ILE A 65 -0.833 4.490 5.723 1.00 0.00 C ATOM 928 O ILE A 65 -1.091 3.792 4.739 1.00 0.00 O ATOM 929 CB ILE A 65 1.094 5.993 4.947 1.00 0.00 C ATOM 930 CG1 ILE A 65 2.606 6.320 5.055 1.00 0.00 C ATOM 931 CG2 ILE A 65 0.305 7.300 5.130 1.00 0.00 C ATOM 932 CD1 ILE A 65 3.532 5.438 4.207 1.00 0.00 C ATOM 0 H ILE A 65 1.853 3.603 5.016 1.00 0.00 H new ATOM 0 HA ILE A 65 0.643 5.445 6.959 1.00 0.00 H new ATOM 0 HB ILE A 65 0.926 5.548 3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 65 2.757 7.360 4.765 1.00 0.00 H new ATOM 0 HG13 ILE A 65 2.906 6.233 6.099 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.644 8.035 4.400 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.758 7.107 4.984 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.469 7.686 6.136 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.566 5.749 4.355 1.00 0.00 H new ATOM 0 HD12 ILE A 65 3.420 4.397 4.509 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.269 5.541 3.154 1.00 0.00 H new ATOM 944 N PRO A 66 -1.783 4.811 6.611 1.00 0.00 N ATOM 945 CA PRO A 66 -3.181 4.475 6.446 1.00 0.00 C ATOM 946 C PRO A 66 -3.795 5.371 5.376 1.00 0.00 C ATOM 947 O PRO A 66 -3.654 6.600 5.406 1.00 0.00 O ATOM 948 CB PRO A 66 -3.844 4.674 7.807 1.00 0.00 C ATOM 949 CG PRO A 66 -2.907 5.624 8.543 1.00 0.00 C ATOM 950 CD PRO A 66 -1.566 5.529 7.842 1.00 0.00 C ATOM 0 HA PRO A 66 -3.321 3.445 6.117 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.843 5.099 7.705 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.952 3.729 8.339 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -3.288 6.645 8.516 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.817 5.345 9.593 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -1.164 6.522 7.643 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.840 5.010 8.468 1.00 0.00 H new ATOM 958 N VAL A 67 -4.497 4.740 4.443 1.00 0.00 N ATOM 959 CA VAL A 67 -5.218 5.418 3.363 1.00 0.00 C ATOM 960 C VAL A 67 -6.635 5.811 3.790 1.00 0.00 C ATOM 961 O VAL A 67 -7.315 6.540 3.070 1.00 0.00 O ATOM 962 CB VAL A 67 -5.210 4.544 2.090 1.00 0.00 C ATOM 963 CG1 VAL A 67 -3.764 4.223 1.679 1.00 0.00 C ATOM 964 CG2 VAL A 67 -5.984 3.220 2.219 1.00 0.00 C ATOM 0 H VAL A 67 -4.585 3.724 4.412 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.702 6.350 3.132 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.721 5.138 1.333 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.770 3.606 0.780 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.228 5.151 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.268 3.684 2.486 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -5.925 2.671 1.279 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.548 2.620 3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.028 3.430 2.452 1.00 0.00 H new ATOM 974 N ALA A 68 -7.090 5.357 4.960 1.00 0.00 N ATOM 975 CA ALA A 68 -8.418 5.665 5.457 1.00 0.00 C ATOM 976 C ALA A 68 -8.580 7.183 5.602 1.00 0.00 C ATOM 977 O ALA A 68 -7.658 7.873 6.046 1.00 0.00 O ATOM 978 CB ALA A 68 -8.624 4.935 6.781 1.00 0.00 C ATOM 0 H ALA A 68 -6.542 4.766 5.584 1.00 0.00 H new ATOM 0 HA ALA A 68 -9.181 5.327 4.756 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -9.619 5.157 7.168 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.527 3.861 6.623 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.874 5.265 7.499 1.00 0.00 H new ATOM 984 N GLY A 69 -9.737 7.713 5.204 1.00 0.00 N ATOM 985 CA GLY A 69 -10.010 9.148 5.170 1.00 0.00 C ATOM 986 C GLY A 69 -9.362 9.889 3.990 1.00 0.00 C ATOM 987 O GLY A 69 -9.741 11.028 3.720 1.00 0.00 O ATOM 0 H GLY A 69 -10.524 7.145 4.891 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.089 9.300 5.130 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -9.659 9.594 6.100 1.00 0.00 H new ATOM 991 N LYS A 70 -8.409 9.281 3.277 1.00 0.00 N ATOM 992 CA LYS A 70 -7.721 9.850 2.122 1.00 0.00 C ATOM 993 C LYS A 70 -8.389 9.384 0.829 1.00 0.00 C ATOM 994 O LYS A 70 -9.425 8.717 0.853 1.00 0.00 O ATOM 995 CB LYS A 70 -6.226 9.486 2.186 1.00 0.00 C ATOM 996 CG LYS A 70 -5.571 9.817 3.538 1.00 0.00 C ATOM 997 CD LYS A 70 -5.771 11.303 3.879 1.00 0.00 C ATOM 998 CE LYS A 70 -4.644 11.893 4.735 1.00 0.00 C ATOM 999 NZ LYS A 70 -4.527 13.353 4.529 1.00 0.00 N ATOM 0 H LYS A 70 -8.085 8.340 3.501 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.794 10.937 2.138 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.111 8.421 1.987 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.697 10.017 1.395 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.005 9.196 4.322 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.506 9.586 3.500 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.849 11.872 2.953 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.717 11.422 4.407 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.836 11.685 5.788 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.700 11.410 4.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.757 13.726 5.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.321 13.547 3.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.421 13.814 4.794 1.00 0.00 H new ATOM 1013 N THR A 71 -7.814 9.790 -0.294 1.00 0.00 N ATOM 1014 CA THR A 71 -8.360 9.686 -1.639 1.00 0.00 C ATOM 1015 C THR A 71 -7.580 8.648 -2.465 1.00 0.00 C ATOM 1016 O THR A 71 -6.571 8.126 -1.994 1.00 0.00 O ATOM 1017 CB THR A 71 -8.292 11.103 -2.240 1.00 0.00 C ATOM 1018 OG1 THR A 71 -7.046 11.727 -1.955 1.00 0.00 O ATOM 1019 CG2 THR A 71 -9.414 11.985 -1.696 1.00 0.00 C ATOM 0 H THR A 71 -6.894 10.229 -0.289 1.00 0.00 H new ATOM 0 HA THR A 71 -9.391 9.333 -1.636 1.00 0.00 H new ATOM 0 HB THR A 71 -8.403 10.993 -3.319 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.031 12.624 -2.350 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.342 12.979 -2.137 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.378 11.545 -1.950 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.324 12.061 -0.612 1.00 0.00 H new ATOM 1027 N HIS A 72 -8.010 8.366 -3.706 1.00 0.00 N ATOM 1028 CA HIS A 72 -7.259 7.545 -4.666 1.00 0.00 C ATOM 1029 C HIS A 72 -5.850 8.118 -4.821 1.00 0.00 C ATOM 1030 O HIS A 72 -4.879 7.423 -4.518 1.00 0.00 O ATOM 1031 CB HIS A 72 -8.035 7.446 -6.001 1.00 0.00 C ATOM 1032 CG HIS A 72 -7.225 7.134 -7.243 1.00 0.00 C ATOM 1033 ND1 HIS A 72 -7.148 5.917 -7.887 1.00 0.00 N ATOM 1034 CD2 HIS A 72 -6.579 8.051 -8.032 1.00 0.00 C ATOM 1035 CE1 HIS A 72 -6.410 6.083 -8.998 1.00 0.00 C ATOM 1036 NE2 HIS A 72 -6.064 7.372 -9.139 1.00 0.00 N ATOM 0 H HIS A 72 -8.899 8.706 -4.073 1.00 0.00 H new ATOM 0 HA HIS A 72 -7.152 6.524 -4.301 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.800 6.677 -5.893 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.554 8.391 -6.163 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.485 9.108 -7.833 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.135 5.292 -9.680 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.528 7.778 -9.906 1.00 0.00 H new ATOM 1044 N ARG A 73 -5.733 9.397 -5.206 1.00 0.00 N ATOM 1045 CA ARG A 73 -4.463 10.102 -5.396 1.00 0.00 C ATOM 1046 C ARG A 73 -3.498 9.858 -4.249 1.00 0.00 C ATOM 1047 O ARG A 73 -2.334 9.572 -4.516 1.00 0.00 O ATOM 1048 CB ARG A 73 -4.767 11.593 -5.570 1.00 0.00 C ATOM 1049 CG ARG A 73 -3.505 12.460 -5.624 1.00 0.00 C ATOM 1050 CD ARG A 73 -2.534 12.171 -6.779 1.00 0.00 C ATOM 1051 NE ARG A 73 -1.512 13.228 -6.906 1.00 0.00 N ATOM 1052 CZ ARG A 73 -1.690 14.383 -7.562 1.00 0.00 C ATOM 1053 NH1 ARG A 73 -2.881 14.702 -8.062 1.00 0.00 N ATOM 1054 NH2 ARG A 73 -0.679 15.227 -7.722 1.00 0.00 N ATOM 0 H ARG A 73 -6.545 9.984 -5.399 1.00 0.00 H new ATOM 0 HA ARG A 73 -3.966 9.719 -6.287 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.339 11.737 -6.487 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.396 11.928 -4.746 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.809 13.505 -5.685 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.966 12.339 -4.684 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -2.046 11.210 -6.614 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -3.091 12.089 -7.712 1.00 0.00 H new ATOM 0 HE ARG A 73 -0.607 13.068 -6.464 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -3.669 14.065 -7.948 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -3.006 15.584 -8.560 1.00 0.00 H new ATOM 0 HH21 ARG A 73 0.241 14.999 -7.345 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.821 16.104 -8.222 1.00 0.00 H new ATOM 1068 N TYR A 74 -3.971 9.951 -3.003 1.00 0.00 N ATOM 1069 CA TYR A 74 -3.142 9.770 -1.820 1.00 0.00 C ATOM 1070 C TYR A 74 -2.316 8.485 -1.908 1.00 0.00 C ATOM 1071 O TYR A 74 -1.154 8.469 -1.509 1.00 0.00 O ATOM 1072 CB TYR A 74 -4.028 9.750 -0.581 1.00 0.00 C ATOM 1073 CG TYR A 74 -3.250 9.789 0.716 1.00 0.00 C ATOM 1074 CD1 TYR A 74 -2.848 8.593 1.343 1.00 0.00 C ATOM 1075 CD2 TYR A 74 -2.979 11.026 1.325 1.00 0.00 C ATOM 1076 CE1 TYR A 74 -2.181 8.631 2.581 1.00 0.00 C ATOM 1077 CE2 TYR A 74 -2.273 11.068 2.535 1.00 0.00 C ATOM 1078 CZ TYR A 74 -1.889 9.877 3.185 1.00 0.00 C ATOM 1079 OH TYR A 74 -1.322 9.965 4.415 1.00 0.00 O ATOM 0 H TYR A 74 -4.948 10.156 -2.791 1.00 0.00 H new ATOM 0 HA TYR A 74 -2.443 10.604 -1.755 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.706 10.603 -0.615 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.645 8.851 -0.599 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -3.053 7.643 0.871 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.314 11.942 0.862 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -1.893 7.712 3.069 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.021 12.022 2.974 1.00 0.00 H new ATOM 0 HH TYR A 74 -1.201 10.908 4.653 1.00 0.00 H new ATOM 1089 N VAL A 75 -2.917 7.410 -2.415 1.00 0.00 N ATOM 1090 CA VAL A 75 -2.291 6.110 -2.555 1.00 0.00 C ATOM 1091 C VAL A 75 -1.368 6.082 -3.771 1.00 0.00 C ATOM 1092 O VAL A 75 -0.273 5.535 -3.685 1.00 0.00 O ATOM 1093 CB VAL A 75 -3.382 5.026 -2.666 1.00 0.00 C ATOM 1094 CG1 VAL A 75 -2.726 3.669 -2.417 1.00 0.00 C ATOM 1095 CG2 VAL A 75 -4.516 5.225 -1.649 1.00 0.00 C ATOM 0 H VAL A 75 -3.881 7.427 -2.747 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.681 5.910 -1.674 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.824 5.088 -3.660 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.477 2.883 -2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.949 3.498 -3.162 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.283 3.656 -1.421 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.257 4.435 -1.771 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.109 5.188 -0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.988 6.193 -1.815 1.00 0.00 H new ATOM 1105 N ILE A 76 -1.769 6.663 -4.900 1.00 0.00 N ATOM 1106 CA ILE A 76 -0.964 6.667 -6.121 1.00 0.00 C ATOM 1107 C ILE A 76 0.384 7.354 -5.848 1.00 0.00 C ATOM 1108 O ILE A 76 1.437 6.879 -6.271 1.00 0.00 O ATOM 1109 CB ILE A 76 -1.768 7.347 -7.255 1.00 0.00 C ATOM 1110 CG1 ILE A 76 -3.200 6.809 -7.444 1.00 0.00 C ATOM 1111 CG2 ILE A 76 -1.077 7.225 -8.609 1.00 0.00 C ATOM 1112 CD1 ILE A 76 -3.330 5.286 -7.564 1.00 0.00 C ATOM 0 H ILE A 76 -2.663 7.145 -4.995 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.742 5.650 -6.443 1.00 0.00 H new ATOM 0 HB ILE A 76 -1.820 8.384 -6.923 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.807 7.141 -6.602 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.623 7.263 -8.340 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.681 7.718 -9.371 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -0.096 7.698 -8.561 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.960 6.172 -8.864 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.379 5.019 -7.694 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -2.758 4.939 -8.425 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -2.945 4.816 -6.659 1.00 0.00 H new ATOM 1124 N ASP A 77 0.354 8.459 -5.106 1.00 0.00 N ATOM 1125 CA ASP A 77 1.519 9.236 -4.682 1.00 0.00 C ATOM 1126 C ASP A 77 2.382 8.476 -3.667 1.00 0.00 C ATOM 1127 O ASP A 77 3.577 8.752 -3.540 1.00 0.00 O ATOM 1128 CB ASP A 77 0.997 10.538 -4.034 1.00 0.00 C ATOM 1129 CG ASP A 77 1.728 11.787 -4.508 1.00 0.00 C ATOM 1130 OD1 ASP A 77 2.979 11.777 -4.508 1.00 0.00 O ATOM 1131 OD2 ASP A 77 1.021 12.762 -4.867 1.00 0.00 O ATOM 0 H ASP A 77 -0.523 8.856 -4.768 1.00 0.00 H new ATOM 0 HA ASP A 77 2.146 9.438 -5.550 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -0.066 10.643 -4.253 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.093 10.459 -2.951 1.00 0.00 H new ATOM 1136 N LEU A 78 1.805 7.517 -2.937 1.00 0.00 N ATOM 1137 CA LEU A 78 2.534 6.653 -2.015 1.00 0.00 C ATOM 1138 C LEU A 78 3.206 5.515 -2.777 1.00 0.00 C ATOM 1139 O LEU A 78 4.383 5.251 -2.546 1.00 0.00 O ATOM 1140 CB LEU A 78 1.579 6.085 -0.946 1.00 0.00 C ATOM 1141 CG LEU A 78 1.304 7.031 0.230 1.00 0.00 C ATOM 1142 CD1 LEU A 78 0.330 6.356 1.201 1.00 0.00 C ATOM 1143 CD2 LEU A 78 2.574 7.451 0.973 1.00 0.00 C ATOM 0 H LEU A 78 0.805 7.319 -2.973 1.00 0.00 H new ATOM 0 HA LEU A 78 3.303 7.245 -1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.631 5.832 -1.421 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.999 5.157 -0.558 1.00 0.00 H new ATOM 0 HG LEU A 78 0.869 7.942 -0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.131 7.024 2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.604 6.134 0.684 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.769 5.430 1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.312 8.119 1.793 1.00 0.00 H new ATOM 0 HD22 LEU A 78 3.072 6.567 1.371 1.00 0.00 H new ATOM 0 HD23 LEU A 78 3.244 7.966 0.285 1.00 0.00 H new ATOM 1155 N MET A 79 2.508 4.861 -3.708 1.00 0.00 N ATOM 1156 CA MET A 79 3.075 3.767 -4.496 1.00 0.00 C ATOM 1157 C MET A 79 4.335 4.200 -5.249 1.00 0.00 C ATOM 1158 O MET A 79 5.269 3.407 -5.389 1.00 0.00 O ATOM 1159 CB MET A 79 2.033 3.243 -5.492 1.00 0.00 C ATOM 1160 CG MET A 79 0.852 2.540 -4.816 1.00 0.00 C ATOM 1161 SD MET A 79 1.224 1.196 -3.652 1.00 0.00 S ATOM 1162 CE MET A 79 2.307 0.115 -4.621 1.00 0.00 C ATOM 0 H MET A 79 1.537 5.075 -3.936 1.00 0.00 H new ATOM 0 HA MET A 79 3.355 2.974 -3.803 1.00 0.00 H new ATOM 0 HB2 MET A 79 1.659 4.075 -6.088 1.00 0.00 H new ATOM 0 HB3 MET A 79 2.515 2.549 -6.181 1.00 0.00 H new ATOM 0 HG2 MET A 79 0.273 3.294 -4.283 1.00 0.00 H new ATOM 0 HG3 MET A 79 0.209 2.138 -5.598 1.00 0.00 H new ATOM 0 HE1 MET A 79 2.515 -0.793 -4.056 1.00 0.00 H new ATOM 0 HE2 MET A 79 1.816 -0.146 -5.559 1.00 0.00 H new ATOM 0 HE3 MET A 79 3.243 0.633 -4.833 1.00 0.00 H new ATOM 1172 N HIS A 80 4.364 5.454 -5.705 1.00 0.00 N ATOM 1173 CA HIS A 80 5.531 6.075 -6.309 1.00 0.00 C ATOM 1174 C HIS A 80 6.733 6.061 -5.355 1.00 0.00 C ATOM 1175 O HIS A 80 7.838 5.715 -5.774 1.00 0.00 O ATOM 1176 CB HIS A 80 5.143 7.484 -6.793 1.00 0.00 C ATOM 1177 CG HIS A 80 4.963 7.503 -8.287 1.00 0.00 C ATOM 1178 ND1 HIS A 80 5.957 7.680 -9.222 1.00 0.00 N ATOM 1179 CD2 HIS A 80 3.812 7.191 -8.955 1.00 0.00 C ATOM 1180 CE1 HIS A 80 5.418 7.478 -10.433 1.00 0.00 C ATOM 1181 NE2 HIS A 80 4.114 7.170 -10.325 1.00 0.00 N ATOM 0 H HIS A 80 3.556 6.075 -5.661 1.00 0.00 H new ATOM 0 HA HIS A 80 5.857 5.501 -7.176 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.220 7.800 -6.307 1.00 0.00 H new ATOM 0 HB3 HIS A 80 5.915 8.198 -6.506 1.00 0.00 H new ATOM 0 HD2 HIS A 80 2.847 6.996 -8.510 1.00 0.00 H new ATOM 0 HE1 HIS A 80 5.957 7.552 -11.366 1.00 0.00 H new ATOM 0 HE2 HIS A 80 3.471 6.962 -11.089 1.00 0.00 H new ATOM 1189 N HIS A 81 6.524 6.366 -4.073 1.00 0.00 N ATOM 1190 CA HIS A 81 7.556 6.280 -3.048 1.00 0.00 C ATOM 1191 C HIS A 81 7.943 4.824 -2.792 1.00 0.00 C ATOM 1192 O HIS A 81 9.125 4.502 -2.761 1.00 0.00 O ATOM 1193 CB HIS A 81 7.092 6.971 -1.753 1.00 0.00 C ATOM 1194 CG HIS A 81 7.926 8.188 -1.443 1.00 0.00 C ATOM 1195 ND1 HIS A 81 9.279 8.187 -1.206 1.00 0.00 N ATOM 1196 CD2 HIS A 81 7.493 9.482 -1.385 1.00 0.00 C ATOM 1197 CE1 HIS A 81 9.663 9.456 -1.004 1.00 0.00 C ATOM 1198 NE2 HIS A 81 8.608 10.289 -1.104 1.00 0.00 N ATOM 0 H HIS A 81 5.622 6.683 -3.717 1.00 0.00 H new ATOM 0 HA HIS A 81 8.443 6.802 -3.406 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.046 7.261 -1.850 1.00 0.00 H new ATOM 0 HB3 HIS A 81 7.152 6.267 -0.923 1.00 0.00 H new ATOM 0 HD2 HIS A 81 6.478 9.823 -1.529 1.00 0.00 H new ATOM 0 HE1 HIS A 81 10.675 9.767 -0.791 1.00 0.00 H new ATOM 0 HE2 HIS A 81 8.617 11.303 -0.997 1.00 0.00 H new ATOM 1206 N ALA A 82 6.982 3.907 -2.662 1.00 0.00 N ATOM 1207 CA ALA A 82 7.298 2.511 -2.374 1.00 0.00 C ATOM 1208 C ALA A 82 8.170 1.877 -3.463 1.00 0.00 C ATOM 1209 O ALA A 82 9.032 1.044 -3.166 1.00 0.00 O ATOM 1210 CB ALA A 82 6.020 1.714 -2.190 1.00 0.00 C ATOM 0 H ALA A 82 5.986 4.106 -2.751 1.00 0.00 H new ATOM 0 HA ALA A 82 7.874 2.491 -1.449 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.267 0.674 -1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.448 2.130 -1.360 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.425 1.765 -3.102 1.00 0.00 H new ATOM 1216 N ALA A 83 8.001 2.292 -4.723 1.00 0.00 N ATOM 1217 CA ALA A 83 8.900 1.882 -5.791 1.00 0.00 C ATOM 1218 C ALA A 83 10.350 2.278 -5.474 1.00 0.00 C ATOM 1219 O ALA A 83 11.258 1.491 -5.742 1.00 0.00 O ATOM 1220 CB ALA A 83 8.430 2.459 -7.129 1.00 0.00 C ATOM 0 H ALA A 83 7.248 2.912 -5.022 1.00 0.00 H new ATOM 0 HA ALA A 83 8.877 0.795 -5.870 1.00 0.00 H new ATOM 0 HB1 ALA A 83 9.111 2.145 -7.920 1.00 0.00 H new ATOM 0 HB2 ALA A 83 7.426 2.096 -7.349 1.00 0.00 H new ATOM 0 HB3 ALA A 83 8.418 3.547 -7.072 1.00 0.00 H new ATOM 1226 N ARG A 84 10.586 3.448 -4.869 1.00 0.00 N ATOM 1227 CA ARG A 84 11.908 3.889 -4.416 1.00 0.00 C ATOM 1228 C ARG A 84 12.418 3.072 -3.235 1.00 0.00 C ATOM 1229 O ARG A 84 13.609 2.761 -3.182 1.00 0.00 O ATOM 1230 CB ARG A 84 11.905 5.381 -4.041 1.00 0.00 C ATOM 1231 CG ARG A 84 11.475 6.257 -5.222 1.00 0.00 C ATOM 1232 CD ARG A 84 11.899 7.705 -4.986 1.00 0.00 C ATOM 1233 NE ARG A 84 11.755 8.491 -6.218 1.00 0.00 N ATOM 1234 CZ ARG A 84 11.312 9.744 -6.347 1.00 0.00 C ATOM 1235 NH1 ARG A 84 11.044 10.505 -5.292 1.00 0.00 N ATOM 1236 NH2 ARG A 84 11.144 10.223 -7.574 1.00 0.00 N ATOM 0 H ARG A 84 9.849 4.127 -4.678 1.00 0.00 H new ATOM 0 HA ARG A 84 12.583 3.732 -5.257 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.230 5.545 -3.201 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.901 5.676 -3.712 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.924 5.884 -6.143 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.394 6.203 -5.350 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.291 8.144 -4.195 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.934 7.736 -4.647 1.00 0.00 H new ATOM 0 HE ARG A 84 12.027 8.022 -7.082 1.00 0.00 H new ATOM 0 HH11 ARG A 84 11.175 10.136 -4.350 1.00 0.00 H new ATOM 0 HH12 ARG A 84 10.707 11.459 -5.424 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.352 9.638 -8.383 1.00 0.00 H new ATOM 0 HH22 ARG A 84 10.807 11.176 -7.708 1.00 0.00 H new ATOM 1250 N ASN A 85 11.542 2.670 -2.311 1.00 0.00 N ATOM 1251 CA ASN A 85 11.925 1.803 -1.192 1.00 0.00 C ATOM 1252 C ASN A 85 12.282 0.388 -1.658 1.00 0.00 C ATOM 1253 O ASN A 85 12.836 -0.391 -0.873 1.00 0.00 O ATOM 1254 CB ASN A 85 10.817 1.719 -0.128 1.00 0.00 C ATOM 1255 CG ASN A 85 10.837 2.862 0.876 1.00 0.00 C ATOM 1256 OD1 ASN A 85 11.872 3.475 1.121 1.00 0.00 O ATOM 1257 ND2 ASN A 85 9.702 3.202 1.463 1.00 0.00 N ATOM 0 H ASN A 85 10.556 2.933 -2.316 1.00 0.00 H new ATOM 0 HA ASN A 85 12.809 2.260 -0.748 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.848 1.704 -0.627 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.913 0.775 0.409 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.682 3.978 2.124 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.846 2.688 1.254 1.00 0.00 H new ATOM 1264 N GLY A 86 11.975 0.041 -2.911 1.00 0.00 N ATOM 1265 CA GLY A 86 12.297 -1.244 -3.513 1.00 0.00 C ATOM 1266 C GLY A 86 11.358 -2.361 -3.068 1.00 0.00 C ATOM 1267 O GLY A 86 11.577 -3.529 -3.378 1.00 0.00 O ATOM 0 H GLY A 86 11.482 0.668 -3.547 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.255 -1.152 -4.598 1.00 0.00 H new ATOM 0 HA3 GLY A 86 13.321 -1.513 -3.256 1.00 0.00 H new ATOM 1271 N GLN A 87 10.298 -2.038 -2.333 1.00 0.00 N ATOM 1272 CA GLN A 87 9.374 -2.999 -1.759 1.00 0.00 C ATOM 1273 C GLN A 87 8.167 -2.227 -1.247 1.00 0.00 C ATOM 1274 O GLN A 87 8.222 -1.002 -1.108 1.00 0.00 O ATOM 1275 CB GLN A 87 10.060 -3.757 -0.605 1.00 0.00 C ATOM 1276 CG GLN A 87 10.339 -2.827 0.585 1.00 0.00 C ATOM 1277 CD GLN A 87 11.571 -3.220 1.372 1.00 0.00 C ATOM 1278 OE1 GLN A 87 11.500 -4.032 2.290 1.00 0.00 O ATOM 1279 NE2 GLN A 87 12.699 -2.596 1.081 1.00 0.00 N ATOM 0 H GLN A 87 10.055 -1.071 -2.117 1.00 0.00 H new ATOM 0 HA GLN A 87 9.063 -3.731 -2.504 1.00 0.00 H new ATOM 0 HB2 GLN A 87 9.427 -4.584 -0.283 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.996 -4.191 -0.957 1.00 0.00 H new ATOM 0 HG2 GLN A 87 10.459 -1.807 0.220 1.00 0.00 H new ATOM 0 HG3 GLN A 87 9.475 -2.829 1.250 1.00 0.00 H new ATOM 0 HE21 GLN A 87 12.728 -1.926 0.312 1.00 0.00 H new ATOM 0 HE22 GLN A 87 13.541 -2.784 1.625 1.00 0.00 H new ATOM 1288 N VAL A 88 7.111 -2.940 -0.887 1.00 0.00 N ATOM 1289 CA VAL A 88 5.958 -2.349 -0.255 1.00 0.00 C ATOM 1290 C VAL A 88 5.329 -3.364 0.683 1.00 0.00 C ATOM 1291 O VAL A 88 5.510 -4.574 0.507 1.00 0.00 O ATOM 1292 CB VAL A 88 5.015 -1.858 -1.371 1.00 0.00 C ATOM 1293 CG1 VAL A 88 4.190 -2.968 -2.036 1.00 0.00 C ATOM 1294 CG2 VAL A 88 4.105 -0.769 -0.833 1.00 0.00 C ATOM 0 H VAL A 88 7.036 -3.947 -1.029 1.00 0.00 H new ATOM 0 HA VAL A 88 6.214 -1.488 0.362 1.00 0.00 H new ATOM 0 HB VAL A 88 5.656 -1.462 -2.158 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.554 -2.536 -2.809 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.861 -3.700 -2.486 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.568 -3.458 -1.287 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.441 -0.425 -1.626 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.512 -1.165 -0.009 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.708 0.067 -0.478 1.00 0.00 H new ATOM 1304 N ASN A 89 4.540 -2.874 1.632 1.00 0.00 N ATOM 1305 CA ASN A 89 3.601 -3.673 2.397 1.00 0.00 C ATOM 1306 C ASN A 89 2.212 -3.070 2.188 1.00 0.00 C ATOM 1307 O ASN A 89 2.077 -1.859 1.962 1.00 0.00 O ATOM 1308 CB ASN A 89 4.057 -3.740 3.860 1.00 0.00 C ATOM 1309 CG ASN A 89 3.465 -4.935 4.612 1.00 0.00 C ATOM 1310 OD1 ASN A 89 2.582 -5.622 4.111 1.00 0.00 O ATOM 1311 ND2 ASN A 89 3.924 -5.223 5.817 1.00 0.00 N ATOM 0 H ASN A 89 4.538 -1.888 1.894 1.00 0.00 H new ATOM 0 HA ASN A 89 3.560 -4.710 2.064 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.145 -3.798 3.894 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.770 -2.819 4.368 1.00 0.00 H new ATOM 0 HD21 ASN A 89 3.544 -6.018 6.331 1.00 0.00 H new ATOM 0 HD22 ASN A 89 4.659 -4.651 6.233 1.00 0.00 H new ATOM 1318 N LEU A 90 1.190 -3.916 2.147 1.00 0.00 N ATOM 1319 CA LEU A 90 -0.173 -3.610 1.742 1.00 0.00 C ATOM 1320 C LEU A 90 -1.051 -4.339 2.743 1.00 0.00 C ATOM 1321 O LEU A 90 -1.233 -5.550 2.618 1.00 0.00 O ATOM 1322 CB LEU A 90 -0.466 -4.127 0.315 1.00 0.00 C ATOM 1323 CG LEU A 90 0.381 -3.505 -0.810 1.00 0.00 C ATOM 1324 CD1 LEU A 90 0.896 -4.583 -1.764 1.00 0.00 C ATOM 1325 CD2 LEU A 90 -0.423 -2.441 -1.558 1.00 0.00 C ATOM 0 H LEU A 90 1.300 -4.895 2.413 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.350 -2.535 1.727 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.316 -5.207 0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.518 -3.948 0.093 1.00 0.00 H new ATOM 0 HG LEU A 90 1.248 -3.020 -0.361 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.492 -4.119 -2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 90 1.513 -5.292 -1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.051 -5.107 -2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.190 -2.011 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -1.312 -2.897 -1.994 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -0.721 -1.656 -0.864 1.00 0.00 H new ATOM 1337 N THR A 91 -1.562 -3.643 3.751 1.00 0.00 N ATOM 1338 CA THR A 91 -2.516 -4.261 4.648 1.00 0.00 C ATOM 1339 C THR A 91 -3.871 -4.109 3.964 1.00 0.00 C ATOM 1340 O THR A 91 -4.360 -2.982 3.817 1.00 0.00 O ATOM 1341 CB THR A 91 -2.534 -3.574 6.021 1.00 0.00 C ATOM 1342 OG1 THR A 91 -1.253 -3.374 6.567 1.00 0.00 O ATOM 1343 CG2 THR A 91 -3.361 -4.378 7.019 1.00 0.00 C ATOM 0 H THR A 91 -1.335 -2.671 3.961 1.00 0.00 H new ATOM 0 HA THR A 91 -2.258 -5.304 4.834 1.00 0.00 H new ATOM 0 HB THR A 91 -2.981 -2.595 5.847 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.334 -2.932 7.438 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.359 -3.872 7.984 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.385 -4.465 6.657 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.930 -5.373 7.130 1.00 0.00 H new ATOM 1351 N VAL A 92 -4.483 -5.218 3.559 1.00 0.00 N ATOM 1352 CA VAL A 92 -5.882 -5.250 3.156 1.00 0.00 C ATOM 1353 C VAL A 92 -6.702 -5.773 4.336 1.00 0.00 C ATOM 1354 O VAL A 92 -6.146 -6.221 5.336 1.00 0.00 O ATOM 1355 CB VAL A 92 -6.075 -6.062 1.857 1.00 0.00 C ATOM 1356 CG1 VAL A 92 -5.393 -5.376 0.668 1.00 0.00 C ATOM 1357 CG2 VAL A 92 -5.577 -7.509 1.947 1.00 0.00 C ATOM 0 H VAL A 92 -4.018 -6.124 3.501 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.236 -4.249 2.911 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.154 -6.098 1.707 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.546 -5.971 -0.232 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.822 -4.384 0.525 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.325 -5.284 0.865 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -5.748 -8.012 0.995 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.511 -7.513 2.174 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.118 -8.031 2.736 1.00 0.00 H new ATOM 1367 N ARG A 93 -8.030 -5.719 4.280 1.00 0.00 N ATOM 1368 CA ARG A 93 -8.893 -6.291 5.305 1.00 0.00 C ATOM 1369 C ARG A 93 -10.215 -6.708 4.692 1.00 0.00 C ATOM 1370 O ARG A 93 -10.571 -6.240 3.611 1.00 0.00 O ATOM 1371 CB ARG A 93 -9.074 -5.289 6.462 1.00 0.00 C ATOM 1372 CG ARG A 93 -10.052 -4.143 6.194 1.00 0.00 C ATOM 1373 CD ARG A 93 -10.238 -3.158 7.366 1.00 0.00 C ATOM 1374 NE ARG A 93 -10.569 -1.802 6.880 1.00 0.00 N ATOM 1375 CZ ARG A 93 -11.547 -1.510 6.013 1.00 0.00 C ATOM 1376 NH1 ARG A 93 -12.593 -2.317 5.875 1.00 0.00 N ATOM 1377 NH2 ARG A 93 -11.487 -0.425 5.252 1.00 0.00 N ATOM 0 H ARG A 93 -8.539 -5.274 3.516 1.00 0.00 H new ATOM 0 HA ARG A 93 -8.430 -7.186 5.721 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -9.413 -5.835 7.342 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.101 -4.863 6.706 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -9.706 -3.587 5.323 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -11.023 -4.566 5.937 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -11.032 -3.515 8.022 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.325 -3.121 7.961 1.00 0.00 H new ATOM 0 HE ARG A 93 -10.008 -1.027 7.233 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -12.657 -3.169 6.432 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -13.332 -2.085 5.212 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.686 0.203 5.322 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -12.241 -0.219 4.597 1.00 0.00 H new ATOM 1391 N ARG A 94 -10.975 -7.531 5.414 1.00 0.00 N ATOM 1392 CA ARG A 94 -12.364 -7.859 5.106 1.00 0.00 C ATOM 1393 C ARG A 94 -13.083 -8.187 6.403 1.00 0.00 C ATOM 1394 O ARG A 94 -12.557 -8.949 7.221 1.00 0.00 O ATOM 1395 CB ARG A 94 -12.430 -9.066 4.159 1.00 0.00 C ATOM 1396 CG ARG A 94 -12.447 -8.675 2.668 1.00 0.00 C ATOM 1397 CD ARG A 94 -11.478 -9.552 1.862 1.00 0.00 C ATOM 1398 NE ARG A 94 -11.995 -9.837 0.520 1.00 0.00 N ATOM 1399 CZ ARG A 94 -12.915 -10.751 0.198 1.00 0.00 C ATOM 1400 NH1 ARG A 94 -13.407 -11.582 1.116 1.00 0.00 N ATOM 1401 NH2 ARG A 94 -13.343 -10.823 -1.053 1.00 0.00 N ATOM 0 H ARG A 94 -10.631 -8.000 6.252 1.00 0.00 H new ATOM 0 HA ARG A 94 -12.839 -7.009 4.616 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -11.573 -9.713 4.347 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.324 -9.647 4.385 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -13.457 -8.782 2.271 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.171 -7.626 2.560 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.514 -9.050 1.782 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -11.307 -10.489 2.393 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.614 -9.281 -0.246 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -13.082 -11.526 2.081 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.109 -12.274 0.854 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -12.971 -10.186 -1.757 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.045 -11.516 -1.313 1.00 0.00 H new ATOM 1415 N LYS A 95 -14.276 -7.624 6.592 1.00 0.00 N ATOM 1416 CA LYS A 95 -15.242 -8.092 7.582 1.00 0.00 C ATOM 1417 C LYS A 95 -15.656 -9.520 7.242 1.00 0.00 C ATOM 1418 O LYS A 95 -15.635 -9.920 6.076 1.00 0.00 O ATOM 1419 CB LYS A 95 -16.432 -7.109 7.660 1.00 0.00 C ATOM 1420 CG LYS A 95 -16.779 -6.663 9.096 1.00 0.00 C ATOM 1421 CD LYS A 95 -18.078 -7.261 9.642 1.00 0.00 C ATOM 1422 CE LYS A 95 -19.322 -6.387 9.415 1.00 0.00 C ATOM 1423 NZ LYS A 95 -19.578 -6.093 7.989 1.00 0.00 N ATOM 0 H LYS A 95 -14.602 -6.820 6.055 1.00 0.00 H new ATOM 0 HA LYS A 95 -14.798 -8.116 8.577 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -16.203 -6.227 7.061 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -17.309 -7.578 7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -15.959 -6.939 9.758 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.855 -5.576 9.118 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -18.241 -8.233 9.175 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.962 -7.436 10.712 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -20.192 -6.889 9.837 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -19.202 -5.449 9.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -20.429 -5.501 7.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -18.763 -5.587 7.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -19.723 -6.983 7.471 1.00 0.00 H new ATOM 1437 N VAL A 96 -16.006 -10.289 8.268 1.00 0.00 N ATOM 1438 CA VAL A 96 -16.245 -11.731 8.152 1.00 0.00 C ATOM 1439 C VAL A 96 -17.713 -12.053 8.375 1.00 0.00 C ATOM 1440 O VAL A 96 -18.361 -11.477 9.253 1.00 0.00 O ATOM 1441 CB VAL A 96 -15.338 -12.496 9.146 1.00 0.00 C ATOM 1442 CG1 VAL A 96 -15.452 -14.021 9.000 1.00 0.00 C ATOM 1443 CG2 VAL A 96 -13.861 -12.128 8.968 1.00 0.00 C ATOM 0 H VAL A 96 -16.134 -9.929 9.214 1.00 0.00 H new ATOM 0 HA VAL A 96 -15.992 -12.054 7.142 1.00 0.00 H new ATOM 0 HB VAL A 96 -15.689 -12.197 10.134 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -14.794 -14.506 9.722 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -16.482 -14.328 9.184 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -15.161 -14.313 7.991 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -13.258 -12.686 9.684 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -13.544 -12.376 7.955 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -13.729 -11.059 9.138 1.00 0.00 H new ATOM 1453 N LEU A 97 -18.235 -13.029 7.625 1.00 0.00 N ATOM 1454 CA LEU A 97 -19.619 -13.469 7.727 1.00 0.00 C ATOM 1455 C LEU A 97 -19.692 -14.958 7.405 1.00 0.00 C ATOM 1456 O LEU A 97 -19.815 -15.761 8.325 1.00 0.00 O ATOM 1457 CB LEU A 97 -20.482 -12.580 6.832 1.00 0.00 C ATOM 1458 CG LEU A 97 -21.946 -12.551 7.312 1.00 0.00 C ATOM 1459 CD1 LEU A 97 -22.531 -11.191 6.957 1.00 0.00 C ATOM 1460 CD2 LEU A 97 -22.785 -13.676 6.706 1.00 0.00 C ATOM 0 H LEU A 97 -17.697 -13.538 6.924 1.00 0.00 H new ATOM 0 HA LEU A 97 -20.013 -13.361 8.737 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -20.079 -11.567 6.826 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -20.441 -12.945 5.806 1.00 0.00 H new ATOM 0 HG LEU A 97 -21.965 -12.710 8.390 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -23.569 -11.144 7.287 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -21.957 -10.408 7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -22.486 -11.046 5.878 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -23.807 -13.608 7.078 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -22.787 -13.584 5.620 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -22.360 -14.639 6.988 1.00 0.00 H new ATOM 1472 N SER A 98 -19.506 -15.324 6.132 1.00 0.00 N ATOM 1473 CA SER A 98 -19.322 -16.700 5.671 1.00 0.00 C ATOM 1474 C SER A 98 -20.420 -17.656 6.170 1.00 0.00 C ATOM 1475 O SER A 98 -20.138 -18.765 6.636 1.00 0.00 O ATOM 1476 CB SER A 98 -17.903 -17.158 6.035 1.00 0.00 C ATOM 1477 OG SER A 98 -16.938 -16.201 5.618 1.00 0.00 O ATOM 0 H SER A 98 -19.479 -14.646 5.371 1.00 0.00 H new ATOM 0 HA SER A 98 -19.428 -16.726 4.586 1.00 0.00 H new ATOM 0 HB2 SER A 98 -17.830 -17.308 7.112 1.00 0.00 H new ATOM 0 HB3 SER A 98 -17.695 -18.119 5.564 1.00 0.00 H new ATOM 0 HG SER A 98 -16.041 -16.513 5.862 1.00 0.00 H new ATOM 1483 N GLY A 99 -21.681 -17.237 6.059 1.00 0.00 N ATOM 1484 CA GLY A 99 -22.854 -18.071 6.290 1.00 0.00 C ATOM 1485 C GLY A 99 -23.554 -18.382 4.963 1.00 0.00 C ATOM 1486 O GLY A 99 -23.100 -17.922 3.907 1.00 0.00 O ATOM 0 H GLY A 99 -21.918 -16.280 5.798 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -22.558 -18.999 6.779 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -23.544 -17.562 6.963 1.00 0.00 H new ATOM 1490 N PRO A 100 -24.639 -19.171 4.979 1.00 0.00 N ATOM 1491 CA PRO A 100 -25.418 -19.500 3.795 1.00 0.00 C ATOM 1492 C PRO A 100 -26.189 -18.260 3.326 1.00 0.00 C ATOM 1493 O PRO A 100 -27.240 -17.916 3.875 1.00 0.00 O ATOM 1494 CB PRO A 100 -26.341 -20.647 4.226 1.00 0.00 C ATOM 1495 CG PRO A 100 -26.537 -20.402 5.720 1.00 0.00 C ATOM 1496 CD PRO A 100 -25.200 -19.813 6.156 1.00 0.00 C ATOM 0 HA PRO A 100 -24.806 -19.808 2.947 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -27.288 -20.624 3.688 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -25.889 -21.620 4.034 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -27.361 -19.714 5.910 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -26.763 -21.326 6.253 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -25.336 -19.094 6.964 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -24.535 -20.591 6.530 1.00 0.00 H new ATOM 1504 N SER A 101 -25.674 -17.568 2.313 1.00 0.00 N ATOM 1505 CA SER A 101 -26.426 -16.538 1.618 1.00 0.00 C ATOM 1506 C SER A 101 -27.596 -17.207 0.889 1.00 0.00 C ATOM 1507 O SER A 101 -27.409 -18.256 0.262 1.00 0.00 O ATOM 1508 CB SER A 101 -25.487 -15.818 0.648 1.00 0.00 C ATOM 1509 OG SER A 101 -26.131 -14.730 0.019 1.00 0.00 O ATOM 0 H SER A 101 -24.729 -17.707 1.956 1.00 0.00 H new ATOM 0 HA SER A 101 -26.829 -15.798 2.310 1.00 0.00 H new ATOM 0 HB2 SER A 101 -24.609 -15.461 1.187 1.00 0.00 H new ATOM 0 HB3 SER A 101 -25.134 -16.520 -0.107 1.00 0.00 H new ATOM 0 HG SER A 101 -25.505 -14.289 -0.593 1.00 0.00 H new ATOM 1515 N SER A 102 -28.770 -16.586 0.950 1.00 0.00 N ATOM 1516 CA SER A 102 -30.001 -16.971 0.274 1.00 0.00 C ATOM 1517 C SER A 102 -30.784 -15.694 -0.061 1.00 0.00 C ATOM 1518 O SER A 102 -30.473 -14.630 0.486 1.00 0.00 O ATOM 1519 CB SER A 102 -30.795 -17.903 1.206 1.00 0.00 C ATOM 1520 OG SER A 102 -30.986 -17.314 2.484 1.00 0.00 O ATOM 0 H SER A 102 -28.893 -15.743 1.512 1.00 0.00 H new ATOM 0 HA SER A 102 -29.804 -17.506 -0.655 1.00 0.00 H new ATOM 0 HB2 SER A 102 -31.763 -18.129 0.759 1.00 0.00 H new ATOM 0 HB3 SER A 102 -30.265 -18.849 1.315 1.00 0.00 H new ATOM 0 HG SER A 102 -31.495 -17.928 3.054 1.00 0.00 H new ATOM 1526 N GLY A 103 -31.806 -15.770 -0.915 1.00 0.00 N ATOM 1527 CA GLY A 103 -32.675 -14.647 -1.233 1.00 0.00 C ATOM 1528 C GLY A 103 -33.137 -14.699 -2.671 1.00 0.00 C ATOM 1529 O GLY A 103 -33.828 -13.738 -3.068 1.00 0.00 O ATOM 0 H GLY A 103 -32.053 -16.627 -1.410 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -33.540 -14.655 -0.570 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -32.145 -13.712 -1.053 1.00 0.00 H new TER 1533 GLY A 103