USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 969 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 Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -19:sc= 1.17 USER MOD Single : A 14 THR OG1 : rot 68:sc= 0.165 USER MOD Single : A 17 LYS NZ :NH3+ -145:sc= -0.584 (180deg=-1.19) USER MOD Single : A 19 LYS NZ :NH3+ -146:sc= -1.49 (180deg=-3.76!) USER MOD Single : A 23 LYS NZ :NH3+ -120:sc= -0.695 (180deg=-2.44!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -1.45 X(o=-1.5,f=-1.2) USER MOD Single : A 28 LYS NZ :NH3+ -173:sc=-0.00405 (180deg=-0.072) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -46:sc= 0.561 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 66:sc= 1.21 USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.808 USER MOD Single : A 61 LYS NZ :NH3+ -176:sc= 0.344 (180deg=0.251) USER MOD Single : A 66 LYS NZ :NH3+ 163:sc= -0.0604 (180deg=-0.324) USER MOD Single : A 72 LYS NZ :NH3+ 161:sc= -0.0513 (180deg=-0.368) USER MOD Single : A 73 SER OG : rot 56:sc= 0.328 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc= -0.158 K(o=-0.16,f=-1.9!) USER MOD Single : A 94 SER OG : rot 81:sc= 0.99 USER MOD Single : A 106 THR OG1 : rot 41:sc= 0.0398 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.299 USER MOD Single : A 114 LYS NZ :NH3+ -173:sc= 0.868 (180deg=0.823) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot 92:sc= 0.854 USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 2.411 3.330 6.567 1.00 45.03 N ATOM 35 CA ILE A 3 1.594 3.511 5.362 1.00 10.02 C ATOM 36 C ILE A 3 1.756 2.308 4.412 1.00 25.22 C ATOM 37 O ILE A 3 2.876 1.938 4.043 1.00 0.21 O ATOM 38 CB ILE A 3 1.957 4.833 4.629 1.00 70.34 C ATOM 39 CG1 ILE A 3 1.193 4.953 3.296 1.00 53.30 C ATOM 40 CG2 ILE A 3 3.465 4.936 4.409 1.00 31.43 C ATOM 41 CD1 ILE A 3 1.441 6.256 2.560 1.00 72.05 C ATOM 0 HA ILE A 3 0.551 3.573 5.672 1.00 10.02 H new ATOM 0 HB ILE A 3 1.652 5.665 5.263 1.00 70.34 H new ATOM 0 HG12 ILE A 3 1.477 4.122 2.650 1.00 53.30 H new ATOM 0 HG13 ILE A 3 0.125 4.855 3.491 1.00 53.30 H new ATOM 0 HG21 ILE A 3 3.695 5.869 3.895 1.00 31.43 H new ATOM 0 HG22 ILE A 3 3.975 4.917 5.372 1.00 31.43 H new ATOM 0 HG23 ILE A 3 3.803 4.095 3.803 1.00 31.43 H new ATOM 0 HD11 ILE A 3 0.869 6.265 1.632 1.00 72.05 H new ATOM 0 HD12 ILE A 3 1.130 7.092 3.186 1.00 72.05 H new ATOM 0 HD13 ILE A 3 2.503 6.349 2.332 1.00 72.05 H new ATOM 53 N VAL A 4 0.636 1.692 4.031 1.00 60.04 N ATOM 54 CA VAL A 4 0.652 0.463 3.225 1.00 74.02 C ATOM 55 C VAL A 4 0.118 0.699 1.800 1.00 60.31 C ATOM 56 O VAL A 4 -0.995 1.193 1.621 1.00 61.12 O ATOM 57 CB VAL A 4 -0.195 -0.652 3.899 1.00 73.01 C ATOM 58 CG1 VAL A 4 -0.136 -1.951 3.093 1.00 34.01 C ATOM 59 CG2 VAL A 4 0.258 -0.879 5.341 1.00 15.30 C ATOM 0 H VAL A 4 -0.299 2.023 4.267 1.00 60.04 H new ATOM 0 HA VAL A 4 1.694 0.149 3.160 1.00 74.02 H new ATOM 0 HB VAL A 4 -1.233 -0.321 3.919 1.00 73.01 H new ATOM 0 HG11 VAL A 4 -0.737 -2.714 3.588 1.00 34.01 H new ATOM 0 HG12 VAL A 4 -0.526 -1.775 2.090 1.00 34.01 H new ATOM 0 HG13 VAL A 4 0.897 -2.291 3.026 1.00 34.01 H new ATOM 0 HG21 VAL A 4 -0.348 -1.664 5.794 1.00 15.30 H new ATOM 0 HG22 VAL A 4 1.306 -1.179 5.350 1.00 15.30 H new ATOM 0 HG23 VAL A 4 0.140 0.044 5.909 1.00 15.30 H new ATOM 69 N ILE A 5 0.914 0.337 0.794 1.00 62.22 N ATOM 70 CA ILE A 5 0.498 0.452 -0.613 1.00 70.12 C ATOM 71 C ILE A 5 0.203 -0.933 -1.224 1.00 13.51 C ATOM 72 O ILE A 5 1.107 -1.748 -1.402 1.00 4.34 O ATOM 73 CB ILE A 5 1.586 1.160 -1.465 1.00 5.11 C ATOM 74 CG1 ILE A 5 1.942 2.528 -0.856 1.00 52.33 C ATOM 75 CG2 ILE A 5 1.122 1.319 -2.915 1.00 22.43 C ATOM 76 CD1 ILE A 5 3.059 3.249 -1.582 1.00 3.31 C ATOM 0 H ILE A 5 1.853 -0.040 0.923 1.00 62.22 H new ATOM 0 HA ILE A 5 -0.413 1.050 -0.626 1.00 70.12 H new ATOM 0 HB ILE A 5 2.481 0.538 -1.462 1.00 5.11 H new ATOM 0 HG12 ILE A 5 1.053 3.159 -0.859 1.00 52.33 H new ATOM 0 HG13 ILE A 5 2.230 2.387 0.186 1.00 52.33 H new ATOM 0 HG21 ILE A 5 1.900 1.817 -3.493 1.00 22.43 H new ATOM 0 HG22 ILE A 5 0.924 0.336 -3.344 1.00 22.43 H new ATOM 0 HG23 ILE A 5 0.211 1.917 -2.942 1.00 22.43 H new ATOM 0 HD11 ILE A 5 3.252 4.205 -1.095 1.00 3.31 H new ATOM 0 HD12 ILE A 5 3.962 2.639 -1.557 1.00 3.31 H new ATOM 0 HD13 ILE A 5 2.767 3.423 -2.618 1.00 3.31 H new ATOM 88 N VAL A 6 -1.065 -1.194 -1.533 1.00 24.14 N ATOM 89 CA VAL A 6 -1.485 -2.472 -2.122 1.00 24.35 C ATOM 90 C VAL A 6 -1.533 -2.392 -3.661 1.00 1.21 C ATOM 91 O VAL A 6 -2.282 -1.597 -4.231 1.00 21.45 O ATOM 92 CB VAL A 6 -2.877 -2.897 -1.584 1.00 52.42 C ATOM 93 CG1 VAL A 6 -3.298 -4.251 -2.156 1.00 61.52 C ATOM 94 CG2 VAL A 6 -2.874 -2.927 -0.055 1.00 24.14 C ATOM 0 H VAL A 6 -1.828 -0.534 -1.385 1.00 24.14 H new ATOM 0 HA VAL A 6 -0.745 -3.219 -1.834 1.00 24.35 H new ATOM 0 HB VAL A 6 -3.608 -2.157 -1.911 1.00 52.42 H new ATOM 0 HG11 VAL A 6 -4.277 -4.524 -1.762 1.00 61.52 H new ATOM 0 HG12 VAL A 6 -3.349 -4.187 -3.243 1.00 61.52 H new ATOM 0 HG13 VAL A 6 -2.568 -5.009 -1.871 1.00 61.52 H new ATOM 0 HG21 VAL A 6 -3.858 -3.227 0.305 1.00 24.14 H new ATOM 0 HG22 VAL A 6 -2.127 -3.640 0.293 1.00 24.14 H new ATOM 0 HG23 VAL A 6 -2.635 -1.935 0.328 1.00 24.14 H new ATOM 104 N VAL A 7 -0.733 -3.226 -4.333 1.00 23.31 N ATOM 105 CA VAL A 7 -0.632 -3.197 -5.801 1.00 71.30 C ATOM 106 C VAL A 7 -1.155 -4.498 -6.442 1.00 15.25 C ATOM 107 O VAL A 7 -0.598 -5.574 -6.226 1.00 74.25 O ATOM 108 CB VAL A 7 0.836 -2.966 -6.247 1.00 41.23 C ATOM 109 CG1 VAL A 7 0.947 -2.895 -7.770 1.00 54.04 C ATOM 110 CG2 VAL A 7 1.404 -1.700 -5.604 1.00 40.12 C ATOM 0 H VAL A 7 -0.145 -3.930 -3.887 1.00 23.31 H new ATOM 0 HA VAL A 7 -1.255 -2.370 -6.142 1.00 71.30 H new ATOM 0 HB VAL A 7 1.426 -3.818 -5.908 1.00 41.23 H new ATOM 0 HG11 VAL A 7 1.987 -2.733 -8.052 1.00 54.04 H new ATOM 0 HG12 VAL A 7 0.595 -3.831 -8.204 1.00 54.04 H new ATOM 0 HG13 VAL A 7 0.338 -2.071 -8.141 1.00 54.04 H new ATOM 0 HG21 VAL A 7 2.434 -1.557 -5.930 1.00 40.12 H new ATOM 0 HG22 VAL A 7 0.806 -0.840 -5.904 1.00 40.12 H new ATOM 0 HG23 VAL A 7 1.378 -1.800 -4.519 1.00 40.12 H new ATOM 120 N PHE A 8 -2.221 -4.387 -7.240 1.00 62.01 N ATOM 121 CA PHE A 8 -2.784 -5.545 -7.962 1.00 52.52 C ATOM 122 C PHE A 8 -2.120 -5.748 -9.339 1.00 21.04 C ATOM 123 O PHE A 8 -2.363 -6.750 -10.011 1.00 10.41 O ATOM 124 CB PHE A 8 -4.298 -5.370 -8.151 1.00 43.12 C ATOM 125 CG PHE A 8 -5.101 -5.450 -6.875 1.00 21.55 C ATOM 126 CD1 PHE A 8 -5.127 -4.387 -5.982 1.00 42.10 C ATOM 127 CD2 PHE A 8 -5.842 -6.586 -6.576 1.00 31.42 C ATOM 128 CE1 PHE A 8 -5.867 -4.460 -4.817 1.00 61.04 C ATOM 129 CE2 PHE A 8 -6.585 -6.662 -5.413 1.00 24.01 C ATOM 130 CZ PHE A 8 -6.598 -5.597 -4.534 1.00 13.45 C ATOM 0 H PHE A 8 -2.715 -3.510 -7.406 1.00 62.01 H new ATOM 0 HA PHE A 8 -2.584 -6.428 -7.355 1.00 52.52 H new ATOM 0 HB2 PHE A 8 -4.483 -4.405 -8.622 1.00 43.12 H new ATOM 0 HB3 PHE A 8 -4.656 -6.135 -8.840 1.00 43.12 H new ATOM 0 HD1 PHE A 8 -4.562 -3.493 -6.200 1.00 42.10 H new ATOM 0 HD2 PHE A 8 -5.838 -7.421 -7.261 1.00 31.42 H new ATOM 0 HE1 PHE A 8 -5.874 -3.628 -4.128 1.00 61.04 H new ATOM 0 HE2 PHE A 8 -7.154 -7.553 -5.192 1.00 24.01 H new ATOM 0 HZ PHE A 8 -7.180 -5.653 -3.626 1.00 13.45 H new ATOM 140 N SER A 9 -1.288 -4.788 -9.750 1.00 75.12 N ATOM 141 CA SER A 9 -0.605 -4.838 -11.062 1.00 51.51 C ATOM 142 C SER A 9 0.321 -6.059 -11.208 1.00 21.12 C ATOM 143 O SER A 9 0.448 -6.618 -12.293 1.00 23.43 O ATOM 144 CB SER A 9 0.211 -3.554 -11.288 1.00 34.42 C ATOM 145 OG SER A 9 1.047 -3.663 -12.430 1.00 71.31 O ATOM 0 H SER A 9 -1.065 -3.960 -9.197 1.00 75.12 H new ATOM 0 HA SER A 9 -1.388 -4.926 -11.815 1.00 51.51 H new ATOM 0 HB2 SER A 9 -0.466 -2.708 -11.411 1.00 34.42 H new ATOM 0 HB3 SER A 9 0.821 -3.349 -10.408 1.00 34.42 H new ATOM 0 HG SER A 9 1.551 -2.831 -12.547 1.00 71.31 H new ATOM 151 N THR A 10 0.970 -6.451 -10.107 1.00 74.15 N ATOM 152 CA THR A 10 1.910 -7.601 -10.068 1.00 53.25 C ATOM 153 C THR A 10 3.130 -7.441 -11.005 1.00 4.11 C ATOM 154 O THR A 10 3.970 -8.341 -11.085 1.00 63.21 O ATOM 155 CB THR A 10 1.220 -8.969 -10.366 1.00 71.23 C ATOM 156 OG1 THR A 10 0.915 -9.111 -11.765 1.00 10.44 O ATOM 157 CG2 THR A 10 -0.057 -9.134 -9.545 1.00 53.41 C ATOM 0 H THR A 10 0.865 -5.983 -9.207 1.00 74.15 H new ATOM 0 HA THR A 10 2.268 -7.602 -9.038 1.00 53.25 H new ATOM 0 HB THR A 10 1.926 -9.749 -10.082 1.00 71.23 H new ATOM 0 HG1 THR A 10 0.924 -8.229 -12.193 1.00 10.44 H new ATOM 0 HG21 THR A 10 -0.515 -10.096 -9.774 1.00 53.41 H new ATOM 0 HG22 THR A 10 0.185 -9.091 -8.483 1.00 53.41 H new ATOM 0 HG23 THR A 10 -0.754 -8.333 -9.791 1.00 53.41 H new ATOM 165 N ASP A 11 3.241 -6.305 -11.698 1.00 71.14 N ATOM 166 CA ASP A 11 4.398 -6.030 -12.559 1.00 51.44 C ATOM 167 C ASP A 11 5.480 -5.240 -11.792 1.00 33.42 C ATOM 168 O ASP A 11 5.211 -4.165 -11.243 1.00 51.55 O ATOM 169 CB ASP A 11 3.949 -5.258 -13.806 1.00 0.11 C ATOM 170 CG ASP A 11 5.092 -4.995 -14.770 1.00 20.11 C ATOM 171 OD1 ASP A 11 5.458 -5.912 -15.537 1.00 41.41 O ATOM 172 OD2 ASP A 11 5.636 -3.874 -14.766 1.00 64.43 O ATOM 0 H ASP A 11 2.545 -5.560 -11.681 1.00 71.14 H new ATOM 0 HA ASP A 11 4.834 -6.980 -12.869 1.00 51.44 H new ATOM 0 HB2 ASP A 11 3.169 -5.822 -14.317 1.00 0.11 H new ATOM 0 HB3 ASP A 11 3.508 -4.308 -13.502 1.00 0.11 H new ATOM 177 N GLU A 12 6.706 -5.770 -11.767 1.00 42.11 N ATOM 178 CA GLU A 12 7.788 -5.179 -10.966 1.00 63.01 C ATOM 179 C GLU A 12 8.271 -3.830 -11.520 1.00 22.25 C ATOM 180 O GLU A 12 8.742 -2.984 -10.757 1.00 73.42 O ATOM 181 CB GLU A 12 8.992 -6.128 -10.854 1.00 74.55 C ATOM 182 CG GLU A 12 8.671 -7.508 -10.278 1.00 34.04 C ATOM 183 CD GLU A 12 8.126 -8.490 -11.308 1.00 51.12 C ATOM 184 OE1 GLU A 12 8.087 -8.152 -12.512 1.00 51.02 O ATOM 185 OE2 GLU A 12 7.760 -9.617 -10.917 1.00 14.22 O ATOM 0 H GLU A 12 6.976 -6.604 -12.289 1.00 42.11 H new ATOM 0 HA GLU A 12 7.359 -5.011 -9.978 1.00 63.01 H new ATOM 0 HB2 GLU A 12 9.429 -6.256 -11.844 1.00 74.55 H new ATOM 0 HB3 GLU A 12 9.751 -5.657 -10.229 1.00 74.55 H new ATOM 0 HG2 GLU A 12 9.574 -7.926 -9.833 1.00 34.04 H new ATOM 0 HG3 GLU A 12 7.943 -7.396 -9.475 1.00 34.04 H new ATOM 192 N GLU A 13 8.172 -3.621 -12.834 1.00 51.12 N ATOM 193 CA GLU A 13 8.676 -2.379 -13.437 1.00 40.32 C ATOM 194 C GLU A 13 7.684 -1.225 -13.205 1.00 70.14 C ATOM 195 O GLU A 13 8.091 -0.075 -13.018 1.00 10.24 O ATOM 196 CB GLU A 13 9.018 -2.589 -14.935 1.00 34.41 C ATOM 197 CG GLU A 13 7.986 -2.094 -15.954 1.00 54.30 C ATOM 198 CD GLU A 13 7.996 -0.583 -16.143 1.00 61.45 C ATOM 199 OE1 GLU A 13 9.082 -0.014 -16.392 1.00 14.10 O ATOM 200 OE2 GLU A 13 6.920 0.044 -16.040 1.00 51.14 O ATOM 0 H GLU A 13 7.756 -4.279 -13.493 1.00 51.12 H new ATOM 0 HA GLU A 13 9.607 -2.099 -12.945 1.00 40.32 H new ATOM 0 HB2 GLU A 13 9.965 -2.090 -15.141 1.00 34.41 H new ATOM 0 HB3 GLU A 13 9.176 -3.655 -15.101 1.00 34.41 H new ATOM 0 HG2 GLU A 13 8.176 -2.574 -16.914 1.00 54.30 H new ATOM 0 HG3 GLU A 13 6.992 -2.406 -15.633 1.00 54.30 H new ATOM 207 N THR A 14 6.387 -1.534 -13.217 1.00 44.23 N ATOM 208 CA THR A 14 5.365 -0.572 -12.780 1.00 22.33 C ATOM 209 C THR A 14 5.580 -0.227 -11.304 1.00 65.13 C ATOM 210 O THR A 14 5.534 0.935 -10.906 1.00 35.11 O ATOM 211 CB THR A 14 3.924 -1.119 -12.964 1.00 53.34 C ATOM 212 OG1 THR A 14 3.682 -1.444 -14.341 1.00 70.32 O ATOM 213 CG2 THR A 14 2.880 -0.105 -12.499 1.00 15.43 C ATOM 0 H THR A 14 6.017 -2.435 -13.521 1.00 44.23 H new ATOM 0 HA THR A 14 5.470 0.316 -13.403 1.00 22.33 H new ATOM 0 HB THR A 14 3.837 -2.018 -12.353 1.00 53.34 H new ATOM 0 HG1 THR A 14 4.233 -2.212 -14.598 1.00 70.32 H new ATOM 0 HG21 THR A 14 1.882 -0.519 -12.641 1.00 15.43 H new ATOM 0 HG22 THR A 14 3.033 0.117 -11.443 1.00 15.43 H new ATOM 0 HG23 THR A 14 2.979 0.812 -13.080 1.00 15.43 H new ATOM 221 N LEU A 15 5.833 -1.261 -10.501 1.00 65.13 N ATOM 222 CA LEU A 15 6.177 -1.089 -9.086 1.00 12.41 C ATOM 223 C LEU A 15 7.451 -0.242 -8.919 1.00 24.23 C ATOM 224 O LEU A 15 7.542 0.595 -8.018 1.00 11.20 O ATOM 225 CB LEU A 15 6.370 -2.465 -8.431 1.00 2.54 C ATOM 226 CG LEU A 15 6.772 -2.443 -6.948 1.00 60.55 C ATOM 227 CD1 LEU A 15 5.697 -1.764 -6.108 1.00 54.30 C ATOM 228 CD2 LEU A 15 7.047 -3.860 -6.445 1.00 51.42 C ATOM 0 H LEU A 15 5.806 -2.233 -10.808 1.00 65.13 H new ATOM 0 HA LEU A 15 5.358 -0.562 -8.596 1.00 12.41 H new ATOM 0 HB2 LEU A 15 5.442 -3.028 -8.529 1.00 2.54 H new ATOM 0 HB3 LEU A 15 7.133 -3.009 -8.988 1.00 2.54 H new ATOM 0 HG LEU A 15 7.691 -1.864 -6.849 1.00 60.55 H new ATOM 0 HD11 LEU A 15 6.002 -1.759 -5.062 1.00 54.30 H new ATOM 0 HD12 LEU A 15 5.561 -0.738 -6.451 1.00 54.30 H new ATOM 0 HD13 LEU A 15 4.758 -2.308 -6.210 1.00 54.30 H new ATOM 0 HD21 LEU A 15 7.330 -3.824 -5.393 1.00 51.42 H new ATOM 0 HD22 LEU A 15 6.149 -4.467 -6.558 1.00 51.42 H new ATOM 0 HD23 LEU A 15 7.858 -4.301 -7.024 1.00 51.42 H new ATOM 240 N ARG A 16 8.426 -0.463 -9.804 1.00 31.11 N ATOM 241 CA ARG A 16 9.686 0.296 -9.805 1.00 45.44 C ATOM 242 C ARG A 16 9.428 1.812 -9.842 1.00 63.41 C ATOM 243 O ARG A 16 10.157 2.591 -9.223 1.00 73.11 O ATOM 244 CB ARG A 16 10.548 -0.134 -11.002 1.00 73.12 C ATOM 245 CG ARG A 16 11.847 0.649 -11.168 1.00 31.01 C ATOM 246 CD ARG A 16 12.702 0.089 -12.304 1.00 23.13 C ATOM 247 NE ARG A 16 11.956 -0.016 -13.563 1.00 0.41 N ATOM 248 CZ ARG A 16 12.389 -0.642 -14.628 1.00 62.20 C ATOM 249 NH1 ARG A 16 13.575 -1.161 -14.652 1.00 74.41 N ATOM 250 NH2 ARG A 16 11.644 -0.720 -15.682 1.00 73.13 N ATOM 0 H ARG A 16 8.368 -1.169 -10.538 1.00 31.11 H new ATOM 0 HA ARG A 16 10.220 0.077 -8.880 1.00 45.44 H new ATOM 0 HB2 ARG A 16 10.789 -1.192 -10.897 1.00 73.12 H new ATOM 0 HB3 ARG A 16 9.958 -0.030 -11.913 1.00 73.12 H new ATOM 0 HG2 ARG A 16 11.618 1.696 -11.367 1.00 31.01 H new ATOM 0 HG3 ARG A 16 12.413 0.617 -10.237 1.00 31.01 H new ATOM 0 HD2 ARG A 16 13.571 0.730 -12.452 1.00 23.13 H new ATOM 0 HD3 ARG A 16 13.076 -0.895 -12.023 1.00 23.13 H new ATOM 0 HE ARG A 16 11.039 0.428 -13.612 1.00 0.41 H new ATOM 0 HH11 ARG A 16 14.182 -1.084 -13.836 1.00 74.41 H new ATOM 0 HH12 ARG A 16 13.902 -1.647 -15.487 1.00 74.41 H new ATOM 0 HH21 ARG A 16 10.718 -0.293 -15.684 1.00 73.13 H new ATOM 0 HH22 ARG A 16 11.983 -1.208 -16.511 1.00 73.13 H new ATOM 264 N LYS A 17 8.377 2.214 -10.561 1.00 73.20 N ATOM 265 CA LYS A 17 7.960 3.621 -10.611 1.00 50.12 C ATOM 266 C LYS A 17 7.661 4.157 -9.200 1.00 23.54 C ATOM 267 O LYS A 17 8.222 5.166 -8.771 1.00 21.05 O ATOM 268 CB LYS A 17 6.714 3.778 -11.497 1.00 12.05 C ATOM 269 CG LYS A 17 6.892 3.293 -12.936 1.00 64.25 C ATOM 270 CD LYS A 17 7.962 4.091 -13.678 1.00 14.11 C ATOM 271 CE LYS A 17 8.001 3.754 -15.167 1.00 12.14 C ATOM 272 NZ LYS A 17 8.398 2.343 -15.419 1.00 15.44 N ATOM 0 H LYS A 17 7.798 1.586 -11.118 1.00 73.20 H new ATOM 0 HA LYS A 17 8.780 4.199 -11.037 1.00 50.12 H new ATOM 0 HB2 LYS A 17 5.889 3.230 -11.042 1.00 12.05 H new ATOM 0 HB3 LYS A 17 6.427 4.829 -11.515 1.00 12.05 H new ATOM 0 HG2 LYS A 17 7.164 2.237 -12.932 1.00 64.25 H new ATOM 0 HG3 LYS A 17 5.944 3.376 -13.467 1.00 64.25 H new ATOM 0 HD2 LYS A 17 7.771 5.157 -13.553 1.00 14.11 H new ATOM 0 HD3 LYS A 17 8.937 3.888 -13.235 1.00 14.11 H new ATOM 0 HE2 LYS A 17 7.019 3.936 -15.604 1.00 12.14 H new ATOM 0 HE3 LYS A 17 8.702 4.421 -15.669 1.00 12.14 H new ATOM 0 HZ1 LYS A 17 8.964 2.292 -16.290 1.00 15.44 H new ATOM 0 HZ2 LYS A 17 8.962 1.993 -14.618 1.00 15.44 H new ATOM 0 HZ3 LYS A 17 7.546 1.756 -15.525 1.00 15.44 H new ATOM 286 N PHE A 18 6.782 3.456 -8.481 1.00 71.14 N ATOM 287 CA PHE A 18 6.418 3.833 -7.109 1.00 45.41 C ATOM 288 C PHE A 18 7.651 3.854 -6.197 1.00 33.02 C ATOM 289 O PHE A 18 7.841 4.780 -5.409 1.00 24.45 O ATOM 290 CB PHE A 18 5.387 2.848 -6.541 1.00 70.33 C ATOM 291 CG PHE A 18 4.121 2.750 -7.356 1.00 73.32 C ATOM 292 CD1 PHE A 18 4.020 1.839 -8.396 1.00 61.12 C ATOM 293 CD2 PHE A 18 3.036 3.569 -7.086 1.00 32.22 C ATOM 294 CE1 PHE A 18 2.866 1.748 -9.147 1.00 72.02 C ATOM 295 CE2 PHE A 18 1.878 3.479 -7.834 1.00 74.12 C ATOM 296 CZ PHE A 18 1.796 2.570 -8.867 1.00 61.04 C ATOM 0 H PHE A 18 6.307 2.622 -8.825 1.00 71.14 H new ATOM 0 HA PHE A 18 5.988 4.834 -7.144 1.00 45.41 H new ATOM 0 HB2 PHE A 18 5.842 1.860 -6.474 1.00 70.33 H new ATOM 0 HB3 PHE A 18 5.131 3.150 -5.526 1.00 70.33 H new ATOM 0 HD1 PHE A 18 4.855 1.192 -8.621 1.00 61.12 H new ATOM 0 HD2 PHE A 18 3.097 4.286 -6.281 1.00 32.22 H new ATOM 0 HE1 PHE A 18 2.801 1.033 -9.954 1.00 72.02 H new ATOM 0 HE2 PHE A 18 1.038 4.120 -7.610 1.00 74.12 H new ATOM 0 HZ PHE A 18 0.894 2.502 -9.457 1.00 61.04 H new ATOM 306 N LYS A 19 8.484 2.822 -6.319 1.00 2.42 N ATOM 307 CA LYS A 19 9.701 2.696 -5.512 1.00 42.55 C ATOM 308 C LYS A 19 10.611 3.930 -5.656 1.00 74.31 C ATOM 309 O LYS A 19 11.091 4.480 -4.663 1.00 24.04 O ATOM 310 CB LYS A 19 10.468 1.426 -5.914 1.00 20.02 C ATOM 311 CG LYS A 19 9.674 0.135 -5.715 1.00 10.23 C ATOM 312 CD LYS A 19 10.402 -1.100 -6.261 1.00 44.12 C ATOM 313 CE LYS A 19 11.568 -1.550 -5.377 1.00 52.30 C ATOM 314 NZ LYS A 19 12.694 -0.578 -5.359 1.00 73.52 N ATOM 0 H LYS A 19 8.338 2.054 -6.974 1.00 2.42 H new ATOM 0 HA LYS A 19 9.401 2.626 -4.466 1.00 42.55 H new ATOM 0 HB2 LYS A 19 10.758 1.505 -6.962 1.00 20.02 H new ATOM 0 HB3 LYS A 19 11.388 1.369 -5.332 1.00 20.02 H new ATOM 0 HG2 LYS A 19 9.477 -0.005 -4.652 1.00 10.23 H new ATOM 0 HG3 LYS A 19 8.707 0.229 -6.209 1.00 10.23 H new ATOM 0 HD2 LYS A 19 9.691 -1.920 -6.359 1.00 44.12 H new ATOM 0 HD3 LYS A 19 10.776 -0.881 -7.261 1.00 44.12 H new ATOM 0 HE2 LYS A 19 11.208 -1.699 -4.359 1.00 52.30 H new ATOM 0 HE3 LYS A 19 11.933 -2.514 -5.730 1.00 52.30 H new ATOM 0 HZ1 LYS A 19 13.595 -1.092 -5.278 1.00 73.52 H new ATOM 0 HZ2 LYS A 19 12.689 -0.025 -6.239 1.00 73.52 H new ATOM 0 HZ3 LYS A 19 12.587 0.063 -4.547 1.00 73.52 H new ATOM 328 N ASP A 20 10.833 4.371 -6.894 1.00 13.42 N ATOM 329 CA ASP A 20 11.688 5.531 -7.145 1.00 74.01 C ATOM 330 C ASP A 20 11.059 6.823 -6.590 1.00 22.14 C ATOM 331 O ASP A 20 11.750 7.642 -5.979 1.00 4.42 O ATOM 332 CB ASP A 20 11.982 5.673 -8.639 1.00 62.41 C ATOM 333 CG ASP A 20 12.992 6.774 -8.915 1.00 14.23 C ATOM 334 OD1 ASP A 20 14.131 6.678 -8.404 1.00 73.21 O ATOM 335 OD2 ASP A 20 12.654 7.741 -9.630 1.00 62.25 O ATOM 0 H ASP A 20 10.436 3.947 -7.733 1.00 13.42 H new ATOM 0 HA ASP A 20 12.630 5.368 -6.621 1.00 74.01 H new ATOM 0 HB2 ASP A 20 12.361 4.727 -9.026 1.00 62.41 H new ATOM 0 HB3 ASP A 20 11.056 5.888 -9.173 1.00 62.41 H new ATOM 340 N ILE A 21 9.749 6.993 -6.794 1.00 62.25 N ATOM 341 CA ILE A 21 9.024 8.154 -6.254 1.00 14.21 C ATOM 342 C ILE A 21 9.164 8.238 -4.722 1.00 44.44 C ATOM 343 O ILE A 21 9.444 9.304 -4.167 1.00 0.42 O ATOM 344 CB ILE A 21 7.515 8.113 -6.631 1.00 11.24 C ATOM 345 CG1 ILE A 21 7.343 8.132 -8.161 1.00 21.24 C ATOM 346 CG2 ILE A 21 6.758 9.280 -5.987 1.00 74.54 C ATOM 347 CD1 ILE A 21 5.900 8.054 -8.621 1.00 62.23 C ATOM 0 H ILE A 21 9.168 6.346 -7.327 1.00 62.25 H new ATOM 0 HA ILE A 21 9.474 9.040 -6.702 1.00 14.21 H new ATOM 0 HB ILE A 21 7.092 7.185 -6.247 1.00 11.24 H new ATOM 0 HG12 ILE A 21 7.790 9.044 -8.555 1.00 21.24 H new ATOM 0 HG13 ILE A 21 7.896 7.295 -8.589 1.00 21.24 H new ATOM 0 HG21 ILE A 21 5.705 9.229 -6.266 1.00 74.54 H new ATOM 0 HG22 ILE A 21 6.850 9.219 -4.903 1.00 74.54 H new ATOM 0 HG23 ILE A 21 7.180 10.223 -6.334 1.00 74.54 H new ATOM 0 HD11 ILE A 21 5.864 8.073 -9.710 1.00 62.23 H new ATOM 0 HD12 ILE A 21 5.452 7.129 -8.259 1.00 62.23 H new ATOM 0 HD13 ILE A 21 5.345 8.905 -8.225 1.00 62.23 H new ATOM 359 N ILE A 22 8.982 7.103 -4.047 1.00 32.54 N ATOM 360 CA ILE A 22 9.139 7.029 -2.590 1.00 64.52 C ATOM 361 C ILE A 22 10.549 7.473 -2.156 1.00 75.24 C ATOM 362 O ILE A 22 10.706 8.254 -1.212 1.00 14.14 O ATOM 363 CB ILE A 22 8.862 5.590 -2.075 1.00 22.41 C ATOM 364 CG1 ILE A 22 7.401 5.190 -2.364 1.00 62.14 C ATOM 365 CG2 ILE A 22 9.171 5.475 -0.583 1.00 74.13 C ATOM 366 CD1 ILE A 22 7.064 3.765 -1.970 1.00 5.53 C ATOM 0 H ILE A 22 8.725 6.219 -4.485 1.00 32.54 H new ATOM 0 HA ILE A 22 8.410 7.710 -2.150 1.00 64.52 H new ATOM 0 HB ILE A 22 9.520 4.903 -2.606 1.00 22.41 H new ATOM 0 HG12 ILE A 22 6.736 5.870 -1.832 1.00 62.14 H new ATOM 0 HG13 ILE A 22 7.203 5.319 -3.428 1.00 62.14 H new ATOM 0 HG21 ILE A 22 8.969 4.458 -0.247 1.00 74.13 H new ATOM 0 HG22 ILE A 22 10.221 5.713 -0.409 1.00 74.13 H new ATOM 0 HG23 ILE A 22 8.544 6.172 -0.027 1.00 74.13 H new ATOM 0 HD11 ILE A 22 6.019 3.560 -2.205 1.00 5.53 H new ATOM 0 HD12 ILE A 22 7.702 3.074 -2.521 1.00 5.53 H new ATOM 0 HD13 ILE A 22 7.228 3.635 -0.900 1.00 5.53 H new ATOM 378 N LYS A 23 11.572 6.985 -2.863 1.00 53.43 N ATOM 379 CA LYS A 23 12.959 7.387 -2.593 1.00 73.10 C ATOM 380 C LYS A 23 13.159 8.894 -2.821 1.00 15.51 C ATOM 381 O LYS A 23 13.787 9.575 -2.007 1.00 74.03 O ATOM 382 CB LYS A 23 13.940 6.596 -3.469 1.00 2.30 C ATOM 383 CG LYS A 23 13.911 5.092 -3.234 1.00 13.01 C ATOM 384 CD LYS A 23 15.002 4.357 -4.017 1.00 24.13 C ATOM 385 CE LYS A 23 14.860 4.511 -5.535 1.00 45.53 C ATOM 386 NZ LYS A 23 15.355 5.828 -6.029 1.00 43.12 N ATOM 0 H LYS A 23 11.469 6.314 -3.624 1.00 53.43 H new ATOM 0 HA LYS A 23 13.162 7.165 -1.545 1.00 73.10 H new ATOM 0 HB2 LYS A 23 13.715 6.793 -4.517 1.00 2.30 H new ATOM 0 HB3 LYS A 23 14.950 6.962 -3.286 1.00 2.30 H new ATOM 0 HG2 LYS A 23 14.034 4.891 -2.170 1.00 13.01 H new ATOM 0 HG3 LYS A 23 12.935 4.701 -3.522 1.00 13.01 H new ATOM 0 HD2 LYS A 23 15.978 4.733 -3.709 1.00 24.13 H new ATOM 0 HD3 LYS A 23 14.974 3.298 -3.761 1.00 24.13 H new ATOM 0 HE2 LYS A 23 15.411 3.711 -6.030 1.00 45.53 H new ATOM 0 HE3 LYS A 23 13.812 4.395 -5.811 1.00 45.53 H new ATOM 0 HZ1 LYS A 23 14.578 6.338 -6.496 1.00 43.12 H new ATOM 0 HZ2 LYS A 23 15.705 6.390 -5.227 1.00 43.12 H new ATOM 0 HZ3 LYS A 23 16.127 5.676 -6.709 1.00 43.12 H new ATOM 400 N LYS A 24 12.611 9.403 -3.924 1.00 53.43 N ATOM 401 CA LYS A 24 12.711 10.828 -4.269 1.00 75.11 C ATOM 402 C LYS A 24 12.130 11.721 -3.160 1.00 31.03 C ATOM 403 O LYS A 24 12.652 12.801 -2.874 1.00 24.23 O ATOM 404 CB LYS A 24 11.990 11.094 -5.601 1.00 63.45 C ATOM 405 CG LYS A 24 12.033 12.553 -6.058 1.00 32.42 C ATOM 406 CD LYS A 24 11.356 12.746 -7.414 1.00 12.10 C ATOM 407 CE LYS A 24 12.016 11.907 -8.503 1.00 51.33 C ATOM 408 NZ LYS A 24 11.384 12.119 -9.835 1.00 72.41 N ATOM 0 H LYS A 24 12.088 8.848 -4.601 1.00 53.43 H new ATOM 0 HA LYS A 24 13.767 11.077 -4.373 1.00 75.11 H new ATOM 0 HB2 LYS A 24 12.438 10.470 -6.374 1.00 63.45 H new ATOM 0 HB3 LYS A 24 10.949 10.786 -5.505 1.00 63.45 H new ATOM 0 HG2 LYS A 24 11.542 13.181 -5.315 1.00 32.42 H new ATOM 0 HG3 LYS A 24 13.070 12.884 -6.120 1.00 32.42 H new ATOM 0 HD2 LYS A 24 10.303 12.476 -7.336 1.00 12.10 H new ATOM 0 HD3 LYS A 24 11.395 13.799 -7.693 1.00 12.10 H new ATOM 0 HE2 LYS A 24 13.075 12.158 -8.561 1.00 51.33 H new ATOM 0 HE3 LYS A 24 11.952 10.852 -8.236 1.00 51.33 H new ATOM 0 HZ1 LYS A 24 11.864 11.529 -10.545 1.00 72.41 H new ATOM 0 HZ2 LYS A 24 10.379 11.856 -9.788 1.00 72.41 H new ATOM 0 HZ3 LYS A 24 11.467 13.120 -10.103 1.00 72.41 H new ATOM 422 N ASN A 25 11.056 11.255 -2.530 1.00 12.00 N ATOM 423 CA ASN A 25 10.414 11.996 -1.437 1.00 2.14 C ATOM 424 C ASN A 25 11.230 11.932 -0.130 1.00 55.10 C ATOM 425 O ASN A 25 10.888 12.589 0.854 1.00 12.45 O ATOM 426 CB ASN A 25 9.002 11.453 -1.201 1.00 1.31 C ATOM 427 CG ASN A 25 8.106 11.639 -2.414 1.00 12.42 C ATOM 428 OD1 ASN A 25 8.255 12.593 -3.169 1.00 5.42 O ATOM 429 ND2 ASN A 25 7.173 10.732 -2.616 1.00 1.05 N ATOM 0 H ASN A 25 10.608 10.367 -2.754 1.00 12.00 H new ATOM 0 HA ASN A 25 10.363 13.043 -1.736 1.00 2.14 H new ATOM 0 HB2 ASN A 25 9.059 10.393 -0.952 1.00 1.31 H new ATOM 0 HB3 ASN A 25 8.559 11.958 -0.343 1.00 1.31 H new ATOM 0 HD21 ASN A 25 6.549 10.812 -3.419 1.00 1.05 H new ATOM 0 HD22 ASN A 25 7.074 9.949 -1.969 1.00 1.05 H new ATOM 436 N GLY A 26 12.299 11.134 -0.122 1.00 25.43 N ATOM 437 CA GLY A 26 13.172 11.044 1.051 1.00 50.31 C ATOM 438 C GLY A 26 12.935 9.799 1.906 1.00 74.54 C ATOM 439 O GLY A 26 13.501 9.671 2.992 1.00 64.14 O ATOM 0 H GLY A 26 12.580 10.546 -0.906 1.00 25.43 H new ATOM 0 HA2 GLY A 26 14.211 11.053 0.720 1.00 50.31 H new ATOM 0 HA3 GLY A 26 13.026 11.930 1.669 1.00 50.31 H new ATOM 443 N PHE A 27 12.103 8.877 1.419 1.00 53.32 N ATOM 444 CA PHE A 27 11.792 7.640 2.154 1.00 24.13 C ATOM 445 C PHE A 27 12.422 6.409 1.482 1.00 54.31 C ATOM 446 O PHE A 27 13.016 6.505 0.408 1.00 1.34 O ATOM 447 CB PHE A 27 10.270 7.453 2.250 1.00 71.43 C ATOM 448 CG PHE A 27 9.569 8.551 3.010 1.00 41.30 C ATOM 449 CD1 PHE A 27 9.211 9.734 2.380 1.00 40.44 C ATOM 450 CD2 PHE A 27 9.274 8.401 4.358 1.00 51.22 C ATOM 451 CE1 PHE A 27 8.574 10.743 3.078 1.00 13.44 C ATOM 452 CE2 PHE A 27 8.639 9.407 5.059 1.00 20.45 C ATOM 453 CZ PHE A 27 8.287 10.577 4.420 1.00 0.20 C ATOM 0 H PHE A 27 11.630 8.959 0.519 1.00 53.32 H new ATOM 0 HA PHE A 27 12.215 7.734 3.154 1.00 24.13 H new ATOM 0 HB2 PHE A 27 9.856 7.399 1.243 1.00 71.43 H new ATOM 0 HB3 PHE A 27 10.060 6.499 2.733 1.00 71.43 H new ATOM 0 HD1 PHE A 27 9.433 9.868 1.332 1.00 40.44 H new ATOM 0 HD2 PHE A 27 9.544 7.486 4.865 1.00 51.22 H new ATOM 0 HE1 PHE A 27 8.301 11.659 2.576 1.00 13.44 H new ATOM 0 HE2 PHE A 27 8.418 9.277 6.108 1.00 20.45 H new ATOM 0 HZ PHE A 27 7.788 11.363 4.967 1.00 0.20 H new ATOM 463 N LYS A 28 12.312 5.257 2.142 1.00 42.21 N ATOM 464 CA LYS A 28 12.760 3.977 1.572 1.00 4.35 C ATOM 465 C LYS A 28 11.554 3.071 1.274 1.00 11.12 C ATOM 466 O LYS A 28 10.427 3.375 1.675 1.00 44.01 O ATOM 467 CB LYS A 28 13.739 3.258 2.522 1.00 23.41 C ATOM 468 CG LYS A 28 15.114 3.920 2.633 1.00 5.41 C ATOM 469 CD LYS A 28 15.058 5.264 3.359 1.00 5.24 C ATOM 470 CE LYS A 28 16.410 5.964 3.371 1.00 14.55 C ATOM 471 NZ LYS A 28 17.443 5.176 4.090 1.00 14.23 N ATOM 0 H LYS A 28 11.915 5.179 3.078 1.00 42.21 H new ATOM 0 HA LYS A 28 13.283 4.190 0.640 1.00 4.35 H new ATOM 0 HB2 LYS A 28 13.292 3.208 3.515 1.00 23.41 H new ATOM 0 HB3 LYS A 28 13.870 2.231 2.180 1.00 23.41 H new ATOM 0 HG2 LYS A 28 15.794 3.252 3.163 1.00 5.41 H new ATOM 0 HG3 LYS A 28 15.525 4.067 1.634 1.00 5.41 H new ATOM 0 HD2 LYS A 28 14.322 5.906 2.876 1.00 5.24 H new ATOM 0 HD3 LYS A 28 14.721 5.108 4.384 1.00 5.24 H new ATOM 0 HE2 LYS A 28 16.736 6.138 2.346 1.00 14.55 H new ATOM 0 HE3 LYS A 28 16.307 6.941 3.843 1.00 14.55 H new ATOM 0 HZ1 LYS A 28 18.312 5.740 4.176 1.00 14.23 H new ATOM 0 HZ2 LYS A 28 17.094 4.930 5.038 1.00 14.23 H new ATOM 0 HZ3 LYS A 28 17.647 4.305 3.559 1.00 14.23 H new ATOM 485 N VAL A 29 11.791 1.954 0.585 1.00 75.24 N ATOM 486 CA VAL A 29 10.706 1.044 0.186 1.00 23.32 C ATOM 487 C VAL A 29 10.865 -0.363 0.791 1.00 54.44 C ATOM 488 O VAL A 29 11.977 -0.879 0.918 1.00 64.34 O ATOM 489 CB VAL A 29 10.637 0.918 -1.357 1.00 73.20 C ATOM 490 CG1 VAL A 29 9.446 0.060 -1.789 1.00 74.22 C ATOM 491 CG2 VAL A 29 10.581 2.299 -2.006 1.00 34.51 C ATOM 0 H VAL A 29 12.720 1.654 0.290 1.00 75.24 H new ATOM 0 HA VAL A 29 9.784 1.480 0.570 1.00 23.32 H new ATOM 0 HB VAL A 29 11.544 0.418 -1.696 1.00 73.20 H new ATOM 0 HG11 VAL A 29 9.424 -0.010 -2.877 1.00 74.22 H new ATOM 0 HG12 VAL A 29 9.543 -0.938 -1.363 1.00 74.22 H new ATOM 0 HG13 VAL A 29 8.521 0.517 -1.436 1.00 74.22 H new ATOM 0 HG21 VAL A 29 10.533 2.190 -3.089 1.00 34.51 H new ATOM 0 HG22 VAL A 29 9.696 2.830 -1.655 1.00 34.51 H new ATOM 0 HG23 VAL A 29 11.474 2.864 -1.737 1.00 34.51 H new ATOM 501 N ARG A 30 9.737 -0.972 1.172 1.00 51.41 N ATOM 502 CA ARG A 30 9.699 -2.372 1.627 1.00 52.41 C ATOM 503 C ARG A 30 8.643 -3.163 0.842 1.00 1.21 C ATOM 504 O ARG A 30 7.455 -3.113 1.159 1.00 44.35 O ATOM 505 CB ARG A 30 9.385 -2.448 3.130 1.00 45.30 C ATOM 506 CG ARG A 30 10.451 -1.822 4.021 1.00 35.14 C ATOM 507 CD ARG A 30 11.787 -2.550 3.913 1.00 62.51 C ATOM 508 NE ARG A 30 12.801 -1.963 4.788 1.00 51.15 N ATOM 509 CZ ARG A 30 13.833 -2.616 5.253 1.00 20.33 C ATOM 510 NH1 ARG A 30 14.021 -3.856 4.936 1.00 44.34 N ATOM 511 NH2 ARG A 30 14.686 -2.020 6.024 1.00 21.45 N ATOM 0 H ARG A 30 8.826 -0.513 1.175 1.00 51.41 H new ATOM 0 HA ARG A 30 10.681 -2.810 1.449 1.00 52.41 H new ATOM 0 HB2 ARG A 30 8.433 -1.951 3.317 1.00 45.30 H new ATOM 0 HB3 ARG A 30 9.260 -3.494 3.412 1.00 45.30 H new ATOM 0 HG2 ARG A 30 10.585 -0.776 3.745 1.00 35.14 H new ATOM 0 HG3 ARG A 30 10.112 -1.838 5.057 1.00 35.14 H new ATOM 0 HD2 ARG A 30 11.650 -3.600 4.170 1.00 62.51 H new ATOM 0 HD3 ARG A 30 12.136 -2.518 2.881 1.00 62.51 H new ATOM 0 HE ARG A 30 12.696 -0.983 5.052 1.00 51.15 H new ATOM 0 HH11 ARG A 30 13.361 -4.330 4.319 1.00 44.34 H new ATOM 0 HH12 ARG A 30 14.829 -4.359 5.303 1.00 44.34 H new ATOM 0 HH21 ARG A 30 14.553 -1.039 6.269 1.00 21.45 H new ATOM 0 HH22 ARG A 30 15.491 -2.532 6.386 1.00 21.45 H new ATOM 525 N THR A 31 9.075 -3.875 -0.194 1.00 71.12 N ATOM 526 CA THR A 31 8.155 -4.647 -1.046 1.00 3.43 C ATOM 527 C THR A 31 7.818 -6.019 -0.439 1.00 41.25 C ATOM 528 O THR A 31 8.665 -6.665 0.183 1.00 44.52 O ATOM 529 CB THR A 31 8.736 -4.849 -2.467 1.00 72.23 C ATOM 530 OG1 THR A 31 10.054 -5.412 -2.391 1.00 32.00 O ATOM 531 CG2 THR A 31 8.788 -3.527 -3.231 1.00 0.44 C ATOM 0 H THR A 31 10.055 -3.938 -0.470 1.00 71.12 H new ATOM 0 HA THR A 31 7.238 -4.062 -1.111 1.00 3.43 H new ATOM 0 HB THR A 31 8.080 -5.535 -3.002 1.00 72.23 H new ATOM 0 HG1 THR A 31 10.409 -5.536 -3.296 1.00 32.00 H new ATOM 0 HG21 THR A 31 9.200 -3.698 -4.226 1.00 0.44 H new ATOM 0 HG22 THR A 31 7.781 -3.119 -3.320 1.00 0.44 H new ATOM 0 HG23 THR A 31 9.420 -2.820 -2.693 1.00 0.44 H new ATOM 539 N VAL A 32 6.567 -6.449 -0.615 1.00 65.52 N ATOM 540 CA VAL A 32 6.091 -7.734 -0.079 1.00 42.21 C ATOM 541 C VAL A 32 5.304 -8.527 -1.138 1.00 23.32 C ATOM 542 O VAL A 32 4.502 -7.959 -1.878 1.00 3.32 O ATOM 543 CB VAL A 32 5.177 -7.515 1.157 1.00 25.41 C ATOM 544 CG1 VAL A 32 4.628 -8.843 1.674 1.00 50.53 C ATOM 545 CG2 VAL A 32 5.920 -6.767 2.266 1.00 11.43 C ATOM 0 H VAL A 32 5.858 -5.925 -1.128 1.00 65.52 H new ATOM 0 HA VAL A 32 6.974 -8.302 0.213 1.00 42.21 H new ATOM 0 HB VAL A 32 4.334 -6.900 0.842 1.00 25.41 H new ATOM 0 HG11 VAL A 32 3.991 -8.661 2.540 1.00 50.53 H new ATOM 0 HG12 VAL A 32 4.045 -9.326 0.890 1.00 50.53 H new ATOM 0 HG13 VAL A 32 5.455 -9.491 1.962 1.00 50.53 H new ATOM 0 HG21 VAL A 32 5.256 -6.628 3.119 1.00 11.43 H new ATOM 0 HG22 VAL A 32 6.791 -7.345 2.575 1.00 11.43 H new ATOM 0 HG23 VAL A 32 6.243 -5.794 1.895 1.00 11.43 H new ATOM 555 N ARG A 33 5.542 -9.837 -1.211 1.00 11.50 N ATOM 556 CA ARG A 33 4.782 -10.720 -2.110 1.00 51.13 C ATOM 557 C ARG A 33 4.105 -11.869 -1.335 1.00 65.11 C ATOM 558 O ARG A 33 3.180 -12.510 -1.841 1.00 42.21 O ATOM 559 CB ARG A 33 5.707 -11.289 -3.201 1.00 65.22 C ATOM 560 CG ARG A 33 6.907 -12.047 -2.646 1.00 30.32 C ATOM 561 CD ARG A 33 7.828 -12.577 -3.735 1.00 72.20 C ATOM 562 NE ARG A 33 9.009 -13.221 -3.164 1.00 35.33 N ATOM 563 CZ ARG A 33 9.871 -13.927 -3.844 1.00 63.05 C ATOM 564 NH1 ARG A 33 9.716 -14.129 -5.116 1.00 15.10 N ATOM 565 NH2 ARG A 33 10.891 -14.436 -3.237 1.00 70.45 N ATOM 0 H ARG A 33 6.255 -10.315 -0.660 1.00 11.50 H new ATOM 0 HA ARG A 33 3.998 -10.125 -2.578 1.00 51.13 H new ATOM 0 HB2 ARG A 33 5.131 -11.956 -3.843 1.00 65.22 H new ATOM 0 HB3 ARG A 33 6.062 -10.471 -3.828 1.00 65.22 H new ATOM 0 HG2 ARG A 33 7.473 -11.389 -1.987 1.00 30.32 H new ATOM 0 HG3 ARG A 33 6.555 -12.880 -2.038 1.00 30.32 H new ATOM 0 HD2 ARG A 33 7.287 -13.290 -4.357 1.00 72.20 H new ATOM 0 HD3 ARG A 33 8.136 -11.758 -4.384 1.00 72.20 H new ATOM 0 HE ARG A 33 9.171 -13.111 -2.163 1.00 35.33 H new ATOM 0 HH11 ARG A 33 8.910 -13.733 -5.601 1.00 15.10 H new ATOM 0 HH12 ARG A 33 10.400 -14.683 -5.631 1.00 15.10 H new ATOM 0 HH21 ARG A 33 11.017 -14.285 -2.236 1.00 70.45 H new ATOM 0 HH22 ARG A 33 11.571 -14.989 -3.758 1.00 70.45 H new ATOM 579 N SER A 34 4.566 -12.122 -0.106 1.00 4.14 N ATOM 580 CA SER A 34 4.022 -13.210 0.731 1.00 60.44 C ATOM 581 C SER A 34 3.818 -12.754 2.191 1.00 21.34 C ATOM 582 O SER A 34 4.495 -11.835 2.661 1.00 20.12 O ATOM 583 CB SER A 34 4.955 -14.434 0.690 1.00 41.35 C ATOM 584 OG SER A 34 6.218 -14.149 1.272 1.00 53.31 O ATOM 0 H SER A 34 5.316 -11.590 0.337 1.00 4.14 H new ATOM 0 HA SER A 34 3.049 -13.484 0.324 1.00 60.44 H new ATOM 0 HB2 SER A 34 4.489 -15.265 1.220 1.00 41.35 H new ATOM 0 HB3 SER A 34 5.094 -14.752 -0.343 1.00 41.35 H new ATOM 0 HG SER A 34 6.544 -13.287 0.940 1.00 53.31 H new ATOM 590 N PRO A 35 2.882 -13.403 2.932 1.00 51.02 N ATOM 591 CA PRO A 35 2.509 -13.009 4.313 1.00 2.14 C ATOM 592 C PRO A 35 3.707 -12.786 5.257 1.00 72.00 C ATOM 593 O PRO A 35 3.802 -11.745 5.912 1.00 43.21 O ATOM 594 CB PRO A 35 1.638 -14.187 4.808 1.00 34.11 C ATOM 595 CG PRO A 35 1.797 -15.268 3.785 1.00 21.53 C ATOM 596 CD PRO A 35 2.097 -14.568 2.489 1.00 44.13 C ATOM 0 HA PRO A 35 2.001 -12.045 4.311 1.00 2.14 H new ATOM 0 HB2 PRO A 35 1.963 -14.528 5.791 1.00 34.11 H new ATOM 0 HB3 PRO A 35 0.594 -13.889 4.903 1.00 34.11 H new ATOM 0 HG2 PRO A 35 2.604 -15.948 4.058 1.00 21.53 H new ATOM 0 HG3 PRO A 35 0.889 -15.866 3.705 1.00 21.53 H new ATOM 0 HD2 PRO A 35 2.662 -15.202 1.806 1.00 44.13 H new ATOM 0 HD3 PRO A 35 1.187 -14.270 1.968 1.00 44.13 H new ATOM 604 N GLN A 36 4.615 -13.762 5.323 1.00 31.13 N ATOM 605 CA GLN A 36 5.769 -13.688 6.236 1.00 24.35 C ATOM 606 C GLN A 36 6.589 -12.399 6.042 1.00 23.32 C ATOM 607 O GLN A 36 7.016 -11.774 7.014 1.00 61.42 O ATOM 608 CB GLN A 36 6.673 -14.920 6.063 1.00 73.23 C ATOM 609 CG GLN A 36 7.138 -15.157 4.628 1.00 10.32 C ATOM 610 CD GLN A 36 8.057 -16.361 4.501 1.00 4.33 C ATOM 611 OE1 GLN A 36 9.277 -16.242 4.568 1.00 41.11 O ATOM 612 NE2 GLN A 36 7.479 -17.531 4.327 1.00 44.02 N ATOM 0 H GLN A 36 4.578 -14.612 4.760 1.00 31.13 H new ATOM 0 HA GLN A 36 5.371 -13.671 7.250 1.00 24.35 H new ATOM 0 HB2 GLN A 36 7.548 -14.808 6.703 1.00 73.23 H new ATOM 0 HB3 GLN A 36 6.136 -15.803 6.410 1.00 73.23 H new ATOM 0 HG2 GLN A 36 6.268 -15.300 3.987 1.00 10.32 H new ATOM 0 HG3 GLN A 36 7.657 -14.269 4.267 1.00 10.32 H new ATOM 0 HE21 GLN A 36 6.462 -17.595 4.276 1.00 44.02 H new ATOM 0 HE22 GLN A 36 8.048 -18.373 4.244 1.00 44.02 H new ATOM 621 N GLU A 37 6.801 -12.002 4.788 1.00 44.03 N ATOM 622 CA GLU A 37 7.552 -10.778 4.486 1.00 62.23 C ATOM 623 C GLU A 37 6.845 -9.541 5.051 1.00 44.32 C ATOM 624 O GLU A 37 7.488 -8.637 5.577 1.00 35.53 O ATOM 625 CB GLU A 37 7.724 -10.615 2.975 1.00 23.44 C ATOM 626 CG GLU A 37 8.483 -11.752 2.305 1.00 74.42 C ATOM 627 CD GLU A 37 8.419 -11.661 0.793 1.00 74.33 C ATOM 628 OE1 GLU A 37 7.294 -11.639 0.262 1.00 20.23 O ATOM 629 OE2 GLU A 37 9.478 -11.614 0.134 1.00 43.44 O ATOM 0 H GLU A 37 6.466 -12.505 3.966 1.00 44.03 H new ATOM 0 HA GLU A 37 8.531 -10.868 4.956 1.00 62.23 H new ATOM 0 HB2 GLU A 37 6.739 -10.531 2.516 1.00 23.44 H new ATOM 0 HB3 GLU A 37 8.248 -9.679 2.779 1.00 23.44 H new ATOM 0 HG2 GLU A 37 9.524 -11.732 2.626 1.00 74.42 H new ATOM 0 HG3 GLU A 37 8.068 -12.706 2.629 1.00 74.42 H new ATOM 636 N LEU A 38 5.518 -9.508 4.932 1.00 34.21 N ATOM 637 CA LEU A 38 4.718 -8.398 5.467 1.00 5.12 C ATOM 638 C LEU A 38 4.944 -8.242 6.974 1.00 1.32 C ATOM 639 O LEU A 38 5.191 -7.139 7.467 1.00 34.31 O ATOM 640 CB LEU A 38 3.226 -8.628 5.183 1.00 24.42 C ATOM 641 CG LEU A 38 2.274 -7.537 5.714 1.00 24.23 C ATOM 642 CD1 LEU A 38 2.591 -6.181 5.087 1.00 24.43 C ATOM 643 CD2 LEU A 38 0.818 -7.922 5.459 1.00 25.01 C ATOM 0 H LEU A 38 4.971 -10.235 4.471 1.00 34.21 H new ATOM 0 HA LEU A 38 5.037 -7.481 4.971 1.00 5.12 H new ATOM 0 HB2 LEU A 38 3.088 -8.713 4.105 1.00 24.42 H new ATOM 0 HB3 LEU A 38 2.934 -9.584 5.618 1.00 24.42 H new ATOM 0 HG LEU A 38 2.424 -7.453 6.790 1.00 24.23 H new ATOM 0 HD11 LEU A 38 1.905 -5.430 5.479 1.00 24.43 H new ATOM 0 HD12 LEU A 38 3.615 -5.899 5.329 1.00 24.43 H new ATOM 0 HD13 LEU A 38 2.479 -6.245 4.005 1.00 24.43 H new ATOM 0 HD21 LEU A 38 0.162 -7.139 5.841 1.00 25.01 H new ATOM 0 HD22 LEU A 38 0.655 -8.041 4.388 1.00 25.01 H new ATOM 0 HD23 LEU A 38 0.596 -8.861 5.966 1.00 25.01 H new ATOM 655 N LYS A 39 4.871 -9.361 7.692 1.00 70.42 N ATOM 656 CA LYS A 39 5.107 -9.380 9.138 1.00 74.14 C ATOM 657 C LYS A 39 6.484 -8.791 9.491 1.00 1.13 C ATOM 658 O LYS A 39 6.577 -7.761 10.163 1.00 71.12 O ATOM 659 CB LYS A 39 5.001 -10.821 9.664 1.00 55.14 C ATOM 660 CG LYS A 39 5.319 -10.965 11.150 1.00 33.12 C ATOM 661 CD LYS A 39 5.297 -12.425 11.597 1.00 73.04 C ATOM 662 CE LYS A 39 5.695 -12.577 13.060 1.00 2.55 C ATOM 663 NZ LYS A 39 5.776 -14.005 13.464 1.00 44.20 N ATOM 0 H LYS A 39 4.649 -10.274 7.294 1.00 70.42 H new ATOM 0 HA LYS A 39 4.346 -8.761 9.613 1.00 74.14 H new ATOM 0 HB2 LYS A 39 3.992 -11.190 9.482 1.00 55.14 H new ATOM 0 HB3 LYS A 39 5.680 -11.456 9.095 1.00 55.14 H new ATOM 0 HG2 LYS A 39 6.300 -10.537 11.355 1.00 33.12 H new ATOM 0 HG3 LYS A 39 4.595 -10.396 11.733 1.00 33.12 H new ATOM 0 HD2 LYS A 39 4.298 -12.835 11.448 1.00 73.04 H new ATOM 0 HD3 LYS A 39 5.977 -13.006 10.974 1.00 73.04 H new ATOM 0 HE2 LYS A 39 6.659 -12.097 13.226 1.00 2.55 H new ATOM 0 HE3 LYS A 39 4.970 -12.062 13.690 1.00 2.55 H new ATOM 0 HZ1 LYS A 39 6.049 -14.067 14.465 1.00 44.20 H new ATOM 0 HZ2 LYS A 39 4.849 -14.457 13.329 1.00 44.20 H new ATOM 0 HZ3 LYS A 39 6.486 -14.491 12.880 1.00 44.20 H new ATOM 677 N ASP A 40 7.547 -9.441 9.015 1.00 65.32 N ATOM 678 CA ASP A 40 8.919 -9.004 9.294 1.00 22.33 C ATOM 679 C ASP A 40 9.173 -7.548 8.856 1.00 63.01 C ATOM 680 O ASP A 40 9.807 -6.782 9.583 1.00 20.10 O ATOM 681 CB ASP A 40 9.915 -9.948 8.616 1.00 51.25 C ATOM 682 CG ASP A 40 9.947 -11.318 9.270 1.00 41.23 C ATOM 683 OD1 ASP A 40 9.136 -12.189 8.900 1.00 14.33 O ATOM 684 OD2 ASP A 40 10.788 -11.532 10.171 1.00 43.12 O ATOM 0 H ASP A 40 7.485 -10.276 8.432 1.00 65.32 H new ATOM 0 HA ASP A 40 9.060 -9.039 10.374 1.00 22.33 H new ATOM 0 HB2 ASP A 40 9.651 -10.056 7.564 1.00 51.25 H new ATOM 0 HB3 ASP A 40 10.911 -9.508 8.651 1.00 51.25 H new ATOM 689 N SER A 41 8.670 -7.170 7.678 1.00 71.53 N ATOM 690 CA SER A 41 8.840 -5.797 7.169 1.00 63.51 C ATOM 691 C SER A 41 8.295 -4.758 8.157 1.00 61.34 C ATOM 692 O SER A 41 8.978 -3.793 8.491 1.00 71.15 O ATOM 693 CB SER A 41 8.150 -5.620 5.807 1.00 60.13 C ATOM 694 OG SER A 41 8.761 -6.423 4.806 1.00 61.13 O ATOM 0 H SER A 41 8.144 -7.787 7.059 1.00 71.53 H new ATOM 0 HA SER A 41 9.911 -5.635 7.049 1.00 63.51 H new ATOM 0 HB2 SER A 41 7.096 -5.885 5.895 1.00 60.13 H new ATOM 0 HB3 SER A 41 8.192 -4.572 5.510 1.00 60.13 H new ATOM 0 HG SER A 41 8.619 -7.370 5.014 1.00 61.13 H new ATOM 863 N ALA A 51 10.640 5.996 8.848 1.00 61.24 N ATOM 864 CA ALA A 51 10.555 6.768 7.602 1.00 61.43 C ATOM 865 C ALA A 51 10.736 5.868 6.364 1.00 22.12 C ATOM 866 O ALA A 51 11.614 6.098 5.523 1.00 44.51 O ATOM 867 CB ALA A 51 11.592 7.887 7.609 1.00 34.14 C ATOM 0 HA ALA A 51 9.559 7.206 7.544 1.00 61.43 H new ATOM 0 HB1 ALA A 51 11.521 8.454 6.681 1.00 34.14 H new ATOM 0 HB2 ALA A 51 11.406 8.550 8.454 1.00 34.14 H new ATOM 0 HB3 ALA A 51 12.590 7.458 7.697 1.00 34.14 H new ATOM 873 N THR A 52 9.905 4.836 6.265 1.00 51.11 N ATOM 874 CA THR A 52 9.951 3.889 5.138 1.00 53.12 C ATOM 875 C THR A 52 8.552 3.347 4.810 1.00 43.33 C ATOM 876 O THR A 52 7.795 2.979 5.707 1.00 61.15 O ATOM 877 CB THR A 52 10.911 2.707 5.438 1.00 73.44 C ATOM 878 OG1 THR A 52 12.263 3.183 5.531 1.00 61.15 O ATOM 879 CG2 THR A 52 10.831 1.626 4.365 1.00 4.01 C ATOM 0 H THR A 52 9.183 4.626 6.954 1.00 51.11 H new ATOM 0 HA THR A 52 10.327 4.436 4.273 1.00 53.12 H new ATOM 0 HB THR A 52 10.603 2.269 6.387 1.00 73.44 H new ATOM 0 HG1 THR A 52 12.862 2.431 5.722 1.00 61.15 H new ATOM 0 HG21 THR A 52 11.518 0.817 4.612 1.00 4.01 H new ATOM 0 HG22 THR A 52 9.814 1.237 4.316 1.00 4.01 H new ATOM 0 HG23 THR A 52 11.104 2.051 3.399 1.00 4.01 H new ATOM 887 N ILE A 53 8.213 3.294 3.523 1.00 24.30 N ATOM 888 CA ILE A 53 6.881 2.851 3.088 1.00 33.53 C ATOM 889 C ILE A 53 6.873 1.361 2.699 1.00 63.12 C ATOM 890 O ILE A 53 7.796 0.871 2.043 1.00 62.35 O ATOM 891 CB ILE A 53 6.380 3.696 1.887 1.00 61.25 C ATOM 892 CG1 ILE A 53 6.363 5.192 2.259 1.00 51.42 C ATOM 893 CG2 ILE A 53 4.992 3.232 1.435 1.00 54.31 C ATOM 894 CD1 ILE A 53 5.879 6.103 1.146 1.00 11.43 C ATOM 0 H ILE A 53 8.839 3.551 2.760 1.00 24.30 H new ATOM 0 HA ILE A 53 6.210 2.992 3.936 1.00 33.53 H new ATOM 0 HB ILE A 53 7.068 3.554 1.053 1.00 61.25 H new ATOM 0 HG12 ILE A 53 5.724 5.331 3.131 1.00 51.42 H new ATOM 0 HG13 ILE A 53 7.369 5.494 2.549 1.00 51.42 H new ATOM 0 HG21 ILE A 53 4.662 3.839 0.592 1.00 54.31 H new ATOM 0 HG22 ILE A 53 5.039 2.186 1.132 1.00 54.31 H new ATOM 0 HG23 ILE A 53 4.286 3.340 2.258 1.00 54.31 H new ATOM 0 HD11 ILE A 53 5.897 7.138 1.489 1.00 11.43 H new ATOM 0 HD12 ILE A 53 6.531 5.996 0.279 1.00 11.43 H new ATOM 0 HD13 ILE A 53 4.860 5.830 0.870 1.00 11.43 H new ATOM 906 N VAL A 54 5.823 0.643 3.101 1.00 54.23 N ATOM 907 CA VAL A 54 5.684 -0.782 2.768 1.00 22.24 C ATOM 908 C VAL A 54 4.678 -0.993 1.620 1.00 71.11 C ATOM 909 O VAL A 54 3.542 -0.516 1.671 1.00 54.03 O ATOM 910 CB VAL A 54 5.262 -1.621 4.006 1.00 3.45 C ATOM 911 CG1 VAL A 54 3.959 -1.101 4.609 1.00 54.51 C ATOM 912 CG2 VAL A 54 5.144 -3.107 3.652 1.00 72.33 C ATOM 0 H VAL A 54 5.056 1.021 3.657 1.00 54.23 H new ATOM 0 HA VAL A 54 6.664 -1.128 2.439 1.00 22.24 H new ATOM 0 HB VAL A 54 6.044 -1.515 4.758 1.00 3.45 H new ATOM 0 HG11 VAL A 54 3.690 -1.708 5.473 1.00 54.51 H new ATOM 0 HG12 VAL A 54 4.090 -0.065 4.921 1.00 54.51 H new ATOM 0 HG13 VAL A 54 3.165 -1.158 3.864 1.00 54.51 H new ATOM 0 HG21 VAL A 54 4.847 -3.669 4.537 1.00 72.33 H new ATOM 0 HG22 VAL A 54 4.394 -3.237 2.872 1.00 72.33 H new ATOM 0 HG23 VAL A 54 6.106 -3.473 3.295 1.00 72.33 H new ATOM 922 N VAL A 55 5.108 -1.707 0.582 1.00 22.24 N ATOM 923 CA VAL A 55 4.270 -1.954 -0.597 1.00 4.03 C ATOM 924 C VAL A 55 3.957 -3.450 -0.756 1.00 4.25 C ATOM 925 O VAL A 55 4.853 -4.264 -0.994 1.00 33.22 O ATOM 926 CB VAL A 55 4.948 -1.438 -1.891 1.00 62.32 C ATOM 927 CG1 VAL A 55 4.019 -1.607 -3.092 1.00 65.40 C ATOM 928 CG2 VAL A 55 5.379 0.021 -1.734 1.00 4.31 C ATOM 0 H VAL A 55 6.036 -2.128 0.530 1.00 22.24 H new ATOM 0 HA VAL A 55 3.340 -1.408 -0.441 1.00 4.03 H new ATOM 0 HB VAL A 55 5.842 -2.035 -2.069 1.00 62.32 H new ATOM 0 HG11 VAL A 55 4.515 -1.238 -3.990 1.00 65.40 H new ATOM 0 HG12 VAL A 55 3.776 -2.662 -3.219 1.00 65.40 H new ATOM 0 HG13 VAL A 55 3.102 -1.041 -2.925 1.00 65.40 H new ATOM 0 HG21 VAL A 55 5.853 0.362 -2.655 1.00 4.31 H new ATOM 0 HG22 VAL A 55 4.505 0.638 -1.526 1.00 4.31 H new ATOM 0 HG23 VAL A 55 6.087 0.105 -0.910 1.00 4.31 H new ATOM 938 N VAL A 56 2.682 -3.804 -0.631 1.00 2.21 N ATOM 939 CA VAL A 56 2.244 -5.199 -0.729 1.00 12.43 C ATOM 940 C VAL A 56 1.702 -5.525 -2.132 1.00 74.40 C ATOM 941 O VAL A 56 0.642 -5.040 -2.531 1.00 54.52 O ATOM 942 CB VAL A 56 1.151 -5.516 0.325 1.00 1.45 C ATOM 943 CG1 VAL A 56 0.748 -6.991 0.271 1.00 12.50 C ATOM 944 CG2 VAL A 56 1.629 -5.128 1.725 1.00 20.51 C ATOM 0 H VAL A 56 1.926 -3.141 -0.460 1.00 2.21 H new ATOM 0 HA VAL A 56 3.120 -5.818 -0.538 1.00 12.43 H new ATOM 0 HB VAL A 56 0.267 -4.923 0.090 1.00 1.45 H new ATOM 0 HG11 VAL A 56 -0.019 -7.186 1.020 1.00 12.50 H new ATOM 0 HG12 VAL A 56 0.357 -7.225 -0.719 1.00 12.50 H new ATOM 0 HG13 VAL A 56 1.619 -7.614 0.473 1.00 12.50 H new ATOM 0 HG21 VAL A 56 0.850 -5.357 2.452 1.00 20.51 H new ATOM 0 HG22 VAL A 56 2.531 -5.689 1.970 1.00 20.51 H new ATOM 0 HG23 VAL A 56 1.848 -4.061 1.752 1.00 20.51 H new ATOM 954 N VAL A 57 2.443 -6.338 -2.879 1.00 53.02 N ATOM 955 CA VAL A 57 1.997 -6.799 -4.195 1.00 22.43 C ATOM 956 C VAL A 57 1.076 -8.019 -4.038 1.00 60.41 C ATOM 957 O VAL A 57 1.482 -9.048 -3.495 1.00 62.21 O ATOM 958 CB VAL A 57 3.200 -7.163 -5.101 1.00 33.44 C ATOM 959 CG1 VAL A 57 2.729 -7.539 -6.502 1.00 23.14 C ATOM 960 CG2 VAL A 57 4.203 -6.008 -5.154 1.00 1.23 C ATOM 0 H VAL A 57 3.357 -6.693 -2.597 1.00 53.02 H new ATOM 0 HA VAL A 57 1.448 -5.985 -4.669 1.00 22.43 H new ATOM 0 HB VAL A 57 3.702 -8.030 -4.671 1.00 33.44 H new ATOM 0 HG11 VAL A 57 3.591 -7.791 -7.120 1.00 23.14 H new ATOM 0 HG12 VAL A 57 2.061 -8.399 -6.443 1.00 23.14 H new ATOM 0 HG13 VAL A 57 2.198 -6.697 -6.946 1.00 23.14 H new ATOM 0 HG21 VAL A 57 5.041 -6.283 -5.795 1.00 1.23 H new ATOM 0 HG22 VAL A 57 3.715 -5.120 -5.556 1.00 1.23 H new ATOM 0 HG23 VAL A 57 4.569 -5.798 -4.149 1.00 1.23 H new ATOM 970 N VAL A 58 -0.163 -7.902 -4.509 1.00 73.40 N ATOM 971 CA VAL A 58 -1.172 -8.936 -4.261 1.00 44.44 C ATOM 972 C VAL A 58 -1.596 -9.683 -5.538 1.00 13.14 C ATOM 973 O VAL A 58 -1.890 -9.073 -6.566 1.00 42.23 O ATOM 974 CB VAL A 58 -2.419 -8.332 -3.569 1.00 73.55 C ATOM 975 CG1 VAL A 58 -2.048 -7.774 -2.196 1.00 71.41 C ATOM 976 CG2 VAL A 58 -3.055 -7.249 -4.438 1.00 34.34 C ATOM 0 H VAL A 58 -0.494 -7.110 -5.060 1.00 73.40 H new ATOM 0 HA VAL A 58 -0.703 -9.665 -3.601 1.00 44.44 H new ATOM 0 HB VAL A 58 -3.152 -9.127 -3.433 1.00 73.55 H new ATOM 0 HG11 VAL A 58 -2.935 -7.353 -1.723 1.00 71.41 H new ATOM 0 HG12 VAL A 58 -1.650 -8.575 -1.573 1.00 71.41 H new ATOM 0 HG13 VAL A 58 -1.294 -6.995 -2.311 1.00 71.41 H new ATOM 0 HG21 VAL A 58 -3.929 -6.841 -3.930 1.00 34.34 H new ATOM 0 HG22 VAL A 58 -2.332 -6.452 -4.614 1.00 34.34 H new ATOM 0 HG23 VAL A 58 -3.359 -7.680 -5.392 1.00 34.34 H new ATOM 986 N ASP A 59 -1.612 -11.015 -5.453 1.00 13.11 N ATOM 987 CA ASP A 59 -2.065 -11.872 -6.559 1.00 22.01 C ATOM 988 C ASP A 59 -3.594 -12.069 -6.530 1.00 51.12 C ATOM 989 O ASP A 59 -4.246 -12.135 -7.576 1.00 71.51 O ATOM 990 CB ASP A 59 -1.356 -13.234 -6.481 1.00 42.20 C ATOM 991 CG ASP A 59 -1.532 -13.894 -5.123 1.00 24.44 C ATOM 992 OD1 ASP A 59 -0.862 -13.465 -4.160 1.00 23.32 O ATOM 993 OD2 ASP A 59 -2.348 -14.832 -5.006 1.00 65.34 O ATOM 0 H ASP A 59 -1.315 -11.530 -4.624 1.00 13.11 H new ATOM 0 HA ASP A 59 -1.811 -11.380 -7.498 1.00 22.01 H new ATOM 0 HB2 ASP A 59 -1.749 -13.891 -7.257 1.00 42.20 H new ATOM 0 HB3 ASP A 59 -0.293 -13.101 -6.684 1.00 42.20 H new ATOM 998 N ASP A 60 -4.159 -12.170 -5.327 1.00 3.14 N ATOM 999 CA ASP A 60 -5.606 -12.359 -5.157 1.00 52.54 C ATOM 1000 C ASP A 60 -6.158 -11.410 -4.078 1.00 0.21 C ATOM 1001 O ASP A 60 -5.419 -10.956 -3.199 1.00 74.14 O ATOM 1002 CB ASP A 60 -5.900 -13.822 -4.786 1.00 71.10 C ATOM 1003 CG ASP A 60 -7.380 -14.157 -4.860 1.00 21.32 C ATOM 1004 OD1 ASP A 60 -8.107 -13.904 -3.878 1.00 32.11 O ATOM 1005 OD2 ASP A 60 -7.832 -14.663 -5.910 1.00 22.43 O ATOM 0 H ASP A 60 -3.638 -12.124 -4.451 1.00 3.14 H new ATOM 0 HA ASP A 60 -6.102 -12.124 -6.099 1.00 52.54 H new ATOM 0 HB2 ASP A 60 -5.348 -14.481 -5.456 1.00 71.10 H new ATOM 0 HB3 ASP A 60 -5.537 -14.017 -3.777 1.00 71.10 H new ATOM 1010 N LYS A 61 -7.460 -11.119 -4.138 1.00 52.42 N ATOM 1011 CA LYS A 61 -8.081 -10.185 -3.190 1.00 73.14 C ATOM 1012 C LYS A 61 -8.103 -10.748 -1.755 1.00 64.34 C ATOM 1013 O LYS A 61 -8.213 -9.992 -0.791 1.00 24.31 O ATOM 1014 CB LYS A 61 -9.494 -9.780 -3.665 1.00 0.03 C ATOM 1015 CG LYS A 61 -10.494 -10.933 -3.839 1.00 74.22 C ATOM 1016 CD LYS A 61 -11.138 -11.368 -2.521 1.00 32.12 C ATOM 1017 CE LYS A 61 -11.914 -10.232 -1.854 1.00 51.34 C ATOM 1018 NZ LYS A 61 -13.049 -9.758 -2.691 1.00 23.04 N ATOM 0 H LYS A 61 -8.102 -11.512 -4.826 1.00 52.42 H new ATOM 0 HA LYS A 61 -7.465 -9.286 -3.163 1.00 73.14 H new ATOM 0 HB2 LYS A 61 -9.908 -9.069 -2.950 1.00 0.03 H new ATOM 0 HB3 LYS A 61 -9.401 -9.257 -4.617 1.00 0.03 H new ATOM 0 HG2 LYS A 61 -11.275 -10.628 -4.535 1.00 74.22 H new ATOM 0 HG3 LYS A 61 -9.983 -11.786 -4.287 1.00 74.22 H new ATOM 0 HD2 LYS A 61 -11.811 -12.205 -2.706 1.00 32.12 H new ATOM 0 HD3 LYS A 61 -10.364 -11.725 -1.841 1.00 32.12 H new ATOM 0 HE2 LYS A 61 -12.293 -10.571 -0.890 1.00 51.34 H new ATOM 0 HE3 LYS A 61 -11.238 -9.400 -1.657 1.00 51.34 H new ATOM 0 HZ1 LYS A 61 -13.504 -8.944 -2.230 1.00 23.04 H new ATOM 0 HZ2 LYS A 61 -12.695 -9.473 -3.627 1.00 23.04 H new ATOM 0 HZ3 LYS A 61 -13.743 -10.525 -2.802 1.00 23.04 H new ATOM 1032 N GLU A 62 -8.000 -12.072 -1.620 1.00 43.44 N ATOM 1033 CA GLU A 62 -7.897 -12.715 -0.301 1.00 2.42 C ATOM 1034 C GLU A 62 -6.557 -12.394 0.373 1.00 44.53 C ATOM 1035 O GLU A 62 -6.504 -12.133 1.574 1.00 30.34 O ATOM 1036 CB GLU A 62 -8.073 -14.232 -0.430 1.00 23.52 C ATOM 1037 CG GLU A 62 -9.501 -14.658 -0.744 1.00 41.55 C ATOM 1038 CD GLU A 62 -10.474 -14.312 0.371 1.00 13.21 C ATOM 1039 OE1 GLU A 62 -10.630 -15.127 1.305 1.00 33.10 O ATOM 1040 OE2 GLU A 62 -11.091 -13.227 0.320 1.00 41.33 O ATOM 0 H GLU A 62 -7.985 -12.723 -2.405 1.00 43.44 H new ATOM 0 HA GLU A 62 -8.695 -12.317 0.326 1.00 2.42 H new ATOM 0 HB2 GLU A 62 -7.412 -14.600 -1.215 1.00 23.52 H new ATOM 0 HB3 GLU A 62 -7.758 -14.706 0.500 1.00 23.52 H new ATOM 0 HG2 GLU A 62 -9.825 -14.176 -1.666 1.00 41.55 H new ATOM 0 HG3 GLU A 62 -9.525 -15.733 -0.921 1.00 41.55 H new ATOM 1047 N TRP A 63 -5.479 -12.424 -0.407 1.00 50.03 N ATOM 1048 CA TRP A 63 -4.163 -11.991 0.077 1.00 3.02 C ATOM 1049 C TRP A 63 -4.189 -10.488 0.405 1.00 13.13 C ATOM 1050 O TRP A 63 -3.696 -10.055 1.447 1.00 4.23 O ATOM 1051 CB TRP A 63 -3.085 -12.326 -0.975 1.00 71.14 C ATOM 1052 CG TRP A 63 -1.740 -11.680 -0.749 1.00 33.24 C ATOM 1053 CD1 TRP A 63 -0.928 -11.172 -1.719 1.00 12.01 C ATOM 1054 CD2 TRP A 63 -1.050 -11.474 0.497 1.00 70.34 C ATOM 1055 NE1 TRP A 63 0.209 -10.651 -1.165 1.00 72.32 N ATOM 1056 CE2 TRP A 63 0.163 -10.826 0.192 1.00 20.05 C ATOM 1057 CE3 TRP A 63 -1.335 -11.769 1.837 1.00 2.33 C ATOM 1058 CZ2 TRP A 63 1.081 -10.463 1.172 1.00 4.24 C ATOM 1059 CZ3 TRP A 63 -0.421 -11.408 2.807 1.00 3.11 C ATOM 1060 CH2 TRP A 63 0.775 -10.762 2.471 1.00 60.33 C ATOM 0 H TRP A 63 -5.487 -12.742 -1.376 1.00 50.03 H new ATOM 0 HA TRP A 63 -3.916 -12.525 0.995 1.00 3.02 H new ATOM 0 HB2 TRP A 63 -2.950 -13.407 -1.001 1.00 71.14 H new ATOM 0 HB3 TRP A 63 -3.453 -12.027 -1.956 1.00 71.14 H new ATOM 0 HD1 TRP A 63 -1.151 -11.180 -2.776 1.00 12.01 H new ATOM 0 HE1 TRP A 63 0.968 -10.204 -1.680 1.00 72.32 H new ATOM 0 HE3 TRP A 63 -2.253 -12.270 2.106 1.00 2.33 H new ATOM 0 HZ2 TRP A 63 2.003 -9.963 0.916 1.00 4.24 H new ATOM 0 HZ3 TRP A 63 -0.632 -11.628 3.843 1.00 3.11 H new ATOM 0 HH2 TRP A 63 1.470 -10.494 3.253 1.00 60.33 H new ATOM 1071 N ALA A 64 -4.801 -9.703 -0.476 1.00 32.22 N ATOM 1072 CA ALA A 64 -4.989 -8.269 -0.232 1.00 15.54 C ATOM 1073 C ALA A 64 -5.742 -8.020 1.089 1.00 55.40 C ATOM 1074 O ALA A 64 -5.333 -7.189 1.902 1.00 44.31 O ATOM 1075 CB ALA A 64 -5.727 -7.631 -1.403 1.00 1.33 C ATOM 0 H ALA A 64 -5.176 -10.031 -1.366 1.00 32.22 H new ATOM 0 HA ALA A 64 -4.006 -7.806 -0.142 1.00 15.54 H new ATOM 0 HB1 ALA A 64 -5.861 -6.566 -1.212 1.00 1.33 H new ATOM 0 HB2 ALA A 64 -5.146 -7.765 -2.316 1.00 1.33 H new ATOM 0 HB3 ALA A 64 -6.702 -8.104 -1.520 1.00 1.33 H new ATOM 1081 N GLU A 65 -6.834 -8.758 1.303 1.00 54.11 N ATOM 1082 CA GLU A 65 -7.621 -8.637 2.535 1.00 23.43 C ATOM 1083 C GLU A 65 -6.853 -9.182 3.746 1.00 51.11 C ATOM 1084 O GLU A 65 -6.958 -8.648 4.850 1.00 25.12 O ATOM 1085 CB GLU A 65 -8.968 -9.364 2.392 1.00 3.12 C ATOM 1086 CG GLU A 65 -9.884 -9.191 3.601 1.00 3.22 C ATOM 1087 CD GLU A 65 -11.261 -9.800 3.398 1.00 45.30 C ATOM 1088 OE1 GLU A 65 -12.147 -9.107 2.855 1.00 72.43 O ATOM 1089 OE2 GLU A 65 -11.470 -10.969 3.791 1.00 2.44 O ATOM 0 H GLU A 65 -7.194 -9.445 0.641 1.00 54.11 H new ATOM 0 HA GLU A 65 -7.808 -7.576 2.702 1.00 23.43 H new ATOM 0 HB2 GLU A 65 -9.479 -8.994 1.503 1.00 3.12 H new ATOM 0 HB3 GLU A 65 -8.784 -10.427 2.235 1.00 3.12 H new ATOM 0 HG2 GLU A 65 -9.416 -9.649 4.472 1.00 3.22 H new ATOM 0 HG3 GLU A 65 -9.992 -8.128 3.818 1.00 3.22 H new ATOM 1096 N LYS A 66 -6.071 -10.239 3.532 1.00 11.13 N ATOM 1097 CA LYS A 66 -5.250 -10.822 4.599 1.00 41.41 C ATOM 1098 C LYS A 66 -4.214 -9.807 5.105 1.00 60.14 C ATOM 1099 O LYS A 66 -3.937 -9.727 6.304 1.00 3.15 O ATOM 1100 CB LYS A 66 -4.550 -12.094 4.100 1.00 71.01 C ATOM 1101 CG LYS A 66 -3.807 -12.854 5.192 1.00 42.14 C ATOM 1102 CD LYS A 66 -3.147 -14.121 4.657 1.00 22.52 C ATOM 1103 CE LYS A 66 -2.539 -14.955 5.778 1.00 22.22 C ATOM 1104 NZ LYS A 66 -3.568 -15.414 6.752 1.00 73.33 N ATOM 0 H LYS A 66 -5.987 -10.711 2.632 1.00 11.13 H new ATOM 0 HA LYS A 66 -5.905 -11.086 5.429 1.00 41.41 H new ATOM 0 HB2 LYS A 66 -5.292 -12.754 3.651 1.00 71.01 H new ATOM 0 HB3 LYS A 66 -3.845 -11.825 3.313 1.00 71.01 H new ATOM 0 HG2 LYS A 66 -3.048 -12.207 5.632 1.00 42.14 H new ATOM 0 HG3 LYS A 66 -4.503 -13.116 5.989 1.00 42.14 H new ATOM 0 HD2 LYS A 66 -3.885 -14.717 4.119 1.00 22.52 H new ATOM 0 HD3 LYS A 66 -2.371 -13.852 3.941 1.00 22.52 H new ATOM 0 HE2 LYS A 66 -2.031 -15.820 5.352 1.00 22.22 H new ATOM 0 HE3 LYS A 66 -1.783 -14.367 6.299 1.00 22.22 H new ATOM 0 HZ1 LYS A 66 -3.184 -16.195 7.321 1.00 73.33 H new ATOM 0 HZ2 LYS A 66 -3.829 -14.626 7.378 1.00 73.33 H new ATOM 0 HZ3 LYS A 66 -4.411 -15.742 6.238 1.00 73.33 H new ATOM 1118 N ALA A 67 -3.648 -9.034 4.179 1.00 24.11 N ATOM 1119 CA ALA A 67 -2.728 -7.949 4.529 1.00 23.01 C ATOM 1120 C ALA A 67 -3.419 -6.913 5.430 1.00 70.15 C ATOM 1121 O ALA A 67 -2.891 -6.528 6.476 1.00 22.55 O ATOM 1122 CB ALA A 67 -2.186 -7.290 3.264 1.00 51.15 C ATOM 0 H ALA A 67 -3.810 -9.138 3.177 1.00 24.11 H new ATOM 0 HA ALA A 67 -1.892 -8.372 5.086 1.00 23.01 H new ATOM 0 HB1 ALA A 67 -1.503 -6.485 3.537 1.00 51.15 H new ATOM 0 HB2 ALA A 67 -1.654 -8.031 2.667 1.00 51.15 H new ATOM 0 HB3 ALA A 67 -3.013 -6.883 2.683 1.00 51.15 H new ATOM 1128 N ILE A 68 -4.611 -6.480 5.022 1.00 13.42 N ATOM 1129 CA ILE A 68 -5.414 -5.546 5.823 1.00 31.32 C ATOM 1130 C ILE A 68 -5.788 -6.169 7.179 1.00 72.30 C ATOM 1131 O ILE A 68 -5.789 -5.497 8.210 1.00 24.23 O ATOM 1132 CB ILE A 68 -6.710 -5.136 5.077 1.00 23.45 C ATOM 1133 CG1 ILE A 68 -6.385 -4.636 3.657 1.00 52.35 C ATOM 1134 CG2 ILE A 68 -7.475 -4.070 5.862 1.00 62.42 C ATOM 1135 CD1 ILE A 68 -5.435 -3.454 3.611 1.00 12.33 C ATOM 0 H ILE A 68 -5.045 -6.759 4.142 1.00 13.42 H new ATOM 0 HA ILE A 68 -4.805 -4.658 5.989 1.00 31.32 H new ATOM 0 HB ILE A 68 -7.346 -6.017 4.993 1.00 23.45 H new ATOM 0 HG12 ILE A 68 -5.952 -5.457 3.086 1.00 52.35 H new ATOM 0 HG13 ILE A 68 -7.315 -4.359 3.161 1.00 52.35 H new ATOM 0 HG21 ILE A 68 -8.380 -3.798 5.319 1.00 62.42 H new ATOM 0 HG22 ILE A 68 -7.744 -4.463 6.842 1.00 62.42 H new ATOM 0 HG23 ILE A 68 -6.847 -3.188 5.985 1.00 62.42 H new ATOM 0 HD11 ILE A 68 -5.261 -3.167 2.574 1.00 12.33 H new ATOM 0 HD12 ILE A 68 -5.873 -2.614 4.151 1.00 12.33 H new ATOM 0 HD13 ILE A 68 -4.488 -3.730 4.075 1.00 12.33 H new ATOM 1147 N ARG A 69 -6.099 -7.465 7.162 1.00 13.43 N ATOM 1148 CA ARG A 69 -6.435 -8.214 8.377 1.00 75.35 C ATOM 1149 C ARG A 69 -5.246 -8.210 9.351 1.00 3.02 C ATOM 1150 O ARG A 69 -5.418 -8.050 10.562 1.00 64.24 O ATOM 1151 CB ARG A 69 -6.839 -9.656 7.997 1.00 54.23 C ATOM 1152 CG ARG A 69 -7.479 -10.489 9.120 1.00 64.43 C ATOM 1153 CD ARG A 69 -6.458 -11.036 10.119 1.00 22.44 C ATOM 1154 NE ARG A 69 -7.072 -11.943 11.087 1.00 23.01 N ATOM 1155 CZ ARG A 69 -6.479 -12.396 12.158 1.00 60.44 C ATOM 1156 NH1 ARG A 69 -5.277 -12.027 12.462 1.00 44.14 N ATOM 1157 NH2 ARG A 69 -7.101 -13.210 12.940 1.00 52.15 N ATOM 0 H ARG A 69 -6.126 -8.025 6.310 1.00 13.43 H new ATOM 0 HA ARG A 69 -7.277 -7.737 8.878 1.00 75.35 H new ATOM 0 HB2 ARG A 69 -7.538 -9.609 7.162 1.00 54.23 H new ATOM 0 HB3 ARG A 69 -5.952 -10.180 7.642 1.00 54.23 H new ATOM 0 HG2 ARG A 69 -8.205 -9.874 9.652 1.00 64.43 H new ATOM 0 HG3 ARG A 69 -8.028 -11.321 8.679 1.00 64.43 H new ATOM 0 HD2 ARG A 69 -5.669 -11.561 9.580 1.00 22.44 H new ATOM 0 HD3 ARG A 69 -5.987 -10.207 10.647 1.00 22.44 H new ATOM 0 HE ARG A 69 -8.031 -12.243 10.913 1.00 23.01 H new ATOM 0 HH11 ARG A 69 -4.777 -11.372 11.861 1.00 44.14 H new ATOM 0 HH12 ARG A 69 -4.829 -12.391 13.303 1.00 44.14 H new ATOM 0 HH21 ARG A 69 -8.054 -13.499 12.721 1.00 52.15 H new ATOM 0 HH22 ARG A 69 -6.640 -13.565 13.777 1.00 52.15 H new ATOM 1171 N PHE A 70 -4.038 -8.385 8.815 1.00 42.34 N ATOM 1172 CA PHE A 70 -2.821 -8.362 9.630 1.00 22.23 C ATOM 1173 C PHE A 70 -2.612 -6.978 10.266 1.00 74.34 C ATOM 1174 O PHE A 70 -2.342 -6.870 11.463 1.00 1.10 O ATOM 1175 CB PHE A 70 -1.600 -8.755 8.784 1.00 3.02 C ATOM 1176 CG PHE A 70 -0.321 -8.846 9.580 1.00 14.30 C ATOM 1177 CD1 PHE A 70 -0.060 -9.956 10.372 1.00 20.32 C ATOM 1178 CD2 PHE A 70 0.616 -7.821 9.542 1.00 62.20 C ATOM 1179 CE1 PHE A 70 1.108 -10.043 11.105 1.00 45.13 C ATOM 1180 CE2 PHE A 70 1.785 -7.906 10.273 1.00 34.04 C ATOM 1181 CZ PHE A 70 2.030 -9.016 11.057 1.00 14.22 C ATOM 0 H PHE A 70 -3.875 -8.544 7.821 1.00 42.34 H new ATOM 0 HA PHE A 70 -2.937 -9.090 10.433 1.00 22.23 H new ATOM 0 HB2 PHE A 70 -1.792 -9.717 8.308 1.00 3.02 H new ATOM 0 HB3 PHE A 70 -1.471 -8.024 7.986 1.00 3.02 H new ATOM 0 HD1 PHE A 70 -0.779 -10.761 10.416 1.00 20.32 H new ATOM 0 HD2 PHE A 70 0.428 -6.948 8.934 1.00 62.20 H new ATOM 0 HE1 PHE A 70 1.300 -10.913 11.715 1.00 45.13 H new ATOM 0 HE2 PHE A 70 2.507 -7.104 10.231 1.00 34.04 H new ATOM 0 HZ PHE A 70 2.942 -9.081 11.632 1.00 14.22 H new ATOM 1191 N VAL A 71 -2.752 -5.922 9.462 1.00 53.15 N ATOM 1192 CA VAL A 71 -2.666 -4.546 9.971 1.00 52.33 C ATOM 1193 C VAL A 71 -3.733 -4.297 11.052 1.00 44.01 C ATOM 1194 O VAL A 71 -3.464 -3.691 12.093 1.00 33.30 O ATOM 1195 CB VAL A 71 -2.831 -3.509 8.835 1.00 31.12 C ATOM 1196 CG1 VAL A 71 -2.704 -2.088 9.379 1.00 2.25 C ATOM 1197 CG2 VAL A 71 -1.815 -3.758 7.720 1.00 12.32 C ATOM 0 H VAL A 71 -2.925 -5.990 8.459 1.00 53.15 H new ATOM 0 HA VAL A 71 -1.675 -4.426 10.408 1.00 52.33 H new ATOM 0 HB VAL A 71 -3.829 -3.623 8.413 1.00 31.12 H new ATOM 0 HG11 VAL A 71 -2.823 -1.374 8.564 1.00 2.25 H new ATOM 0 HG12 VAL A 71 -3.476 -1.915 10.129 1.00 2.25 H new ATOM 0 HG13 VAL A 71 -1.722 -1.959 9.834 1.00 2.25 H new ATOM 0 HG21 VAL A 71 -1.950 -3.017 6.932 1.00 12.32 H new ATOM 0 HG22 VAL A 71 -0.805 -3.679 8.123 1.00 12.32 H new ATOM 0 HG23 VAL A 71 -1.964 -4.756 7.308 1.00 12.32 H new ATOM 1207 N LYS A 72 -4.942 -4.788 10.796 1.00 20.25 N ATOM 1208 CA LYS A 72 -6.030 -4.756 11.779 1.00 4.43 C ATOM 1209 C LYS A 72 -5.602 -5.486 13.065 1.00 53.50 C ATOM 1210 O LYS A 72 -5.885 -5.037 14.178 1.00 32.44 O ATOM 1211 CB LYS A 72 -7.291 -5.395 11.156 1.00 15.12 C ATOM 1212 CG LYS A 72 -8.558 -5.346 12.020 1.00 21.41 C ATOM 1213 CD LYS A 72 -8.595 -6.461 13.067 1.00 74.42 C ATOM 1214 CE LYS A 72 -9.946 -6.541 13.762 1.00 70.34 C ATOM 1215 NZ LYS A 72 -11.037 -6.883 12.812 1.00 42.45 N ATOM 0 H LYS A 72 -5.198 -5.218 9.907 1.00 20.25 H new ATOM 0 HA LYS A 72 -6.261 -3.725 12.049 1.00 4.43 H new ATOM 0 HB2 LYS A 72 -7.499 -4.896 10.210 1.00 15.12 H new ATOM 0 HB3 LYS A 72 -7.071 -6.437 10.925 1.00 15.12 H new ATOM 0 HG2 LYS A 72 -8.616 -4.379 12.521 1.00 21.41 H new ATOM 0 HG3 LYS A 72 -9.435 -5.425 11.378 1.00 21.41 H new ATOM 0 HD2 LYS A 72 -8.375 -7.416 12.589 1.00 74.42 H new ATOM 0 HD3 LYS A 72 -7.815 -6.289 13.808 1.00 74.42 H new ATOM 0 HE2 LYS A 72 -9.904 -7.291 14.552 1.00 70.34 H new ATOM 0 HE3 LYS A 72 -10.166 -5.586 14.240 1.00 70.34 H new ATOM 0 HZ1 LYS A 72 -11.858 -7.240 13.341 1.00 42.45 H new ATOM 0 HZ2 LYS A 72 -11.312 -6.034 12.278 1.00 42.45 H new ATOM 0 HZ3 LYS A 72 -10.705 -7.615 12.151 1.00 42.45 H new ATOM 1229 N SER A 73 -4.897 -6.604 12.897 1.00 64.32 N ATOM 1230 CA SER A 73 -4.401 -7.397 14.034 1.00 75.14 C ATOM 1231 C SER A 73 -3.340 -6.628 14.833 1.00 12.11 C ATOM 1232 O SER A 73 -3.180 -6.837 16.036 1.00 5.54 O ATOM 1233 CB SER A 73 -3.822 -8.733 13.547 1.00 23.54 C ATOM 1234 OG SER A 73 -4.793 -9.483 12.828 1.00 65.20 O ATOM 0 H SER A 73 -4.653 -6.987 11.983 1.00 64.32 H new ATOM 0 HA SER A 73 -5.247 -7.593 14.692 1.00 75.14 H new ATOM 0 HB2 SER A 73 -2.958 -8.547 12.910 1.00 23.54 H new ATOM 0 HB3 SER A 73 -3.470 -9.312 14.400 1.00 23.54 H new ATOM 0 HG SER A 73 -5.135 -8.946 12.083 1.00 65.20 H new ATOM 1240 N LEU A 74 -2.613 -5.743 14.155 1.00 74.42 N ATOM 1241 CA LEU A 74 -1.647 -4.858 14.818 1.00 35.51 C ATOM 1242 C LEU A 74 -2.362 -3.880 15.765 1.00 20.32 C ATOM 1243 O LEU A 74 -1.818 -3.479 16.795 1.00 42.31 O ATOM 1244 CB LEU A 74 -0.855 -4.058 13.773 1.00 51.02 C ATOM 1245 CG LEU A 74 -0.068 -4.891 12.750 1.00 22.33 C ATOM 1246 CD1 LEU A 74 0.505 -3.988 11.660 1.00 14.34 C ATOM 1247 CD2 LEU A 74 1.039 -5.691 13.436 1.00 44.11 C ATOM 0 H LEU A 74 -2.672 -5.616 13.145 1.00 74.42 H new ATOM 0 HA LEU A 74 -0.965 -5.480 15.397 1.00 35.51 H new ATOM 0 HB2 LEU A 74 -1.549 -3.415 13.233 1.00 51.02 H new ATOM 0 HB3 LEU A 74 -0.157 -3.405 14.296 1.00 51.02 H new ATOM 0 HG LEU A 74 -0.751 -5.601 12.284 1.00 22.33 H new ATOM 0 HD11 LEU A 74 1.060 -4.592 10.942 1.00 14.34 H new ATOM 0 HD12 LEU A 74 -0.309 -3.473 11.149 1.00 14.34 H new ATOM 0 HD13 LEU A 74 1.173 -3.254 12.110 1.00 14.34 H new ATOM 0 HD21 LEU A 74 1.582 -6.273 12.691 1.00 44.11 H new ATOM 0 HD22 LEU A 74 1.726 -5.008 13.935 1.00 44.11 H new ATOM 0 HD23 LEU A 74 0.599 -6.364 14.172 1.00 44.11 H new ATOM 1259 N GLY A 75 -3.586 -3.495 15.397 1.00 63.44 N ATOM 1260 CA GLY A 75 -4.346 -2.526 16.180 1.00 62.31 C ATOM 1261 C GLY A 75 -3.868 -1.094 15.967 1.00 74.34 C ATOM 1262 O GLY A 75 -4.205 -0.194 16.739 1.00 32.40 O ATOM 0 H GLY A 75 -4.067 -3.839 14.566 1.00 63.44 H new ATOM 0 HA2 GLY A 75 -5.401 -2.596 15.913 1.00 62.31 H new ATOM 0 HA3 GLY A 75 -4.267 -2.778 17.238 1.00 62.31 H new ATOM 1266 N ALA A 76 -3.084 -0.883 14.913 1.00 61.11 N ATOM 1267 CA ALA A 76 -2.509 0.434 14.617 1.00 25.43 C ATOM 1268 C ALA A 76 -3.288 1.157 13.509 1.00 43.45 C ATOM 1269 O ALA A 76 -3.817 0.528 12.592 1.00 55.22 O ATOM 1270 CB ALA A 76 -1.042 0.286 14.224 1.00 62.43 C ATOM 0 H ALA A 76 -2.829 -1.609 14.244 1.00 61.11 H new ATOM 0 HA ALA A 76 -2.581 1.042 15.519 1.00 25.43 H new ATOM 0 HB1 ALA A 76 -0.623 1.268 14.006 1.00 62.43 H new ATOM 0 HB2 ALA A 76 -0.489 -0.170 15.045 1.00 62.43 H new ATOM 0 HB3 ALA A 76 -0.964 -0.346 13.339 1.00 62.43 H new ATOM 1276 N GLN A 77 -3.353 2.484 13.595 1.00 42.22 N ATOM 1277 CA GLN A 77 -4.038 3.294 12.582 1.00 30.04 C ATOM 1278 C GLN A 77 -3.066 3.713 11.464 1.00 13.11 C ATOM 1279 O GLN A 77 -2.194 4.563 11.659 1.00 22.41 O ATOM 1280 CB GLN A 77 -4.691 4.524 13.240 1.00 74.03 C ATOM 1281 CG GLN A 77 -3.732 5.362 14.087 1.00 12.42 C ATOM 1282 CD GLN A 77 -4.430 6.481 14.842 1.00 2.03 C ATOM 1283 OE1 GLN A 77 -5.591 6.367 15.223 1.00 53.20 O ATOM 1284 NE2 GLN A 77 -3.723 7.565 15.087 1.00 30.43 N ATOM 0 H GLN A 77 -2.940 3.024 14.355 1.00 42.22 H new ATOM 0 HA GLN A 77 -4.823 2.690 12.126 1.00 30.04 H new ATOM 0 HB2 GLN A 77 -5.117 5.156 12.461 1.00 74.03 H new ATOM 0 HB3 GLN A 77 -5.517 4.191 13.868 1.00 74.03 H new ATOM 0 HG2 GLN A 77 -3.223 4.713 14.799 1.00 12.42 H new ATOM 0 HG3 GLN A 77 -2.965 5.790 13.441 1.00 12.42 H new ATOM 0 HE21 GLN A 77 -2.760 7.631 14.758 1.00 30.43 H new ATOM 0 HE22 GLN A 77 -4.139 8.338 15.606 1.00 30.43 H new ATOM 1293 N VAL A 78 -3.209 3.096 10.292 1.00 13.01 N ATOM 1294 CA VAL A 78 -2.298 3.345 9.169 1.00 75.01 C ATOM 1295 C VAL A 78 -3.031 3.935 7.956 1.00 0.22 C ATOM 1296 O VAL A 78 -4.260 3.884 7.863 1.00 15.14 O ATOM 1297 CB VAL A 78 -1.573 2.044 8.731 1.00 2.05 C ATOM 1298 CG1 VAL A 78 -0.954 1.341 9.936 1.00 64.32 C ATOM 1299 CG2 VAL A 78 -2.521 1.111 7.978 1.00 21.11 C ATOM 0 H VAL A 78 -3.946 2.420 10.093 1.00 13.01 H new ATOM 0 HA VAL A 78 -1.565 4.069 9.525 1.00 75.01 H new ATOM 0 HB VAL A 78 -0.769 2.319 8.048 1.00 2.05 H new ATOM 0 HG11 VAL A 78 -0.451 0.432 9.608 1.00 64.32 H new ATOM 0 HG12 VAL A 78 -0.232 2.004 10.412 1.00 64.32 H new ATOM 0 HG13 VAL A 78 -1.737 1.085 10.650 1.00 64.32 H new ATOM 0 HG21 VAL A 78 -1.986 0.208 7.684 1.00 21.11 H new ATOM 0 HG22 VAL A 78 -3.357 0.843 8.624 1.00 21.11 H new ATOM 0 HG23 VAL A 78 -2.898 1.616 7.088 1.00 21.11 H new ATOM 1309 N LEU A 79 -2.260 4.492 7.028 1.00 23.42 N ATOM 1310 CA LEU A 79 -2.803 5.027 5.776 1.00 23.42 C ATOM 1311 C LEU A 79 -2.577 4.031 4.628 1.00 62.13 C ATOM 1312 O LEU A 79 -1.479 3.500 4.472 1.00 43.04 O ATOM 1313 CB LEU A 79 -2.139 6.373 5.463 1.00 22.52 C ATOM 1314 CG LEU A 79 -2.643 7.091 4.200 1.00 61.10 C ATOM 1315 CD1 LEU A 79 -4.154 7.298 4.252 1.00 65.01 C ATOM 1316 CD2 LEU A 79 -1.929 8.428 4.034 1.00 55.52 C ATOM 0 H LEU A 79 -1.248 4.587 7.117 1.00 23.42 H new ATOM 0 HA LEU A 79 -3.877 5.180 5.886 1.00 23.42 H new ATOM 0 HB2 LEU A 79 -2.284 7.035 6.317 1.00 22.52 H new ATOM 0 HB3 LEU A 79 -1.066 6.212 5.363 1.00 22.52 H new ATOM 0 HG LEU A 79 -2.419 6.462 3.339 1.00 61.10 H new ATOM 0 HD11 LEU A 79 -4.483 7.808 3.346 1.00 65.01 H new ATOM 0 HD12 LEU A 79 -4.651 6.331 4.325 1.00 65.01 H new ATOM 0 HD13 LEU A 79 -4.409 7.903 5.122 1.00 65.01 H new ATOM 0 HD21 LEU A 79 -2.294 8.927 3.136 1.00 55.52 H new ATOM 0 HD22 LEU A 79 -2.125 9.056 4.903 1.00 55.52 H new ATOM 0 HD23 LEU A 79 -0.856 8.259 3.944 1.00 55.52 H new ATOM 1328 N ILE A 80 -3.613 3.772 3.831 1.00 13.25 N ATOM 1329 CA ILE A 80 -3.536 2.751 2.776 1.00 24.20 C ATOM 1330 C ILE A 80 -3.730 3.343 1.368 1.00 53.15 C ATOM 1331 O ILE A 80 -4.637 4.139 1.134 1.00 32.31 O ATOM 1332 CB ILE A 80 -4.592 1.639 3.013 1.00 2.22 C ATOM 1333 CG1 ILE A 80 -4.407 1.020 4.408 1.00 34.43 C ATOM 1334 CG2 ILE A 80 -4.502 0.564 1.927 1.00 14.01 C ATOM 1335 CD1 ILE A 80 -5.447 -0.021 4.761 1.00 34.33 C ATOM 0 H ILE A 80 -4.512 4.250 3.891 1.00 13.25 H new ATOM 0 HA ILE A 80 -2.533 2.328 2.828 1.00 24.20 H new ATOM 0 HB ILE A 80 -5.584 2.087 2.961 1.00 2.22 H new ATOM 0 HG12 ILE A 80 -3.418 0.565 4.464 1.00 34.43 H new ATOM 0 HG13 ILE A 80 -4.435 1.815 5.154 1.00 34.43 H new ATOM 0 HG21 ILE A 80 -5.251 -0.205 2.113 1.00 14.01 H new ATOM 0 HG22 ILE A 80 -4.681 1.016 0.952 1.00 14.01 H new ATOM 0 HG23 ILE A 80 -3.509 0.114 1.942 1.00 14.01 H new ATOM 0 HD11 ILE A 80 -5.248 -0.410 5.760 1.00 34.33 H new ATOM 0 HD12 ILE A 80 -6.438 0.433 4.739 1.00 34.33 H new ATOM 0 HD13 ILE A 80 -5.405 -0.836 4.039 1.00 34.33 H new ATOM 1347 N ILE A 81 -2.865 2.943 0.436 1.00 2.22 N ATOM 1348 CA ILE A 81 -2.979 3.344 -0.974 1.00 40.13 C ATOM 1349 C ILE A 81 -3.126 2.102 -1.869 1.00 33.33 C ATOM 1350 O ILE A 81 -2.316 1.184 -1.795 1.00 55.42 O ATOM 1351 CB ILE A 81 -1.734 4.150 -1.436 1.00 71.31 C ATOM 1352 CG1 ILE A 81 -1.509 5.371 -0.528 1.00 20.40 C ATOM 1353 CG2 ILE A 81 -1.881 4.587 -2.896 1.00 2.04 C ATOM 1354 CD1 ILE A 81 -0.283 6.185 -0.889 1.00 12.14 C ATOM 0 H ILE A 81 -2.069 2.336 0.631 1.00 2.22 H new ATOM 0 HA ILE A 81 -3.862 3.977 -1.064 1.00 40.13 H new ATOM 0 HB ILE A 81 -0.862 3.500 -1.360 1.00 71.31 H new ATOM 0 HG12 ILE A 81 -2.388 6.014 -0.576 1.00 20.40 H new ATOM 0 HG13 ILE A 81 -1.418 5.032 0.504 1.00 20.40 H new ATOM 0 HG21 ILE A 81 -0.998 5.150 -3.198 1.00 2.04 H new ATOM 0 HG22 ILE A 81 -1.985 3.707 -3.531 1.00 2.04 H new ATOM 0 HG23 ILE A 81 -2.765 5.216 -3.000 1.00 2.04 H new ATOM 0 HD11 ILE A 81 -0.192 7.028 -0.204 1.00 12.14 H new ATOM 0 HD12 ILE A 81 0.605 5.558 -0.813 1.00 12.14 H new ATOM 0 HD13 ILE A 81 -0.380 6.555 -1.910 1.00 12.14 H new ATOM 1366 N ILE A 82 -4.157 2.066 -2.707 1.00 32.31 N ATOM 1367 CA ILE A 82 -4.403 0.904 -3.573 1.00 12.12 C ATOM 1368 C ILE A 82 -4.256 1.259 -5.064 1.00 32.54 C ATOM 1369 O ILE A 82 -4.748 2.292 -5.523 1.00 43.21 O ATOM 1370 CB ILE A 82 -5.809 0.300 -3.320 1.00 40.11 C ATOM 1371 CG1 ILE A 82 -5.990 -0.028 -1.829 1.00 54.43 C ATOM 1372 CG2 ILE A 82 -6.019 -0.955 -4.169 1.00 71.51 C ATOM 1373 CD1 ILE A 82 -7.328 -0.657 -1.494 1.00 21.31 C ATOM 0 H ILE A 82 -4.836 2.820 -2.809 1.00 32.31 H new ATOM 0 HA ILE A 82 -3.646 0.162 -3.319 1.00 12.12 H new ATOM 0 HB ILE A 82 -6.556 1.039 -3.609 1.00 40.11 H new ATOM 0 HG12 ILE A 82 -5.194 -0.704 -1.517 1.00 54.43 H new ATOM 0 HG13 ILE A 82 -5.875 0.888 -1.249 1.00 54.43 H new ATOM 0 HG21 ILE A 82 -7.011 -1.363 -3.976 1.00 71.51 H new ATOM 0 HG22 ILE A 82 -5.931 -0.699 -5.225 1.00 71.51 H new ATOM 0 HG23 ILE A 82 -5.265 -1.699 -3.912 1.00 71.51 H new ATOM 0 HD11 ILE A 82 -7.378 -0.858 -0.424 1.00 21.31 H new ATOM 0 HD12 ILE A 82 -8.131 0.026 -1.773 1.00 21.31 H new ATOM 0 HD13 ILE A 82 -7.439 -1.591 -2.044 1.00 21.31 H new ATOM 1385 N TYR A 83 -3.582 0.385 -5.815 1.00 34.31 N ATOM 1386 CA TYR A 83 -3.350 0.593 -7.251 1.00 11.10 C ATOM 1387 C TYR A 83 -3.775 -0.636 -8.076 1.00 73.24 C ATOM 1388 O TYR A 83 -3.194 -1.718 -7.943 1.00 75.10 O ATOM 1389 CB TYR A 83 -1.863 0.895 -7.498 1.00 23.03 C ATOM 1390 CG TYR A 83 -1.514 1.177 -8.952 1.00 63.40 C ATOM 1391 CD1 TYR A 83 -1.603 2.463 -9.469 1.00 32.14 C ATOM 1392 CD2 TYR A 83 -1.090 0.159 -9.808 1.00 41.15 C ATOM 1393 CE1 TYR A 83 -1.283 2.730 -10.784 1.00 40.35 C ATOM 1394 CE2 TYR A 83 -0.767 0.423 -11.127 1.00 61.22 C ATOM 1395 CZ TYR A 83 -0.867 1.712 -11.611 1.00 43.40 C ATOM 1396 OH TYR A 83 -0.539 1.987 -12.919 1.00 20.21 O ATOM 0 H TYR A 83 -3.184 -0.481 -5.451 1.00 34.31 H new ATOM 0 HA TYR A 83 -3.958 1.440 -7.571 1.00 11.10 H new ATOM 0 HB2 TYR A 83 -1.574 1.755 -6.894 1.00 23.03 H new ATOM 0 HB3 TYR A 83 -1.270 0.048 -7.152 1.00 23.03 H new ATOM 0 HD1 TYR A 83 -1.929 3.270 -8.829 1.00 32.14 H new ATOM 0 HD2 TYR A 83 -1.013 -0.851 -9.434 1.00 41.15 H new ATOM 0 HE1 TYR A 83 -1.359 3.738 -11.164 1.00 40.35 H new ATOM 0 HE2 TYR A 83 -0.438 -0.376 -11.775 1.00 61.22 H new ATOM 0 HH TYR A 83 -0.264 1.160 -13.368 1.00 20.21 H new ATOM 1406 N ASP A 84 -4.780 -0.458 -8.934 1.00 40.15 N ATOM 1407 CA ASP A 84 -5.238 -1.524 -9.836 1.00 35.45 C ATOM 1408 C ASP A 84 -5.826 -0.939 -11.130 1.00 64.14 C ATOM 1409 O ASP A 84 -6.284 0.204 -11.163 1.00 73.12 O ATOM 1410 CB ASP A 84 -6.273 -2.421 -9.136 1.00 74.34 C ATOM 1411 CG ASP A 84 -6.719 -3.601 -9.997 1.00 30.31 C ATOM 1412 OD1 ASP A 84 -5.894 -4.118 -10.791 1.00 14.33 O ATOM 1413 OD2 ASP A 84 -7.883 -4.022 -9.878 1.00 4.13 O ATOM 0 H ASP A 84 -5.296 0.417 -9.026 1.00 40.15 H new ATOM 0 HA ASP A 84 -4.373 -2.132 -10.100 1.00 35.45 H new ATOM 0 HB2 ASP A 84 -5.849 -2.797 -8.205 1.00 74.34 H new ATOM 0 HB3 ASP A 84 -7.144 -1.822 -8.870 1.00 74.34 H new ATOM 1418 N GLN A 85 -5.798 -1.737 -12.194 1.00 41.14 N ATOM 1419 CA GLN A 85 -6.314 -1.326 -13.502 1.00 22.10 C ATOM 1420 C GLN A 85 -7.772 -1.777 -13.696 1.00 1.32 C ATOM 1421 O GLN A 85 -8.531 -1.160 -14.449 1.00 70.25 O ATOM 1422 CB GLN A 85 -5.437 -1.915 -14.614 1.00 74.12 C ATOM 1423 CG GLN A 85 -3.967 -1.510 -14.523 1.00 73.12 C ATOM 1424 CD GLN A 85 -3.095 -2.206 -15.558 1.00 70.43 C ATOM 1425 OE1 GLN A 85 -2.907 -1.714 -16.667 1.00 64.20 O ATOM 1426 NE2 GLN A 85 -2.566 -3.363 -15.209 1.00 43.50 N ATOM 0 H GLN A 85 -5.419 -2.684 -12.177 1.00 41.14 H new ATOM 0 HA GLN A 85 -6.287 -0.237 -13.549 1.00 22.10 H new ATOM 0 HB2 GLN A 85 -5.507 -3.002 -14.581 1.00 74.12 H new ATOM 0 HB3 GLN A 85 -5.832 -1.600 -15.580 1.00 74.12 H new ATOM 0 HG2 GLN A 85 -3.884 -0.431 -14.652 1.00 73.12 H new ATOM 0 HG3 GLN A 85 -3.593 -1.741 -13.526 1.00 73.12 H new ATOM 0 HE21 GLN A 85 -2.742 -3.744 -14.279 1.00 43.50 H new ATOM 0 HE22 GLN A 85 -1.981 -3.876 -15.869 1.00 43.50 H new ATOM 1435 N ASP A 86 -8.152 -2.863 -13.030 1.00 73.54 N ATOM 1436 CA ASP A 86 -9.513 -3.395 -13.117 1.00 24.22 C ATOM 1437 C ASP A 86 -10.437 -2.707 -12.094 1.00 14.34 C ATOM 1438 O ASP A 86 -10.567 -3.157 -10.955 1.00 4.20 O ATOM 1439 CB ASP A 86 -9.494 -4.914 -12.893 1.00 22.53 C ATOM 1440 CG ASP A 86 -8.639 -5.636 -13.923 1.00 74.14 C ATOM 1441 OD1 ASP A 86 -9.171 -6.012 -14.986 1.00 1.33 O ATOM 1442 OD2 ASP A 86 -7.430 -5.830 -13.678 1.00 63.42 O ATOM 0 H ASP A 86 -7.534 -3.397 -12.419 1.00 73.54 H new ATOM 0 HA ASP A 86 -9.905 -3.190 -14.113 1.00 24.22 H new ATOM 0 HB2 ASP A 86 -9.114 -5.127 -11.894 1.00 22.53 H new ATOM 0 HB3 ASP A 86 -10.513 -5.299 -12.935 1.00 22.53 H new ATOM 1447 N GLN A 87 -11.075 -1.611 -12.514 1.00 71.10 N ATOM 1448 CA GLN A 87 -11.915 -0.799 -11.619 1.00 5.40 C ATOM 1449 C GLN A 87 -12.975 -1.640 -10.885 1.00 32.30 C ATOM 1450 O GLN A 87 -13.313 -1.360 -9.730 1.00 21.41 O ATOM 1451 CB GLN A 87 -12.593 0.332 -12.406 1.00 32.20 C ATOM 1452 CG GLN A 87 -11.612 1.320 -13.032 1.00 23.13 C ATOM 1453 CD GLN A 87 -12.310 2.447 -13.778 1.00 13.15 C ATOM 1454 OE1 GLN A 87 -12.621 3.487 -13.211 1.00 55.44 O ATOM 1455 NE2 GLN A 87 -12.570 2.248 -15.053 1.00 60.13 N ATOM 0 H GLN A 87 -11.028 -1.262 -13.471 1.00 71.10 H new ATOM 0 HA GLN A 87 -11.257 -0.374 -10.861 1.00 5.40 H new ATOM 0 HB2 GLN A 87 -13.208 -0.104 -13.194 1.00 32.20 H new ATOM 0 HB3 GLN A 87 -13.265 0.874 -11.740 1.00 32.20 H new ATOM 0 HG2 GLN A 87 -10.981 1.743 -12.251 1.00 23.13 H new ATOM 0 HG3 GLN A 87 -10.955 0.787 -13.719 1.00 23.13 H new ATOM 0 HE21 GLN A 87 -12.299 1.371 -15.498 1.00 60.13 H new ATOM 0 HE22 GLN A 87 -13.043 2.971 -15.596 1.00 60.13 H new ATOM 1464 N ASN A 88 -13.497 -2.664 -11.560 1.00 22.32 N ATOM 1465 CA ASN A 88 -14.462 -3.592 -10.950 1.00 54.11 C ATOM 1466 C ASN A 88 -13.872 -4.229 -9.674 1.00 4.42 C ATOM 1467 O ASN A 88 -14.482 -4.184 -8.602 1.00 65.03 O ATOM 1468 CB ASN A 88 -14.846 -4.682 -11.963 1.00 72.01 C ATOM 1469 CG ASN A 88 -16.061 -5.492 -11.544 1.00 4.33 C ATOM 1470 OD1 ASN A 88 -16.376 -5.616 -10.366 1.00 11.44 O ATOM 1471 ND2 ASN A 88 -16.743 -6.071 -12.510 1.00 5.05 N ATOM 0 H ASN A 88 -13.270 -2.876 -12.532 1.00 22.32 H new ATOM 0 HA ASN A 88 -15.356 -3.035 -10.670 1.00 54.11 H new ATOM 0 HB2 ASN A 88 -15.044 -4.217 -12.929 1.00 72.01 H new ATOM 0 HB3 ASN A 88 -13.999 -5.355 -12.100 1.00 72.01 H new ATOM 0 HD21 ASN A 88 -17.559 -6.642 -12.287 1.00 5.05 H new ATOM 0 HD22 ASN A 88 -16.456 -5.949 -13.481 1.00 5.05 H new ATOM 1478 N ARG A 89 -12.669 -4.796 -9.800 1.00 25.51 N ATOM 1479 CA ARG A 89 -11.963 -5.409 -8.662 1.00 51.34 C ATOM 1480 C ARG A 89 -11.535 -4.344 -7.639 1.00 71.10 C ATOM 1481 O ARG A 89 -11.764 -4.489 -6.434 1.00 73.45 O ATOM 1482 CB ARG A 89 -10.713 -6.156 -9.151 1.00 10.22 C ATOM 1483 CG ARG A 89 -10.988 -7.243 -10.182 1.00 11.53 C ATOM 1484 CD ARG A 89 -9.690 -7.884 -10.666 1.00 10.35 C ATOM 1485 NE ARG A 89 -9.925 -8.960 -11.625 1.00 14.55 N ATOM 1486 CZ ARG A 89 -8.974 -9.624 -12.224 1.00 32.21 C ATOM 1487 NH1 ARG A 89 -7.731 -9.324 -12.023 1.00 62.21 N ATOM 1488 NH2 ARG A 89 -9.262 -10.583 -13.039 1.00 1.34 N ATOM 0 H ARG A 89 -12.158 -4.845 -10.682 1.00 25.51 H new ATOM 0 HA ARG A 89 -12.650 -6.107 -8.185 1.00 51.34 H new ATOM 0 HB2 ARG A 89 -10.019 -5.434 -9.580 1.00 10.22 H new ATOM 0 HB3 ARG A 89 -10.215 -6.606 -8.292 1.00 10.22 H new ATOM 0 HG2 ARG A 89 -11.634 -8.006 -9.747 1.00 11.53 H new ATOM 0 HG3 ARG A 89 -11.525 -6.817 -11.030 1.00 11.53 H new ATOM 0 HD2 ARG A 89 -9.061 -7.122 -11.126 1.00 10.35 H new ATOM 0 HD3 ARG A 89 -9.141 -8.277 -9.810 1.00 10.35 H new ATOM 0 HE ARG A 89 -10.891 -9.208 -11.840 1.00 14.55 H new ATOM 0 HH11 ARG A 89 -7.486 -8.562 -11.391 1.00 62.21 H new ATOM 0 HH12 ARG A 89 -6.996 -9.850 -12.497 1.00 62.21 H new ATOM 0 HH21 ARG A 89 -10.237 -10.825 -13.218 1.00 1.34 H new ATOM 0 HH22 ARG A 89 -8.515 -11.098 -13.504 1.00 1.34 H new ATOM 1502 N LEU A 90 -10.909 -3.281 -8.146 1.00 73.11 N ATOM 1503 CA LEU A 90 -10.415 -2.168 -7.324 1.00 74.43 C ATOM 1504 C LEU A 90 -11.446 -1.704 -6.284 1.00 35.23 C ATOM 1505 O LEU A 90 -11.186 -1.747 -5.081 1.00 12.13 O ATOM 1506 CB LEU A 90 -10.021 -0.991 -8.235 1.00 55.30 C ATOM 1507 CG LEU A 90 -9.519 0.276 -7.518 1.00 5.23 C ATOM 1508 CD1 LEU A 90 -8.252 -0.012 -6.718 1.00 71.05 C ATOM 1509 CD2 LEU A 90 -9.279 1.399 -8.524 1.00 63.30 C ATOM 0 H LEU A 90 -10.728 -3.164 -9.143 1.00 73.11 H new ATOM 0 HA LEU A 90 -9.544 -2.526 -6.775 1.00 74.43 H new ATOM 0 HB2 LEU A 90 -9.243 -1.331 -8.919 1.00 55.30 H new ATOM 0 HB3 LEU A 90 -10.885 -0.723 -8.843 1.00 55.30 H new ATOM 0 HG LEU A 90 -10.290 0.598 -6.818 1.00 5.23 H new ATOM 0 HD11 LEU A 90 -7.920 0.900 -6.222 1.00 71.05 H new ATOM 0 HD12 LEU A 90 -8.460 -0.777 -5.970 1.00 71.05 H new ATOM 0 HD13 LEU A 90 -7.470 -0.365 -7.390 1.00 71.05 H new ATOM 0 HD21 LEU A 90 -8.925 2.287 -8.000 1.00 63.30 H new ATOM 0 HD22 LEU A 90 -8.530 1.083 -9.250 1.00 63.30 H new ATOM 0 HD23 LEU A 90 -10.211 1.630 -9.040 1.00 63.30 H new ATOM 1521 N GLU A 91 -12.616 -1.270 -6.749 1.00 64.33 N ATOM 1522 CA GLU A 91 -13.646 -0.730 -5.854 1.00 51.44 C ATOM 1523 C GLU A 91 -14.298 -1.819 -4.985 1.00 1.12 C ATOM 1524 O GLU A 91 -14.729 -1.541 -3.862 1.00 51.42 O ATOM 1525 CB GLU A 91 -14.714 0.022 -6.655 1.00 52.33 C ATOM 1526 CG GLU A 91 -14.172 1.235 -7.409 1.00 53.22 C ATOM 1527 CD GLU A 91 -15.274 2.060 -8.055 1.00 62.00 C ATOM 1528 OE1 GLU A 91 -15.667 1.748 -9.197 1.00 44.30 O ATOM 1529 OE2 GLU A 91 -15.765 3.010 -7.409 1.00 72.31 O ATOM 0 H GLU A 91 -12.877 -1.280 -7.735 1.00 64.33 H new ATOM 0 HA GLU A 91 -13.148 -0.034 -5.179 1.00 51.44 H new ATOM 0 HB2 GLU A 91 -15.171 -0.664 -7.368 1.00 52.33 H new ATOM 0 HB3 GLU A 91 -15.502 0.349 -5.977 1.00 52.33 H new ATOM 0 HG2 GLU A 91 -13.608 1.864 -6.721 1.00 53.22 H new ATOM 0 HG3 GLU A 91 -13.476 0.900 -8.178 1.00 53.22 H new ATOM 1536 N GLU A 92 -14.369 -3.050 -5.501 1.00 43.02 N ATOM 1537 CA GLU A 92 -14.909 -4.186 -4.737 1.00 1.13 C ATOM 1538 C GLU A 92 -14.114 -4.383 -3.439 1.00 30.12 C ATOM 1539 O GLU A 92 -14.680 -4.443 -2.343 1.00 12.32 O ATOM 1540 CB GLU A 92 -14.882 -5.464 -5.607 1.00 73.14 C ATOM 1541 CG GLU A 92 -15.519 -6.703 -4.963 1.00 52.22 C ATOM 1542 CD GLU A 92 -14.530 -7.577 -4.197 1.00 10.00 C ATOM 1543 OE1 GLU A 92 -13.805 -8.368 -4.837 1.00 1.45 O ATOM 1544 OE2 GLU A 92 -14.495 -7.506 -2.951 1.00 41.13 O ATOM 0 H GLU A 92 -14.060 -3.288 -6.444 1.00 43.02 H new ATOM 0 HA GLU A 92 -15.944 -3.976 -4.466 1.00 1.13 H new ATOM 0 HB2 GLU A 92 -15.396 -5.257 -6.546 1.00 73.14 H new ATOM 0 HB3 GLU A 92 -13.846 -5.694 -5.855 1.00 73.14 H new ATOM 0 HG2 GLU A 92 -16.308 -6.382 -4.283 1.00 52.22 H new ATOM 0 HG3 GLU A 92 -15.992 -7.302 -5.741 1.00 52.22 H new ATOM 1551 N PHE A 93 -12.792 -4.451 -3.571 1.00 13.44 N ATOM 1552 CA PHE A 93 -11.902 -4.579 -2.416 1.00 41.41 C ATOM 1553 C PHE A 93 -11.848 -3.276 -1.598 1.00 51.12 C ATOM 1554 O PHE A 93 -11.946 -3.299 -0.368 1.00 21.52 O ATOM 1555 CB PHE A 93 -10.494 -4.976 -2.880 1.00 61.30 C ATOM 1556 CG PHE A 93 -9.485 -5.055 -1.761 1.00 20.45 C ATOM 1557 CD1 PHE A 93 -9.657 -5.956 -0.719 1.00 12.20 C ATOM 1558 CD2 PHE A 93 -8.374 -4.225 -1.745 1.00 74.30 C ATOM 1559 CE1 PHE A 93 -8.740 -6.030 0.310 1.00 71.32 C ATOM 1560 CE2 PHE A 93 -7.452 -4.297 -0.719 1.00 21.21 C ATOM 1561 CZ PHE A 93 -7.638 -5.197 0.312 1.00 4.14 C ATOM 0 H PHE A 93 -12.310 -4.420 -4.469 1.00 13.44 H new ATOM 0 HA PHE A 93 -12.300 -5.360 -1.768 1.00 41.41 H new ATOM 0 HB2 PHE A 93 -10.545 -5.943 -3.380 1.00 61.30 H new ATOM 0 HB3 PHE A 93 -10.148 -4.253 -3.619 1.00 61.30 H new ATOM 0 HD1 PHE A 93 -10.519 -6.607 -0.713 1.00 12.20 H new ATOM 0 HD2 PHE A 93 -8.228 -3.514 -2.544 1.00 74.30 H new ATOM 0 HE1 PHE A 93 -8.884 -6.738 1.113 1.00 71.32 H new ATOM 0 HE2 PHE A 93 -6.587 -3.650 -0.723 1.00 21.21 H new ATOM 0 HZ PHE A 93 -6.922 -5.249 1.119 1.00 4.14 H new ATOM 1571 N SER A 94 -11.703 -2.141 -2.289 1.00 71.11 N ATOM 1572 CA SER A 94 -11.618 -0.825 -1.627 1.00 22.22 C ATOM 1573 C SER A 94 -12.826 -0.556 -0.714 1.00 64.14 C ATOM 1574 O SER A 94 -12.710 0.149 0.293 1.00 1.02 O ATOM 1575 CB SER A 94 -11.495 0.302 -2.663 1.00 11.03 C ATOM 1576 OG SER A 94 -10.265 0.225 -3.370 1.00 54.00 O ATOM 0 H SER A 94 -11.642 -2.102 -3.306 1.00 71.11 H new ATOM 0 HA SER A 94 -10.723 -0.845 -1.006 1.00 22.22 H new ATOM 0 HB2 SER A 94 -12.325 0.243 -3.367 1.00 11.03 H new ATOM 0 HB3 SER A 94 -11.569 1.268 -2.163 1.00 11.03 H new ATOM 0 HG SER A 94 -10.341 -0.439 -4.087 1.00 54.00 H new ATOM 1582 N ARG A 95 -13.984 -1.114 -1.072 1.00 53.21 N ATOM 1583 CA ARG A 95 -15.185 -1.003 -0.238 1.00 24.15 C ATOM 1584 C ARG A 95 -14.950 -1.633 1.145 1.00 53.53 C ATOM 1585 O ARG A 95 -15.194 -1.008 2.181 1.00 41.43 O ATOM 1586 CB ARG A 95 -16.380 -1.682 -0.927 1.00 74.33 C ATOM 1587 CG ARG A 95 -17.711 -1.533 -0.182 1.00 31.13 C ATOM 1588 CD ARG A 95 -18.298 -0.122 -0.290 1.00 23.52 C ATOM 1589 NE ARG A 95 -17.419 0.907 0.273 1.00 64.13 N ATOM 1590 CZ ARG A 95 -17.613 1.503 1.419 1.00 20.30 C ATOM 1591 NH1 ARG A 95 -18.608 1.177 2.182 1.00 63.10 N ATOM 1592 NH2 ARG A 95 -16.795 2.426 1.807 1.00 64.55 N ATOM 0 H ARG A 95 -14.117 -1.646 -1.932 1.00 53.21 H new ATOM 0 HA ARG A 95 -15.407 0.056 -0.104 1.00 24.15 H new ATOM 0 HB2 ARG A 95 -16.490 -1.266 -1.929 1.00 74.33 H new ATOM 0 HB3 ARG A 95 -16.161 -2.743 -1.045 1.00 74.33 H new ATOM 0 HG2 ARG A 95 -18.428 -2.251 -0.581 1.00 31.13 H new ATOM 0 HG3 ARG A 95 -17.563 -1.780 0.869 1.00 31.13 H new ATOM 0 HD2 ARG A 95 -18.491 0.106 -1.338 1.00 23.52 H new ATOM 0 HD3 ARG A 95 -19.258 -0.093 0.225 1.00 23.52 H new ATOM 0 HE ARG A 95 -16.598 1.177 -0.268 1.00 64.13 H new ATOM 0 HH11 ARG A 95 -19.255 0.444 1.891 1.00 63.10 H new ATOM 0 HH12 ARG A 95 -18.744 1.653 3.074 1.00 63.10 H new ATOM 0 HH21 ARG A 95 -16.003 2.686 1.219 1.00 64.55 H new ATOM 0 HH22 ARG A 95 -16.942 2.895 2.701 1.00 64.55 H new ATOM 1606 N GLU A 96 -14.452 -2.868 1.147 1.00 30.00 N ATOM 1607 CA GLU A 96 -14.175 -3.605 2.384 1.00 3.05 C ATOM 1608 C GLU A 96 -13.045 -2.959 3.203 1.00 33.41 C ATOM 1609 O GLU A 96 -12.985 -3.115 4.421 1.00 35.41 O ATOM 1610 CB GLU A 96 -13.821 -5.060 2.051 1.00 24.10 C ATOM 1611 CG GLU A 96 -14.982 -5.851 1.457 1.00 35.13 C ATOM 1612 CD GLU A 96 -16.103 -6.088 2.460 1.00 12.24 C ATOM 1613 OE1 GLU A 96 -15.932 -6.948 3.348 1.00 25.14 O ATOM 1614 OE2 GLU A 96 -17.157 -5.419 2.371 1.00 25.14 O ATOM 0 H GLU A 96 -14.229 -3.386 0.297 1.00 30.00 H new ATOM 0 HA GLU A 96 -15.076 -3.575 2.997 1.00 3.05 H new ATOM 0 HB2 GLU A 96 -12.988 -5.071 1.348 1.00 24.10 H new ATOM 0 HB3 GLU A 96 -13.479 -5.559 2.958 1.00 24.10 H new ATOM 0 HG2 GLU A 96 -15.378 -5.315 0.595 1.00 35.13 H new ATOM 0 HG3 GLU A 96 -14.615 -6.811 1.094 1.00 35.13 H new ATOM 1621 N VAL A 97 -12.146 -2.240 2.534 1.00 31.22 N ATOM 1622 CA VAL A 97 -11.053 -1.545 3.228 1.00 1.34 C ATOM 1623 C VAL A 97 -11.581 -0.377 4.076 1.00 14.03 C ATOM 1624 O VAL A 97 -11.337 -0.314 5.283 1.00 71.44 O ATOM 1625 CB VAL A 97 -9.984 -1.015 2.238 1.00 15.22 C ATOM 1626 CG1 VAL A 97 -8.839 -0.334 2.988 1.00 1.11 C ATOM 1627 CG2 VAL A 97 -9.456 -2.147 1.363 1.00 33.44 C ATOM 0 H VAL A 97 -12.148 -2.121 1.521 1.00 31.22 H new ATOM 0 HA VAL A 97 -10.587 -2.281 3.883 1.00 1.34 H new ATOM 0 HB VAL A 97 -10.455 -0.273 1.593 1.00 15.22 H new ATOM 0 HG11 VAL A 97 -8.101 0.030 2.273 1.00 1.11 H new ATOM 0 HG12 VAL A 97 -9.230 0.504 3.565 1.00 1.11 H new ATOM 0 HG13 VAL A 97 -8.369 -1.050 3.662 1.00 1.11 H new ATOM 0 HG21 VAL A 97 -8.707 -1.756 0.675 1.00 33.44 H new ATOM 0 HG22 VAL A 97 -9.005 -2.914 1.993 1.00 33.44 H new ATOM 0 HG23 VAL A 97 -10.278 -2.582 0.795 1.00 33.44 H new ATOM 1637 N ARG A 98 -12.316 0.541 3.442 1.00 31.15 N ATOM 1638 CA ARG A 98 -12.891 1.695 4.152 1.00 23.40 C ATOM 1639 C ARG A 98 -13.890 1.220 5.219 1.00 54.32 C ATOM 1640 O ARG A 98 -13.997 1.809 6.294 1.00 1.42 O ATOM 1641 CB ARG A 98 -13.569 2.656 3.150 1.00 11.32 C ATOM 1642 CG ARG A 98 -13.729 4.099 3.650 1.00 11.34 C ATOM 1643 CD ARG A 98 -14.863 4.263 4.663 1.00 72.34 C ATOM 1644 NE ARG A 98 -14.892 5.610 5.231 1.00 2.23 N ATOM 1645 CZ ARG A 98 -15.978 6.258 5.556 1.00 11.03 C ATOM 1646 NH1 ARG A 98 -17.146 5.718 5.413 1.00 53.25 N ATOM 1647 NH2 ARG A 98 -15.886 7.449 6.041 1.00 71.23 N ATOM 0 H ARG A 98 -12.528 0.511 2.445 1.00 31.15 H new ATOM 0 HA ARG A 98 -12.089 2.236 4.654 1.00 23.40 H new ATOM 0 HB2 ARG A 98 -12.987 2.668 2.229 1.00 11.32 H new ATOM 0 HB3 ARG A 98 -14.554 2.262 2.899 1.00 11.32 H new ATOM 0 HG2 ARG A 98 -12.794 4.425 4.105 1.00 11.34 H new ATOM 0 HG3 ARG A 98 -13.914 4.754 2.798 1.00 11.34 H new ATOM 0 HD2 ARG A 98 -15.816 4.052 4.179 1.00 72.34 H new ATOM 0 HD3 ARG A 98 -14.744 3.533 5.464 1.00 72.34 H new ATOM 0 HE ARG A 98 -13.999 6.078 5.385 1.00 2.23 H new ATOM 0 HH11 ARG A 98 -17.228 4.772 5.041 1.00 53.25 H new ATOM 0 HH12 ARG A 98 -17.984 6.239 5.672 1.00 53.25 H new ATOM 0 HH21 ARG A 98 -14.970 7.878 6.168 1.00 71.23 H new ATOM 0 HH22 ARG A 98 -16.730 7.962 6.297 1.00 71.23 H new ATOM 1661 N ARG A 99 -14.602 0.138 4.910 1.00 41.11 N ATOM 1662 CA ARG A 99 -15.542 -0.493 5.846 1.00 44.40 C ATOM 1663 C ARG A 99 -14.880 -0.804 7.203 1.00 65.23 C ATOM 1664 O ARG A 99 -15.541 -0.825 8.241 1.00 4.32 O ATOM 1665 CB ARG A 99 -16.079 -1.786 5.210 1.00 20.13 C ATOM 1666 CG ARG A 99 -17.053 -2.575 6.078 1.00 2.11 C ATOM 1667 CD ARG A 99 -17.489 -3.866 5.386 1.00 54.40 C ATOM 1668 NE ARG A 99 -18.402 -4.659 6.210 1.00 11.55 N ATOM 1669 CZ ARG A 99 -18.615 -5.940 6.048 1.00 34.33 C ATOM 1670 NH1 ARG A 99 -18.010 -6.606 5.114 1.00 4.21 N ATOM 1671 NH2 ARG A 99 -19.449 -6.559 6.818 1.00 21.11 N ATOM 0 H ARG A 99 -14.546 -0.329 4.005 1.00 41.11 H new ATOM 0 HA ARG A 99 -16.359 0.202 6.039 1.00 44.40 H new ATOM 0 HB2 ARG A 99 -16.574 -1.533 4.272 1.00 20.13 H new ATOM 0 HB3 ARG A 99 -15.234 -2.429 4.962 1.00 20.13 H new ATOM 0 HG2 ARG A 99 -16.584 -2.812 7.033 1.00 2.11 H new ATOM 0 HG3 ARG A 99 -17.928 -1.963 6.296 1.00 2.11 H new ATOM 0 HD2 ARG A 99 -17.975 -3.622 4.441 1.00 54.40 H new ATOM 0 HD3 ARG A 99 -16.608 -4.462 5.147 1.00 54.40 H new ATOM 0 HE ARG A 99 -18.905 -4.183 6.959 1.00 11.55 H new ATOM 0 HH11 ARG A 99 -17.356 -6.132 4.491 1.00 4.21 H new ATOM 0 HH12 ARG A 99 -18.188 -7.604 5.002 1.00 4.21 H new ATOM 0 HH21 ARG A 99 -19.941 -6.049 7.552 1.00 21.11 H new ATOM 0 HH22 ARG A 99 -19.615 -7.557 6.692 1.00 21.11 H new ATOM 1685 N ARG A 100 -13.564 -1.028 7.185 1.00 72.13 N ATOM 1686 CA ARG A 100 -12.814 -1.393 8.397 1.00 52.15 C ATOM 1687 C ARG A 100 -12.182 -0.172 9.095 1.00 51.43 C ATOM 1688 O ARG A 100 -11.350 -0.320 9.993 1.00 54.21 O ATOM 1689 CB ARG A 100 -11.736 -2.421 8.031 1.00 45.03 C ATOM 1690 CG ARG A 100 -12.315 -3.694 7.428 1.00 32.31 C ATOM 1691 CD ARG A 100 -11.236 -4.680 6.997 1.00 21.24 C ATOM 1692 NE ARG A 100 -11.820 -5.951 6.567 1.00 64.12 N ATOM 1693 CZ ARG A 100 -11.867 -6.371 5.331 1.00 70.40 C ATOM 1694 NH1 ARG A 100 -11.388 -5.651 4.367 1.00 75.21 N ATOM 1695 NH2 ARG A 100 -12.411 -7.511 5.063 1.00 4.34 N ATOM 0 H ARG A 100 -12.991 -0.964 6.344 1.00 72.13 H new ATOM 0 HA ARG A 100 -13.518 -1.825 9.109 1.00 52.15 H new ATOM 0 HB2 ARG A 100 -11.039 -1.973 7.323 1.00 45.03 H new ATOM 0 HB3 ARG A 100 -11.164 -2.675 8.924 1.00 45.03 H new ATOM 0 HG2 ARG A 100 -12.969 -4.172 8.157 1.00 32.31 H new ATOM 0 HG3 ARG A 100 -12.932 -3.436 6.567 1.00 32.31 H new ATOM 0 HD2 ARG A 100 -10.653 -4.251 6.182 1.00 21.24 H new ATOM 0 HD3 ARG A 100 -10.548 -4.855 7.824 1.00 21.24 H new ATOM 0 HE ARG A 100 -12.220 -6.554 7.286 1.00 64.12 H new ATOM 0 HH11 ARG A 100 -10.967 -4.744 4.568 1.00 75.21 H new ATOM 0 HH12 ARG A 100 -11.431 -5.991 3.406 1.00 75.21 H new ATOM 0 HH21 ARG A 100 -12.802 -8.079 5.815 1.00 4.34 H new ATOM 0 HH22 ARG A 100 -12.450 -7.843 4.099 1.00 4.34 H new ATOM 1709 N GLY A 101 -12.574 1.030 8.676 1.00 21.30 N ATOM 1710 CA GLY A 101 -12.117 2.251 9.341 1.00 32.43 C ATOM 1711 C GLY A 101 -10.826 2.839 8.767 1.00 31.41 C ATOM 1712 O GLY A 101 -10.528 4.015 8.987 1.00 22.34 O ATOM 0 H GLY A 101 -13.201 1.185 7.887 1.00 21.30 H new ATOM 0 HA2 GLY A 101 -12.904 3.002 9.276 1.00 32.43 H new ATOM 0 HA3 GLY A 101 -11.966 2.039 10.399 1.00 32.43 H new ATOM 1716 N PHE A 102 -10.056 2.034 8.036 1.00 12.33 N ATOM 1717 CA PHE A 102 -8.791 2.499 7.454 1.00 40.43 C ATOM 1718 C PHE A 102 -9.019 3.514 6.319 1.00 14.01 C ATOM 1719 O PHE A 102 -9.989 3.417 5.563 1.00 50.35 O ATOM 1720 CB PHE A 102 -7.970 1.313 6.926 1.00 35.43 C ATOM 1721 CG PHE A 102 -7.347 0.456 8.006 1.00 24.22 C ATOM 1722 CD1 PHE A 102 -6.241 0.910 8.714 1.00 55.45 C ATOM 1723 CD2 PHE A 102 -7.847 -0.809 8.301 1.00 2.45 C ATOM 1724 CE1 PHE A 102 -5.649 0.128 9.689 1.00 32.20 C ATOM 1725 CE2 PHE A 102 -7.258 -1.594 9.280 1.00 44.10 C ATOM 1726 CZ PHE A 102 -6.156 -1.125 9.974 1.00 52.14 C ATOM 0 H PHE A 102 -10.282 1.061 7.832 1.00 12.33 H new ATOM 0 HA PHE A 102 -8.238 2.998 8.250 1.00 40.43 H new ATOM 0 HB2 PHE A 102 -8.614 0.687 6.308 1.00 35.43 H new ATOM 0 HB3 PHE A 102 -7.179 1.693 6.279 1.00 35.43 H new ATOM 0 HD1 PHE A 102 -5.837 1.889 8.500 1.00 55.45 H new ATOM 0 HD2 PHE A 102 -8.704 -1.183 7.761 1.00 2.45 H new ATOM 0 HE1 PHE A 102 -4.789 0.497 10.228 1.00 32.20 H new ATOM 0 HE2 PHE A 102 -7.659 -2.572 9.501 1.00 44.10 H new ATOM 0 HZ PHE A 102 -5.694 -1.736 10.735 1.00 52.14 H new ATOM 1736 N GLU A 103 -8.121 4.495 6.212 1.00 70.42 N ATOM 1737 CA GLU A 103 -8.188 5.485 5.132 1.00 34.03 C ATOM 1738 C GLU A 103 -7.632 4.915 3.820 1.00 54.54 C ATOM 1739 O GLU A 103 -6.417 4.803 3.641 1.00 34.23 O ATOM 1740 CB GLU A 103 -7.433 6.768 5.512 1.00 40.15 C ATOM 1741 CG GLU A 103 -8.081 7.551 6.649 1.00 1.25 C ATOM 1742 CD GLU A 103 -7.419 8.900 6.886 1.00 64.10 C ATOM 1743 OE1 GLU A 103 -7.533 9.776 6.008 1.00 30.14 O ATOM 1744 OE2 GLU A 103 -6.806 9.098 7.956 1.00 31.12 O ATOM 0 H GLU A 103 -7.341 4.626 6.856 1.00 70.42 H new ATOM 0 HA GLU A 103 -9.239 5.732 4.981 1.00 34.03 H new ATOM 0 HB2 GLU A 103 -6.414 6.507 5.798 1.00 40.15 H new ATOM 0 HB3 GLU A 103 -7.363 7.411 4.634 1.00 40.15 H new ATOM 0 HG2 GLU A 103 -9.137 7.704 6.424 1.00 1.25 H new ATOM 0 HG3 GLU A 103 -8.032 6.961 7.564 1.00 1.25 H new ATOM 1751 N VAL A 104 -8.534 4.547 2.913 1.00 40.13 N ATOM 1752 CA VAL A 104 -8.148 3.997 1.611 1.00 5.35 C ATOM 1753 C VAL A 104 -8.029 5.098 0.541 1.00 51.53 C ATOM 1754 O VAL A 104 -8.952 5.890 0.330 1.00 24.54 O ATOM 1755 CB VAL A 104 -9.152 2.908 1.142 1.00 50.11 C ATOM 1756 CG1 VAL A 104 -10.589 3.431 1.168 1.00 14.32 C ATOM 1757 CG2 VAL A 104 -8.785 2.389 -0.249 1.00 41.11 C ATOM 0 H VAL A 104 -9.542 4.619 3.054 1.00 40.13 H new ATOM 0 HA VAL A 104 -7.167 3.538 1.738 1.00 5.35 H new ATOM 0 HB VAL A 104 -9.089 2.075 1.842 1.00 50.11 H new ATOM 0 HG11 VAL A 104 -11.268 2.646 0.835 1.00 14.32 H new ATOM 0 HG12 VAL A 104 -10.849 3.729 2.184 1.00 14.32 H new ATOM 0 HG13 VAL A 104 -10.675 4.291 0.504 1.00 14.32 H new ATOM 0 HG21 VAL A 104 -9.503 1.628 -0.554 1.00 41.11 H new ATOM 0 HG22 VAL A 104 -8.805 3.213 -0.962 1.00 41.11 H new ATOM 0 HG23 VAL A 104 -7.785 1.955 -0.223 1.00 41.11 H new ATOM 1767 N ARG A 105 -6.874 5.147 -0.118 1.00 31.34 N ATOM 1768 CA ARG A 105 -6.618 6.105 -1.198 1.00 61.40 C ATOM 1769 C ARG A 105 -6.400 5.365 -2.525 1.00 74.10 C ATOM 1770 O ARG A 105 -5.482 4.554 -2.651 1.00 71.35 O ATOM 1771 CB ARG A 105 -5.388 6.965 -0.858 1.00 41.15 C ATOM 1772 CG ARG A 105 -5.489 7.673 0.493 1.00 13.11 C ATOM 1773 CD ARG A 105 -6.668 8.641 0.545 1.00 13.32 C ATOM 1774 NE ARG A 105 -6.905 9.159 1.893 1.00 14.14 N ATOM 1775 CZ ARG A 105 -7.973 9.829 2.240 1.00 52.24 C ATOM 1776 NH1 ARG A 105 -8.869 10.145 1.361 1.00 64.12 N ATOM 1777 NH2 ARG A 105 -8.139 10.202 3.465 1.00 61.22 N ATOM 0 H ARG A 105 -6.089 4.526 0.079 1.00 31.34 H new ATOM 0 HA ARG A 105 -7.485 6.757 -1.303 1.00 61.40 H new ATOM 0 HB2 ARG A 105 -4.501 6.332 -0.861 1.00 41.15 H new ATOM 0 HB3 ARG A 105 -5.250 7.711 -1.640 1.00 41.15 H new ATOM 0 HG2 ARG A 105 -5.594 6.931 1.284 1.00 13.11 H new ATOM 0 HG3 ARG A 105 -4.565 8.217 0.687 1.00 13.11 H new ATOM 0 HD2 ARG A 105 -6.481 9.473 -0.134 1.00 13.32 H new ATOM 0 HD3 ARG A 105 -7.566 8.135 0.190 1.00 13.32 H new ATOM 0 HE ARG A 105 -6.195 8.987 2.604 1.00 14.14 H new ATOM 0 HH11 ARG A 105 -8.746 9.871 0.386 1.00 64.12 H new ATOM 0 HH12 ARG A 105 -9.698 10.668 1.643 1.00 64.12 H new ATOM 0 HH21 ARG A 105 -7.435 9.974 4.167 1.00 61.22 H new ATOM 0 HH22 ARG A 105 -8.974 10.724 3.730 1.00 61.22 H new ATOM 1791 N THR A 106 -7.248 5.643 -3.506 1.00 3.35 N ATOM 1792 CA THR A 106 -7.214 4.931 -4.793 1.00 62.54 C ATOM 1793 C THR A 106 -6.432 5.709 -5.866 1.00 62.20 C ATOM 1794 O THR A 106 -6.692 6.885 -6.109 1.00 72.13 O ATOM 1795 CB THR A 106 -8.647 4.666 -5.316 1.00 74.32 C ATOM 1796 OG1 THR A 106 -9.393 5.893 -5.348 1.00 70.53 O ATOM 1797 CG2 THR A 106 -9.379 3.649 -4.439 1.00 24.42 C ATOM 0 H THR A 106 -7.973 6.358 -3.442 1.00 3.35 H new ATOM 0 HA THR A 106 -6.705 3.985 -4.608 1.00 62.54 H new ATOM 0 HB THR A 106 -8.565 4.258 -6.323 1.00 74.32 H new ATOM 0 HG1 THR A 106 -8.818 6.617 -5.674 1.00 70.53 H new ATOM 0 HG21 THR A 106 -10.382 3.485 -4.832 1.00 24.42 H new ATOM 0 HG22 THR A 106 -8.830 2.707 -4.439 1.00 24.42 H new ATOM 0 HG23 THR A 106 -9.447 4.030 -3.420 1.00 24.42 H new ATOM 1805 N VAL A 107 -5.472 5.039 -6.506 1.00 42.31 N ATOM 1806 CA VAL A 107 -4.672 5.651 -7.579 1.00 41.44 C ATOM 1807 C VAL A 107 -4.610 4.743 -8.822 1.00 62.13 C ATOM 1808 O VAL A 107 -4.513 3.521 -8.709 1.00 61.41 O ATOM 1809 CB VAL A 107 -3.230 5.978 -7.098 1.00 33.42 C ATOM 1810 CG1 VAL A 107 -3.246 7.095 -6.051 1.00 12.33 C ATOM 1811 CG2 VAL A 107 -2.544 4.730 -6.538 1.00 51.14 C ATOM 0 H VAL A 107 -5.226 4.070 -6.302 1.00 42.31 H new ATOM 0 HA VAL A 107 -5.169 6.582 -7.850 1.00 41.44 H new ATOM 0 HB VAL A 107 -2.660 6.323 -7.960 1.00 33.42 H new ATOM 0 HG11 VAL A 107 -2.226 7.307 -5.729 1.00 12.33 H new ATOM 0 HG12 VAL A 107 -3.684 7.994 -6.485 1.00 12.33 H new ATOM 0 HG13 VAL A 107 -3.839 6.781 -5.193 1.00 12.33 H new ATOM 0 HG21 VAL A 107 -1.537 4.985 -6.208 1.00 51.14 H new ATOM 0 HG22 VAL A 107 -3.117 4.348 -5.693 1.00 51.14 H new ATOM 0 HG23 VAL A 107 -2.489 3.966 -7.314 1.00 51.14 H new ATOM 1821 N THR A 108 -4.682 5.348 -10.010 1.00 61.14 N ATOM 1822 CA THR A 108 -4.685 4.586 -11.273 1.00 21.05 C ATOM 1823 C THR A 108 -3.456 4.887 -12.147 1.00 5.33 C ATOM 1824 O THR A 108 -3.358 4.402 -13.275 1.00 42.52 O ATOM 1825 CB THR A 108 -5.958 4.881 -12.103 1.00 31.22 C ATOM 1826 OG1 THR A 108 -6.052 6.290 -12.374 1.00 44.15 O ATOM 1827 CG2 THR A 108 -7.213 4.413 -11.371 1.00 23.51 C ATOM 0 H THR A 108 -4.739 6.359 -10.130 1.00 61.14 H new ATOM 0 HA THR A 108 -4.660 3.535 -10.984 1.00 21.05 H new ATOM 0 HB THR A 108 -5.884 4.333 -13.042 1.00 31.22 H new ATOM 0 HG1 THR A 108 -6.859 6.469 -12.901 1.00 44.15 H new ATOM 0 HG21 THR A 108 -8.091 4.633 -11.978 1.00 23.51 H new ATOM 0 HG22 THR A 108 -7.153 3.339 -11.196 1.00 23.51 H new ATOM 0 HG23 THR A 108 -7.292 4.932 -10.416 1.00 23.51 H new ATOM 1835 N SER A 109 -2.513 5.671 -11.624 1.00 55.41 N ATOM 1836 CA SER A 109 -1.304 6.044 -12.379 1.00 52.14 C ATOM 1837 C SER A 109 -0.191 6.540 -11.444 1.00 43.24 C ATOM 1838 O SER A 109 -0.476 7.134 -10.402 1.00 33.33 O ATOM 1839 CB SER A 109 -1.633 7.135 -13.413 1.00 43.34 C ATOM 1840 OG SER A 109 -0.460 7.613 -14.057 1.00 50.33 O ATOM 0 H SER A 109 -2.557 6.062 -10.683 1.00 55.41 H new ATOM 0 HA SER A 109 -0.949 5.151 -12.894 1.00 52.14 H new ATOM 0 HB2 SER A 109 -2.321 6.736 -14.158 1.00 43.34 H new ATOM 0 HB3 SER A 109 -2.142 7.963 -12.920 1.00 43.34 H new ATOM 0 HG SER A 109 -0.703 8.303 -14.709 1.00 50.33 H new ATOM 1846 N PRO A 110 1.094 6.301 -11.795 1.00 25.54 N ATOM 1847 CA PRO A 110 2.248 6.792 -11.011 1.00 4.01 C ATOM 1848 C PRO A 110 2.172 8.299 -10.692 1.00 50.44 C ATOM 1849 O PRO A 110 2.506 8.728 -9.586 1.00 72.35 O ATOM 1850 CB PRO A 110 3.442 6.495 -11.926 1.00 3.42 C ATOM 1851 CG PRO A 110 3.005 5.322 -12.736 1.00 73.24 C ATOM 1852 CD PRO A 110 1.528 5.513 -12.970 1.00 53.04 C ATOM 0 HA PRO A 110 2.302 6.312 -10.034 1.00 4.01 H new ATOM 0 HB2 PRO A 110 3.679 7.349 -12.560 1.00 3.42 H new ATOM 0 HB3 PRO A 110 4.338 6.268 -11.349 1.00 3.42 H new ATOM 0 HG2 PRO A 110 3.548 5.275 -13.680 1.00 73.24 H new ATOM 0 HG3 PRO A 110 3.200 4.388 -12.209 1.00 73.24 H new ATOM 0 HD2 PRO A 110 1.334 6.042 -13.903 1.00 53.04 H new ATOM 0 HD3 PRO A 110 1.004 4.559 -13.030 1.00 53.04 H new ATOM 1860 N ASP A 111 1.730 9.096 -11.666 1.00 71.14 N ATOM 1861 CA ASP A 111 1.561 10.540 -11.468 1.00 32.15 C ATOM 1862 C ASP A 111 0.453 10.841 -10.445 1.00 42.31 C ATOM 1863 O ASP A 111 0.663 11.602 -9.495 1.00 3.14 O ATOM 1864 CB ASP A 111 1.260 11.226 -12.806 1.00 50.12 C ATOM 1865 CG ASP A 111 2.457 11.213 -13.739 1.00 34.41 C ATOM 1866 OD1 ASP A 111 2.759 10.147 -14.316 1.00 22.40 O ATOM 1867 OD2 ASP A 111 3.111 12.267 -13.896 1.00 34.50 O ATOM 0 H ASP A 111 1.482 8.768 -12.600 1.00 71.14 H new ATOM 0 HA ASP A 111 2.495 10.937 -11.069 1.00 32.15 H new ATOM 0 HB2 ASP A 111 0.420 10.726 -13.288 1.00 50.12 H new ATOM 0 HB3 ASP A 111 0.955 12.256 -12.624 1.00 50.12 H new ATOM 1872 N ASP A 112 -0.724 10.240 -10.638 1.00 30.01 N ATOM 1873 CA ASP A 112 -1.827 10.366 -9.673 1.00 4.23 C ATOM 1874 C ASP A 112 -1.400 9.891 -8.276 1.00 3.45 C ATOM 1875 O ASP A 112 -1.855 10.416 -7.256 1.00 4.11 O ATOM 1876 CB ASP A 112 -3.045 9.573 -10.155 1.00 33.32 C ATOM 1877 CG ASP A 112 -3.650 10.177 -11.406 1.00 23.12 C ATOM 1878 OD1 ASP A 112 -4.537 11.047 -11.284 1.00 75.13 O ATOM 1879 OD2 ASP A 112 -3.234 9.795 -12.516 1.00 4.11 O ATOM 0 H ASP A 112 -0.940 9.662 -11.450 1.00 30.01 H new ATOM 0 HA ASP A 112 -2.095 11.420 -9.602 1.00 4.23 H new ATOM 0 HB2 ASP A 112 -2.752 8.542 -10.354 1.00 33.32 H new ATOM 0 HB3 ASP A 112 -3.796 9.544 -9.365 1.00 33.32 H new ATOM 1884 N PHE A 113 -0.518 8.899 -8.242 1.00 14.21 N ATOM 1885 CA PHE A 113 0.069 8.419 -6.991 1.00 45.12 C ATOM 1886 C PHE A 113 0.927 9.508 -6.327 1.00 44.22 C ATOM 1887 O PHE A 113 0.746 9.823 -5.152 1.00 35.22 O ATOM 1888 CB PHE A 113 0.909 7.162 -7.256 1.00 41.10 C ATOM 1889 CG PHE A 113 1.736 6.718 -6.076 1.00 51.25 C ATOM 1890 CD1 PHE A 113 1.143 6.080 -4.996 1.00 32.34 C ATOM 1891 CD2 PHE A 113 3.107 6.943 -6.045 1.00 63.10 C ATOM 1892 CE1 PHE A 113 1.900 5.677 -3.914 1.00 74.13 C ATOM 1893 CE2 PHE A 113 3.867 6.542 -4.964 1.00 32.34 C ATOM 1894 CZ PHE A 113 3.262 5.909 -3.896 1.00 54.23 C ATOM 0 H PHE A 113 -0.190 8.406 -9.073 1.00 14.21 H new ATOM 0 HA PHE A 113 -0.741 8.169 -6.306 1.00 45.12 H new ATOM 0 HB2 PHE A 113 0.245 6.348 -7.548 1.00 41.10 H new ATOM 0 HB3 PHE A 113 1.572 7.351 -8.101 1.00 41.10 H new ATOM 0 HD1 PHE A 113 0.079 5.897 -5.002 1.00 32.34 H new ATOM 0 HD2 PHE A 113 3.585 7.438 -6.878 1.00 63.10 H new ATOM 0 HE1 PHE A 113 1.427 5.180 -3.080 1.00 74.13 H new ATOM 0 HE2 PHE A 113 4.932 6.723 -4.954 1.00 32.34 H new ATOM 0 HZ PHE A 113 3.853 5.596 -3.048 1.00 54.23 H new ATOM 1904 N LYS A 114 1.850 10.088 -7.094 1.00 54.13 N ATOM 1905 CA LYS A 114 2.764 11.113 -6.567 1.00 34.23 C ATOM 1906 C LYS A 114 2.002 12.326 -6.007 1.00 54.23 C ATOM 1907 O LYS A 114 2.164 12.683 -4.841 1.00 34.23 O ATOM 1908 CB LYS A 114 3.741 11.577 -7.657 1.00 70.33 C ATOM 1909 CG LYS A 114 4.804 12.554 -7.151 1.00 63.31 C ATOM 1910 CD LYS A 114 5.693 13.067 -8.281 1.00 64.43 C ATOM 1911 CE LYS A 114 4.928 13.966 -9.248 1.00 3.54 C ATOM 1912 NZ LYS A 114 4.531 15.258 -8.621 1.00 4.44 N ATOM 0 H LYS A 114 1.988 9.869 -8.081 1.00 54.13 H new ATOM 0 HA LYS A 114 3.322 10.656 -5.750 1.00 34.23 H new ATOM 0 HB2 LYS A 114 4.235 10.705 -8.085 1.00 70.33 H new ATOM 0 HB3 LYS A 114 3.177 12.051 -8.461 1.00 70.33 H new ATOM 0 HG2 LYS A 114 4.317 13.397 -6.661 1.00 63.31 H new ATOM 0 HG3 LYS A 114 5.421 12.061 -6.399 1.00 63.31 H new ATOM 0 HD2 LYS A 114 6.532 13.620 -7.859 1.00 64.43 H new ATOM 0 HD3 LYS A 114 6.111 12.221 -8.826 1.00 64.43 H new ATOM 0 HE2 LYS A 114 5.546 14.164 -10.124 1.00 3.54 H new ATOM 0 HE3 LYS A 114 4.037 13.445 -9.598 1.00 3.54 H new ATOM 0 HZ1 LYS A 114 3.914 15.785 -9.272 1.00 4.44 H new ATOM 0 HZ2 LYS A 114 4.020 15.071 -7.735 1.00 4.44 H new ATOM 0 HZ3 LYS A 114 5.381 15.821 -8.418 1.00 4.44 H new ATOM 1926 N LYS A 115 1.151 12.938 -6.839 1.00 42.21 N ATOM 1927 CA LYS A 115 0.401 14.141 -6.438 1.00 30.34 C ATOM 1928 C LYS A 115 -0.464 13.886 -5.189 1.00 72.31 C ATOM 1929 O LYS A 115 -0.783 14.810 -4.437 1.00 4.43 O ATOM 1930 CB LYS A 115 -0.456 14.652 -7.615 1.00 71.15 C ATOM 1931 CG LYS A 115 -1.471 13.643 -8.161 1.00 74.43 C ATOM 1932 CD LYS A 115 -2.825 13.710 -7.449 1.00 54.54 C ATOM 1933 CE LYS A 115 -3.551 15.020 -7.736 1.00 40.14 C ATOM 1934 NZ LYS A 115 -4.873 15.081 -7.061 1.00 70.20 N ATOM 0 H LYS A 115 0.963 12.624 -7.791 1.00 42.21 H new ATOM 0 HA LYS A 115 1.122 14.914 -6.172 1.00 30.34 H new ATOM 0 HB2 LYS A 115 -0.991 15.546 -7.294 1.00 71.15 H new ATOM 0 HB3 LYS A 115 0.208 14.952 -8.426 1.00 71.15 H new ATOM 0 HG2 LYS A 115 -1.618 13.824 -9.226 1.00 74.43 H new ATOM 0 HG3 LYS A 115 -1.064 12.637 -8.062 1.00 74.43 H new ATOM 0 HD2 LYS A 115 -3.446 12.873 -7.769 1.00 54.54 H new ATOM 0 HD3 LYS A 115 -2.676 13.605 -6.374 1.00 54.54 H new ATOM 0 HE2 LYS A 115 -2.935 15.856 -7.405 1.00 40.14 H new ATOM 0 HE3 LYS A 115 -3.687 15.131 -8.812 1.00 40.14 H new ATOM 0 HZ1 LYS A 115 -5.334 15.987 -7.281 1.00 70.20 H new ATOM 0 HZ2 LYS A 115 -5.470 14.298 -7.396 1.00 70.20 H new ATOM 0 HZ3 LYS A 115 -4.742 15.001 -6.032 1.00 70.20 H new ATOM 1948 N SER A 116 -0.844 12.627 -4.978 1.00 45.33 N ATOM 1949 CA SER A 116 -1.564 12.227 -3.762 1.00 43.30 C ATOM 1950 C SER A 116 -0.596 12.035 -2.588 1.00 73.11 C ATOM 1951 O SER A 116 -0.819 12.548 -1.491 1.00 63.55 O ATOM 1952 CB SER A 116 -2.348 10.927 -4.003 1.00 30.45 C ATOM 1953 OG SER A 116 -3.373 11.114 -4.969 1.00 71.12 O ATOM 0 H SER A 116 -0.667 11.864 -5.631 1.00 45.33 H new ATOM 0 HA SER A 116 -2.263 13.025 -3.511 1.00 43.30 H new ATOM 0 HB2 SER A 116 -1.666 10.146 -4.339 1.00 30.45 H new ATOM 0 HB3 SER A 116 -2.787 10.585 -3.066 1.00 30.45 H new ATOM 0 HG SER A 116 -3.026 10.898 -5.860 1.00 71.12 H new ATOM 1959 N LEU A 117 0.492 11.313 -2.839 1.00 74.42 N ATOM 1960 CA LEU A 117 1.482 10.993 -1.806 1.00 10.11 C ATOM 1961 C LEU A 117 2.111 12.267 -1.213 1.00 25.12 C ATOM 1962 O LEU A 117 2.324 12.359 -0.004 1.00 43.12 O ATOM 1963 CB LEU A 117 2.575 10.081 -2.390 1.00 35.21 C ATOM 1964 CG LEU A 117 3.560 9.493 -1.363 1.00 62.42 C ATOM 1965 CD1 LEU A 117 2.836 8.572 -0.381 1.00 1.14 C ATOM 1966 CD2 LEU A 117 4.703 8.751 -2.059 1.00 74.02 C ATOM 0 H LEU A 117 0.715 10.933 -3.759 1.00 74.42 H new ATOM 0 HA LEU A 117 0.970 10.470 -0.999 1.00 10.11 H new ATOM 0 HB2 LEU A 117 2.094 9.259 -2.920 1.00 35.21 H new ATOM 0 HB3 LEU A 117 3.142 10.648 -3.129 1.00 35.21 H new ATOM 0 HG LEU A 117 3.990 10.321 -0.800 1.00 62.42 H new ATOM 0 HD11 LEU A 117 3.552 8.168 0.335 1.00 1.14 H new ATOM 0 HD12 LEU A 117 2.070 9.137 0.151 1.00 1.14 H new ATOM 0 HD13 LEU A 117 2.369 7.753 -0.927 1.00 1.14 H new ATOM 0 HD21 LEU A 117 5.383 8.346 -1.310 1.00 74.02 H new ATOM 0 HD22 LEU A 117 4.296 7.936 -2.658 1.00 74.02 H new ATOM 0 HD23 LEU A 117 5.245 9.441 -2.706 1.00 74.02 H new ATOM 1978 N GLU A 118 2.385 13.255 -2.069 1.00 61.41 N ATOM 1979 CA GLU A 118 2.962 14.539 -1.630 1.00 64.52 C ATOM 1980 C GLU A 118 2.074 15.235 -0.579 1.00 54.33 C ATOM 1981 O GLU A 118 2.532 16.101 0.171 1.00 60.50 O ATOM 1982 CB GLU A 118 3.187 15.459 -2.843 1.00 44.53 C ATOM 1983 CG GLU A 118 4.175 14.892 -3.863 1.00 0.21 C ATOM 1984 CD GLU A 118 4.391 15.800 -5.068 1.00 23.40 C ATOM 1985 OE1 GLU A 118 3.629 15.686 -6.059 1.00 44.41 O ATOM 1986 OE2 GLU A 118 5.331 16.624 -5.039 1.00 71.30 O ATOM 0 H GLU A 118 2.218 13.195 -3.073 1.00 61.41 H new ATOM 0 HA GLU A 118 3.922 14.330 -1.157 1.00 64.52 H new ATOM 0 HB2 GLU A 118 2.231 15.638 -3.335 1.00 44.53 H new ATOM 0 HB3 GLU A 118 3.552 16.425 -2.494 1.00 44.53 H new ATOM 0 HG2 GLU A 118 5.133 14.719 -3.372 1.00 0.21 H new ATOM 0 HG3 GLU A 118 3.813 13.923 -4.208 1.00 0.21 H new ATOM 1993 N ARG A 119 0.798 14.854 -0.541 1.00 41.01 N ATOM 1994 CA ARG A 119 -0.128 15.304 0.503 1.00 61.12 C ATOM 1995 C ARG A 119 -0.136 14.325 1.684 1.00 12.01 C ATOM 1996 O ARG A 119 0.079 14.713 2.834 1.00 11.51 O ATOM 1997 CB ARG A 119 -1.548 15.433 -0.068 1.00 24.14 C ATOM 1998 CG ARG A 119 -1.765 16.683 -0.910 1.00 43.13 C ATOM 1999 CD ARG A 119 -1.680 17.941 -0.056 1.00 12.30 C ATOM 2000 NE ARG A 119 -1.852 19.157 -0.840 1.00 41.23 N ATOM 2001 CZ ARG A 119 -2.078 20.331 -0.325 1.00 33.05 C ATOM 2002 NH1 ARG A 119 -2.204 20.473 0.955 1.00 12.13 N ATOM 2003 NH2 ARG A 119 -2.187 21.360 -1.090 1.00 62.13 N ATOM 0 H ARG A 119 0.377 14.228 -1.228 1.00 41.01 H new ATOM 0 HA ARG A 119 0.209 16.278 0.858 1.00 61.12 H new ATOM 0 HB2 ARG A 119 -1.765 14.555 -0.677 1.00 24.14 H new ATOM 0 HB3 ARG A 119 -2.261 15.434 0.756 1.00 24.14 H new ATOM 0 HG2 ARG A 119 -1.017 16.726 -1.702 1.00 43.13 H new ATOM 0 HG3 ARG A 119 -2.740 16.634 -1.395 1.00 43.13 H new ATOM 0 HD2 ARG A 119 -2.444 17.902 0.721 1.00 12.30 H new ATOM 0 HD3 ARG A 119 -0.714 17.970 0.448 1.00 12.30 H new ATOM 0 HE ARG A 119 -1.792 19.084 -1.856 1.00 41.23 H new ATOM 0 HH11 ARG A 119 -2.126 19.662 1.568 1.00 12.13 H new ATOM 0 HH12 ARG A 119 -2.381 21.396 1.351 1.00 12.13 H new ATOM 0 HH21 ARG A 119 -2.096 21.256 -2.101 1.00 62.13 H new ATOM 0 HH22 ARG A 119 -2.364 22.280 -0.686 1.00 62.13 H new ATOM 2017 N LEU A 120 -0.368 13.054 1.370 1.00 52.35 N ATOM 2018 CA LEU A 120 -0.488 11.992 2.372 1.00 21.34 C ATOM 2019 C LEU A 120 0.711 11.954 3.337 1.00 0.13 C ATOM 2020 O LEU A 120 0.541 11.740 4.537 1.00 3.04 O ATOM 2021 CB LEU A 120 -0.645 10.639 1.665 1.00 11.51 C ATOM 2022 CG LEU A 120 -1.868 10.528 0.735 1.00 44.41 C ATOM 2023 CD1 LEU A 120 -1.924 9.160 0.062 1.00 71.01 C ATOM 2024 CD2 LEU A 120 -3.157 10.809 1.504 1.00 20.25 C ATOM 0 H LEU A 120 -0.479 12.727 0.410 1.00 52.35 H new ATOM 0 HA LEU A 120 -1.371 12.203 2.975 1.00 21.34 H new ATOM 0 HB2 LEU A 120 0.255 10.444 1.082 1.00 11.51 H new ATOM 0 HB3 LEU A 120 -0.710 9.856 2.421 1.00 11.51 H new ATOM 0 HG LEU A 120 -1.766 11.280 -0.047 1.00 44.41 H new ATOM 0 HD11 LEU A 120 -2.797 9.110 -0.588 1.00 71.01 H new ATOM 0 HD12 LEU A 120 -1.021 9.009 -0.530 1.00 71.01 H new ATOM 0 HD13 LEU A 120 -1.993 8.383 0.823 1.00 71.01 H new ATOM 0 HD21 LEU A 120 -4.009 10.726 0.829 1.00 20.25 H new ATOM 0 HD22 LEU A 120 -3.263 10.086 2.313 1.00 20.25 H new ATOM 0 HD23 LEU A 120 -3.121 11.816 1.919 1.00 20.25 H new ATOM 2036 N ILE A 121 1.917 12.168 2.804 1.00 51.24 N ATOM 2037 CA ILE A 121 3.143 12.191 3.620 1.00 55.01 C ATOM 2038 C ILE A 121 3.041 13.199 4.779 1.00 53.41 C ATOM 2039 O ILE A 121 3.372 12.886 5.923 1.00 33.01 O ATOM 2040 CB ILE A 121 4.387 12.533 2.755 1.00 72.21 C ATOM 2041 CG1 ILE A 121 4.667 11.404 1.749 1.00 44.15 C ATOM 2042 CG2 ILE A 121 5.615 12.792 3.634 1.00 24.13 C ATOM 2043 CD1 ILE A 121 5.823 11.691 0.811 1.00 72.12 C ATOM 0 H ILE A 121 2.075 12.329 1.809 1.00 51.24 H new ATOM 0 HA ILE A 121 3.257 11.190 4.037 1.00 55.01 H new ATOM 0 HB ILE A 121 4.174 13.447 2.200 1.00 72.21 H new ATOM 0 HG12 ILE A 121 4.876 10.485 2.297 1.00 44.15 H new ATOM 0 HG13 ILE A 121 3.768 11.225 1.159 1.00 44.15 H new ATOM 0 HG21 ILE A 121 6.471 13.029 3.002 1.00 24.13 H new ATOM 0 HG22 ILE A 121 5.414 13.629 4.302 1.00 24.13 H new ATOM 0 HG23 ILE A 121 5.835 11.902 4.224 1.00 24.13 H new ATOM 0 HD11 ILE A 121 5.958 10.849 0.132 1.00 72.12 H new ATOM 0 HD12 ILE A 121 5.609 12.591 0.235 1.00 72.12 H new ATOM 0 HD13 ILE A 121 6.734 11.840 1.391 1.00 72.12 H new ATOM 2055 N ARG A 122 2.558 14.401 4.474 1.00 11.40 N ATOM 2056 CA ARG A 122 2.459 15.475 5.472 1.00 23.13 C ATOM 2057 C ARG A 122 1.474 15.108 6.590 1.00 15.15 C ATOM 2058 O ARG A 122 1.653 15.486 7.747 1.00 34.03 O ATOM 2059 CB ARG A 122 2.005 16.779 4.801 1.00 41.31 C ATOM 2060 CG ARG A 122 2.752 17.102 3.510 1.00 64.14 C ATOM 2061 CD ARG A 122 2.258 18.404 2.883 1.00 22.22 C ATOM 2062 NE ARG A 122 2.739 18.567 1.513 1.00 24.51 N ATOM 2063 CZ ARG A 122 2.631 19.668 0.821 1.00 54.50 C ATOM 2064 NH1 ARG A 122 2.182 20.752 1.369 1.00 22.43 N ATOM 2065 NH2 ARG A 122 3.011 19.688 -0.413 1.00 43.05 N ATOM 0 H ARG A 122 2.228 14.661 3.545 1.00 11.40 H new ATOM 0 HA ARG A 122 3.447 15.612 5.912 1.00 23.13 H new ATOM 0 HB2 ARG A 122 0.939 16.713 4.586 1.00 41.31 H new ATOM 0 HB3 ARG A 122 2.138 17.603 5.502 1.00 41.31 H new ATOM 0 HG2 ARG A 122 3.819 17.180 3.717 1.00 64.14 H new ATOM 0 HG3 ARG A 122 2.623 16.285 2.801 1.00 64.14 H new ATOM 0 HD2 ARG A 122 1.168 18.419 2.889 1.00 22.22 H new ATOM 0 HD3 ARG A 122 2.592 19.247 3.488 1.00 22.22 H new ATOM 0 HE ARG A 122 3.189 17.767 1.068 1.00 24.51 H new ATOM 0 HH11 ARG A 122 1.908 20.751 2.352 1.00 22.43 H new ATOM 0 HH12 ARG A 122 2.102 21.607 0.818 1.00 22.43 H new ATOM 0 HH21 ARG A 122 3.393 18.846 -0.843 1.00 43.05 H new ATOM 0 HH22 ARG A 122 2.929 20.546 -0.958 1.00 43.05 H new ATOM 2079 N GLU A 123 0.429 14.369 6.230 1.00 5.32 N ATOM 2080 CA GLU A 123 -0.626 13.991 7.176 1.00 20.51 C ATOM 2081 C GLU A 123 -0.234 12.760 8.015 1.00 1.33 C ATOM 2082 O GLU A 123 -0.467 12.721 9.226 1.00 41.34 O ATOM 2083 CB GLU A 123 -1.928 13.725 6.407 1.00 35.30 C ATOM 2084 CG GLU A 123 -2.402 14.924 5.584 1.00 4.45 C ATOM 2085 CD GLU A 123 -3.670 14.640 4.794 1.00 45.32 C ATOM 2086 OE1 GLU A 123 -4.771 14.714 5.381 1.00 42.43 O ATOM 2087 OE2 GLU A 123 -3.576 14.349 3.584 1.00 50.04 O ATOM 0 H GLU A 123 0.286 14.016 5.284 1.00 5.32 H new ATOM 0 HA GLU A 123 -0.772 14.818 7.871 1.00 20.51 H new ATOM 0 HB2 GLU A 123 -1.782 12.873 5.743 1.00 35.30 H new ATOM 0 HB3 GLU A 123 -2.709 13.448 7.115 1.00 35.30 H new ATOM 0 HG2 GLU A 123 -2.578 15.768 6.251 1.00 4.45 H new ATOM 0 HG3 GLU A 123 -1.611 15.221 4.896 1.00 4.45 H new