USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1077 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 THR OG1 : rot 160:sc= 0 USER MOD Set 1.2: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 140:sc= 0.606 USER MOD Single : A 9 SER OG : rot 90:sc= -0.195 USER MOD Single : A 10 ASN : amide:sc= -0.71 K(o=-0.71,f=-1.9!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -70:sc= 0.0763 USER MOD Single : A 28 ASN : amide:sc= -0.402 K(o=-0.4,f=-10!) USER MOD Single : A 30 LYS NZ :NH3+ 148:sc= -0.96 (180deg=-2.5!) USER MOD Single : A 31 THR OG1 : rot 27:sc= 0.532 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -125:sc= 0.574 (180deg=-0.599) USER MOD Single : A 46 LYS NZ :NH3+ -178:sc= 0.215 (180deg=0.205) USER MOD Single : A 49 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000782) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 112:sc= 0.649 USER MOD Single : A 74 GLN : amide:sc= -2.32! K(o=-2.3!,f=-0.52) USER MOD Single : A 75 LYS NZ :NH3+ -163:sc= 0.913 (180deg=0.771) USER MOD Single : A 84 LYS NZ :NH3+ 132:sc= 0.77 (180deg=-1.33) USER MOD Single : A 87 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.25) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0.071) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0.0412 X(o=0.041,f=-0.025) USER MOD Single : A 100 LYS NZ :NH3+ 132:sc= -0.525 (180deg=-3.45!) USER MOD Single : A 101 LYS NZ :NH3+ -151:sc= 0.594 (180deg=0.13) USER MOD Single : A 109 THR OG1 : rot 100:sc= -1.05 USER MOD Single : A 111 ASN : amide:sc= 0.0357 K(o=0.036,f=-7.8!) USER MOD Single : A 116 LYS NZ :NH3+ 160:sc= 0.976 (180deg=0.712) USER MOD Single : A 117 LYS NZ :NH3+ -124:sc= 1.04 (180deg=-0.14) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -170:sc= -0.0502 (180deg=-0.212) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -1.428 -12.896 0.572 1.00 62.54 N ATOM 21 CA GLY A 2 -0.360 -12.048 1.121 1.00 24.42 C ATOM 22 C GLY A 2 -0.099 -10.825 0.251 1.00 53.23 C ATOM 23 O GLY A 2 1.049 -10.393 0.098 1.00 12.40 O ATOM 0 HA2 GLY A 2 -0.633 -11.726 2.126 1.00 24.42 H new ATOM 0 HA3 GLY A 2 0.556 -12.631 1.211 1.00 24.42 H new ATOM 27 N THR A 3 -1.189 -10.281 -0.323 1.00 20.11 N ATOM 28 CA THR A 3 -1.141 -9.150 -1.261 1.00 55.22 C ATOM 29 C THR A 3 -0.653 -7.875 -0.552 1.00 62.42 C ATOM 30 O THR A 3 -1.082 -7.581 0.567 1.00 61.12 O ATOM 31 CB THR A 3 -2.552 -8.905 -1.890 1.00 4.44 C ATOM 32 OG1 THR A 3 -3.072 -10.153 -2.388 1.00 22.42 O ATOM 33 CG2 THR A 3 -2.511 -7.873 -3.036 1.00 14.43 C ATOM 0 H THR A 3 -2.135 -10.619 -0.145 1.00 20.11 H new ATOM 0 HA THR A 3 -0.437 -9.396 -2.056 1.00 55.22 H new ATOM 0 HB THR A 3 -3.198 -8.503 -1.109 1.00 4.44 H new ATOM 0 HG1 THR A 3 -4.031 -10.208 -2.194 1.00 22.42 H new ATOM 0 HG21 THR A 3 -3.514 -7.738 -3.440 1.00 14.43 H new ATOM 0 HG22 THR A 3 -2.142 -6.921 -2.655 1.00 14.43 H new ATOM 0 HG23 THR A 3 -1.848 -8.230 -3.824 1.00 14.43 H new ATOM 41 N VAL A 4 0.225 -7.115 -1.220 1.00 74.15 N ATOM 42 CA VAL A 4 0.843 -5.923 -0.636 1.00 30.31 C ATOM 43 C VAL A 4 0.038 -4.728 -1.137 1.00 44.13 C ATOM 44 O VAL A 4 0.061 -4.432 -2.328 1.00 41.12 O ATOM 45 CB VAL A 4 2.365 -5.800 -1.061 1.00 51.41 C ATOM 46 CG1 VAL A 4 3.083 -4.657 -0.297 1.00 32.42 C ATOM 47 CG2 VAL A 4 3.102 -7.149 -0.873 1.00 70.12 C ATOM 0 H VAL A 4 0.524 -7.310 -2.176 1.00 74.15 H new ATOM 0 HA VAL A 4 0.832 -5.974 0.453 1.00 30.31 H new ATOM 0 HB VAL A 4 2.391 -5.546 -2.121 1.00 51.41 H new ATOM 0 HG11 VAL A 4 4.124 -4.604 -0.616 1.00 32.42 H new ATOM 0 HG12 VAL A 4 2.589 -3.709 -0.512 1.00 32.42 H new ATOM 0 HG13 VAL A 4 3.041 -4.853 0.774 1.00 32.42 H new ATOM 0 HG21 VAL A 4 4.145 -7.039 -1.171 1.00 70.12 H new ATOM 0 HG22 VAL A 4 3.054 -7.447 0.174 1.00 70.12 H new ATOM 0 HG23 VAL A 4 2.627 -7.912 -1.489 1.00 70.12 H new ATOM 57 N VAL A 5 -0.684 -4.054 -0.232 1.00 71.12 N ATOM 58 CA VAL A 5 -1.554 -2.917 -0.581 1.00 33.53 C ATOM 59 C VAL A 5 -1.021 -1.649 0.107 1.00 63.50 C ATOM 60 O VAL A 5 -1.070 -1.517 1.316 1.00 25.30 O ATOM 61 CB VAL A 5 -3.075 -3.211 -0.215 1.00 71.20 C ATOM 62 CG1 VAL A 5 -3.669 -4.272 -1.169 1.00 34.33 C ATOM 63 CG2 VAL A 5 -3.255 -3.671 1.255 1.00 14.54 C ATOM 0 H VAL A 5 -0.683 -4.279 0.763 1.00 71.12 H new ATOM 0 HA VAL A 5 -1.532 -2.761 -1.660 1.00 33.53 H new ATOM 0 HB VAL A 5 -3.612 -2.270 -0.334 1.00 71.20 H new ATOM 0 HG11 VAL A 5 -4.709 -4.459 -0.903 1.00 34.33 H new ATOM 0 HG12 VAL A 5 -3.617 -3.908 -2.195 1.00 34.33 H new ATOM 0 HG13 VAL A 5 -3.100 -5.198 -1.083 1.00 34.33 H new ATOM 0 HG21 VAL A 5 -4.311 -3.858 1.451 1.00 14.54 H new ATOM 0 HG22 VAL A 5 -2.687 -4.586 1.422 1.00 14.54 H new ATOM 0 HG23 VAL A 5 -2.893 -2.892 1.927 1.00 14.54 H new ATOM 73 N ILE A 6 -0.497 -0.707 -0.680 1.00 23.22 N ATOM 74 CA ILE A 6 0.216 0.464 -0.144 1.00 54.22 C ATOM 75 C ILE A 6 -0.712 1.681 -0.172 1.00 50.32 C ATOM 76 O ILE A 6 -1.026 2.178 -1.251 1.00 74.30 O ATOM 77 CB ILE A 6 1.545 0.797 -0.941 1.00 53.34 C ATOM 78 CG1 ILE A 6 2.530 -0.427 -1.030 1.00 14.43 C ATOM 79 CG2 ILE A 6 2.257 2.004 -0.289 1.00 53.43 C ATOM 80 CD1 ILE A 6 2.157 -1.501 -2.039 1.00 3.44 C ATOM 0 H ILE A 6 -0.552 -0.729 -1.698 1.00 23.22 H new ATOM 0 HA ILE A 6 0.507 0.222 0.878 1.00 54.22 H new ATOM 0 HB ILE A 6 1.253 1.041 -1.963 1.00 53.34 H new ATOM 0 HG12 ILE A 6 3.524 -0.053 -1.276 1.00 14.43 H new ATOM 0 HG13 ILE A 6 2.598 -0.888 -0.045 1.00 14.43 H new ATOM 0 HG21 ILE A 6 3.170 2.229 -0.840 1.00 53.43 H new ATOM 0 HG22 ILE A 6 1.597 2.871 -0.311 1.00 53.43 H new ATOM 0 HG23 ILE A 6 2.507 1.764 0.744 1.00 53.43 H new ATOM 0 HD11 ILE A 6 2.903 -2.296 -2.017 1.00 3.44 H new ATOM 0 HD12 ILE A 6 1.180 -1.913 -1.787 1.00 3.44 H new ATOM 0 HD13 ILE A 6 2.121 -1.065 -3.037 1.00 3.44 H new ATOM 92 N VAL A 7 -1.145 2.147 1.013 1.00 43.32 N ATOM 93 CA VAL A 7 -1.963 3.363 1.144 1.00 41.22 C ATOM 94 C VAL A 7 -1.045 4.578 1.286 1.00 55.53 C ATOM 95 O VAL A 7 -0.250 4.674 2.231 1.00 64.11 O ATOM 96 CB VAL A 7 -2.939 3.298 2.371 1.00 34.44 C ATOM 97 CG1 VAL A 7 -3.787 4.594 2.501 1.00 34.43 C ATOM 98 CG2 VAL A 7 -3.837 2.059 2.269 1.00 61.45 C ATOM 0 H VAL A 7 -0.938 1.693 1.902 1.00 43.32 H new ATOM 0 HA VAL A 7 -2.574 3.447 0.245 1.00 41.22 H new ATOM 0 HB VAL A 7 -2.337 3.218 3.276 1.00 34.44 H new ATOM 0 HG11 VAL A 7 -4.450 4.510 3.362 1.00 34.43 H new ATOM 0 HG12 VAL A 7 -3.125 5.450 2.635 1.00 34.43 H new ATOM 0 HG13 VAL A 7 -4.381 4.732 1.598 1.00 34.43 H new ATOM 0 HG21 VAL A 7 -4.509 2.025 3.126 1.00 61.45 H new ATOM 0 HG22 VAL A 7 -4.422 2.108 1.351 1.00 61.45 H new ATOM 0 HG23 VAL A 7 -3.219 1.161 2.258 1.00 61.45 H new ATOM 108 N VAL A 8 -1.158 5.486 0.317 1.00 24.40 N ATOM 109 CA VAL A 8 -0.373 6.715 0.248 1.00 72.31 C ATOM 110 C VAL A 8 -1.322 7.921 0.194 1.00 12.13 C ATOM 111 O VAL A 8 -2.434 7.832 -0.346 1.00 73.41 O ATOM 112 CB VAL A 8 0.572 6.709 -1.009 1.00 31.33 C ATOM 113 CG1 VAL A 8 1.418 7.998 -1.104 1.00 43.02 C ATOM 114 CG2 VAL A 8 1.470 5.453 -1.022 1.00 74.53 C ATOM 0 H VAL A 8 -1.813 5.384 -0.458 1.00 24.40 H new ATOM 0 HA VAL A 8 0.254 6.783 1.137 1.00 72.31 H new ATOM 0 HB VAL A 8 -0.067 6.679 -1.891 1.00 31.33 H new ATOM 0 HG11 VAL A 8 2.056 7.950 -1.987 1.00 43.02 H new ATOM 0 HG12 VAL A 8 0.758 8.862 -1.179 1.00 43.02 H new ATOM 0 HG13 VAL A 8 2.039 8.092 -0.213 1.00 43.02 H new ATOM 0 HG21 VAL A 8 2.113 5.475 -1.902 1.00 74.53 H new ATOM 0 HG22 VAL A 8 2.086 5.437 -0.123 1.00 74.53 H new ATOM 0 HG23 VAL A 8 0.846 4.560 -1.051 1.00 74.53 H new ATOM 124 N SER A 9 -0.868 9.042 0.763 1.00 31.44 N ATOM 125 CA SER A 9 -1.603 10.306 0.756 1.00 71.52 C ATOM 126 C SER A 9 -0.633 11.472 0.929 1.00 5.52 C ATOM 127 O SER A 9 0.525 11.278 1.315 1.00 44.21 O ATOM 128 CB SER A 9 -2.681 10.321 1.870 1.00 34.42 C ATOM 129 OG SER A 9 -3.384 11.555 1.889 1.00 24.30 O ATOM 0 H SER A 9 0.029 9.096 1.246 1.00 31.44 H new ATOM 0 HA SER A 9 -2.110 10.410 -0.203 1.00 71.52 H new ATOM 0 HB2 SER A 9 -3.383 9.502 1.711 1.00 34.42 H new ATOM 0 HB3 SER A 9 -2.209 10.153 2.838 1.00 34.42 H new ATOM 0 HG SER A 9 -4.164 11.496 1.298 1.00 24.30 H new ATOM 135 N ASN A 10 -1.132 12.682 0.652 1.00 41.15 N ATOM 136 CA ASN A 10 -0.368 13.923 0.823 1.00 15.30 C ATOM 137 C ASN A 10 -0.475 14.453 2.266 1.00 52.10 C ATOM 138 O ASN A 10 0.055 15.531 2.565 1.00 10.21 O ATOM 139 CB ASN A 10 -0.818 15.000 -0.212 1.00 13.20 C ATOM 140 CG ASN A 10 -2.318 15.349 -0.194 1.00 42.31 C ATOM 141 OD1 ASN A 10 -3.024 15.164 0.803 1.00 53.30 O ATOM 142 ND2 ASN A 10 -2.807 15.899 -1.297 1.00 60.14 N ATOM 0 H ASN A 10 -2.079 12.829 0.302 1.00 41.15 H new ATOM 0 HA ASN A 10 0.682 13.698 0.636 1.00 15.30 H new ATOM 0 HB2 ASN A 10 -0.248 15.912 -0.033 1.00 13.20 H new ATOM 0 HB3 ASN A 10 -0.556 14.651 -1.211 1.00 13.20 H new ATOM 0 HD21 ASN A 10 -3.787 16.180 -1.336 1.00 60.14 H new ATOM 0 HD22 ASN A 10 -2.203 16.041 -2.107 1.00 60.14 H new ATOM 149 N ASP A 11 -1.128 13.686 3.168 1.00 75.03 N ATOM 150 CA ASP A 11 -1.342 14.120 4.556 1.00 13.33 C ATOM 151 C ASP A 11 -1.377 12.928 5.535 1.00 22.35 C ATOM 152 O ASP A 11 -1.820 11.828 5.182 1.00 42.10 O ATOM 153 CB ASP A 11 -2.638 14.947 4.653 1.00 22.13 C ATOM 154 CG ASP A 11 -2.817 15.608 6.022 1.00 31.51 C ATOM 155 OD1 ASP A 11 -2.106 16.598 6.305 1.00 44.13 O ATOM 156 OD2 ASP A 11 -3.640 15.134 6.827 1.00 55.42 O ATOM 0 H ASP A 11 -1.513 12.766 2.954 1.00 75.03 H new ATOM 0 HA ASP A 11 -0.497 14.744 4.846 1.00 13.33 H new ATOM 0 HB2 ASP A 11 -2.632 15.716 3.881 1.00 22.13 H new ATOM 0 HB3 ASP A 11 -3.492 14.301 4.452 1.00 22.13 H new ATOM 161 N GLU A 12 -0.943 13.200 6.782 1.00 62.33 N ATOM 162 CA GLU A 12 -0.737 12.192 7.840 1.00 15.33 C ATOM 163 C GLU A 12 -2.047 11.874 8.564 1.00 24.21 C ATOM 164 O GLU A 12 -2.226 10.754 9.045 1.00 51.11 O ATOM 165 CB GLU A 12 0.325 12.673 8.873 1.00 64.03 C ATOM 166 CG GLU A 12 1.724 12.984 8.291 1.00 73.15 C ATOM 167 CD GLU A 12 1.798 14.290 7.472 1.00 74.21 C ATOM 168 OE1 GLU A 12 1.967 15.366 8.073 1.00 32.31 O ATOM 169 OE2 GLU A 12 1.678 14.244 6.235 1.00 74.42 O ATOM 0 H GLU A 12 -0.721 14.148 7.088 1.00 62.33 H new ATOM 0 HA GLU A 12 -0.374 11.286 7.355 1.00 15.33 H new ATOM 0 HB2 GLU A 12 -0.052 13.569 9.366 1.00 64.03 H new ATOM 0 HB3 GLU A 12 0.432 11.908 9.642 1.00 64.03 H new ATOM 0 HG2 GLU A 12 2.440 13.042 9.111 1.00 73.15 H new ATOM 0 HG3 GLU A 12 2.033 12.153 7.656 1.00 73.15 H new ATOM 176 N ARG A 13 -2.950 12.875 8.668 1.00 41.32 N ATOM 177 CA ARG A 13 -4.289 12.666 9.250 1.00 13.35 C ATOM 178 C ARG A 13 -5.172 11.875 8.279 1.00 60.33 C ATOM 179 O ARG A 13 -6.123 11.243 8.707 1.00 14.40 O ATOM 180 CB ARG A 13 -5.017 13.984 9.619 1.00 24.23 C ATOM 181 CG ARG A 13 -4.324 14.878 10.671 1.00 4.13 C ATOM 182 CD ARG A 13 -5.291 15.941 11.245 1.00 34.54 C ATOM 183 NE ARG A 13 -5.985 16.709 10.180 1.00 24.50 N ATOM 184 CZ ARG A 13 -7.316 16.939 10.118 1.00 72.50 C ATOM 185 NH1 ARG A 13 -8.138 16.450 11.047 1.00 10.23 N ATOM 186 NH2 ARG A 13 -7.817 17.657 9.120 1.00 14.00 N ATOM 0 H ARG A 13 -2.774 13.830 8.357 1.00 41.32 H new ATOM 0 HA ARG A 13 -4.128 12.110 10.174 1.00 13.35 H new ATOM 0 HB2 ARG A 13 -5.150 14.568 8.708 1.00 24.23 H new ATOM 0 HB3 ARG A 13 -6.013 13.734 9.985 1.00 24.23 H new ATOM 0 HG2 ARG A 13 -3.943 14.257 11.482 1.00 4.13 H new ATOM 0 HG3 ARG A 13 -3.465 15.374 10.218 1.00 4.13 H new ATOM 0 HD2 ARG A 13 -6.032 15.451 11.877 1.00 34.54 H new ATOM 0 HD3 ARG A 13 -4.734 16.629 11.881 1.00 34.54 H new ATOM 0 HE ARG A 13 -5.409 17.096 9.432 1.00 24.50 H new ATOM 0 HH11 ARG A 13 -7.765 15.895 11.817 1.00 10.23 H new ATOM 0 HH12 ARG A 13 -9.140 16.631 10.988 1.00 10.23 H new ATOM 0 HH21 ARG A 13 -7.198 18.034 8.402 1.00 14.00 H new ATOM 0 HH22 ARG A 13 -8.821 17.832 9.071 1.00 14.00 H new ATOM 200 N ILE A 14 -4.889 11.981 6.965 1.00 15.45 N ATOM 201 CA ILE A 14 -5.582 11.180 5.931 1.00 40.14 C ATOM 202 C ILE A 14 -5.060 9.737 5.955 1.00 4.42 C ATOM 203 O ILE A 14 -5.831 8.790 5.805 1.00 60.22 O ATOM 204 CB ILE A 14 -5.429 11.798 4.492 1.00 23.53 C ATOM 205 CG1 ILE A 14 -5.939 13.272 4.473 1.00 35.11 C ATOM 206 CG2 ILE A 14 -6.166 10.946 3.420 1.00 70.10 C ATOM 207 CD1 ILE A 14 -7.371 13.462 4.953 1.00 63.33 C ATOM 0 H ILE A 14 -4.183 12.616 6.592 1.00 15.45 H new ATOM 0 HA ILE A 14 -6.646 11.187 6.166 1.00 40.14 H new ATOM 0 HB ILE A 14 -4.368 11.793 4.241 1.00 23.53 H new ATOM 0 HG12 ILE A 14 -5.280 13.877 5.095 1.00 35.11 H new ATOM 0 HG13 ILE A 14 -5.858 13.656 3.456 1.00 35.11 H new ATOM 0 HG21 ILE A 14 -6.038 11.404 2.439 1.00 70.10 H new ATOM 0 HG22 ILE A 14 -5.750 9.939 3.407 1.00 70.10 H new ATOM 0 HG23 ILE A 14 -7.228 10.897 3.661 1.00 70.10 H new ATOM 0 HD11 ILE A 14 -7.634 14.519 4.903 1.00 63.33 H new ATOM 0 HD12 ILE A 14 -8.047 12.889 4.318 1.00 63.33 H new ATOM 0 HD13 ILE A 14 -7.459 13.114 5.982 1.00 63.33 H new ATOM 219 N LEU A 15 -3.738 9.584 6.162 1.00 54.51 N ATOM 220 CA LEU A 15 -3.125 8.266 6.414 1.00 42.42 C ATOM 221 C LEU A 15 -3.704 7.651 7.698 1.00 42.24 C ATOM 222 O LEU A 15 -3.978 6.469 7.739 1.00 4.11 O ATOM 223 CB LEU A 15 -1.579 8.379 6.508 1.00 41.20 C ATOM 224 CG LEU A 15 -0.842 8.649 5.159 1.00 60.03 C ATOM 225 CD1 LEU A 15 0.657 8.930 5.393 1.00 0.33 C ATOM 226 CD2 LEU A 15 -1.051 7.470 4.171 1.00 11.14 C ATOM 0 H LEU A 15 -3.074 10.358 6.160 1.00 54.51 H new ATOM 0 HA LEU A 15 -3.360 7.611 5.575 1.00 42.42 H new ATOM 0 HB2 LEU A 15 -1.332 9.181 7.204 1.00 41.20 H new ATOM 0 HB3 LEU A 15 -1.190 7.455 6.936 1.00 41.20 H new ATOM 0 HG LEU A 15 -1.276 9.541 4.708 1.00 60.03 H new ATOM 0 HD11 LEU A 15 1.146 9.115 4.437 1.00 0.33 H new ATOM 0 HD12 LEU A 15 0.768 9.806 6.032 1.00 0.33 H new ATOM 0 HD13 LEU A 15 1.118 8.068 5.876 1.00 0.33 H new ATOM 0 HD21 LEU A 15 -0.528 7.680 3.238 1.00 11.14 H new ATOM 0 HD22 LEU A 15 -0.656 6.554 4.609 1.00 11.14 H new ATOM 0 HD23 LEU A 15 -2.115 7.347 3.971 1.00 11.14 H new ATOM 238 N GLU A 16 -3.921 8.494 8.724 1.00 40.12 N ATOM 239 CA GLU A 16 -4.451 8.065 10.027 1.00 5.05 C ATOM 240 C GLU A 16 -5.959 7.733 9.928 1.00 43.02 C ATOM 241 O GLU A 16 -6.431 6.777 10.545 1.00 43.04 O ATOM 242 CB GLU A 16 -4.225 9.184 11.070 1.00 43.03 C ATOM 243 CG GLU A 16 -4.404 8.752 12.539 1.00 10.22 C ATOM 244 CD GLU A 16 -3.183 8.015 13.120 1.00 24.33 C ATOM 245 OE1 GLU A 16 -2.165 8.683 13.416 1.00 35.13 O ATOM 246 OE2 GLU A 16 -3.234 6.777 13.286 1.00 40.10 O ATOM 0 H GLU A 16 -3.732 9.495 8.670 1.00 40.12 H new ATOM 0 HA GLU A 16 -3.924 7.163 10.337 1.00 5.05 H new ATOM 0 HB2 GLU A 16 -3.217 9.579 10.944 1.00 43.03 H new ATOM 0 HB3 GLU A 16 -4.916 10.000 10.860 1.00 43.03 H new ATOM 0 HG2 GLU A 16 -4.607 9.634 13.146 1.00 10.22 H new ATOM 0 HG3 GLU A 16 -5.278 8.105 12.614 1.00 10.22 H new ATOM 253 N GLU A 17 -6.696 8.557 9.149 1.00 73.11 N ATOM 254 CA GLU A 17 -8.148 8.387 8.890 1.00 62.34 C ATOM 255 C GLU A 17 -8.393 7.028 8.231 1.00 11.31 C ATOM 256 O GLU A 17 -9.187 6.215 8.710 1.00 40.43 O ATOM 257 CB GLU A 17 -8.649 9.541 7.964 1.00 70.23 C ATOM 258 CG GLU A 17 -10.125 9.459 7.508 1.00 30.03 C ATOM 259 CD GLU A 17 -11.134 9.534 8.667 1.00 71.44 C ATOM 260 OE1 GLU A 17 -11.231 10.603 9.310 1.00 73.23 O ATOM 261 OE2 GLU A 17 -11.840 8.536 8.935 1.00 21.10 O ATOM 0 H GLU A 17 -6.297 9.368 8.676 1.00 73.11 H new ATOM 0 HA GLU A 17 -8.698 8.426 9.830 1.00 62.34 H new ATOM 0 HB2 GLU A 17 -8.504 10.487 8.486 1.00 70.23 H new ATOM 0 HB3 GLU A 17 -8.017 9.567 7.076 1.00 70.23 H new ATOM 0 HG2 GLU A 17 -10.326 10.271 6.809 1.00 30.03 H new ATOM 0 HG3 GLU A 17 -10.277 8.526 6.965 1.00 30.03 H new ATOM 268 N LEU A 18 -7.627 6.792 7.165 1.00 24.22 N ATOM 269 CA LEU A 18 -7.678 5.566 6.371 1.00 4.35 C ATOM 270 C LEU A 18 -7.084 4.380 7.163 1.00 0.51 C ATOM 271 O LEU A 18 -7.524 3.245 6.986 1.00 20.34 O ATOM 272 CB LEU A 18 -6.951 5.799 5.008 1.00 72.21 C ATOM 273 CG LEU A 18 -7.795 6.476 3.857 1.00 4.03 C ATOM 274 CD1 LEU A 18 -8.485 7.793 4.289 1.00 2.35 C ATOM 275 CD2 LEU A 18 -6.916 6.703 2.610 1.00 53.24 C ATOM 0 H LEU A 18 -6.939 7.463 6.823 1.00 24.22 H new ATOM 0 HA LEU A 18 -8.715 5.308 6.156 1.00 4.35 H new ATOM 0 HB2 LEU A 18 -6.072 6.417 5.193 1.00 72.21 H new ATOM 0 HB3 LEU A 18 -6.593 4.836 4.645 1.00 72.21 H new ATOM 0 HG LEU A 18 -8.599 5.781 3.614 1.00 4.03 H new ATOM 0 HD11 LEU A 18 -9.046 8.202 3.449 1.00 2.35 H new ATOM 0 HD12 LEU A 18 -9.165 7.593 5.117 1.00 2.35 H new ATOM 0 HD13 LEU A 18 -7.730 8.513 4.606 1.00 2.35 H new ATOM 0 HD21 LEU A 18 -7.511 7.170 1.825 1.00 53.24 H new ATOM 0 HD22 LEU A 18 -6.080 7.354 2.867 1.00 53.24 H new ATOM 0 HD23 LEU A 18 -6.534 5.746 2.255 1.00 53.24 H new ATOM 287 N LEU A 19 -6.113 4.666 8.068 1.00 63.42 N ATOM 288 CA LEU A 19 -5.477 3.638 8.925 1.00 3.42 C ATOM 289 C LEU A 19 -6.488 3.028 9.867 1.00 64.14 C ATOM 290 O LEU A 19 -6.578 1.820 9.966 1.00 44.14 O ATOM 291 CB LEU A 19 -4.293 4.213 9.753 1.00 13.35 C ATOM 292 CG LEU A 19 -3.584 3.223 10.739 1.00 64.00 C ATOM 293 CD1 LEU A 19 -2.964 2.017 10.009 1.00 22.40 C ATOM 294 CD2 LEU A 19 -2.535 3.946 11.588 1.00 25.34 C ATOM 0 H LEU A 19 -5.753 5.608 8.222 1.00 63.42 H new ATOM 0 HA LEU A 19 -5.086 2.873 8.255 1.00 3.42 H new ATOM 0 HB2 LEU A 19 -3.546 4.597 9.059 1.00 13.35 H new ATOM 0 HB3 LEU A 19 -4.660 5.063 10.328 1.00 13.35 H new ATOM 0 HG LEU A 19 -4.354 2.834 11.405 1.00 64.00 H new ATOM 0 HD11 LEU A 19 -2.484 1.360 10.734 1.00 22.40 H new ATOM 0 HD12 LEU A 19 -3.746 1.468 9.484 1.00 22.40 H new ATOM 0 HD13 LEU A 19 -2.222 2.368 9.291 1.00 22.40 H new ATOM 0 HD21 LEU A 19 -2.059 3.234 12.263 1.00 25.34 H new ATOM 0 HD22 LEU A 19 -1.781 4.388 10.936 1.00 25.34 H new ATOM 0 HD23 LEU A 19 -3.017 4.732 12.170 1.00 25.34 H new ATOM 306 N GLU A 20 -7.255 3.893 10.532 1.00 1.52 N ATOM 307 CA GLU A 20 -8.220 3.483 11.551 1.00 41.12 C ATOM 308 C GLU A 20 -9.422 2.764 10.923 1.00 42.21 C ATOM 309 O GLU A 20 -10.041 1.936 11.577 1.00 10.31 O ATOM 310 CB GLU A 20 -8.629 4.686 12.430 1.00 11.51 C ATOM 311 CG GLU A 20 -7.444 5.294 13.219 1.00 4.55 C ATOM 312 CD GLU A 20 -7.879 6.168 14.409 1.00 41.40 C ATOM 313 OE1 GLU A 20 -8.434 5.612 15.382 1.00 64.33 O ATOM 314 OE2 GLU A 20 -7.648 7.397 14.398 1.00 13.35 O ATOM 0 H GLU A 20 -7.224 4.901 10.378 1.00 1.52 H new ATOM 0 HA GLU A 20 -7.744 2.758 12.211 1.00 41.12 H new ATOM 0 HB2 GLU A 20 -9.070 5.457 11.798 1.00 11.51 H new ATOM 0 HB3 GLU A 20 -9.401 4.370 13.132 1.00 11.51 H new ATOM 0 HG2 GLU A 20 -6.810 4.487 13.585 1.00 4.55 H new ATOM 0 HG3 GLU A 20 -6.837 5.894 12.541 1.00 4.55 H new ATOM 321 N VAL A 21 -9.742 3.096 9.656 1.00 44.31 N ATOM 322 CA VAL A 21 -10.726 2.339 8.850 1.00 31.14 C ATOM 323 C VAL A 21 -10.223 0.887 8.599 1.00 41.31 C ATOM 324 O VAL A 21 -11.005 -0.072 8.684 1.00 14.45 O ATOM 325 CB VAL A 21 -11.038 3.081 7.490 1.00 61.25 C ATOM 326 CG1 VAL A 21 -11.968 2.259 6.556 1.00 64.00 C ATOM 327 CG2 VAL A 21 -11.647 4.479 7.768 1.00 62.15 C ATOM 0 H VAL A 21 -9.331 3.889 9.164 1.00 44.31 H new ATOM 0 HA VAL A 21 -11.658 2.282 9.413 1.00 31.14 H new ATOM 0 HB VAL A 21 -10.089 3.197 6.966 1.00 61.25 H new ATOM 0 HG11 VAL A 21 -12.148 2.818 5.638 1.00 64.00 H new ATOM 0 HG12 VAL A 21 -11.493 1.308 6.315 1.00 64.00 H new ATOM 0 HG13 VAL A 21 -12.917 2.073 7.059 1.00 64.00 H new ATOM 0 HG21 VAL A 21 -11.857 4.979 6.822 1.00 62.15 H new ATOM 0 HG22 VAL A 21 -12.573 4.367 8.333 1.00 62.15 H new ATOM 0 HG23 VAL A 21 -10.940 5.076 8.345 1.00 62.15 H new ATOM 337 N VAL A 22 -8.903 0.742 8.338 1.00 41.33 N ATOM 338 CA VAL A 22 -8.253 -0.570 8.124 1.00 24.42 C ATOM 339 C VAL A 22 -8.135 -1.345 9.467 1.00 51.45 C ATOM 340 O VAL A 22 -8.400 -2.548 9.525 1.00 62.20 O ATOM 341 CB VAL A 22 -6.831 -0.399 7.443 1.00 21.22 C ATOM 342 CG1 VAL A 22 -6.087 -1.745 7.280 1.00 43.11 C ATOM 343 CG2 VAL A 22 -6.958 0.298 6.068 1.00 72.23 C ATOM 0 H VAL A 22 -8.260 1.531 8.270 1.00 41.33 H new ATOM 0 HA VAL A 22 -8.878 -1.151 7.446 1.00 24.42 H new ATOM 0 HB VAL A 22 -6.241 0.226 8.113 1.00 21.22 H new ATOM 0 HG11 VAL A 22 -5.120 -1.571 6.809 1.00 43.11 H new ATOM 0 HG12 VAL A 22 -5.937 -2.199 8.260 1.00 43.11 H new ATOM 0 HG13 VAL A 22 -6.679 -2.415 6.656 1.00 43.11 H new ATOM 0 HG21 VAL A 22 -5.970 0.404 5.621 1.00 72.23 H new ATOM 0 HG22 VAL A 22 -7.590 -0.302 5.413 1.00 72.23 H new ATOM 0 HG23 VAL A 22 -7.404 1.284 6.200 1.00 72.23 H new ATOM 353 N LEU A 23 -7.777 -0.627 10.548 1.00 0.22 N ATOM 354 CA LEU A 23 -7.625 -1.205 11.898 1.00 33.54 C ATOM 355 C LEU A 23 -8.962 -1.758 12.431 1.00 10.30 C ATOM 356 O LEU A 23 -9.040 -2.920 12.862 1.00 44.14 O ATOM 357 CB LEU A 23 -7.083 -0.136 12.888 1.00 74.44 C ATOM 358 CG LEU A 23 -5.621 0.358 12.679 1.00 33.20 C ATOM 359 CD1 LEU A 23 -5.259 1.442 13.715 1.00 32.33 C ATOM 360 CD2 LEU A 23 -4.621 -0.812 12.731 1.00 33.20 C ATOM 0 H LEU A 23 -7.584 0.374 10.510 1.00 0.22 H new ATOM 0 HA LEU A 23 -6.915 -2.028 11.820 1.00 33.54 H new ATOM 0 HB2 LEU A 23 -7.742 0.731 12.841 1.00 74.44 H new ATOM 0 HB3 LEU A 23 -7.161 -0.541 13.897 1.00 74.44 H new ATOM 0 HG LEU A 23 -5.556 0.801 11.685 1.00 33.20 H new ATOM 0 HD11 LEU A 23 -4.234 1.774 13.552 1.00 32.33 H new ATOM 0 HD12 LEU A 23 -5.936 2.289 13.607 1.00 32.33 H new ATOM 0 HD13 LEU A 23 -5.351 1.030 14.720 1.00 32.33 H new ATOM 0 HD21 LEU A 23 -3.610 -0.433 12.582 1.00 33.20 H new ATOM 0 HD22 LEU A 23 -4.685 -1.302 13.702 1.00 33.20 H new ATOM 0 HD23 LEU A 23 -4.859 -1.530 11.946 1.00 33.20 H new ATOM 372 N LYS A 24 -10.010 -0.907 12.375 1.00 34.30 N ATOM 373 CA LYS A 24 -11.331 -1.217 12.954 1.00 42.00 C ATOM 374 C LYS A 24 -12.003 -2.374 12.196 1.00 51.05 C ATOM 375 O LYS A 24 -12.750 -3.157 12.792 1.00 30.23 O ATOM 376 CB LYS A 24 -12.249 0.050 12.973 1.00 75.15 C ATOM 377 CG LYS A 24 -12.849 0.471 11.607 1.00 74.44 C ATOM 378 CD LYS A 24 -13.465 1.895 11.625 1.00 33.43 C ATOM 379 CE LYS A 24 -14.637 2.054 12.611 1.00 30.25 C ATOM 380 NZ LYS A 24 -15.076 3.478 12.715 1.00 31.23 N ATOM 0 H LYS A 24 -9.962 0.009 11.929 1.00 34.30 H new ATOM 0 HA LYS A 24 -11.179 -1.533 13.986 1.00 42.00 H new ATOM 0 HB2 LYS A 24 -13.069 -0.129 13.668 1.00 75.15 H new ATOM 0 HB3 LYS A 24 -11.673 0.887 13.368 1.00 75.15 H new ATOM 0 HG2 LYS A 24 -12.070 0.428 10.846 1.00 74.44 H new ATOM 0 HG3 LYS A 24 -13.617 -0.247 11.318 1.00 74.44 H new ATOM 0 HD2 LYS A 24 -12.687 2.614 11.881 1.00 33.43 H new ATOM 0 HD3 LYS A 24 -13.811 2.144 10.622 1.00 33.43 H new ATOM 0 HE2 LYS A 24 -15.474 1.437 12.285 1.00 30.25 H new ATOM 0 HE3 LYS A 24 -14.338 1.692 13.595 1.00 30.25 H new ATOM 0 HZ1 LYS A 24 -15.867 3.549 13.387 1.00 31.23 H new ATOM 0 HZ2 LYS A 24 -14.283 4.062 13.050 1.00 31.23 H new ATOM 0 HZ3 LYS A 24 -15.384 3.815 11.781 1.00 31.23 H new ATOM 394 N SER A 25 -11.719 -2.466 10.880 1.00 60.32 N ATOM 395 CA SER A 25 -12.241 -3.532 10.020 1.00 43.24 C ATOM 396 C SER A 25 -11.547 -4.865 10.351 1.00 55.33 C ATOM 397 O SER A 25 -12.199 -5.835 10.770 1.00 12.34 O ATOM 398 CB SER A 25 -12.062 -3.159 8.528 1.00 53.23 C ATOM 399 OG SER A 25 -12.597 -4.154 7.663 1.00 42.33 O ATOM 0 H SER A 25 -11.121 -1.800 10.390 1.00 60.32 H new ATOM 0 HA SER A 25 -13.308 -3.650 10.207 1.00 43.24 H new ATOM 0 HB2 SER A 25 -12.552 -2.206 8.331 1.00 53.23 H new ATOM 0 HB3 SER A 25 -11.002 -3.023 8.313 1.00 53.23 H new ATOM 0 HG SER A 25 -12.038 -4.958 7.704 1.00 42.33 H new ATOM 405 N ASP A 26 -10.213 -4.894 10.187 1.00 2.43 N ATOM 406 CA ASP A 26 -9.389 -6.086 10.457 1.00 32.04 C ATOM 407 C ASP A 26 -8.045 -5.687 11.092 1.00 25.03 C ATOM 408 O ASP A 26 -7.212 -5.057 10.428 1.00 41.51 O ATOM 409 CB ASP A 26 -9.123 -6.917 9.170 1.00 10.24 C ATOM 410 CG ASP A 26 -10.385 -7.589 8.611 1.00 43.02 C ATOM 411 OD1 ASP A 26 -10.713 -8.711 9.046 1.00 43.13 O ATOM 412 OD2 ASP A 26 -11.066 -6.988 7.759 1.00 12.42 O ATOM 0 H ASP A 26 -9.675 -4.091 9.863 1.00 2.43 H new ATOM 0 HA ASP A 26 -9.954 -6.707 11.153 1.00 32.04 H new ATOM 0 HB2 ASP A 26 -8.698 -6.266 8.406 1.00 10.24 H new ATOM 0 HB3 ASP A 26 -8.378 -7.682 9.387 1.00 10.24 H new ATOM 417 N PRO A 27 -7.807 -6.066 12.390 1.00 32.23 N ATOM 418 CA PRO A 27 -6.438 -6.078 12.999 1.00 34.24 C ATOM 419 C PRO A 27 -5.567 -7.217 12.403 1.00 54.10 C ATOM 420 O PRO A 27 -4.343 -7.250 12.577 1.00 53.22 O ATOM 421 CB PRO A 27 -6.740 -6.351 14.498 1.00 5.35 C ATOM 422 CG PRO A 27 -8.014 -7.145 14.464 1.00 12.34 C ATOM 423 CD PRO A 27 -8.842 -6.489 13.386 1.00 40.32 C ATOM 0 HA PRO A 27 -5.880 -5.159 12.821 1.00 34.24 H new ATOM 0 HB2 PRO A 27 -5.933 -6.908 14.974 1.00 5.35 H new ATOM 0 HB3 PRO A 27 -6.861 -5.424 15.058 1.00 5.35 H new ATOM 0 HG2 PRO A 27 -7.822 -8.193 14.234 1.00 12.34 H new ATOM 0 HG3 PRO A 27 -8.524 -7.118 15.427 1.00 12.34 H new ATOM 0 HD2 PRO A 27 -9.563 -7.181 12.952 1.00 40.32 H new ATOM 0 HD3 PRO A 27 -9.407 -5.639 13.769 1.00 40.32 H new ATOM 431 N ASN A 28 -6.254 -8.143 11.713 1.00 4.50 N ATOM 432 CA ASN A 28 -5.689 -9.358 11.109 1.00 61.43 C ATOM 433 C ASN A 28 -4.727 -9.033 9.952 1.00 5.34 C ATOM 434 O ASN A 28 -3.735 -9.738 9.732 1.00 71.34 O ATOM 435 CB ASN A 28 -6.878 -10.223 10.616 1.00 64.45 C ATOM 436 CG ASN A 28 -6.481 -11.574 10.046 1.00 41.21 C ATOM 437 OD1 ASN A 28 -5.461 -12.149 10.415 1.00 72.44 O ATOM 438 ND2 ASN A 28 -7.322 -12.111 9.188 1.00 61.12 N ATOM 0 H ASN A 28 -7.258 -8.061 11.555 1.00 4.50 H new ATOM 0 HA ASN A 28 -5.098 -9.897 11.849 1.00 61.43 H new ATOM 0 HB2 ASN A 28 -7.565 -10.381 11.447 1.00 64.45 H new ATOM 0 HB3 ASN A 28 -7.423 -9.667 9.853 1.00 64.45 H new ATOM 0 HD21 ASN A 28 -7.137 -13.038 8.804 1.00 61.12 H new ATOM 0 HD22 ASN A 28 -8.159 -11.600 8.907 1.00 61.12 H new ATOM 445 N VAL A 29 -5.038 -7.964 9.222 1.00 23.31 N ATOM 446 CA VAL A 29 -4.221 -7.488 8.095 1.00 13.42 C ATOM 447 C VAL A 29 -3.036 -6.659 8.646 1.00 52.02 C ATOM 448 O VAL A 29 -3.254 -5.762 9.466 1.00 23.50 O ATOM 449 CB VAL A 29 -5.109 -6.642 7.105 1.00 54.33 C ATOM 450 CG1 VAL A 29 -4.307 -6.161 5.881 1.00 65.32 C ATOM 451 CG2 VAL A 29 -6.351 -7.455 6.661 1.00 73.31 C ATOM 0 H VAL A 29 -5.868 -7.396 9.393 1.00 23.31 H new ATOM 0 HA VAL A 29 -3.822 -8.335 7.536 1.00 13.42 H new ATOM 0 HB VAL A 29 -5.444 -5.754 7.642 1.00 54.33 H new ATOM 0 HG11 VAL A 29 -4.957 -5.582 5.225 1.00 65.32 H new ATOM 0 HG12 VAL A 29 -3.477 -5.537 6.212 1.00 65.32 H new ATOM 0 HG13 VAL A 29 -3.919 -7.023 5.339 1.00 65.32 H new ATOM 0 HG21 VAL A 29 -6.953 -6.856 5.978 1.00 73.31 H new ATOM 0 HG22 VAL A 29 -6.028 -8.366 6.157 1.00 73.31 H new ATOM 0 HG23 VAL A 29 -6.947 -7.716 7.536 1.00 73.31 H new ATOM 461 N LYS A 30 -1.796 -6.995 8.218 1.00 10.21 N ATOM 462 CA LYS A 30 -0.540 -6.368 8.706 1.00 74.43 C ATOM 463 C LYS A 30 -0.496 -4.851 8.390 1.00 60.41 C ATOM 464 O LYS A 30 -0.025 -4.447 7.325 1.00 12.43 O ATOM 465 CB LYS A 30 0.689 -7.091 8.066 1.00 13.21 C ATOM 466 CG LYS A 30 0.910 -8.557 8.515 1.00 52.32 C ATOM 467 CD LYS A 30 1.562 -8.700 9.919 1.00 70.24 C ATOM 468 CE LYS A 30 3.095 -8.423 9.930 1.00 24.13 C ATOM 469 NZ LYS A 30 3.454 -6.985 9.716 1.00 41.14 N ATOM 0 H LYS A 30 -1.636 -7.717 7.516 1.00 10.21 H new ATOM 0 HA LYS A 30 -0.505 -6.476 9.790 1.00 74.43 H new ATOM 0 HB2 LYS A 30 0.574 -7.075 6.982 1.00 13.21 H new ATOM 0 HB3 LYS A 30 1.587 -6.519 8.299 1.00 13.21 H new ATOM 0 HG2 LYS A 30 -0.050 -9.073 8.518 1.00 52.32 H new ATOM 0 HG3 LYS A 30 1.540 -9.059 7.781 1.00 52.32 H new ATOM 0 HD2 LYS A 30 1.073 -8.012 10.609 1.00 70.24 H new ATOM 0 HD3 LYS A 30 1.381 -9.708 10.293 1.00 70.24 H new ATOM 0 HE2 LYS A 30 3.507 -8.752 10.884 1.00 24.13 H new ATOM 0 HE3 LYS A 30 3.568 -9.025 9.154 1.00 24.13 H new ATOM 0 HZ1 LYS A 30 4.326 -6.763 10.238 1.00 41.14 H new ATOM 0 HZ2 LYS A 30 3.605 -6.812 8.702 1.00 41.14 H new ATOM 0 HZ3 LYS A 30 2.681 -6.379 10.059 1.00 41.14 H new ATOM 483 N THR A 31 -1.015 -4.030 9.318 1.00 15.14 N ATOM 484 CA THR A 31 -1.051 -2.562 9.178 1.00 44.55 C ATOM 485 C THR A 31 0.311 -1.967 9.569 1.00 75.34 C ATOM 486 O THR A 31 0.703 -1.991 10.741 1.00 44.03 O ATOM 487 CB THR A 31 -2.193 -1.941 10.047 1.00 73.30 C ATOM 488 OG1 THR A 31 -1.996 -2.263 11.437 1.00 71.31 O ATOM 489 CG2 THR A 31 -3.571 -2.453 9.611 1.00 63.25 C ATOM 0 H THR A 31 -1.423 -4.366 10.190 1.00 15.14 H new ATOM 0 HA THR A 31 -1.259 -2.319 8.136 1.00 44.55 H new ATOM 0 HB THR A 31 -2.157 -0.861 9.906 1.00 73.30 H new ATOM 0 HG1 THR A 31 -1.041 -2.400 11.609 1.00 71.31 H new ATOM 0 HG21 THR A 31 -4.341 -2.001 10.236 1.00 63.25 H new ATOM 0 HG22 THR A 31 -3.746 -2.185 8.569 1.00 63.25 H new ATOM 0 HG23 THR A 31 -3.607 -3.537 9.718 1.00 63.25 H new ATOM 497 N VAL A 32 1.024 -1.456 8.570 1.00 43.23 N ATOM 498 CA VAL A 32 2.404 -0.970 8.693 1.00 13.25 C ATOM 499 C VAL A 32 2.424 0.537 8.431 1.00 21.14 C ATOM 500 O VAL A 32 1.805 0.995 7.477 1.00 62.32 O ATOM 501 CB VAL A 32 3.324 -1.699 7.635 1.00 71.44 C ATOM 502 CG1 VAL A 32 4.785 -1.208 7.682 1.00 0.33 C ATOM 503 CG2 VAL A 32 3.239 -3.233 7.795 1.00 42.31 C ATOM 0 H VAL A 32 0.652 -1.364 7.625 1.00 43.23 H new ATOM 0 HA VAL A 32 2.778 -1.179 9.695 1.00 13.25 H new ATOM 0 HB VAL A 32 2.943 -1.437 6.648 1.00 71.44 H new ATOM 0 HG11 VAL A 32 5.372 -1.742 6.935 1.00 0.33 H new ATOM 0 HG12 VAL A 32 4.816 -0.139 7.472 1.00 0.33 H new ATOM 0 HG13 VAL A 32 5.200 -1.396 8.672 1.00 0.33 H new ATOM 0 HG21 VAL A 32 3.881 -3.712 7.056 1.00 42.31 H new ATOM 0 HG22 VAL A 32 3.567 -3.513 8.796 1.00 42.31 H new ATOM 0 HG23 VAL A 32 2.209 -3.558 7.646 1.00 42.31 H new ATOM 513 N ARG A 33 3.084 1.304 9.306 1.00 35.22 N ATOM 514 CA ARG A 33 3.397 2.718 9.055 1.00 30.31 C ATOM 515 C ARG A 33 4.921 2.855 9.145 1.00 11.31 C ATOM 516 O ARG A 33 5.483 3.004 10.237 1.00 21.30 O ATOM 517 CB ARG A 33 2.647 3.615 10.081 1.00 50.24 C ATOM 518 CG ARG A 33 2.715 5.134 9.798 1.00 51.03 C ATOM 519 CD ARG A 33 1.868 5.960 10.788 1.00 54.34 C ATOM 520 NE ARG A 33 1.933 7.411 10.510 1.00 32.32 N ATOM 521 CZ ARG A 33 1.051 8.329 10.955 1.00 31.31 C ATOM 522 NH1 ARG A 33 0.000 7.966 11.694 1.00 31.30 N ATOM 523 NH2 ARG A 33 1.239 9.613 10.666 1.00 60.35 N ATOM 0 H ARG A 33 3.417 0.964 10.208 1.00 35.22 H new ATOM 0 HA ARG A 33 3.065 3.046 8.070 1.00 30.31 H new ATOM 0 HB2 ARG A 33 1.600 3.313 10.107 1.00 50.24 H new ATOM 0 HB3 ARG A 33 3.058 3.427 11.073 1.00 50.24 H new ATOM 0 HG2 ARG A 33 3.753 5.464 9.850 1.00 51.03 H new ATOM 0 HG3 ARG A 33 2.370 5.326 8.782 1.00 51.03 H new ATOM 0 HD2 ARG A 33 0.831 5.629 10.739 1.00 54.34 H new ATOM 0 HD3 ARG A 33 2.215 5.771 11.804 1.00 54.34 H new ATOM 0 HE ARG A 33 2.707 7.744 9.936 1.00 32.32 H new ATOM 0 HH11 ARG A 33 -0.144 6.984 11.929 1.00 31.30 H new ATOM 0 HH12 ARG A 33 -0.659 8.671 12.024 1.00 31.30 H new ATOM 0 HH21 ARG A 33 2.046 9.898 10.111 1.00 60.35 H new ATOM 0 HH22 ARG A 33 0.576 10.313 10.999 1.00 60.35 H new ATOM 537 N THR A 34 5.583 2.762 7.983 1.00 52.44 N ATOM 538 CA THR A 34 7.045 2.605 7.885 1.00 31.35 C ATOM 539 C THR A 34 7.554 3.096 6.517 1.00 54.23 C ATOM 540 O THR A 34 7.140 2.585 5.467 1.00 23.01 O ATOM 541 CB THR A 34 7.467 1.100 8.100 1.00 62.13 C ATOM 542 OG1 THR A 34 7.232 0.704 9.465 1.00 20.52 O ATOM 543 CG2 THR A 34 8.935 0.828 7.736 1.00 31.21 C ATOM 0 H THR A 34 5.117 2.794 7.076 1.00 52.44 H new ATOM 0 HA THR A 34 7.497 3.211 8.671 1.00 31.35 H new ATOM 0 HB THR A 34 6.849 0.509 7.424 1.00 62.13 H new ATOM 0 HG1 THR A 34 7.185 -0.273 9.519 1.00 20.52 H new ATOM 0 HG21 THR A 34 9.163 -0.224 7.906 1.00 31.21 H new ATOM 0 HG22 THR A 34 9.100 1.070 6.686 1.00 31.21 H new ATOM 0 HG23 THR A 34 9.584 1.445 8.357 1.00 31.21 H new ATOM 551 N ASP A 35 8.465 4.082 6.551 1.00 31.14 N ATOM 552 CA ASP A 35 9.210 4.564 5.365 1.00 73.41 C ATOM 553 C ASP A 35 10.706 4.203 5.486 1.00 11.31 C ATOM 554 O ASP A 35 11.537 4.682 4.709 1.00 42.14 O ATOM 555 CB ASP A 35 9.018 6.095 5.210 1.00 61.12 C ATOM 556 CG ASP A 35 9.615 6.910 6.375 1.00 63.11 C ATOM 557 OD1 ASP A 35 9.030 6.893 7.479 1.00 23.24 O ATOM 558 OD2 ASP A 35 10.663 7.569 6.190 1.00 70.12 O ATOM 0 H ASP A 35 8.711 4.575 7.409 1.00 31.14 H new ATOM 0 HA ASP A 35 8.818 4.074 4.473 1.00 73.41 H new ATOM 0 HB2 ASP A 35 9.479 6.419 4.277 1.00 61.12 H new ATOM 0 HB3 ASP A 35 7.953 6.314 5.132 1.00 61.12 H new ATOM 563 N ASP A 36 11.024 3.315 6.451 1.00 21.12 N ATOM 564 CA ASP A 36 12.405 2.830 6.723 1.00 25.42 C ATOM 565 C ASP A 36 12.943 1.914 5.592 1.00 73.13 C ATOM 566 O ASP A 36 14.085 1.442 5.676 1.00 52.05 O ATOM 567 CB ASP A 36 12.453 2.074 8.080 1.00 3.40 C ATOM 568 CG ASP A 36 12.021 2.955 9.264 1.00 53.54 C ATOM 569 OD1 ASP A 36 10.801 3.196 9.418 1.00 43.33 O ATOM 570 OD2 ASP A 36 12.893 3.401 10.047 1.00 4.43 O ATOM 0 H ASP A 36 10.326 2.907 7.073 1.00 21.12 H new ATOM 0 HA ASP A 36 13.048 3.709 6.768 1.00 25.42 H new ATOM 0 HB2 ASP A 36 11.805 1.199 8.027 1.00 3.40 H new ATOM 0 HB3 ASP A 36 13.466 1.710 8.253 1.00 3.40 H new ATOM 575 N LYS A 37 12.089 1.646 4.572 1.00 21.44 N ATOM 576 CA LYS A 37 12.447 0.941 3.318 1.00 52.40 C ATOM 577 C LYS A 37 12.706 -0.563 3.568 1.00 31.23 C ATOM 578 O LYS A 37 11.839 -1.406 3.296 1.00 55.55 O ATOM 579 CB LYS A 37 13.658 1.621 2.577 1.00 54.30 C ATOM 580 CG LYS A 37 13.502 3.142 2.327 1.00 11.32 C ATOM 581 CD LYS A 37 14.581 3.732 1.380 1.00 11.13 C ATOM 582 CE LYS A 37 14.491 3.172 -0.053 1.00 75.42 C ATOM 583 NZ LYS A 37 15.444 3.838 -0.985 1.00 71.14 N ATOM 0 H LYS A 37 11.107 1.922 4.601 1.00 21.44 H new ATOM 0 HA LYS A 37 11.587 1.021 2.654 1.00 52.40 H new ATOM 0 HB2 LYS A 37 14.562 1.455 3.163 1.00 54.30 H new ATOM 0 HB3 LYS A 37 13.803 1.123 1.618 1.00 54.30 H new ATOM 0 HG2 LYS A 37 12.516 3.332 1.903 1.00 11.32 H new ATOM 0 HG3 LYS A 37 13.545 3.665 3.283 1.00 11.32 H new ATOM 0 HD2 LYS A 37 14.476 4.816 1.348 1.00 11.13 H new ATOM 0 HD3 LYS A 37 15.570 3.519 1.787 1.00 11.13 H new ATOM 0 HE2 LYS A 37 14.694 2.101 -0.035 1.00 75.42 H new ATOM 0 HE3 LYS A 37 13.475 3.298 -0.426 1.00 75.42 H new ATOM 0 HZ1 LYS A 37 15.345 3.427 -1.935 1.00 71.14 H new ATOM 0 HZ2 LYS A 37 15.236 4.856 -1.025 1.00 71.14 H new ATOM 0 HZ3 LYS A 37 16.417 3.697 -0.646 1.00 71.14 H new ATOM 597 N GLU A 38 13.893 -0.874 4.117 1.00 75.44 N ATOM 598 CA GLU A 38 14.347 -2.258 4.367 1.00 61.12 C ATOM 599 C GLU A 38 13.411 -3.001 5.346 1.00 61.41 C ATOM 600 O GLU A 38 13.196 -4.205 5.203 1.00 22.20 O ATOM 601 CB GLU A 38 15.799 -2.245 4.913 1.00 50.04 C ATOM 602 CG GLU A 38 15.977 -1.491 6.250 1.00 55.15 C ATOM 603 CD GLU A 38 17.389 -1.613 6.840 1.00 74.22 C ATOM 604 OE1 GLU A 38 17.787 -2.739 7.204 1.00 73.12 O ATOM 605 OE2 GLU A 38 18.095 -0.589 6.970 1.00 53.11 O ATOM 0 H GLU A 38 14.572 -0.168 4.403 1.00 75.44 H new ATOM 0 HA GLU A 38 14.320 -2.796 3.420 1.00 61.12 H new ATOM 0 HB2 GLU A 38 16.133 -3.274 5.044 1.00 50.04 H new ATOM 0 HB3 GLU A 38 16.450 -1.791 4.166 1.00 50.04 H new ATOM 0 HG2 GLU A 38 15.746 -0.437 6.097 1.00 55.15 H new ATOM 0 HG3 GLU A 38 15.256 -1.874 6.972 1.00 55.15 H new ATOM 612 N LYS A 39 12.849 -2.255 6.326 1.00 4.40 N ATOM 613 CA LYS A 39 11.936 -2.810 7.344 1.00 73.03 C ATOM 614 C LYS A 39 10.627 -3.310 6.707 1.00 73.00 C ATOM 615 O LYS A 39 10.084 -4.338 7.133 1.00 43.20 O ATOM 616 CB LYS A 39 11.637 -1.762 8.447 1.00 14.40 C ATOM 617 CG LYS A 39 10.613 -2.237 9.510 1.00 74.41 C ATOM 618 CD LYS A 39 10.229 -1.143 10.530 1.00 53.04 C ATOM 619 CE LYS A 39 9.014 -1.545 11.380 1.00 20.14 C ATOM 620 NZ LYS A 39 8.592 -0.464 12.308 1.00 3.54 N ATOM 0 H LYS A 39 13.017 -1.254 6.430 1.00 4.40 H new ATOM 0 HA LYS A 39 12.434 -3.663 7.804 1.00 73.03 H new ATOM 0 HB2 LYS A 39 12.569 -1.501 8.947 1.00 14.40 H new ATOM 0 HB3 LYS A 39 11.262 -0.853 7.977 1.00 14.40 H new ATOM 0 HG2 LYS A 39 9.712 -2.584 9.005 1.00 74.41 H new ATOM 0 HG3 LYS A 39 11.027 -3.092 10.045 1.00 74.41 H new ATOM 0 HD2 LYS A 39 11.078 -0.944 11.184 1.00 53.04 H new ATOM 0 HD3 LYS A 39 10.010 -0.216 10.001 1.00 53.04 H new ATOM 0 HE2 LYS A 39 8.183 -1.802 10.723 1.00 20.14 H new ATOM 0 HE3 LYS A 39 9.255 -2.440 11.954 1.00 20.14 H new ATOM 0 HZ1 LYS A 39 7.770 -0.782 12.860 1.00 3.54 H new ATOM 0 HZ2 LYS A 39 9.375 -0.235 12.954 1.00 3.54 H new ATOM 0 HZ3 LYS A 39 8.336 0.383 11.761 1.00 3.54 H new ATOM 634 N VAL A 40 10.144 -2.580 5.674 1.00 22.31 N ATOM 635 CA VAL A 40 8.935 -2.964 4.917 1.00 61.41 C ATOM 636 C VAL A 40 9.136 -4.367 4.316 1.00 64.31 C ATOM 637 O VAL A 40 8.340 -5.275 4.557 1.00 61.45 O ATOM 638 CB VAL A 40 8.597 -1.934 3.767 1.00 54.03 C ATOM 639 CG1 VAL A 40 7.372 -2.393 2.947 1.00 20.31 C ATOM 640 CG2 VAL A 40 8.381 -0.507 4.325 1.00 33.54 C ATOM 0 H VAL A 40 10.578 -1.717 5.346 1.00 22.31 H new ATOM 0 HA VAL A 40 8.094 -2.964 5.610 1.00 61.41 H new ATOM 0 HB VAL A 40 9.458 -1.902 3.100 1.00 54.03 H new ATOM 0 HG11 VAL A 40 7.165 -1.664 2.164 1.00 20.31 H new ATOM 0 HG12 VAL A 40 7.580 -3.363 2.494 1.00 20.31 H new ATOM 0 HG13 VAL A 40 6.506 -2.477 3.603 1.00 20.31 H new ATOM 0 HG21 VAL A 40 8.151 0.173 3.505 1.00 33.54 H new ATOM 0 HG22 VAL A 40 7.553 -0.515 5.034 1.00 33.54 H new ATOM 0 HG23 VAL A 40 9.287 -0.173 4.830 1.00 33.54 H new ATOM 650 N LYS A 41 10.258 -4.522 3.584 1.00 24.31 N ATOM 651 CA LYS A 41 10.663 -5.793 2.947 1.00 34.34 C ATOM 652 C LYS A 41 10.857 -6.921 3.980 1.00 65.35 C ATOM 653 O LYS A 41 10.501 -8.076 3.731 1.00 62.23 O ATOM 654 CB LYS A 41 11.980 -5.593 2.156 1.00 61.33 C ATOM 655 CG LYS A 41 11.886 -4.578 1.003 1.00 61.20 C ATOM 656 CD LYS A 41 13.222 -4.438 0.233 1.00 70.15 C ATOM 657 CE LYS A 41 13.102 -3.541 -1.009 1.00 23.11 C ATOM 658 NZ LYS A 41 14.392 -3.406 -1.737 1.00 10.24 N ATOM 0 H LYS A 41 10.916 -3.761 3.416 1.00 24.31 H new ATOM 0 HA LYS A 41 9.860 -6.087 2.271 1.00 34.34 H new ATOM 0 HB2 LYS A 41 12.758 -5.267 2.847 1.00 61.33 H new ATOM 0 HB3 LYS A 41 12.295 -6.555 1.751 1.00 61.33 H new ATOM 0 HG2 LYS A 41 11.102 -4.888 0.312 1.00 61.20 H new ATOM 0 HG3 LYS A 41 11.595 -3.606 1.401 1.00 61.20 H new ATOM 0 HD2 LYS A 41 13.980 -4.027 0.900 1.00 70.15 H new ATOM 0 HD3 LYS A 41 13.567 -5.427 -0.070 1.00 70.15 H new ATOM 0 HE2 LYS A 41 12.350 -3.954 -1.681 1.00 23.11 H new ATOM 0 HE3 LYS A 41 12.752 -2.553 -0.708 1.00 23.11 H new ATOM 0 HZ1 LYS A 41 14.629 -2.399 -1.839 1.00 10.24 H new ATOM 0 HZ2 LYS A 41 15.144 -3.886 -1.203 1.00 10.24 H new ATOM 0 HZ3 LYS A 41 14.306 -3.839 -2.679 1.00 10.24 H new ATOM 672 N GLU A 42 11.417 -6.549 5.139 1.00 3.14 N ATOM 673 CA GLU A 42 11.759 -7.480 6.222 1.00 3.11 C ATOM 674 C GLU A 42 10.481 -8.178 6.730 1.00 74.33 C ATOM 675 O GLU A 42 10.385 -9.409 6.730 1.00 62.21 O ATOM 676 CB GLU A 42 12.500 -6.670 7.339 1.00 34.52 C ATOM 677 CG GLU A 42 13.070 -7.463 8.541 1.00 64.12 C ATOM 678 CD GLU A 42 12.029 -7.846 9.615 1.00 72.52 C ATOM 679 OE1 GLU A 42 11.569 -6.955 10.363 1.00 62.54 O ATOM 680 OE2 GLU A 42 11.678 -9.036 9.724 1.00 73.33 O ATOM 0 H GLU A 42 11.648 -5.579 5.353 1.00 3.14 H new ATOM 0 HA GLU A 42 12.425 -8.271 5.877 1.00 3.11 H new ATOM 0 HB2 GLU A 42 13.324 -6.130 6.872 1.00 34.52 H new ATOM 0 HB3 GLU A 42 11.808 -5.923 7.727 1.00 34.52 H new ATOM 0 HG2 GLU A 42 13.539 -8.374 8.168 1.00 64.12 H new ATOM 0 HG3 GLU A 42 13.855 -6.870 9.011 1.00 64.12 H new ATOM 687 N GLU A 43 9.489 -7.358 7.098 1.00 15.24 N ATOM 688 CA GLU A 43 8.218 -7.817 7.678 1.00 20.01 C ATOM 689 C GLU A 43 7.229 -8.380 6.631 1.00 54.21 C ATOM 690 O GLU A 43 6.262 -9.060 7.012 1.00 41.32 O ATOM 691 CB GLU A 43 7.592 -6.733 8.574 1.00 3.23 C ATOM 692 CG GLU A 43 7.072 -5.474 7.867 1.00 61.24 C ATOM 693 CD GLU A 43 6.480 -4.485 8.875 1.00 32.32 C ATOM 694 OE1 GLU A 43 5.457 -4.846 9.517 1.00 41.04 O ATOM 695 OE2 GLU A 43 7.041 -3.381 9.070 1.00 12.14 O ATOM 0 H GLU A 43 9.546 -6.344 7.001 1.00 15.24 H new ATOM 0 HA GLU A 43 8.455 -8.668 8.317 1.00 20.01 H new ATOM 0 HB2 GLU A 43 6.765 -7.181 9.124 1.00 3.23 H new ATOM 0 HB3 GLU A 43 8.336 -6.428 9.310 1.00 3.23 H new ATOM 0 HG2 GLU A 43 7.885 -4.998 7.319 1.00 61.24 H new ATOM 0 HG3 GLU A 43 6.313 -5.751 7.135 1.00 61.24 H new ATOM 702 N ILE A 44 7.417 -8.036 5.329 1.00 61.10 N ATOM 703 CA ILE A 44 6.656 -8.675 4.214 1.00 41.35 C ATOM 704 C ILE A 44 6.748 -10.227 4.290 1.00 23.43 C ATOM 705 O ILE A 44 5.756 -10.917 4.012 1.00 14.01 O ATOM 706 CB ILE A 44 7.120 -8.168 2.777 1.00 21.24 C ATOM 707 CG1 ILE A 44 6.552 -6.747 2.455 1.00 43.42 C ATOM 708 CG2 ILE A 44 6.728 -9.155 1.647 1.00 75.53 C ATOM 709 CD1 ILE A 44 6.965 -6.192 1.096 1.00 74.10 C ATOM 0 H ILE A 44 8.083 -7.326 5.024 1.00 61.10 H new ATOM 0 HA ILE A 44 5.617 -8.372 4.343 1.00 41.35 H new ATOM 0 HB ILE A 44 8.208 -8.113 2.816 1.00 21.24 H new ATOM 0 HG12 ILE A 44 5.464 -6.786 2.502 1.00 43.42 H new ATOM 0 HG13 ILE A 44 6.880 -6.055 3.231 1.00 43.42 H new ATOM 0 HG21 ILE A 44 7.067 -8.763 0.688 1.00 75.53 H new ATOM 0 HG22 ILE A 44 7.196 -10.122 1.830 1.00 75.53 H new ATOM 0 HG23 ILE A 44 5.645 -9.274 1.628 1.00 75.53 H new ATOM 0 HD11 ILE A 44 6.526 -5.204 0.958 1.00 74.10 H new ATOM 0 HD12 ILE A 44 8.051 -6.116 1.049 1.00 74.10 H new ATOM 0 HD13 ILE A 44 6.613 -6.859 0.309 1.00 74.10 H new ATOM 721 N GLU A 45 7.931 -10.758 4.696 1.00 65.23 N ATOM 722 CA GLU A 45 8.132 -12.211 4.909 1.00 65.42 C ATOM 723 C GLU A 45 7.090 -12.783 5.903 1.00 44.45 C ATOM 724 O GLU A 45 6.513 -13.838 5.652 1.00 41.12 O ATOM 725 CB GLU A 45 9.570 -12.519 5.413 1.00 63.53 C ATOM 726 CG GLU A 45 9.821 -14.022 5.694 1.00 20.45 C ATOM 727 CD GLU A 45 11.184 -14.342 6.324 1.00 15.12 C ATOM 728 OE1 GLU A 45 11.446 -13.870 7.448 1.00 62.11 O ATOM 729 OE2 GLU A 45 11.986 -15.092 5.716 1.00 70.43 O ATOM 0 H GLU A 45 8.762 -10.196 4.882 1.00 65.23 H new ATOM 0 HA GLU A 45 7.995 -12.696 3.943 1.00 65.42 H new ATOM 0 HB2 GLU A 45 10.288 -12.172 4.670 1.00 63.53 H new ATOM 0 HB3 GLU A 45 9.756 -11.952 6.325 1.00 63.53 H new ATOM 0 HG2 GLU A 45 9.036 -14.389 6.355 1.00 20.45 H new ATOM 0 HG3 GLU A 45 9.732 -14.572 4.757 1.00 20.45 H new ATOM 736 N LYS A 46 6.840 -12.045 7.003 1.00 60.25 N ATOM 737 CA LYS A 46 5.832 -12.421 8.027 1.00 33.10 C ATOM 738 C LYS A 46 4.411 -12.482 7.428 1.00 43.03 C ATOM 739 O LYS A 46 3.634 -13.401 7.726 1.00 13.52 O ATOM 740 CB LYS A 46 5.867 -11.399 9.195 1.00 60.01 C ATOM 741 CG LYS A 46 7.188 -11.379 9.997 1.00 45.30 C ATOM 742 CD LYS A 46 7.271 -10.177 10.969 1.00 74.12 C ATOM 743 CE LYS A 46 8.480 -10.249 11.920 1.00 34.35 C ATOM 744 NZ LYS A 46 9.772 -10.357 11.202 1.00 22.20 N ATOM 0 H LYS A 46 7.327 -11.173 7.211 1.00 60.25 H new ATOM 0 HA LYS A 46 6.082 -13.415 8.398 1.00 33.10 H new ATOM 0 HB2 LYS A 46 5.687 -10.402 8.793 1.00 60.01 H new ATOM 0 HB3 LYS A 46 5.047 -11.620 9.878 1.00 60.01 H new ATOM 0 HG2 LYS A 46 7.281 -12.307 10.562 1.00 45.30 H new ATOM 0 HG3 LYS A 46 8.029 -11.342 9.305 1.00 45.30 H new ATOM 0 HD2 LYS A 46 7.325 -9.254 10.392 1.00 74.12 H new ATOM 0 HD3 LYS A 46 6.355 -10.131 11.558 1.00 74.12 H new ATOM 0 HE2 LYS A 46 8.494 -9.360 12.550 1.00 34.35 H new ATOM 0 HE3 LYS A 46 8.365 -11.107 12.582 1.00 34.35 H new ATOM 0 HZ1 LYS A 46 10.547 -10.436 11.891 1.00 22.20 H new ATOM 0 HZ2 LYS A 46 9.762 -11.201 10.594 1.00 22.20 H new ATOM 0 HZ3 LYS A 46 9.915 -9.510 10.616 1.00 22.20 H new ATOM 758 N ALA A 47 4.103 -11.504 6.559 1.00 61.32 N ATOM 759 CA ALA A 47 2.779 -11.362 5.929 1.00 75.15 C ATOM 760 C ALA A 47 2.484 -12.529 4.972 1.00 51.41 C ATOM 761 O ALA A 47 1.437 -13.179 5.075 1.00 61.42 O ATOM 762 CB ALA A 47 2.696 -10.020 5.196 1.00 72.14 C ATOM 0 H ALA A 47 4.769 -10.786 6.273 1.00 61.32 H new ATOM 0 HA ALA A 47 2.020 -11.386 6.711 1.00 75.15 H new ATOM 0 HB1 ALA A 47 1.715 -9.919 4.732 1.00 72.14 H new ATOM 0 HB2 ALA A 47 2.846 -9.207 5.907 1.00 72.14 H new ATOM 0 HB3 ALA A 47 3.468 -9.977 4.427 1.00 72.14 H new ATOM 768 N ARG A 48 3.438 -12.805 4.058 1.00 72.14 N ATOM 769 CA ARG A 48 3.305 -13.883 3.060 1.00 3.42 C ATOM 770 C ARG A 48 3.404 -15.281 3.716 1.00 12.42 C ATOM 771 O ARG A 48 2.826 -16.244 3.202 1.00 61.20 O ATOM 772 CB ARG A 48 4.363 -13.743 1.932 1.00 12.34 C ATOM 773 CG ARG A 48 5.834 -13.885 2.383 1.00 62.44 C ATOM 774 CD ARG A 48 6.808 -14.024 1.204 1.00 42.34 C ATOM 775 NE ARG A 48 6.544 -15.243 0.417 1.00 1.31 N ATOM 776 CZ ARG A 48 7.369 -15.775 -0.500 1.00 75.14 C ATOM 777 NH1 ARG A 48 8.543 -15.210 -0.786 1.00 4.31 N ATOM 778 NH2 ARG A 48 7.008 -16.884 -1.133 1.00 2.23 N ATOM 0 H ARG A 48 4.316 -12.290 3.992 1.00 72.14 H new ATOM 0 HA ARG A 48 2.314 -13.785 2.616 1.00 3.42 H new ATOM 0 HB2 ARG A 48 4.160 -14.496 1.171 1.00 12.34 H new ATOM 0 HB3 ARG A 48 4.238 -12.769 1.459 1.00 12.34 H new ATOM 0 HG2 ARG A 48 6.112 -13.015 2.977 1.00 62.44 H new ATOM 0 HG3 ARG A 48 5.928 -14.757 3.031 1.00 62.44 H new ATOM 0 HD2 ARG A 48 6.725 -13.150 0.559 1.00 42.34 H new ATOM 0 HD3 ARG A 48 7.831 -14.048 1.579 1.00 42.34 H new ATOM 0 HE ARG A 48 5.660 -15.723 0.583 1.00 1.31 H new ATOM 0 HH11 ARG A 48 8.829 -14.357 -0.305 1.00 4.31 H new ATOM 0 HH12 ARG A 48 9.154 -15.631 -1.486 1.00 4.31 H new ATOM 0 HH21 ARG A 48 6.112 -17.323 -0.921 1.00 2.23 H new ATOM 0 HH22 ARG A 48 7.626 -17.297 -1.831 1.00 2.23 H new ATOM 792 N LYS A 49 4.150 -15.365 4.845 1.00 63.11 N ATOM 793 CA LYS A 49 4.262 -16.592 5.687 1.00 63.31 C ATOM 794 C LYS A 49 2.870 -17.076 6.111 1.00 42.42 C ATOM 795 O LYS A 49 2.535 -18.263 6.008 1.00 64.23 O ATOM 796 CB LYS A 49 5.109 -16.287 6.956 1.00 24.03 C ATOM 797 CG LYS A 49 5.159 -17.413 8.022 1.00 64.44 C ATOM 798 CD LYS A 49 5.730 -16.923 9.370 1.00 74.43 C ATOM 799 CE LYS A 49 7.183 -16.431 9.270 1.00 22.12 C ATOM 800 NZ LYS A 49 8.130 -17.524 8.920 1.00 62.52 N ATOM 0 H LYS A 49 4.696 -14.581 5.203 1.00 63.11 H new ATOM 0 HA LYS A 49 4.749 -17.372 5.101 1.00 63.31 H new ATOM 0 HB2 LYS A 49 6.129 -16.063 6.644 1.00 24.03 H new ATOM 0 HB3 LYS A 49 4.714 -15.386 7.425 1.00 24.03 H new ATOM 0 HG2 LYS A 49 4.155 -17.807 8.178 1.00 64.44 H new ATOM 0 HG3 LYS A 49 5.770 -18.235 7.649 1.00 64.44 H new ATOM 0 HD2 LYS A 49 5.105 -16.115 9.749 1.00 74.43 H new ATOM 0 HD3 LYS A 49 5.677 -17.734 10.096 1.00 74.43 H new ATOM 0 HE2 LYS A 49 7.246 -15.645 8.518 1.00 22.12 H new ATOM 0 HE3 LYS A 49 7.480 -15.988 10.221 1.00 22.12 H new ATOM 0 HZ1 LYS A 49 9.098 -17.146 8.881 1.00 62.52 H new ATOM 0 HZ2 LYS A 49 8.079 -18.272 9.641 1.00 62.52 H new ATOM 0 HZ3 LYS A 49 7.876 -17.920 7.992 1.00 62.52 H new ATOM 814 N GLN A 50 2.085 -16.113 6.595 1.00 54.11 N ATOM 815 CA GLN A 50 0.705 -16.321 7.034 1.00 63.32 C ATOM 816 C GLN A 50 -0.263 -16.336 5.829 1.00 54.22 C ATOM 817 O GLN A 50 -1.327 -16.948 5.893 1.00 24.42 O ATOM 818 CB GLN A 50 0.333 -15.195 8.029 1.00 74.11 C ATOM 819 CG GLN A 50 1.167 -15.182 9.333 1.00 10.31 C ATOM 820 CD GLN A 50 0.851 -16.338 10.294 1.00 11.23 C ATOM 821 OE1 GLN A 50 -0.280 -16.828 10.356 1.00 21.11 O ATOM 822 NE2 GLN A 50 1.843 -16.776 11.055 1.00 53.32 N ATOM 0 H GLN A 50 2.397 -15.147 6.695 1.00 54.11 H new ATOM 0 HA GLN A 50 0.619 -17.290 7.526 1.00 63.32 H new ATOM 0 HB2 GLN A 50 0.451 -14.234 7.529 1.00 74.11 H new ATOM 0 HB3 GLN A 50 -0.721 -15.292 8.289 1.00 74.11 H new ATOM 0 HG2 GLN A 50 2.225 -15.218 9.075 1.00 10.31 H new ATOM 0 HG3 GLN A 50 0.997 -14.238 9.850 1.00 10.31 H new ATOM 0 HE21 GLN A 50 2.768 -16.352 10.982 1.00 53.32 H new ATOM 0 HE22 GLN A 50 1.682 -17.538 11.714 1.00 53.32 H new ATOM 831 N GLY A 51 0.135 -15.662 4.732 1.00 34.51 N ATOM 832 CA GLY A 51 -0.725 -15.483 3.553 1.00 64.13 C ATOM 833 C GLY A 51 -1.735 -14.352 3.737 1.00 75.34 C ATOM 834 O GLY A 51 -2.704 -14.240 2.988 1.00 62.11 O ATOM 0 H GLY A 51 1.055 -15.231 4.641 1.00 34.51 H new ATOM 0 HA2 GLY A 51 -0.104 -15.274 2.682 1.00 64.13 H new ATOM 0 HA3 GLY A 51 -1.257 -16.412 3.350 1.00 64.13 H new ATOM 838 N ARG A 52 -1.484 -13.496 4.734 1.00 34.41 N ATOM 839 CA ARG A 52 -2.371 -12.379 5.099 1.00 72.32 C ATOM 840 C ARG A 52 -1.841 -11.084 4.454 1.00 52.34 C ATOM 841 O ARG A 52 -0.620 -10.872 4.445 1.00 35.13 O ATOM 842 CB ARG A 52 -2.439 -12.259 6.647 1.00 53.50 C ATOM 843 CG ARG A 52 -2.886 -13.571 7.327 1.00 33.35 C ATOM 844 CD ARG A 52 -2.824 -13.534 8.863 1.00 41.42 C ATOM 845 NE ARG A 52 -2.980 -14.887 9.448 1.00 23.33 N ATOM 846 CZ ARG A 52 -4.134 -15.433 9.868 1.00 61.40 C ATOM 847 NH1 ARG A 52 -5.272 -14.766 9.788 1.00 20.11 N ATOM 848 NH2 ARG A 52 -4.138 -16.658 10.369 1.00 33.14 N ATOM 0 H ARG A 52 -0.650 -13.558 5.318 1.00 34.41 H new ATOM 0 HA ARG A 52 -3.381 -12.557 4.730 1.00 72.32 H new ATOM 0 HB2 ARG A 52 -1.459 -11.972 7.029 1.00 53.50 H new ATOM 0 HB3 ARG A 52 -3.131 -11.461 6.915 1.00 53.50 H new ATOM 0 HG2 ARG A 52 -3.907 -13.797 7.021 1.00 33.35 H new ATOM 0 HG3 ARG A 52 -2.258 -14.386 6.968 1.00 33.35 H new ATOM 0 HD2 ARG A 52 -1.872 -13.108 9.179 1.00 41.42 H new ATOM 0 HD3 ARG A 52 -3.608 -12.880 9.244 1.00 41.42 H new ATOM 0 HE ARG A 52 -2.137 -15.454 9.540 1.00 23.33 H new ATOM 0 HH11 ARG A 52 -5.284 -13.822 9.403 1.00 20.11 H new ATOM 0 HH12 ARG A 52 -6.139 -15.196 10.111 1.00 20.11 H new ATOM 0 HH21 ARG A 52 -3.267 -17.185 10.435 1.00 33.14 H new ATOM 0 HH22 ARG A 52 -5.012 -17.075 10.689 1.00 33.14 H new ATOM 862 N PRO A 53 -2.736 -10.215 3.868 1.00 51.42 N ATOM 863 CA PRO A 53 -2.320 -8.947 3.215 1.00 13.11 C ATOM 864 C PRO A 53 -1.531 -8.003 4.155 1.00 72.10 C ATOM 865 O PRO A 53 -1.696 -8.049 5.385 1.00 63.13 O ATOM 866 CB PRO A 53 -3.663 -8.306 2.758 1.00 11.20 C ATOM 867 CG PRO A 53 -4.624 -9.456 2.676 1.00 22.14 C ATOM 868 CD PRO A 53 -4.215 -10.404 3.784 1.00 3.33 C ATOM 0 HA PRO A 53 -1.629 -9.130 2.393 1.00 13.11 H new ATOM 0 HB2 PRO A 53 -4.005 -7.554 3.469 1.00 11.20 H new ATOM 0 HB3 PRO A 53 -3.557 -7.809 1.794 1.00 11.20 H new ATOM 0 HG2 PRO A 53 -5.652 -9.119 2.808 1.00 22.14 H new ATOM 0 HG3 PRO A 53 -4.571 -9.944 1.703 1.00 22.14 H new ATOM 0 HD2 PRO A 53 -4.706 -10.158 4.726 1.00 3.33 H new ATOM 0 HD3 PRO A 53 -4.476 -11.436 3.548 1.00 3.33 H new ATOM 876 N ILE A 54 -0.672 -7.159 3.566 1.00 74.30 N ATOM 877 CA ILE A 54 0.163 -6.205 4.308 1.00 31.22 C ATOM 878 C ILE A 54 -0.037 -4.790 3.733 1.00 72.24 C ATOM 879 O ILE A 54 0.231 -4.541 2.553 1.00 14.24 O ATOM 880 CB ILE A 54 1.684 -6.641 4.303 1.00 5.10 C ATOM 881 CG1 ILE A 54 2.573 -5.600 5.057 1.00 32.33 C ATOM 882 CG2 ILE A 54 2.218 -6.919 2.874 1.00 44.55 C ATOM 883 CD1 ILE A 54 4.017 -6.027 5.283 1.00 64.23 C ATOM 0 H ILE A 54 -0.537 -7.119 2.556 1.00 74.30 H new ATOM 0 HA ILE A 54 -0.149 -6.197 5.352 1.00 31.22 H new ATOM 0 HB ILE A 54 1.744 -7.586 4.843 1.00 5.10 H new ATOM 0 HG12 ILE A 54 2.570 -4.667 4.493 1.00 32.33 H new ATOM 0 HG13 ILE A 54 2.117 -5.389 6.024 1.00 32.33 H new ATOM 0 HG21 ILE A 54 3.266 -7.214 2.928 1.00 44.55 H new ATOM 0 HG22 ILE A 54 1.638 -7.722 2.419 1.00 44.55 H new ATOM 0 HG23 ILE A 54 2.126 -6.017 2.269 1.00 44.55 H new ATOM 0 HD11 ILE A 54 4.551 -5.238 5.813 1.00 64.23 H new ATOM 0 HD12 ILE A 54 4.037 -6.941 5.876 1.00 64.23 H new ATOM 0 HD13 ILE A 54 4.498 -6.208 4.322 1.00 64.23 H new ATOM 895 N VAL A 55 -0.550 -3.874 4.577 1.00 33.00 N ATOM 896 CA VAL A 55 -0.844 -2.493 4.181 1.00 21.24 C ATOM 897 C VAL A 55 0.324 -1.585 4.582 1.00 10.22 C ATOM 898 O VAL A 55 0.766 -1.642 5.718 1.00 32.20 O ATOM 899 CB VAL A 55 -2.173 -1.936 4.832 1.00 33.35 C ATOM 900 CG1 VAL A 55 -2.676 -0.707 4.057 1.00 42.33 C ATOM 901 CG2 VAL A 55 -3.274 -3.006 4.916 1.00 13.23 C ATOM 0 H VAL A 55 -0.771 -4.076 5.552 1.00 33.00 H new ATOM 0 HA VAL A 55 -0.984 -2.496 3.100 1.00 21.24 H new ATOM 0 HB VAL A 55 -1.933 -1.641 5.853 1.00 33.35 H new ATOM 0 HG11 VAL A 55 -3.591 -0.336 4.518 1.00 42.33 H new ATOM 0 HG12 VAL A 55 -1.916 0.074 4.080 1.00 42.33 H new ATOM 0 HG13 VAL A 55 -2.878 -0.987 3.023 1.00 42.33 H new ATOM 0 HG21 VAL A 55 -4.166 -2.575 5.370 1.00 13.23 H new ATOM 0 HG22 VAL A 55 -3.513 -3.362 3.914 1.00 13.23 H new ATOM 0 HG23 VAL A 55 -2.925 -3.841 5.524 1.00 13.23 H new ATOM 911 N ILE A 56 0.818 -0.754 3.644 1.00 0.01 N ATOM 912 CA ILE A 56 1.961 0.153 3.891 1.00 73.01 C ATOM 913 C ILE A 56 1.464 1.613 3.859 1.00 53.53 C ATOM 914 O ILE A 56 0.983 2.076 2.828 1.00 3.11 O ATOM 915 CB ILE A 56 3.107 -0.058 2.821 1.00 24.13 C ATOM 916 CG1 ILE A 56 3.480 -1.573 2.675 1.00 70.04 C ATOM 917 CG2 ILE A 56 4.363 0.792 3.151 1.00 24.20 C ATOM 918 CD1 ILE A 56 3.947 -2.250 3.956 1.00 53.01 C ATOM 0 H ILE A 56 0.440 -0.691 2.699 1.00 0.01 H new ATOM 0 HA ILE A 56 2.381 -0.074 4.871 1.00 73.01 H new ATOM 0 HB ILE A 56 2.718 0.286 1.863 1.00 24.13 H new ATOM 0 HG12 ILE A 56 2.611 -2.110 2.295 1.00 70.04 H new ATOM 0 HG13 ILE A 56 4.266 -1.667 1.926 1.00 70.04 H new ATOM 0 HG21 ILE A 56 5.128 0.620 2.394 1.00 24.20 H new ATOM 0 HG22 ILE A 56 4.095 1.848 3.163 1.00 24.20 H new ATOM 0 HG23 ILE A 56 4.750 0.505 4.129 1.00 24.20 H new ATOM 0 HD11 ILE A 56 4.181 -3.295 3.751 1.00 53.01 H new ATOM 0 HD12 ILE A 56 4.838 -1.745 4.330 1.00 53.01 H new ATOM 0 HD13 ILE A 56 3.157 -2.195 4.705 1.00 53.01 H new ATOM 930 N PHE A 57 1.574 2.310 4.995 1.00 74.52 N ATOM 931 CA PHE A 57 1.124 3.709 5.153 1.00 21.04 C ATOM 932 C PHE A 57 2.323 4.657 5.088 1.00 0.02 C ATOM 933 O PHE A 57 3.166 4.678 6.001 1.00 61.23 O ATOM 934 CB PHE A 57 0.346 3.893 6.487 1.00 11.24 C ATOM 935 CG PHE A 57 -1.091 3.399 6.414 1.00 31.23 C ATOM 936 CD1 PHE A 57 -1.404 2.053 6.581 1.00 41.23 C ATOM 937 CD2 PHE A 57 -2.126 4.289 6.134 1.00 2.11 C ATOM 938 CE1 PHE A 57 -2.711 1.620 6.487 1.00 12.05 C ATOM 939 CE2 PHE A 57 -3.426 3.850 6.032 1.00 5.21 C ATOM 940 CZ PHE A 57 -3.716 2.517 6.199 1.00 3.12 C ATOM 0 H PHE A 57 1.982 1.919 5.844 1.00 74.52 H new ATOM 0 HA PHE A 57 0.445 3.950 4.335 1.00 21.04 H new ATOM 0 HB2 PHE A 57 0.867 3.359 7.281 1.00 11.24 H new ATOM 0 HB3 PHE A 57 0.347 4.949 6.759 1.00 11.24 H new ATOM 0 HD1 PHE A 57 -0.618 1.342 6.786 1.00 41.23 H new ATOM 0 HD2 PHE A 57 -1.905 5.337 5.995 1.00 2.11 H new ATOM 0 HE1 PHE A 57 -2.946 0.577 6.639 1.00 12.05 H new ATOM 0 HE2 PHE A 57 -4.218 4.553 5.821 1.00 5.21 H new ATOM 0 HZ PHE A 57 -4.735 2.172 6.104 1.00 3.12 H new ATOM 950 N ILE A 58 2.379 5.430 3.997 1.00 61.12 N ATOM 951 CA ILE A 58 3.453 6.400 3.717 1.00 3.15 C ATOM 952 C ILE A 58 2.903 7.617 2.960 1.00 23.51 C ATOM 953 O ILE A 58 1.830 7.565 2.361 1.00 35.33 O ATOM 954 CB ILE A 58 4.646 5.757 2.907 1.00 33.31 C ATOM 955 CG1 ILE A 58 4.126 4.802 1.795 1.00 42.11 C ATOM 956 CG2 ILE A 58 5.642 5.032 3.849 1.00 51.42 C ATOM 957 CD1 ILE A 58 5.227 4.121 1.011 1.00 12.40 C ATOM 0 H ILE A 58 1.667 5.401 3.268 1.00 61.12 H new ATOM 0 HA ILE A 58 3.845 6.722 4.682 1.00 3.15 H new ATOM 0 HB ILE A 58 5.185 6.569 2.419 1.00 33.31 H new ATOM 0 HG12 ILE A 58 3.492 4.041 2.250 1.00 42.11 H new ATOM 0 HG13 ILE A 58 3.499 5.369 1.106 1.00 42.11 H new ATOM 0 HG21 ILE A 58 6.451 4.600 3.260 1.00 51.42 H new ATOM 0 HG22 ILE A 58 6.053 5.746 4.563 1.00 51.42 H new ATOM 0 HG23 ILE A 58 5.122 4.239 4.387 1.00 51.42 H new ATOM 0 HD11 ILE A 58 4.787 3.472 0.254 1.00 12.40 H new ATOM 0 HD12 ILE A 58 5.848 4.874 0.526 1.00 12.40 H new ATOM 0 HD13 ILE A 58 5.841 3.526 1.687 1.00 12.40 H new ATOM 969 N ARG A 59 3.660 8.715 3.011 1.00 1.43 N ATOM 970 CA ARG A 59 3.288 9.996 2.389 1.00 23.34 C ATOM 971 C ARG A 59 3.742 10.007 0.913 1.00 51.50 C ATOM 972 O ARG A 59 4.539 9.153 0.514 1.00 24.15 O ATOM 973 CB ARG A 59 3.942 11.141 3.207 1.00 20.04 C ATOM 974 CG ARG A 59 3.370 12.552 2.982 1.00 61.21 C ATOM 975 CD ARG A 59 4.117 13.597 3.829 1.00 11.44 C ATOM 976 NE ARG A 59 4.116 13.221 5.259 1.00 23.44 N ATOM 977 CZ ARG A 59 5.174 13.226 6.086 1.00 53.21 C ATOM 978 NH1 ARG A 59 6.379 13.604 5.665 1.00 22.05 N ATOM 979 NH2 ARG A 59 5.016 12.831 7.339 1.00 33.00 N ATOM 0 H ARG A 59 4.560 8.744 3.490 1.00 1.43 H new ATOM 0 HA ARG A 59 2.207 10.136 2.396 1.00 23.34 H new ATOM 0 HB2 ARG A 59 3.851 10.900 4.266 1.00 20.04 H new ATOM 0 HB3 ARG A 59 5.007 11.162 2.975 1.00 20.04 H new ATOM 0 HG2 ARG A 59 3.446 12.814 1.927 1.00 61.21 H new ATOM 0 HG3 ARG A 59 2.310 12.563 3.238 1.00 61.21 H new ATOM 0 HD2 ARG A 59 5.144 13.690 3.475 1.00 11.44 H new ATOM 0 HD3 ARG A 59 3.647 14.573 3.706 1.00 11.44 H new ATOM 0 HE ARG A 59 3.223 12.929 5.657 1.00 23.44 H new ATOM 0 HH11 ARG A 59 6.512 13.897 4.697 1.00 22.05 H new ATOM 0 HH12 ARG A 59 7.169 13.600 6.310 1.00 22.05 H new ATOM 0 HH21 ARG A 59 4.099 12.528 7.666 1.00 33.00 H new ATOM 0 HH22 ARG A 59 5.811 12.830 7.978 1.00 33.00 H new ATOM 993 N GLY A 60 3.238 10.983 0.129 1.00 1.33 N ATOM 994 CA GLY A 60 3.513 11.084 -1.317 1.00 70.30 C ATOM 995 C GLY A 60 4.997 11.124 -1.688 1.00 63.04 C ATOM 996 O GLY A 60 5.368 10.682 -2.775 1.00 33.43 O ATOM 0 H GLY A 60 2.630 11.722 0.482 1.00 1.33 H new ATOM 0 HA2 GLY A 60 3.050 10.235 -1.820 1.00 70.30 H new ATOM 0 HA3 GLY A 60 3.033 11.984 -1.702 1.00 70.30 H new ATOM 1000 N ALA A 61 5.846 11.663 -0.786 1.00 2.24 N ATOM 1001 CA ALA A 61 7.312 11.682 -0.985 1.00 71.15 C ATOM 1002 C ALA A 61 7.887 10.271 -0.791 1.00 14.32 C ATOM 1003 O ALA A 61 8.623 9.752 -1.636 1.00 3.41 O ATOM 1004 CB ALA A 61 7.976 12.668 -0.012 1.00 31.14 C ATOM 0 H ALA A 61 5.541 12.091 0.088 1.00 2.24 H new ATOM 0 HA ALA A 61 7.522 12.012 -2.003 1.00 71.15 H new ATOM 0 HB1 ALA A 61 9.054 12.668 -0.173 1.00 31.14 H new ATOM 0 HB2 ALA A 61 7.583 13.670 -0.185 1.00 31.14 H new ATOM 0 HB3 ALA A 61 7.763 12.367 1.014 1.00 31.14 H new ATOM 1010 N TYR A 62 7.482 9.660 0.331 1.00 20.54 N ATOM 1011 CA TYR A 62 7.902 8.313 0.746 1.00 35.54 C ATOM 1012 C TYR A 62 7.443 7.224 -0.249 1.00 72.44 C ATOM 1013 O TYR A 62 8.018 6.143 -0.286 1.00 74.32 O ATOM 1014 CB TYR A 62 7.404 8.010 2.176 1.00 3.34 C ATOM 1015 CG TYR A 62 7.876 9.012 3.248 1.00 70.11 C ATOM 1016 CD1 TYR A 62 9.224 9.377 3.356 1.00 60.21 C ATOM 1017 CD2 TYR A 62 6.978 9.588 4.148 1.00 35.52 C ATOM 1018 CE1 TYR A 62 9.648 10.273 4.323 1.00 32.33 C ATOM 1019 CE2 TYR A 62 7.401 10.480 5.115 1.00 50.03 C ATOM 1020 CZ TYR A 62 8.733 10.820 5.198 1.00 64.31 C ATOM 1021 OH TYR A 62 9.148 11.714 6.165 1.00 71.23 O ATOM 0 H TYR A 62 6.839 10.098 0.991 1.00 20.54 H new ATOM 0 HA TYR A 62 8.992 8.295 0.746 1.00 35.54 H new ATOM 0 HB2 TYR A 62 6.314 7.991 2.170 1.00 3.34 H new ATOM 0 HB3 TYR A 62 7.738 7.012 2.459 1.00 3.34 H new ATOM 0 HD1 TYR A 62 9.945 8.952 2.673 1.00 60.21 H new ATOM 0 HD2 TYR A 62 5.931 9.331 4.087 1.00 35.52 H new ATOM 0 HE1 TYR A 62 10.692 10.542 4.392 1.00 32.33 H new ATOM 0 HE2 TYR A 62 6.689 10.909 5.804 1.00 50.03 H new ATOM 0 HH TYR A 62 8.377 12.003 6.696 1.00 71.23 H new ATOM 1031 N GLU A 63 6.355 7.503 -0.991 1.00 24.22 N ATOM 1032 CA GLU A 63 5.805 6.594 -2.025 1.00 23.12 C ATOM 1033 C GLU A 63 6.865 6.177 -3.081 1.00 31.32 C ATOM 1034 O GLU A 63 6.749 5.113 -3.683 1.00 13.21 O ATOM 1035 CB GLU A 63 4.584 7.237 -2.711 1.00 11.01 C ATOM 1036 CG GLU A 63 3.820 6.293 -3.685 1.00 53.03 C ATOM 1037 CD GLU A 63 2.700 6.953 -4.511 1.00 44.32 C ATOM 1038 OE1 GLU A 63 2.590 8.196 -4.514 1.00 71.52 O ATOM 1039 OE2 GLU A 63 1.934 6.216 -5.182 1.00 4.42 O ATOM 0 H GLU A 63 5.827 8.370 -0.892 1.00 24.22 H new ATOM 0 HA GLU A 63 5.493 5.683 -1.514 1.00 23.12 H new ATOM 0 HB2 GLU A 63 3.892 7.583 -1.943 1.00 11.01 H new ATOM 0 HB3 GLU A 63 4.915 8.117 -3.263 1.00 11.01 H new ATOM 0 HG2 GLU A 63 4.540 5.850 -4.372 1.00 53.03 H new ATOM 0 HG3 GLU A 63 3.387 5.477 -3.106 1.00 53.03 H new ATOM 1046 N GLU A 64 7.895 7.021 -3.292 1.00 70.12 N ATOM 1047 CA GLU A 64 9.039 6.706 -4.188 1.00 24.42 C ATOM 1048 C GLU A 64 9.677 5.333 -3.835 1.00 34.24 C ATOM 1049 O GLU A 64 10.062 4.555 -4.723 1.00 53.21 O ATOM 1050 CB GLU A 64 10.103 7.827 -4.070 1.00 24.23 C ATOM 1051 CG GLU A 64 11.376 7.601 -4.902 1.00 52.13 C ATOM 1052 CD GLU A 64 12.438 8.679 -4.665 1.00 50.13 C ATOM 1053 OE1 GLU A 64 12.299 9.794 -5.206 1.00 4.04 O ATOM 1054 OE2 GLU A 64 13.411 8.417 -3.921 1.00 13.42 O ATOM 0 H GLU A 64 7.963 7.938 -2.851 1.00 70.12 H new ATOM 0 HA GLU A 64 8.669 6.647 -5.212 1.00 24.42 H new ATOM 0 HB2 GLU A 64 9.651 8.771 -4.374 1.00 24.23 H new ATOM 0 HB3 GLU A 64 10.385 7.932 -3.022 1.00 24.23 H new ATOM 0 HG2 GLU A 64 11.795 6.625 -4.659 1.00 52.13 H new ATOM 0 HG3 GLU A 64 11.115 7.581 -5.960 1.00 52.13 H new ATOM 1061 N VAL A 65 9.709 5.050 -2.520 1.00 21.22 N ATOM 1062 CA VAL A 65 10.236 3.803 -1.940 1.00 61.20 C ATOM 1063 C VAL A 65 9.478 2.552 -2.449 1.00 32.04 C ATOM 1064 O VAL A 65 10.096 1.496 -2.637 1.00 53.50 O ATOM 1065 CB VAL A 65 10.163 3.862 -0.362 1.00 24.43 C ATOM 1066 CG1 VAL A 65 10.592 2.532 0.294 1.00 72.33 C ATOM 1067 CG2 VAL A 65 10.998 5.052 0.180 1.00 14.01 C ATOM 0 H VAL A 65 9.360 5.699 -1.815 1.00 21.22 H new ATOM 0 HA VAL A 65 11.274 3.714 -2.260 1.00 61.20 H new ATOM 0 HB VAL A 65 9.119 4.022 -0.091 1.00 24.43 H new ATOM 0 HG11 VAL A 65 10.525 2.623 1.378 1.00 72.33 H new ATOM 0 HG12 VAL A 65 9.935 1.731 -0.044 1.00 72.33 H new ATOM 0 HG13 VAL A 65 11.620 2.302 0.012 1.00 72.33 H new ATOM 0 HG21 VAL A 65 10.935 5.075 1.268 1.00 14.01 H new ATOM 0 HG22 VAL A 65 12.039 4.933 -0.121 1.00 14.01 H new ATOM 0 HG23 VAL A 65 10.608 5.985 -0.226 1.00 14.01 H new ATOM 1077 N VAL A 66 8.154 2.697 -2.694 1.00 73.15 N ATOM 1078 CA VAL A 66 7.268 1.562 -3.050 1.00 40.14 C ATOM 1079 C VAL A 66 7.789 0.767 -4.255 1.00 62.12 C ATOM 1080 O VAL A 66 7.749 -0.443 -4.217 1.00 64.35 O ATOM 1081 CB VAL A 66 5.791 2.015 -3.340 1.00 63.33 C ATOM 1082 CG1 VAL A 66 4.870 0.826 -3.708 1.00 33.43 C ATOM 1083 CG2 VAL A 66 5.220 2.803 -2.164 1.00 52.43 C ATOM 0 H VAL A 66 7.673 3.595 -2.651 1.00 73.15 H new ATOM 0 HA VAL A 66 7.271 0.917 -2.171 1.00 40.14 H new ATOM 0 HB VAL A 66 5.827 2.670 -4.210 1.00 63.33 H new ATOM 0 HG11 VAL A 66 3.861 1.193 -3.899 1.00 33.43 H new ATOM 0 HG12 VAL A 66 5.252 0.333 -4.602 1.00 33.43 H new ATOM 0 HG13 VAL A 66 4.847 0.114 -2.883 1.00 33.43 H new ATOM 0 HG21 VAL A 66 4.197 3.105 -2.390 1.00 52.43 H new ATOM 0 HG22 VAL A 66 5.225 2.178 -1.271 1.00 52.43 H new ATOM 0 HG23 VAL A 66 5.830 3.690 -1.990 1.00 52.43 H new ATOM 1093 N ARG A 67 8.309 1.453 -5.297 1.00 71.13 N ATOM 1094 CA ARG A 67 8.791 0.782 -6.541 1.00 40.34 C ATOM 1095 C ARG A 67 9.929 -0.222 -6.211 1.00 31.33 C ATOM 1096 O ARG A 67 10.007 -1.311 -6.795 1.00 11.13 O ATOM 1097 CB ARG A 67 9.249 1.849 -7.591 1.00 51.52 C ATOM 1098 CG ARG A 67 9.265 1.382 -9.085 1.00 40.11 C ATOM 1099 CD ARG A 67 10.448 0.470 -9.470 1.00 42.43 C ATOM 1100 NE ARG A 67 10.412 0.061 -10.889 1.00 53.33 N ATOM 1101 CZ ARG A 67 11.447 -0.469 -11.561 1.00 71.33 C ATOM 1102 NH1 ARG A 67 12.620 -0.690 -10.959 1.00 34.43 N ATOM 1103 NH2 ARG A 67 11.293 -0.794 -12.833 1.00 55.35 N ATOM 0 H ARG A 67 8.409 2.468 -5.309 1.00 71.13 H new ATOM 0 HA ARG A 67 7.969 0.215 -6.979 1.00 40.34 H new ATOM 0 HB2 ARG A 67 8.592 2.715 -7.509 1.00 51.52 H new ATOM 0 HB3 ARG A 67 10.252 2.183 -7.325 1.00 51.52 H new ATOM 0 HG2 ARG A 67 8.335 0.854 -9.295 1.00 40.11 H new ATOM 0 HG3 ARG A 67 9.282 2.264 -9.726 1.00 40.11 H new ATOM 0 HD2 ARG A 67 11.384 0.991 -9.270 1.00 42.43 H new ATOM 0 HD3 ARG A 67 10.437 -0.419 -8.839 1.00 42.43 H new ATOM 0 HE ARG A 67 9.536 0.191 -11.396 1.00 53.33 H new ATOM 0 HH11 ARG A 67 12.740 -0.455 -9.974 1.00 34.43 H new ATOM 0 HH12 ARG A 67 13.395 -1.093 -11.485 1.00 34.43 H new ATOM 0 HH21 ARG A 67 10.396 -0.641 -13.293 1.00 55.35 H new ATOM 0 HH22 ARG A 67 12.072 -1.197 -13.354 1.00 55.35 H new ATOM 1117 N ASP A 68 10.767 0.157 -5.236 1.00 71.13 N ATOM 1118 CA ASP A 68 11.875 -0.679 -4.735 1.00 22.31 C ATOM 1119 C ASP A 68 11.329 -1.868 -3.906 1.00 62.44 C ATOM 1120 O ASP A 68 11.860 -2.986 -3.972 1.00 11.25 O ATOM 1121 CB ASP A 68 12.844 0.206 -3.903 1.00 73.31 C ATOM 1122 CG ASP A 68 14.123 -0.519 -3.451 1.00 61.41 C ATOM 1123 OD1 ASP A 68 14.817 -1.099 -4.309 1.00 31.03 O ATOM 1124 OD2 ASP A 68 14.459 -0.494 -2.246 1.00 50.41 O ATOM 0 H ASP A 68 10.697 1.060 -4.767 1.00 71.13 H new ATOM 0 HA ASP A 68 12.426 -1.102 -5.575 1.00 22.31 H new ATOM 0 HB2 ASP A 68 13.123 1.077 -4.496 1.00 73.31 H new ATOM 0 HB3 ASP A 68 12.317 0.575 -3.023 1.00 73.31 H new ATOM 1129 N ILE A 69 10.242 -1.603 -3.153 1.00 40.34 N ATOM 1130 CA ILE A 69 9.495 -2.629 -2.384 1.00 71.32 C ATOM 1131 C ILE A 69 8.776 -3.608 -3.348 1.00 64.32 C ATOM 1132 O ILE A 69 8.625 -4.799 -3.047 1.00 14.22 O ATOM 1133 CB ILE A 69 8.433 -1.954 -1.428 1.00 4.24 C ATOM 1134 CG1 ILE A 69 9.092 -0.866 -0.516 1.00 22.52 C ATOM 1135 CG2 ILE A 69 7.653 -2.994 -0.590 1.00 3.33 C ATOM 1136 CD1 ILE A 69 10.254 -1.330 0.353 1.00 65.23 C ATOM 0 H ILE A 69 9.852 -0.665 -3.058 1.00 40.34 H new ATOM 0 HA ILE A 69 10.212 -3.182 -1.777 1.00 71.32 H new ATOM 0 HB ILE A 69 7.706 -1.455 -2.069 1.00 4.24 H new ATOM 0 HG12 ILE A 69 9.443 -0.053 -1.152 1.00 22.52 H new ATOM 0 HG13 ILE A 69 8.322 -0.452 0.135 1.00 22.52 H new ATOM 0 HG21 ILE A 69 6.936 -2.481 0.051 1.00 3.33 H new ATOM 0 HG22 ILE A 69 7.123 -3.674 -1.256 1.00 3.33 H new ATOM 0 HG23 ILE A 69 8.350 -3.561 0.027 1.00 3.33 H new ATOM 0 HD11 ILE A 69 10.628 -0.491 0.939 1.00 65.23 H new ATOM 0 HD12 ILE A 69 9.914 -2.119 1.024 1.00 65.23 H new ATOM 0 HD13 ILE A 69 11.053 -1.713 -0.282 1.00 65.23 H new ATOM 1148 N VAL A 70 8.346 -3.075 -4.512 1.00 11.03 N ATOM 1149 CA VAL A 70 7.666 -3.845 -5.561 1.00 11.10 C ATOM 1150 C VAL A 70 8.661 -4.820 -6.201 1.00 2.42 C ATOM 1151 O VAL A 70 8.331 -5.972 -6.434 1.00 73.43 O ATOM 1152 CB VAL A 70 7.052 -2.917 -6.688 1.00 64.23 C ATOM 1153 CG1 VAL A 70 6.520 -3.750 -7.867 1.00 20.52 C ATOM 1154 CG2 VAL A 70 5.930 -2.007 -6.146 1.00 1.04 C ATOM 0 H VAL A 70 8.465 -2.089 -4.746 1.00 11.03 H new ATOM 0 HA VAL A 70 6.844 -4.384 -5.090 1.00 11.10 H new ATOM 0 HB VAL A 70 7.864 -2.280 -7.039 1.00 64.23 H new ATOM 0 HG11 VAL A 70 6.105 -3.085 -8.624 1.00 20.52 H new ATOM 0 HG12 VAL A 70 7.335 -4.329 -8.300 1.00 20.52 H new ATOM 0 HG13 VAL A 70 5.742 -4.427 -7.513 1.00 20.52 H new ATOM 0 HG21 VAL A 70 5.540 -1.389 -6.955 1.00 1.04 H new ATOM 0 HG22 VAL A 70 5.127 -2.622 -5.740 1.00 1.04 H new ATOM 0 HG23 VAL A 70 6.329 -1.366 -5.360 1.00 1.04 H new ATOM 1164 N GLU A 71 9.883 -4.319 -6.461 1.00 33.51 N ATOM 1165 CA GLU A 71 10.981 -5.105 -7.054 1.00 33.13 C ATOM 1166 C GLU A 71 11.298 -6.343 -6.178 1.00 45.33 C ATOM 1167 O GLU A 71 11.547 -7.443 -6.691 1.00 41.11 O ATOM 1168 CB GLU A 71 12.227 -4.190 -7.236 1.00 21.34 C ATOM 1169 CG GLU A 71 13.394 -4.836 -7.999 1.00 32.30 C ATOM 1170 CD GLU A 71 14.558 -3.865 -8.255 1.00 12.35 C ATOM 1171 OE1 GLU A 71 14.546 -3.157 -9.293 1.00 12.40 O ATOM 1172 OE2 GLU A 71 15.495 -3.814 -7.431 1.00 3.40 O ATOM 0 H GLU A 71 10.138 -3.351 -6.264 1.00 33.51 H new ATOM 0 HA GLU A 71 10.681 -5.476 -8.034 1.00 33.13 H new ATOM 0 HB2 GLU A 71 11.923 -3.286 -7.763 1.00 21.34 H new ATOM 0 HB3 GLU A 71 12.581 -3.882 -6.252 1.00 21.34 H new ATOM 0 HG2 GLU A 71 13.761 -5.692 -7.433 1.00 32.30 H new ATOM 0 HG3 GLU A 71 13.030 -5.217 -8.953 1.00 32.30 H new ATOM 1179 N TYR A 72 11.239 -6.136 -4.849 1.00 2.13 N ATOM 1180 CA TYR A 72 11.321 -7.214 -3.843 1.00 63.31 C ATOM 1181 C TYR A 72 10.132 -8.191 -3.998 1.00 22.34 C ATOM 1182 O TYR A 72 10.327 -9.395 -4.155 1.00 42.12 O ATOM 1183 CB TYR A 72 11.338 -6.582 -2.422 1.00 24.13 C ATOM 1184 CG TYR A 72 11.303 -7.569 -1.241 1.00 23.54 C ATOM 1185 CD1 TYR A 72 12.469 -8.168 -0.749 1.00 61.31 C ATOM 1186 CD2 TYR A 72 10.102 -7.891 -0.603 1.00 14.20 C ATOM 1187 CE1 TYR A 72 12.432 -9.045 0.322 1.00 13.13 C ATOM 1188 CE2 TYR A 72 10.071 -8.766 0.462 1.00 35.42 C ATOM 1189 CZ TYR A 72 11.232 -9.341 0.920 1.00 74.11 C ATOM 1190 OH TYR A 72 11.188 -10.220 1.982 1.00 71.34 O ATOM 0 H TYR A 72 11.132 -5.208 -4.439 1.00 2.13 H new ATOM 0 HA TYR A 72 12.238 -7.783 -3.992 1.00 63.31 H new ATOM 0 HB2 TYR A 72 12.234 -5.969 -2.330 1.00 24.13 H new ATOM 0 HB3 TYR A 72 10.483 -5.912 -2.334 1.00 24.13 H new ATOM 0 HD1 TYR A 72 13.417 -7.941 -1.214 1.00 61.31 H new ATOM 0 HD2 TYR A 72 9.181 -7.446 -0.951 1.00 14.20 H new ATOM 0 HE1 TYR A 72 13.344 -9.495 0.686 1.00 13.13 H new ATOM 0 HE2 TYR A 72 9.130 -9.000 0.938 1.00 35.42 H new ATOM 0 HH TYR A 72 10.940 -9.736 2.797 1.00 71.34 H new ATOM 1200 N ALA A 73 8.908 -7.638 -3.983 1.00 32.01 N ATOM 1201 CA ALA A 73 7.651 -8.412 -4.048 1.00 61.34 C ATOM 1202 C ALA A 73 7.519 -9.223 -5.360 1.00 24.12 C ATOM 1203 O ALA A 73 6.856 -10.268 -5.386 1.00 74.45 O ATOM 1204 CB ALA A 73 6.452 -7.482 -3.838 1.00 64.10 C ATOM 0 H ALA A 73 8.759 -6.631 -3.925 1.00 32.01 H new ATOM 0 HA ALA A 73 7.672 -9.146 -3.242 1.00 61.34 H new ATOM 0 HB1 ALA A 73 5.530 -8.061 -3.887 1.00 64.10 H new ATOM 0 HB2 ALA A 73 6.529 -7.004 -2.861 1.00 64.10 H new ATOM 0 HB3 ALA A 73 6.443 -6.718 -4.616 1.00 64.10 H new ATOM 1210 N GLN A 74 8.146 -8.721 -6.444 1.00 42.22 N ATOM 1211 CA GLN A 74 8.165 -9.391 -7.762 1.00 54.21 C ATOM 1212 C GLN A 74 8.889 -10.751 -7.675 1.00 53.42 C ATOM 1213 O GLN A 74 8.385 -11.760 -8.183 1.00 72.15 O ATOM 1214 CB GLN A 74 8.834 -8.484 -8.843 1.00 2.25 C ATOM 1215 CG GLN A 74 7.972 -7.282 -9.304 1.00 65.55 C ATOM 1216 CD GLN A 74 8.654 -6.402 -10.363 1.00 75.14 C ATOM 1217 OE1 GLN A 74 9.504 -6.865 -11.123 1.00 61.44 O ATOM 1218 NE2 GLN A 74 8.235 -5.147 -10.481 1.00 54.20 N ATOM 0 H GLN A 74 8.655 -7.837 -6.430 1.00 42.22 H new ATOM 0 HA GLN A 74 7.132 -9.569 -8.060 1.00 54.21 H new ATOM 0 HB2 GLN A 74 9.777 -8.107 -8.448 1.00 2.25 H new ATOM 0 HB3 GLN A 74 9.075 -9.096 -9.713 1.00 2.25 H new ATOM 0 HG2 GLN A 74 7.030 -7.655 -9.706 1.00 65.55 H new ATOM 0 HG3 GLN A 74 7.727 -6.668 -8.437 1.00 65.55 H new ATOM 0 HE21 GLN A 74 7.530 -4.783 -9.841 1.00 54.20 H new ATOM 0 HE22 GLN A 74 8.619 -4.548 -11.212 1.00 54.20 H new ATOM 1227 N LYS A 75 10.065 -10.771 -7.001 1.00 11.40 N ATOM 1228 CA LYS A 75 10.844 -12.015 -6.807 1.00 51.44 C ATOM 1229 C LYS A 75 10.277 -12.854 -5.644 1.00 51.40 C ATOM 1230 O LYS A 75 10.681 -13.999 -5.458 1.00 34.54 O ATOM 1231 CB LYS A 75 12.379 -11.712 -6.650 1.00 25.51 C ATOM 1232 CG LYS A 75 12.817 -10.860 -5.428 1.00 51.32 C ATOM 1233 CD LYS A 75 12.982 -11.674 -4.116 1.00 5.44 C ATOM 1234 CE LYS A 75 13.412 -10.800 -2.933 1.00 24.22 C ATOM 1235 NZ LYS A 75 13.568 -11.585 -1.682 1.00 63.53 N ATOM 0 H LYS A 75 10.492 -9.943 -6.585 1.00 11.40 H new ATOM 0 HA LYS A 75 10.742 -12.623 -7.706 1.00 51.44 H new ATOM 0 HB2 LYS A 75 12.907 -12.664 -6.604 1.00 25.51 H new ATOM 0 HB3 LYS A 75 12.716 -11.204 -7.553 1.00 25.51 H new ATOM 0 HG2 LYS A 75 13.762 -10.370 -5.660 1.00 51.32 H new ATOM 0 HG3 LYS A 75 12.081 -10.073 -5.265 1.00 51.32 H new ATOM 0 HD2 LYS A 75 12.039 -12.166 -3.876 1.00 5.44 H new ATOM 0 HD3 LYS A 75 13.721 -12.460 -4.270 1.00 5.44 H new ATOM 0 HE2 LYS A 75 14.355 -10.308 -3.171 1.00 24.22 H new ATOM 0 HE3 LYS A 75 12.673 -10.014 -2.777 1.00 24.22 H new ATOM 0 HZ1 LYS A 75 13.573 -10.940 -0.866 1.00 63.53 H new ATOM 0 HZ2 LYS A 75 12.776 -12.253 -1.590 1.00 63.53 H new ATOM 0 HZ3 LYS A 75 14.464 -12.112 -1.712 1.00 63.53 H new ATOM 1249 N GLU A 76 9.370 -12.258 -4.848 1.00 62.12 N ATOM 1250 CA GLU A 76 8.604 -12.983 -3.809 1.00 10.12 C ATOM 1251 C GLU A 76 7.418 -13.747 -4.428 1.00 44.11 C ATOM 1252 O GLU A 76 6.948 -14.742 -3.861 1.00 12.41 O ATOM 1253 CB GLU A 76 8.110 -11.989 -2.723 1.00 24.44 C ATOM 1254 CG GLU A 76 9.229 -11.341 -1.899 1.00 51.14 C ATOM 1255 CD GLU A 76 9.972 -12.340 -1.005 1.00 75.32 C ATOM 1256 OE1 GLU A 76 9.543 -12.541 0.146 1.00 31.54 O ATOM 1257 OE2 GLU A 76 10.971 -12.949 -1.450 1.00 64.43 O ATOM 0 H GLU A 76 9.146 -11.265 -4.904 1.00 62.12 H new ATOM 0 HA GLU A 76 9.263 -13.715 -3.342 1.00 10.12 H new ATOM 0 HB2 GLU A 76 7.529 -11.203 -3.205 1.00 24.44 H new ATOM 0 HB3 GLU A 76 7.436 -12.515 -2.047 1.00 24.44 H new ATOM 0 HG2 GLU A 76 9.941 -10.867 -2.574 1.00 51.14 H new ATOM 0 HG3 GLU A 76 8.805 -10.552 -1.278 1.00 51.14 H new ATOM 1264 N GLY A 77 6.955 -13.272 -5.601 1.00 70.43 N ATOM 1265 CA GLY A 77 5.780 -13.838 -6.276 1.00 14.33 C ATOM 1266 C GLY A 77 4.473 -13.230 -5.783 1.00 22.11 C ATOM 1267 O GLY A 77 3.398 -13.778 -6.031 1.00 1.23 O ATOM 0 H GLY A 77 7.383 -12.492 -6.100 1.00 70.43 H new ATOM 0 HA2 GLY A 77 5.869 -13.676 -7.350 1.00 14.33 H new ATOM 0 HA3 GLY A 77 5.758 -14.916 -6.117 1.00 14.33 H new ATOM 1271 N LEU A 78 4.584 -12.090 -5.081 1.00 20.52 N ATOM 1272 CA LEU A 78 3.441 -11.381 -4.485 1.00 44.52 C ATOM 1273 C LEU A 78 2.806 -10.414 -5.482 1.00 20.00 C ATOM 1274 O LEU A 78 3.493 -9.832 -6.338 1.00 0.01 O ATOM 1275 CB LEU A 78 3.899 -10.601 -3.225 1.00 52.22 C ATOM 1276 CG LEU A 78 4.402 -11.475 -2.043 1.00 61.25 C ATOM 1277 CD1 LEU A 78 4.975 -10.607 -0.920 1.00 1.43 C ATOM 1278 CD2 LEU A 78 3.282 -12.385 -1.511 1.00 55.11 C ATOM 0 H LEU A 78 5.479 -11.631 -4.910 1.00 20.52 H new ATOM 0 HA LEU A 78 2.695 -12.125 -4.206 1.00 44.52 H new ATOM 0 HB2 LEU A 78 4.697 -9.916 -3.513 1.00 52.22 H new ATOM 0 HB3 LEU A 78 3.067 -9.991 -2.874 1.00 52.22 H new ATOM 0 HG LEU A 78 5.203 -12.111 -2.420 1.00 61.25 H new ATOM 0 HD11 LEU A 78 5.319 -11.245 -0.106 1.00 1.43 H new ATOM 0 HD12 LEU A 78 5.812 -10.023 -1.302 1.00 1.43 H new ATOM 0 HD13 LEU A 78 4.202 -9.933 -0.550 1.00 1.43 H new ATOM 0 HD21 LEU A 78 3.663 -12.985 -0.684 1.00 55.11 H new ATOM 0 HD22 LEU A 78 2.451 -11.773 -1.162 1.00 55.11 H new ATOM 0 HD23 LEU A 78 2.938 -13.043 -2.309 1.00 55.11 H new ATOM 1290 N ARG A 79 1.487 -10.250 -5.341 1.00 43.43 N ATOM 1291 CA ARG A 79 0.711 -9.250 -6.070 1.00 3.11 C ATOM 1292 C ARG A 79 0.810 -7.931 -5.282 1.00 33.43 C ATOM 1293 O ARG A 79 0.740 -7.937 -4.050 1.00 3.05 O ATOM 1294 CB ARG A 79 -0.762 -9.746 -6.226 1.00 50.05 C ATOM 1295 CG ARG A 79 -1.615 -9.037 -7.315 1.00 75.24 C ATOM 1296 CD ARG A 79 -2.126 -7.628 -6.933 1.00 43.20 C ATOM 1297 NE ARG A 79 -2.987 -7.067 -7.986 1.00 1.23 N ATOM 1298 CZ ARG A 79 -4.323 -7.087 -7.986 1.00 10.12 C ATOM 1299 NH1 ARG A 79 -4.997 -7.637 -6.987 1.00 0.13 N ATOM 1300 NH2 ARG A 79 -4.977 -6.596 -9.019 1.00 53.34 N ATOM 0 H ARG A 79 0.923 -10.817 -4.708 1.00 43.43 H new ATOM 0 HA ARG A 79 1.095 -9.089 -7.077 1.00 3.11 H new ATOM 0 HB2 ARG A 79 -0.742 -10.813 -6.448 1.00 50.05 H new ATOM 0 HB3 ARG A 79 -1.266 -9.629 -5.267 1.00 50.05 H new ATOM 0 HG2 ARG A 79 -1.020 -8.957 -8.225 1.00 75.24 H new ATOM 0 HG3 ARG A 79 -2.473 -9.667 -7.549 1.00 75.24 H new ATOM 0 HD2 ARG A 79 -2.681 -7.682 -5.997 1.00 43.20 H new ATOM 0 HD3 ARG A 79 -1.278 -6.965 -6.763 1.00 43.20 H new ATOM 0 HE ARG A 79 -2.526 -6.626 -8.782 1.00 1.23 H new ATOM 0 HH11 ARG A 79 -4.496 -8.054 -6.202 1.00 0.13 H new ATOM 0 HH12 ARG A 79 -6.017 -7.644 -7.003 1.00 0.13 H new ATOM 0 HH21 ARG A 79 -4.463 -6.205 -9.809 1.00 53.34 H new ATOM 0 HH22 ARG A 79 -5.997 -6.607 -9.029 1.00 53.34 H new ATOM 1314 N VAL A 80 0.982 -6.813 -5.999 1.00 12.34 N ATOM 1315 CA VAL A 80 1.149 -5.479 -5.412 1.00 53.32 C ATOM 1316 C VAL A 80 0.026 -4.585 -5.947 1.00 32.14 C ATOM 1317 O VAL A 80 -0.288 -4.618 -7.149 1.00 1.41 O ATOM 1318 CB VAL A 80 2.551 -4.844 -5.755 1.00 42.13 C ATOM 1319 CG1 VAL A 80 2.731 -3.482 -5.050 1.00 51.31 C ATOM 1320 CG2 VAL A 80 3.710 -5.804 -5.403 1.00 52.15 C ATOM 0 H VAL A 80 1.009 -6.811 -7.019 1.00 12.34 H new ATOM 0 HA VAL A 80 1.102 -5.565 -4.326 1.00 53.32 H new ATOM 0 HB VAL A 80 2.578 -4.675 -6.831 1.00 42.13 H new ATOM 0 HG11 VAL A 80 3.706 -3.067 -5.304 1.00 51.31 H new ATOM 0 HG12 VAL A 80 1.949 -2.797 -5.377 1.00 51.31 H new ATOM 0 HG13 VAL A 80 2.665 -3.619 -3.971 1.00 51.31 H new ATOM 0 HG21 VAL A 80 4.661 -5.333 -5.653 1.00 52.15 H new ATOM 0 HG22 VAL A 80 3.685 -6.029 -4.337 1.00 52.15 H new ATOM 0 HG23 VAL A 80 3.602 -6.728 -5.971 1.00 52.15 H new ATOM 1330 N LEU A 81 -0.580 -3.813 -5.048 1.00 65.33 N ATOM 1331 CA LEU A 81 -1.700 -2.935 -5.350 1.00 71.43 C ATOM 1332 C LEU A 81 -1.433 -1.608 -4.638 1.00 52.22 C ATOM 1333 O LEU A 81 -1.534 -1.538 -3.412 1.00 25.04 O ATOM 1334 CB LEU A 81 -3.008 -3.610 -4.837 1.00 60.21 C ATOM 1335 CG LEU A 81 -4.345 -3.086 -5.435 1.00 45.05 C ATOM 1336 CD1 LEU A 81 -4.414 -3.394 -6.938 1.00 44.30 C ATOM 1337 CD2 LEU A 81 -5.558 -3.677 -4.692 1.00 64.31 C ATOM 0 H LEU A 81 -0.297 -3.782 -4.068 1.00 65.33 H new ATOM 0 HA LEU A 81 -1.812 -2.755 -6.419 1.00 71.43 H new ATOM 0 HB2 LEU A 81 -2.941 -4.679 -5.039 1.00 60.21 H new ATOM 0 HB3 LEU A 81 -3.050 -3.492 -3.754 1.00 60.21 H new ATOM 0 HG LEU A 81 -4.377 -2.004 -5.304 1.00 45.05 H new ATOM 0 HD11 LEU A 81 -5.355 -3.022 -7.343 1.00 44.30 H new ATOM 0 HD12 LEU A 81 -3.582 -2.908 -7.448 1.00 44.30 H new ATOM 0 HD13 LEU A 81 -4.354 -4.471 -7.092 1.00 44.30 H new ATOM 0 HD21 LEU A 81 -6.478 -3.292 -5.133 1.00 64.31 H new ATOM 0 HD22 LEU A 81 -5.542 -4.764 -4.776 1.00 64.31 H new ATOM 0 HD23 LEU A 81 -5.514 -3.394 -3.640 1.00 64.31 H new ATOM 1349 N VAL A 82 -1.065 -0.557 -5.381 1.00 72.22 N ATOM 1350 CA VAL A 82 -0.694 0.731 -4.764 1.00 73.54 C ATOM 1351 C VAL A 82 -1.882 1.692 -4.826 1.00 52.23 C ATOM 1352 O VAL A 82 -2.249 2.188 -5.896 1.00 51.33 O ATOM 1353 CB VAL A 82 0.579 1.350 -5.450 1.00 23.40 C ATOM 1354 CG1 VAL A 82 1.012 2.683 -4.780 1.00 43.32 C ATOM 1355 CG2 VAL A 82 1.726 0.313 -5.447 1.00 14.35 C ATOM 0 H VAL A 82 -1.015 -0.568 -6.400 1.00 72.22 H new ATOM 0 HA VAL A 82 -0.438 0.557 -3.719 1.00 73.54 H new ATOM 0 HB VAL A 82 0.328 1.595 -6.482 1.00 23.40 H new ATOM 0 HG11 VAL A 82 1.895 3.075 -5.286 1.00 43.32 H new ATOM 0 HG12 VAL A 82 0.201 3.407 -4.853 1.00 43.32 H new ATOM 0 HG13 VAL A 82 1.245 2.504 -3.730 1.00 43.32 H new ATOM 0 HG21 VAL A 82 2.607 0.744 -5.923 1.00 14.35 H new ATOM 0 HG22 VAL A 82 1.966 0.039 -4.420 1.00 14.35 H new ATOM 0 HG23 VAL A 82 1.415 -0.575 -5.997 1.00 14.35 H new ATOM 1365 N ILE A 83 -2.453 1.954 -3.651 1.00 74.32 N ATOM 1366 CA ILE A 83 -3.646 2.781 -3.473 1.00 12.43 C ATOM 1367 C ILE A 83 -3.203 4.152 -2.971 1.00 13.44 C ATOM 1368 O ILE A 83 -2.743 4.265 -1.839 1.00 22.31 O ATOM 1369 CB ILE A 83 -4.622 2.132 -2.423 1.00 22.41 C ATOM 1370 CG1 ILE A 83 -4.810 0.617 -2.728 1.00 0.15 C ATOM 1371 CG2 ILE A 83 -5.989 2.875 -2.391 1.00 73.34 C ATOM 1372 CD1 ILE A 83 -5.547 -0.137 -1.655 1.00 34.52 C ATOM 0 H ILE A 83 -2.088 1.587 -2.772 1.00 74.32 H new ATOM 0 HA ILE A 83 -4.174 2.867 -4.423 1.00 12.43 H new ATOM 0 HB ILE A 83 -4.177 2.230 -1.433 1.00 22.41 H new ATOM 0 HG12 ILE A 83 -5.350 0.511 -3.669 1.00 0.15 H new ATOM 0 HG13 ILE A 83 -3.830 0.161 -2.870 1.00 0.15 H new ATOM 0 HG21 ILE A 83 -6.642 2.404 -1.656 1.00 73.34 H new ATOM 0 HG22 ILE A 83 -5.830 3.918 -2.119 1.00 73.34 H new ATOM 0 HG23 ILE A 83 -6.454 2.824 -3.375 1.00 73.34 H new ATOM 0 HD11 ILE A 83 -5.637 -1.185 -1.943 1.00 34.52 H new ATOM 0 HD12 ILE A 83 -4.998 -0.064 -0.716 1.00 34.52 H new ATOM 0 HD13 ILE A 83 -6.541 0.291 -1.527 1.00 34.52 H new ATOM 1384 N LYS A 84 -3.323 5.192 -3.792 1.00 22.43 N ATOM 1385 CA LYS A 84 -2.891 6.540 -3.395 1.00 62.31 C ATOM 1386 C LYS A 84 -3.946 7.574 -3.754 1.00 14.04 C ATOM 1387 O LYS A 84 -4.632 7.474 -4.790 1.00 35.35 O ATOM 1388 CB LYS A 84 -1.503 6.932 -3.970 1.00 61.32 C ATOM 1389 CG LYS A 84 -1.394 7.117 -5.489 1.00 72.45 C ATOM 1390 CD LYS A 84 -1.393 5.799 -6.291 1.00 4.41 C ATOM 1391 CE LYS A 84 -0.861 6.030 -7.707 1.00 74.13 C ATOM 1392 NZ LYS A 84 0.562 6.501 -7.682 1.00 30.42 N ATOM 0 H LYS A 84 -3.713 5.134 -4.733 1.00 22.43 H new ATOM 0 HA LYS A 84 -2.775 6.521 -2.311 1.00 62.31 H new ATOM 0 HB2 LYS A 84 -1.192 7.862 -3.494 1.00 61.32 H new ATOM 0 HB3 LYS A 84 -0.787 6.167 -3.672 1.00 61.32 H new ATOM 0 HG2 LYS A 84 -2.226 7.735 -5.829 1.00 72.45 H new ATOM 0 HG3 LYS A 84 -0.478 7.665 -5.712 1.00 72.45 H new ATOM 0 HD2 LYS A 84 -0.777 5.058 -5.782 1.00 4.41 H new ATOM 0 HD3 LYS A 84 -2.404 5.395 -6.338 1.00 4.41 H new ATOM 0 HE2 LYS A 84 -0.931 5.105 -8.280 1.00 74.13 H new ATOM 0 HE3 LYS A 84 -1.482 6.767 -8.216 1.00 74.13 H new ATOM 0 HZ1 LYS A 84 1.124 5.945 -8.358 1.00 30.42 H new ATOM 0 HZ2 LYS A 84 0.600 7.507 -7.945 1.00 30.42 H new ATOM 0 HZ3 LYS A 84 0.952 6.378 -6.726 1.00 30.42 H new ATOM 1406 N VAL A 85 -4.094 8.542 -2.851 1.00 33.21 N ATOM 1407 CA VAL A 85 -5.014 9.649 -2.996 1.00 54.52 C ATOM 1408 C VAL A 85 -4.330 10.738 -3.828 1.00 75.10 C ATOM 1409 O VAL A 85 -3.335 11.334 -3.387 1.00 23.41 O ATOM 1410 CB VAL A 85 -5.435 10.195 -1.576 1.00 74.24 C ATOM 1411 CG1 VAL A 85 -6.356 11.427 -1.679 1.00 24.33 C ATOM 1412 CG2 VAL A 85 -6.081 9.074 -0.720 1.00 55.24 C ATOM 0 H VAL A 85 -3.562 8.571 -1.981 1.00 33.21 H new ATOM 0 HA VAL A 85 -5.922 9.324 -3.504 1.00 54.52 H new ATOM 0 HB VAL A 85 -4.526 10.523 -1.072 1.00 74.24 H new ATOM 0 HG11 VAL A 85 -6.620 11.768 -0.678 1.00 24.33 H new ATOM 0 HG12 VAL A 85 -5.838 12.226 -2.210 1.00 24.33 H new ATOM 0 HG13 VAL A 85 -7.262 11.159 -2.222 1.00 24.33 H new ATOM 0 HG21 VAL A 85 -6.362 9.476 0.253 1.00 55.24 H new ATOM 0 HG22 VAL A 85 -6.969 8.695 -1.226 1.00 55.24 H new ATOM 0 HG23 VAL A 85 -5.367 8.262 -0.585 1.00 55.24 H new ATOM 1422 N ALA A 86 -4.853 10.948 -5.050 1.00 23.23 N ATOM 1423 CA ALA A 86 -4.276 11.876 -6.022 1.00 24.23 C ATOM 1424 C ALA A 86 -4.426 13.329 -5.557 1.00 61.32 C ATOM 1425 O ALA A 86 -3.422 14.029 -5.379 1.00 4.55 O ATOM 1426 CB ALA A 86 -4.932 11.674 -7.400 1.00 71.42 C ATOM 0 H ALA A 86 -5.691 10.474 -5.386 1.00 23.23 H new ATOM 0 HA ALA A 86 -3.210 11.665 -6.107 1.00 24.23 H new ATOM 0 HB1 ALA A 86 -4.495 12.370 -8.116 1.00 71.42 H new ATOM 0 HB2 ALA A 86 -4.762 10.652 -7.737 1.00 71.42 H new ATOM 0 HB3 ALA A 86 -6.004 11.857 -7.323 1.00 71.42 H new ATOM 1432 N GLN A 87 -5.694 13.732 -5.316 1.00 31.12 N ATOM 1433 CA GLN A 87 -6.104 15.136 -5.108 1.00 55.31 C ATOM 1434 C GLN A 87 -5.694 15.969 -6.345 1.00 21.11 C ATOM 1435 O GLN A 87 -6.523 16.213 -7.233 1.00 4.14 O ATOM 1436 CB GLN A 87 -5.538 15.723 -3.779 1.00 13.24 C ATOM 1437 CG GLN A 87 -6.038 15.037 -2.494 1.00 0.32 C ATOM 1438 CD GLN A 87 -7.549 15.176 -2.273 1.00 2.43 C ATOM 1439 OE1 GLN A 87 -8.340 14.327 -2.686 1.00 51.44 O ATOM 1440 NE2 GLN A 87 -7.958 16.260 -1.628 1.00 74.53 N ATOM 0 H GLN A 87 -6.474 13.077 -5.260 1.00 31.12 H new ATOM 0 HA GLN A 87 -7.188 15.178 -5.002 1.00 55.31 H new ATOM 0 HB2 GLN A 87 -4.450 15.659 -3.806 1.00 13.24 H new ATOM 0 HB3 GLN A 87 -5.794 16.781 -3.730 1.00 13.24 H new ATOM 0 HG2 GLN A 87 -5.781 13.979 -2.533 1.00 0.32 H new ATOM 0 HG3 GLN A 87 -5.513 15.461 -1.638 1.00 0.32 H new ATOM 0 HE21 GLN A 87 -7.277 16.945 -1.298 1.00 74.53 H new ATOM 0 HE22 GLN A 87 -8.953 16.409 -1.461 1.00 74.53 H new ATOM 1449 N ASP A 88 -4.401 16.357 -6.397 1.00 12.34 N ATOM 1450 CA ASP A 88 -3.751 16.938 -7.584 1.00 33.54 C ATOM 1451 C ASP A 88 -2.240 17.058 -7.300 1.00 30.33 C ATOM 1452 O ASP A 88 -1.779 18.055 -6.732 1.00 52.42 O ATOM 1453 CB ASP A 88 -4.359 18.315 -7.970 1.00 51.42 C ATOM 1454 CG ASP A 88 -3.876 18.821 -9.347 1.00 13.44 C ATOM 1455 OD1 ASP A 88 -4.375 18.324 -10.385 1.00 2.41 O ATOM 1456 OD2 ASP A 88 -3.006 19.713 -9.403 1.00 22.14 O ATOM 0 H ASP A 88 -3.772 16.272 -5.599 1.00 12.34 H new ATOM 0 HA ASP A 88 -3.921 16.282 -8.438 1.00 33.54 H new ATOM 0 HB2 ASP A 88 -5.446 18.237 -7.978 1.00 51.42 H new ATOM 0 HB3 ASP A 88 -4.098 19.048 -7.207 1.00 51.42 H new ATOM 1461 N GLN A 89 -1.495 15.989 -7.630 1.00 41.11 N ATOM 1462 CA GLN A 89 -0.043 15.884 -7.387 1.00 43.54 C ATOM 1463 C GLN A 89 0.667 15.625 -8.725 1.00 4.53 C ATOM 1464 O GLN A 89 0.361 14.641 -9.413 1.00 63.30 O ATOM 1465 CB GLN A 89 0.252 14.727 -6.388 1.00 71.30 C ATOM 1466 CG GLN A 89 -0.331 14.892 -4.968 1.00 62.11 C ATOM 1467 CD GLN A 89 0.306 16.031 -4.166 1.00 13.11 C ATOM 1468 OE1 GLN A 89 -0.165 17.170 -4.188 1.00 52.14 O ATOM 1469 NE2 GLN A 89 1.401 15.741 -3.469 1.00 61.42 N ATOM 0 H GLN A 89 -1.888 15.162 -8.079 1.00 41.11 H new ATOM 0 HA GLN A 89 0.324 16.813 -6.952 1.00 43.54 H new ATOM 0 HB2 GLN A 89 -0.134 13.800 -6.812 1.00 71.30 H new ATOM 0 HB3 GLN A 89 1.333 14.613 -6.304 1.00 71.30 H new ATOM 0 HG2 GLN A 89 -1.404 15.070 -5.044 1.00 62.11 H new ATOM 0 HG3 GLN A 89 -0.201 13.958 -4.421 1.00 62.11 H new ATOM 0 HE21 GLN A 89 1.768 14.789 -3.469 1.00 61.42 H new ATOM 0 HE22 GLN A 89 1.873 16.470 -2.934 1.00 61.42 H new ATOM 1478 N GLU A 90 1.615 16.508 -9.072 1.00 14.35 N ATOM 1479 CA GLU A 90 2.373 16.433 -10.339 1.00 20.44 C ATOM 1480 C GLU A 90 3.327 15.228 -10.333 1.00 42.24 C ATOM 1481 O GLU A 90 3.287 14.386 -11.231 1.00 71.32 O ATOM 1482 CB GLU A 90 3.173 17.747 -10.559 1.00 12.11 C ATOM 1483 CG GLU A 90 2.311 19.021 -10.569 1.00 23.44 C ATOM 1484 CD GLU A 90 3.139 20.293 -10.796 1.00 54.31 C ATOM 1485 OE1 GLU A 90 3.367 20.670 -11.970 1.00 71.22 O ATOM 1486 OE2 GLU A 90 3.582 20.913 -9.806 1.00 54.32 O ATOM 0 H GLU A 90 1.881 17.297 -8.484 1.00 14.35 H new ATOM 0 HA GLU A 90 1.664 16.305 -11.157 1.00 20.44 H new ATOM 0 HB2 GLU A 90 3.924 17.837 -9.774 1.00 12.11 H new ATOM 0 HB3 GLU A 90 3.709 17.678 -11.506 1.00 12.11 H new ATOM 0 HG2 GLU A 90 1.557 18.939 -11.352 1.00 23.44 H new ATOM 0 HG3 GLU A 90 1.779 19.103 -9.621 1.00 23.44 H new ATOM 1493 N LEU A 91 4.153 15.161 -9.271 1.00 32.23 N ATOM 1494 CA LEU A 91 5.150 14.088 -9.040 1.00 0.35 C ATOM 1495 C LEU A 91 4.528 12.663 -9.048 1.00 44.41 C ATOM 1496 O LEU A 91 5.218 11.684 -9.339 1.00 51.24 O ATOM 1497 CB LEU A 91 5.951 14.376 -7.719 1.00 65.23 C ATOM 1498 CG LEU A 91 5.143 14.920 -6.473 1.00 13.00 C ATOM 1499 CD1 LEU A 91 4.171 13.874 -5.880 1.00 43.14 C ATOM 1500 CD2 LEU A 91 6.101 15.466 -5.385 1.00 44.02 C ATOM 0 H LEU A 91 4.149 15.864 -8.532 1.00 32.23 H new ATOM 0 HA LEU A 91 5.845 14.100 -9.880 1.00 0.35 H new ATOM 0 HB2 LEU A 91 6.447 13.453 -7.420 1.00 65.23 H new ATOM 0 HB3 LEU A 91 6.734 15.098 -7.952 1.00 65.23 H new ATOM 0 HG LEU A 91 4.527 15.741 -6.840 1.00 13.00 H new ATOM 0 HD11 LEU A 91 3.646 14.307 -5.028 1.00 43.14 H new ATOM 0 HD12 LEU A 91 3.448 13.578 -6.640 1.00 43.14 H new ATOM 0 HD13 LEU A 91 4.733 12.999 -5.553 1.00 43.14 H new ATOM 0 HD21 LEU A 91 5.520 15.834 -4.540 1.00 44.02 H new ATOM 0 HD22 LEU A 91 6.764 14.668 -5.050 1.00 44.02 H new ATOM 0 HD23 LEU A 91 6.695 16.281 -5.799 1.00 44.02 H new ATOM 1512 N LEU A 92 3.228 12.584 -8.707 1.00 40.30 N ATOM 1513 CA LEU A 92 2.476 11.319 -8.585 1.00 0.31 C ATOM 1514 C LEU A 92 2.467 10.523 -9.903 1.00 64.54 C ATOM 1515 O LEU A 92 2.556 9.294 -9.901 1.00 21.11 O ATOM 1516 CB LEU A 92 1.013 11.621 -8.182 1.00 34.14 C ATOM 1517 CG LEU A 92 0.193 10.418 -7.622 1.00 40.12 C ATOM 1518 CD1 LEU A 92 0.551 10.147 -6.148 1.00 73.14 C ATOM 1519 CD2 LEU A 92 -1.319 10.630 -7.807 1.00 43.34 C ATOM 0 H LEU A 92 2.662 13.408 -8.506 1.00 40.30 H new ATOM 0 HA LEU A 92 2.973 10.718 -7.823 1.00 0.31 H new ATOM 0 HB2 LEU A 92 1.020 12.411 -7.431 1.00 34.14 H new ATOM 0 HB3 LEU A 92 0.491 12.015 -9.054 1.00 34.14 H new ATOM 0 HG LEU A 92 0.465 9.533 -8.198 1.00 40.12 H new ATOM 0 HD11 LEU A 92 -0.034 9.304 -5.781 1.00 73.14 H new ATOM 0 HD12 LEU A 92 1.613 9.914 -6.068 1.00 73.14 H new ATOM 0 HD13 LEU A 92 0.328 11.031 -5.551 1.00 73.14 H new ATOM 0 HD21 LEU A 92 -1.858 9.772 -7.405 1.00 43.34 H new ATOM 0 HD22 LEU A 92 -1.627 11.532 -7.279 1.00 43.34 H new ATOM 0 HD23 LEU A 92 -1.544 10.736 -8.868 1.00 43.34 H new ATOM 1531 N GLU A 93 2.356 11.270 -11.013 1.00 24.52 N ATOM 1532 CA GLU A 93 2.138 10.728 -12.363 1.00 23.01 C ATOM 1533 C GLU A 93 3.327 9.884 -12.860 1.00 55.51 C ATOM 1534 O GLU A 93 3.115 8.834 -13.470 1.00 51.32 O ATOM 1535 CB GLU A 93 1.852 11.897 -13.337 1.00 42.40 C ATOM 1536 CG GLU A 93 0.611 12.736 -12.966 1.00 51.12 C ATOM 1537 CD GLU A 93 0.459 13.981 -13.850 1.00 34.50 C ATOM 1538 OE1 GLU A 93 -0.135 13.888 -14.945 1.00 72.41 O ATOM 1539 OE2 GLU A 93 0.974 15.052 -13.472 1.00 52.40 O ATOM 0 H GLU A 93 2.417 12.288 -10.996 1.00 24.52 H new ATOM 0 HA GLU A 93 1.280 10.057 -12.323 1.00 23.01 H new ATOM 0 HB2 GLU A 93 2.723 12.551 -13.369 1.00 42.40 H new ATOM 0 HB3 GLU A 93 1.719 11.495 -14.341 1.00 42.40 H new ATOM 0 HG2 GLU A 93 -0.282 12.118 -13.057 1.00 51.12 H new ATOM 0 HG3 GLU A 93 0.682 13.042 -11.922 1.00 51.12 H new ATOM 1546 N ARG A 94 4.572 10.338 -12.584 1.00 12.32 N ATOM 1547 CA ARG A 94 5.799 9.630 -13.037 1.00 63.34 C ATOM 1548 C ARG A 94 5.954 8.278 -12.312 1.00 21.11 C ATOM 1549 O ARG A 94 6.452 7.302 -12.889 1.00 23.34 O ATOM 1550 CB ARG A 94 7.071 10.513 -12.838 1.00 45.04 C ATOM 1551 CG ARG A 94 7.542 10.673 -11.371 1.00 64.32 C ATOM 1552 CD ARG A 94 8.653 11.725 -11.190 1.00 63.11 C ATOM 1553 NE ARG A 94 8.180 13.083 -11.532 1.00 55.51 N ATOM 1554 CZ ARG A 94 8.602 14.231 -10.970 1.00 54.41 C ATOM 1555 NH1 ARG A 94 9.532 14.243 -10.019 1.00 51.04 N ATOM 1556 NH2 ARG A 94 8.060 15.376 -11.352 1.00 44.12 N ATOM 0 H ARG A 94 4.756 11.188 -12.052 1.00 12.32 H new ATOM 0 HA ARG A 94 5.692 9.435 -14.104 1.00 63.34 H new ATOM 0 HB2 ARG A 94 7.887 10.083 -13.419 1.00 45.04 H new ATOM 0 HB3 ARG A 94 6.874 11.503 -13.249 1.00 45.04 H new ATOM 0 HG2 ARG A 94 6.688 10.949 -10.752 1.00 64.32 H new ATOM 0 HG3 ARG A 94 7.902 9.711 -11.007 1.00 64.32 H new ATOM 0 HD2 ARG A 94 9.003 11.711 -10.158 1.00 63.11 H new ATOM 0 HD3 ARG A 94 9.505 11.467 -11.819 1.00 63.11 H new ATOM 0 HE ARG A 94 7.469 13.157 -12.260 1.00 55.51 H new ATOM 0 HH11 ARG A 94 9.944 13.367 -9.698 1.00 51.04 H new ATOM 0 HH12 ARG A 94 9.833 15.128 -9.611 1.00 51.04 H new ATOM 0 HH21 ARG A 94 7.331 15.382 -12.065 1.00 44.12 H new ATOM 0 HH22 ARG A 94 8.371 16.252 -10.933 1.00 44.12 H new ATOM 1570 N PHE A 95 5.506 8.237 -11.037 1.00 33.02 N ATOM 1571 CA PHE A 95 5.543 7.023 -10.217 1.00 15.12 C ATOM 1572 C PHE A 95 4.444 6.045 -10.666 1.00 11.32 C ATOM 1573 O PHE A 95 4.698 4.854 -10.860 1.00 44.12 O ATOM 1574 CB PHE A 95 5.379 7.360 -8.715 1.00 42.10 C ATOM 1575 CG PHE A 95 5.526 6.125 -7.833 1.00 43.01 C ATOM 1576 CD1 PHE A 95 6.792 5.625 -7.534 1.00 64.15 C ATOM 1577 CD2 PHE A 95 4.410 5.429 -7.364 1.00 30.00 C ATOM 1578 CE1 PHE A 95 6.935 4.486 -6.784 1.00 31.21 C ATOM 1579 CE2 PHE A 95 4.560 4.281 -6.622 1.00 3.22 C ATOM 1580 CZ PHE A 95 5.822 3.813 -6.336 1.00 61.34 C ATOM 0 H PHE A 95 5.112 9.046 -10.557 1.00 33.02 H new ATOM 0 HA PHE A 95 6.516 6.551 -10.354 1.00 15.12 H new ATOM 0 HB2 PHE A 95 6.123 8.102 -8.427 1.00 42.10 H new ATOM 0 HB3 PHE A 95 4.400 7.809 -8.549 1.00 42.10 H new ATOM 0 HD1 PHE A 95 7.669 6.140 -7.897 1.00 64.15 H new ATOM 0 HD2 PHE A 95 3.419 5.796 -7.586 1.00 30.00 H new ATOM 0 HE1 PHE A 95 7.922 4.117 -6.545 1.00 31.21 H new ATOM 0 HE2 PHE A 95 3.691 3.749 -6.265 1.00 3.22 H new ATOM 0 HZ PHE A 95 5.940 2.910 -5.755 1.00 61.34 H new ATOM 1590 N TYR A 96 3.223 6.588 -10.814 1.00 35.14 N ATOM 1591 CA TYR A 96 2.038 5.848 -11.275 1.00 44.22 C ATOM 1592 C TYR A 96 2.346 5.112 -12.595 1.00 23.41 C ATOM 1593 O TYR A 96 2.076 3.919 -12.722 1.00 21.20 O ATOM 1594 CB TYR A 96 0.842 6.852 -11.430 1.00 74.30 C ATOM 1595 CG TYR A 96 -0.299 6.399 -12.366 1.00 74.31 C ATOM 1596 CD1 TYR A 96 -1.318 5.556 -11.920 1.00 72.11 C ATOM 1597 CD2 TYR A 96 -0.345 6.813 -13.708 1.00 33.12 C ATOM 1598 CE1 TYR A 96 -2.328 5.143 -12.772 1.00 25.20 C ATOM 1599 CE2 TYR A 96 -1.359 6.400 -14.554 1.00 43.42 C ATOM 1600 CZ TYR A 96 -2.343 5.564 -14.082 1.00 64.30 C ATOM 1601 OH TYR A 96 -3.346 5.141 -14.926 1.00 54.22 O ATOM 0 H TYR A 96 3.030 7.569 -10.613 1.00 35.14 H new ATOM 0 HA TYR A 96 1.761 5.089 -10.544 1.00 44.22 H new ATOM 0 HB2 TYR A 96 0.422 7.043 -10.442 1.00 74.30 H new ATOM 0 HB3 TYR A 96 1.234 7.800 -11.798 1.00 74.30 H new ATOM 0 HD1 TYR A 96 -1.319 5.220 -10.893 1.00 72.11 H new ATOM 0 HD2 TYR A 96 0.427 7.467 -14.087 1.00 33.12 H new ATOM 0 HE1 TYR A 96 -3.106 4.489 -12.408 1.00 25.20 H new ATOM 0 HE2 TYR A 96 -1.377 6.733 -15.581 1.00 43.42 H new ATOM 0 HH TYR A 96 -3.211 5.530 -15.815 1.00 54.22 H new ATOM 1611 N GLU A 97 2.983 5.843 -13.518 1.00 43.33 N ATOM 1612 CA GLU A 97 3.286 5.382 -14.886 1.00 60.34 C ATOM 1613 C GLU A 97 4.397 4.303 -14.867 1.00 75.45 C ATOM 1614 O GLU A 97 4.343 3.331 -15.630 1.00 11.51 O ATOM 1615 CB GLU A 97 3.687 6.636 -15.726 1.00 34.32 C ATOM 1616 CG GLU A 97 3.538 6.532 -17.264 1.00 13.32 C ATOM 1617 CD GLU A 97 4.678 5.785 -17.982 1.00 71.02 C ATOM 1618 OE1 GLU A 97 5.731 6.413 -18.243 1.00 22.00 O ATOM 1619 OE2 GLU A 97 4.521 4.586 -18.318 1.00 34.50 O ATOM 0 H GLU A 97 3.310 6.791 -13.335 1.00 43.33 H new ATOM 0 HA GLU A 97 2.416 4.908 -15.341 1.00 60.34 H new ATOM 0 HB2 GLU A 97 3.086 7.479 -15.384 1.00 34.32 H new ATOM 0 HB3 GLU A 97 4.727 6.875 -15.502 1.00 34.32 H new ATOM 0 HG2 GLU A 97 2.597 6.030 -17.489 1.00 13.32 H new ATOM 0 HG3 GLU A 97 3.468 7.539 -17.676 1.00 13.32 H new ATOM 1626 N GLN A 98 5.380 4.482 -13.957 1.00 72.11 N ATOM 1627 CA GLN A 98 6.519 3.552 -13.777 1.00 32.44 C ATOM 1628 C GLN A 98 6.042 2.117 -13.459 1.00 11.11 C ATOM 1629 O GLN A 98 6.520 1.153 -14.053 1.00 21.23 O ATOM 1630 CB GLN A 98 7.447 4.086 -12.646 1.00 74.31 C ATOM 1631 CG GLN A 98 8.616 3.166 -12.223 1.00 75.41 C ATOM 1632 CD GLN A 98 9.585 2.813 -13.357 1.00 40.23 C ATOM 1633 OE1 GLN A 98 10.544 3.540 -13.614 1.00 23.44 O ATOM 1634 NE2 GLN A 98 9.357 1.688 -14.022 1.00 75.34 N ATOM 0 H GLN A 98 5.406 5.280 -13.323 1.00 72.11 H new ATOM 0 HA GLN A 98 7.075 3.503 -14.713 1.00 32.44 H new ATOM 0 HB2 GLN A 98 7.863 5.041 -12.968 1.00 74.31 H new ATOM 0 HB3 GLN A 98 6.834 4.285 -11.767 1.00 74.31 H new ATOM 0 HG2 GLN A 98 9.174 3.652 -11.423 1.00 75.41 H new ATOM 0 HG3 GLN A 98 8.206 2.244 -11.811 1.00 75.41 H new ATOM 0 HE21 GLN A 98 8.552 1.108 -13.783 1.00 75.34 H new ATOM 0 HE22 GLN A 98 9.986 1.403 -14.772 1.00 75.34 H new ATOM 1643 N LEU A 99 5.074 1.999 -12.547 1.00 33.10 N ATOM 1644 CA LEU A 99 4.550 0.691 -12.081 1.00 73.52 C ATOM 1645 C LEU A 99 3.783 -0.031 -13.190 1.00 25.13 C ATOM 1646 O LEU A 99 3.744 -1.262 -13.227 1.00 21.52 O ATOM 1647 CB LEU A 99 3.672 0.876 -10.813 1.00 71.10 C ATOM 1648 CG LEU A 99 4.453 1.005 -9.467 1.00 41.51 C ATOM 1649 CD1 LEU A 99 5.533 2.096 -9.528 1.00 11.54 C ATOM 1650 CD2 LEU A 99 3.485 1.259 -8.305 1.00 5.41 C ATOM 0 H LEU A 99 4.625 2.801 -12.105 1.00 33.10 H new ATOM 0 HA LEU A 99 5.400 0.062 -11.816 1.00 73.52 H new ATOM 0 HB2 LEU A 99 3.059 1.768 -10.944 1.00 71.10 H new ATOM 0 HB3 LEU A 99 2.990 0.029 -10.738 1.00 71.10 H new ATOM 0 HG LEU A 99 4.965 0.058 -9.295 1.00 41.51 H new ATOM 0 HD11 LEU A 99 6.050 2.150 -8.570 1.00 11.54 H new ATOM 0 HD12 LEU A 99 6.249 1.856 -10.314 1.00 11.54 H new ATOM 0 HD13 LEU A 99 5.067 3.058 -9.743 1.00 11.54 H new ATOM 0 HD21 LEU A 99 4.047 1.346 -7.375 1.00 5.41 H new ATOM 0 HD22 LEU A 99 2.935 2.183 -8.485 1.00 5.41 H new ATOM 0 HD23 LEU A 99 2.783 0.429 -8.228 1.00 5.41 H new ATOM 1662 N LYS A 100 3.181 0.750 -14.089 1.00 51.22 N ATOM 1663 CA LYS A 100 2.435 0.224 -15.239 1.00 71.24 C ATOM 1664 C LYS A 100 3.382 -0.497 -16.232 1.00 13.12 C ATOM 1665 O LYS A 100 2.969 -1.431 -16.928 1.00 20.03 O ATOM 1666 CB LYS A 100 1.665 1.377 -15.933 1.00 61.51 C ATOM 1667 CG LYS A 100 0.822 2.285 -14.979 1.00 45.32 C ATOM 1668 CD LYS A 100 -0.633 1.815 -14.666 1.00 3.13 C ATOM 1669 CE LYS A 100 -0.746 0.596 -13.716 1.00 71.43 C ATOM 1670 NZ LYS A 100 -0.629 -0.707 -14.423 1.00 51.44 N ATOM 0 H LYS A 100 3.196 1.769 -14.042 1.00 51.22 H new ATOM 0 HA LYS A 100 1.714 -0.513 -14.886 1.00 71.24 H new ATOM 0 HB2 LYS A 100 2.382 2.003 -16.464 1.00 61.51 H new ATOM 0 HB3 LYS A 100 0.999 0.948 -16.682 1.00 61.51 H new ATOM 0 HG2 LYS A 100 1.360 2.378 -14.035 1.00 45.32 H new ATOM 0 HG3 LYS A 100 0.771 3.282 -15.416 1.00 45.32 H new ATOM 0 HD2 LYS A 100 -1.180 2.649 -14.226 1.00 3.13 H new ATOM 0 HD3 LYS A 100 -1.128 1.569 -15.606 1.00 3.13 H new ATOM 0 HE2 LYS A 100 0.033 0.662 -12.956 1.00 71.43 H new ATOM 0 HE3 LYS A 100 -1.703 0.636 -13.196 1.00 71.43 H new ATOM 0 HZ1 LYS A 100 0.046 -1.316 -13.918 1.00 51.44 H new ATOM 0 HZ2 LYS A 100 -1.559 -1.171 -14.452 1.00 51.44 H new ATOM 0 HZ3 LYS A 100 -0.292 -0.546 -15.394 1.00 51.44 H new ATOM 1684 N LYS A 101 4.659 -0.048 -16.261 1.00 1.33 N ATOM 1685 CA LYS A 101 5.743 -0.701 -17.036 1.00 54.04 C ATOM 1686 C LYS A 101 6.047 -2.092 -16.449 1.00 51.42 C ATOM 1687 O LYS A 101 6.155 -3.088 -17.177 1.00 21.23 O ATOM 1688 CB LYS A 101 7.039 0.160 -17.003 1.00 54.22 C ATOM 1689 CG LYS A 101 6.840 1.633 -17.402 1.00 13.30 C ATOM 1690 CD LYS A 101 8.154 2.443 -17.319 1.00 15.11 C ATOM 1691 CE LYS A 101 7.952 3.921 -17.666 1.00 45.40 C ATOM 1692 NZ LYS A 101 7.322 4.104 -19.002 1.00 21.24 N ATOM 0 H LYS A 101 4.968 0.778 -15.748 1.00 1.33 H new ATOM 0 HA LYS A 101 5.408 -0.802 -18.068 1.00 54.04 H new ATOM 0 HB2 LYS A 101 7.458 0.123 -15.998 1.00 54.22 H new ATOM 0 HB3 LYS A 101 7.774 -0.288 -17.672 1.00 54.22 H new ATOM 0 HG2 LYS A 101 6.448 1.683 -18.418 1.00 13.30 H new ATOM 0 HG3 LYS A 101 6.094 2.087 -16.750 1.00 13.30 H new ATOM 0 HD2 LYS A 101 8.565 2.362 -16.313 1.00 15.11 H new ATOM 0 HD3 LYS A 101 8.888 2.010 -17.999 1.00 15.11 H new ATOM 0 HE2 LYS A 101 7.328 4.389 -16.905 1.00 45.40 H new ATOM 0 HE3 LYS A 101 8.915 4.432 -17.647 1.00 45.40 H new ATOM 0 HZ1 LYS A 101 7.631 5.009 -19.411 1.00 21.24 H new ATOM 0 HZ2 LYS A 101 7.607 3.325 -19.630 1.00 21.24 H new ATOM 0 HZ3 LYS A 101 6.287 4.106 -18.900 1.00 21.24 H new ATOM 1706 N ASP A 102 6.173 -2.116 -15.110 1.00 54.44 N ATOM 1707 CA ASP A 102 6.442 -3.335 -14.323 1.00 54.01 C ATOM 1708 C ASP A 102 5.244 -4.308 -14.363 1.00 41.42 C ATOM 1709 O ASP A 102 5.400 -5.498 -14.089 1.00 3.21 O ATOM 1710 CB ASP A 102 6.778 -2.945 -12.858 1.00 33.43 C ATOM 1711 CG ASP A 102 8.100 -2.167 -12.723 1.00 2.14 C ATOM 1712 OD1 ASP A 102 9.157 -2.813 -12.579 1.00 11.32 O ATOM 1713 OD2 ASP A 102 8.091 -0.911 -12.774 1.00 63.52 O ATOM 0 H ASP A 102 6.090 -1.278 -14.535 1.00 54.44 H new ATOM 0 HA ASP A 102 7.295 -3.849 -14.765 1.00 54.01 H new ATOM 0 HB2 ASP A 102 5.966 -2.340 -12.455 1.00 33.43 H new ATOM 0 HB3 ASP A 102 6.833 -3.849 -12.252 1.00 33.43 H new ATOM 1718 N GLY A 103 4.058 -3.779 -14.705 1.00 63.12 N ATOM 1719 CA GLY A 103 2.824 -4.578 -14.814 1.00 73.24 C ATOM 1720 C GLY A 103 2.033 -4.618 -13.512 1.00 60.25 C ATOM 1721 O GLY A 103 1.099 -5.409 -13.358 1.00 31.22 O ATOM 0 H GLY A 103 3.926 -2.789 -14.913 1.00 63.12 H new ATOM 0 HA2 GLY A 103 2.196 -4.164 -15.603 1.00 73.24 H new ATOM 0 HA3 GLY A 103 3.080 -5.595 -15.111 1.00 73.24 H new ATOM 1725 N VAL A 104 2.425 -3.742 -12.587 1.00 43.34 N ATOM 1726 CA VAL A 104 1.845 -3.628 -11.242 1.00 52.11 C ATOM 1727 C VAL A 104 0.499 -2.901 -11.297 1.00 73.14 C ATOM 1728 O VAL A 104 0.380 -1.858 -11.957 1.00 41.03 O ATOM 1729 CB VAL A 104 2.830 -2.842 -10.309 1.00 32.41 C ATOM 1730 CG1 VAL A 104 2.304 -2.703 -8.857 1.00 54.43 C ATOM 1731 CG2 VAL A 104 4.214 -3.504 -10.351 1.00 72.00 C ATOM 0 H VAL A 104 3.176 -3.072 -12.754 1.00 43.34 H new ATOM 0 HA VAL A 104 1.685 -4.630 -10.845 1.00 52.11 H new ATOM 0 HB VAL A 104 2.909 -1.823 -10.688 1.00 32.41 H new ATOM 0 HG11 VAL A 104 3.028 -2.150 -8.259 1.00 54.43 H new ATOM 0 HG12 VAL A 104 1.355 -2.167 -8.864 1.00 54.43 H new ATOM 0 HG13 VAL A 104 2.159 -3.694 -8.426 1.00 54.43 H new ATOM 0 HG21 VAL A 104 4.899 -2.957 -9.702 1.00 72.00 H new ATOM 0 HG22 VAL A 104 4.135 -4.535 -10.008 1.00 72.00 H new ATOM 0 HG23 VAL A 104 4.593 -3.490 -11.373 1.00 72.00 H new ATOM 1741 N ASP A 105 -0.495 -3.459 -10.600 1.00 4.51 N ATOM 1742 CA ASP A 105 -1.826 -2.865 -10.481 1.00 51.32 C ATOM 1743 C ASP A 105 -1.792 -1.747 -9.427 1.00 61.02 C ATOM 1744 O ASP A 105 -1.198 -1.909 -8.357 1.00 61.22 O ATOM 1745 CB ASP A 105 -2.867 -3.942 -10.095 1.00 61.32 C ATOM 1746 CG ASP A 105 -2.899 -5.119 -11.082 1.00 2.53 C ATOM 1747 OD1 ASP A 105 -3.509 -4.988 -12.166 1.00 22.13 O ATOM 1748 OD2 ASP A 105 -2.308 -6.181 -10.781 1.00 63.45 O ATOM 0 H ASP A 105 -0.396 -4.342 -10.099 1.00 4.51 H new ATOM 0 HA ASP A 105 -2.118 -2.443 -11.443 1.00 51.32 H new ATOM 0 HB2 ASP A 105 -2.642 -4.317 -9.097 1.00 61.32 H new ATOM 0 HB3 ASP A 105 -3.856 -3.485 -10.049 1.00 61.32 H new ATOM 1753 N VAL A 106 -2.407 -0.610 -9.754 1.00 4.44 N ATOM 1754 CA VAL A 106 -2.520 0.548 -8.853 1.00 11.40 C ATOM 1755 C VAL A 106 -3.997 0.958 -8.761 1.00 72.53 C ATOM 1756 O VAL A 106 -4.741 0.867 -9.753 1.00 0.30 O ATOM 1757 CB VAL A 106 -1.653 1.781 -9.346 1.00 74.22 C ATOM 1758 CG1 VAL A 106 -0.143 1.447 -9.350 1.00 73.25 C ATOM 1759 CG2 VAL A 106 -2.117 2.270 -10.734 1.00 13.33 C ATOM 0 H VAL A 106 -2.847 -0.461 -10.662 1.00 4.44 H new ATOM 0 HA VAL A 106 -2.137 0.256 -7.875 1.00 11.40 H new ATOM 0 HB VAL A 106 -1.808 2.593 -8.636 1.00 74.22 H new ATOM 0 HG11 VAL A 106 0.421 2.315 -9.693 1.00 73.25 H new ATOM 0 HG12 VAL A 106 0.174 1.184 -8.341 1.00 73.25 H new ATOM 0 HG13 VAL A 106 0.042 0.606 -10.019 1.00 73.25 H new ATOM 0 HG21 VAL A 106 -1.504 3.116 -11.045 1.00 13.33 H new ATOM 0 HG22 VAL A 106 -2.014 1.461 -11.458 1.00 13.33 H new ATOM 0 HG23 VAL A 106 -3.161 2.579 -10.681 1.00 13.33 H new ATOM 1769 N ARG A 107 -4.438 1.360 -7.566 1.00 70.23 N ATOM 1770 CA ARG A 107 -5.769 1.942 -7.375 1.00 1.11 C ATOM 1771 C ARG A 107 -5.619 3.452 -7.144 1.00 20.22 C ATOM 1772 O ARG A 107 -5.150 3.885 -6.088 1.00 50.43 O ATOM 1773 CB ARG A 107 -6.505 1.273 -6.178 1.00 63.54 C ATOM 1774 CG ARG A 107 -6.715 -0.254 -6.312 1.00 32.22 C ATOM 1775 CD ARG A 107 -7.558 -0.647 -7.542 1.00 5.05 C ATOM 1776 NE ARG A 107 -7.752 -2.108 -7.641 1.00 40.32 N ATOM 1777 CZ ARG A 107 -8.645 -2.719 -8.440 1.00 5.22 C ATOM 1778 NH1 ARG A 107 -9.453 -2.019 -9.236 1.00 14.12 N ATOM 1779 NH2 ARG A 107 -8.728 -4.037 -8.440 1.00 73.32 N ATOM 0 H ARG A 107 -3.887 1.292 -6.710 1.00 70.23 H new ATOM 0 HA ARG A 107 -6.371 1.765 -8.266 1.00 1.11 H new ATOM 0 HB2 ARG A 107 -5.939 1.468 -5.267 1.00 63.54 H new ATOM 0 HB3 ARG A 107 -7.478 1.749 -6.057 1.00 63.54 H new ATOM 0 HG2 ARG A 107 -5.743 -0.744 -6.375 1.00 32.22 H new ATOM 0 HG3 ARG A 107 -7.203 -0.627 -5.411 1.00 32.22 H new ATOM 0 HD2 ARG A 107 -8.530 -0.156 -7.487 1.00 5.05 H new ATOM 0 HD3 ARG A 107 -7.069 -0.285 -8.446 1.00 5.05 H new ATOM 0 HE ARG A 107 -7.162 -2.701 -7.057 1.00 40.32 H new ATOM 0 HH11 ARG A 107 -9.401 -1.000 -9.247 1.00 14.12 H new ATOM 0 HH12 ARG A 107 -10.123 -2.502 -9.834 1.00 14.12 H new ATOM 0 HH21 ARG A 107 -8.117 -4.586 -7.836 1.00 73.32 H new ATOM 0 HH22 ARG A 107 -9.403 -4.505 -9.044 1.00 73.32 H new ATOM 1793 N VAL A 108 -5.983 4.244 -8.159 1.00 1.02 N ATOM 1794 CA VAL A 108 -6.152 5.691 -8.010 1.00 35.04 C ATOM 1795 C VAL A 108 -7.629 5.952 -7.677 1.00 4.23 C ATOM 1796 O VAL A 108 -8.529 5.565 -8.428 1.00 42.50 O ATOM 1797 CB VAL A 108 -5.666 6.506 -9.282 1.00 3.53 C ATOM 1798 CG1 VAL A 108 -4.124 6.424 -9.431 1.00 71.21 C ATOM 1799 CG2 VAL A 108 -6.363 6.043 -10.590 1.00 3.12 C ATOM 0 H VAL A 108 -6.168 3.901 -9.102 1.00 1.02 H new ATOM 0 HA VAL A 108 -5.516 6.050 -7.201 1.00 35.04 H new ATOM 0 HB VAL A 108 -5.953 7.545 -9.118 1.00 3.53 H new ATOM 0 HG11 VAL A 108 -3.813 6.990 -10.309 1.00 71.21 H new ATOM 0 HG12 VAL A 108 -3.650 6.842 -8.543 1.00 71.21 H new ATOM 0 HG13 VAL A 108 -3.824 5.382 -9.545 1.00 71.21 H new ATOM 0 HG21 VAL A 108 -5.993 6.634 -11.428 1.00 3.12 H new ATOM 0 HG22 VAL A 108 -6.145 4.989 -10.765 1.00 3.12 H new ATOM 0 HG23 VAL A 108 -7.440 6.180 -10.497 1.00 3.12 H new ATOM 1809 N THR A 109 -7.870 6.510 -6.493 1.00 24.31 N ATOM 1810 CA THR A 109 -9.224 6.812 -5.999 1.00 23.41 C ATOM 1811 C THR A 109 -9.519 8.319 -6.121 1.00 11.15 C ATOM 1812 O THR A 109 -10.684 8.740 -6.074 1.00 25.50 O ATOM 1813 CB THR A 109 -9.341 6.358 -4.522 1.00 61.21 C ATOM 1814 OG1 THR A 109 -8.323 7.003 -3.742 1.00 2.33 O ATOM 1815 CG2 THR A 109 -9.219 4.822 -4.384 1.00 2.34 C ATOM 0 H THR A 109 -7.131 6.770 -5.840 1.00 24.31 H new ATOM 0 HA THR A 109 -9.955 6.274 -6.602 1.00 23.41 H new ATOM 0 HB THR A 109 -10.327 6.644 -4.156 1.00 61.21 H new ATOM 0 HG1 THR A 109 -8.710 7.768 -3.267 1.00 2.33 H new ATOM 0 HG21 THR A 109 -9.306 4.543 -3.334 1.00 2.34 H new ATOM 0 HG22 THR A 109 -10.014 4.341 -4.954 1.00 2.34 H new ATOM 0 HG23 THR A 109 -8.251 4.498 -4.766 1.00 2.34 H new ATOM 1823 N ASP A 110 -8.423 9.102 -6.263 1.00 51.01 N ATOM 1824 CA ASP A 110 -8.422 10.573 -6.415 1.00 22.11 C ATOM 1825 C ASP A 110 -8.783 11.275 -5.096 1.00 4.32 C ATOM 1826 O ASP A 110 -7.943 11.949 -4.501 1.00 24.01 O ATOM 1827 CB ASP A 110 -9.317 11.058 -7.596 1.00 70.04 C ATOM 1828 CG ASP A 110 -8.935 10.408 -8.944 1.00 23.21 C ATOM 1829 OD1 ASP A 110 -7.774 10.555 -9.375 1.00 44.14 O ATOM 1830 OD2 ASP A 110 -9.797 9.742 -9.574 1.00 2.53 O ATOM 0 H ASP A 110 -7.481 8.710 -6.275 1.00 51.01 H new ATOM 0 HA ASP A 110 -7.402 10.859 -6.671 1.00 22.11 H new ATOM 0 HB2 ASP A 110 -10.360 10.832 -7.372 1.00 70.04 H new ATOM 0 HB3 ASP A 110 -9.237 12.141 -7.685 1.00 70.04 H new ATOM 1835 N ASN A 111 -10.028 11.096 -4.646 1.00 61.43 N ATOM 1836 CA ASN A 111 -10.525 11.665 -3.379 1.00 32.33 C ATOM 1837 C ASN A 111 -10.106 10.759 -2.188 1.00 72.34 C ATOM 1838 O ASN A 111 -10.078 9.522 -2.304 1.00 42.34 O ATOM 1839 CB ASN A 111 -12.073 11.828 -3.460 1.00 13.53 C ATOM 1840 CG ASN A 111 -12.694 12.709 -2.355 1.00 72.12 C ATOM 1841 OD1 ASN A 111 -12.223 12.760 -1.222 1.00 25.54 O ATOM 1842 ND2 ASN A 111 -13.758 13.416 -2.693 1.00 45.43 N ATOM 0 H ASN A 111 -10.727 10.550 -5.149 1.00 61.43 H new ATOM 0 HA ASN A 111 -10.085 12.649 -3.215 1.00 32.33 H new ATOM 0 HB2 ASN A 111 -12.328 12.254 -4.430 1.00 13.53 H new ATOM 0 HB3 ASN A 111 -12.530 10.840 -3.416 1.00 13.53 H new ATOM 0 HD21 ASN A 111 -14.207 14.022 -2.006 1.00 45.43 H new ATOM 0 HD22 ASN A 111 -14.130 13.356 -3.641 1.00 45.43 H new ATOM 1849 N GLU A 112 -9.765 11.416 -1.069 1.00 62.41 N ATOM 1850 CA GLU A 112 -9.390 10.784 0.222 1.00 4.43 C ATOM 1851 C GLU A 112 -10.530 9.901 0.799 1.00 4.32 C ATOM 1852 O GLU A 112 -10.294 8.793 1.297 1.00 11.13 O ATOM 1853 CB GLU A 112 -8.993 11.921 1.214 1.00 12.54 C ATOM 1854 CG GLU A 112 -10.070 13.022 1.374 1.00 22.32 C ATOM 1855 CD GLU A 112 -9.601 14.271 2.134 1.00 14.40 C ATOM 1856 OE1 GLU A 112 -8.789 15.044 1.579 1.00 0.02 O ATOM 1857 OE2 GLU A 112 -10.073 14.511 3.270 1.00 41.01 O ATOM 0 H GLU A 112 -9.739 12.435 -1.028 1.00 62.41 H new ATOM 0 HA GLU A 112 -8.548 10.110 0.063 1.00 4.43 H new ATOM 0 HB2 GLU A 112 -8.789 11.482 2.191 1.00 12.54 H new ATOM 0 HB3 GLU A 112 -8.066 12.381 0.871 1.00 12.54 H new ATOM 0 HG2 GLU A 112 -10.413 13.323 0.384 1.00 22.32 H new ATOM 0 HG3 GLU A 112 -10.929 12.598 1.894 1.00 22.32 H new ATOM 1864 N ASP A 113 -11.760 10.418 0.683 1.00 2.33 N ATOM 1865 CA ASP A 113 -12.995 9.766 1.157 1.00 41.12 C ATOM 1866 C ASP A 113 -13.314 8.500 0.335 1.00 15.23 C ATOM 1867 O ASP A 113 -13.858 7.524 0.861 1.00 74.31 O ATOM 1868 CB ASP A 113 -14.143 10.803 1.069 1.00 53.12 C ATOM 1869 CG ASP A 113 -15.534 10.249 1.408 1.00 33.44 C ATOM 1870 OD1 ASP A 113 -15.734 9.773 2.548 1.00 72.13 O ATOM 1871 OD2 ASP A 113 -16.439 10.297 0.532 1.00 24.35 O ATOM 0 H ASP A 113 -11.932 11.324 0.247 1.00 2.33 H new ATOM 0 HA ASP A 113 -12.870 9.437 2.189 1.00 41.12 H new ATOM 0 HB2 ASP A 113 -13.921 11.629 1.745 1.00 53.12 H new ATOM 0 HB3 ASP A 113 -14.167 11.214 0.060 1.00 53.12 H new ATOM 1876 N GLU A 114 -12.938 8.539 -0.951 1.00 72.33 N ATOM 1877 CA GLU A 114 -13.132 7.425 -1.894 1.00 70.13 C ATOM 1878 C GLU A 114 -12.241 6.219 -1.512 1.00 23.22 C ATOM 1879 O GLU A 114 -12.707 5.071 -1.489 1.00 1.23 O ATOM 1880 CB GLU A 114 -12.807 7.922 -3.326 1.00 71.31 C ATOM 1881 CG GLU A 114 -13.041 6.905 -4.464 1.00 52.42 C ATOM 1882 CD GLU A 114 -14.525 6.629 -4.735 1.00 31.50 C ATOM 1883 OE1 GLU A 114 -15.170 7.423 -5.457 1.00 21.44 O ATOM 1884 OE2 GLU A 114 -15.057 5.637 -4.220 1.00 61.14 O ATOM 0 H GLU A 114 -12.486 9.351 -1.371 1.00 72.33 H new ATOM 0 HA GLU A 114 -14.168 7.089 -1.853 1.00 70.13 H new ATOM 0 HB2 GLU A 114 -13.409 8.808 -3.527 1.00 71.31 H new ATOM 0 HB3 GLU A 114 -11.763 8.234 -3.353 1.00 71.31 H new ATOM 0 HG2 GLU A 114 -12.575 7.278 -5.376 1.00 52.42 H new ATOM 0 HG3 GLU A 114 -12.544 5.968 -4.212 1.00 52.42 H new ATOM 1891 N ALA A 115 -10.961 6.513 -1.189 1.00 32.32 N ATOM 1892 CA ALA A 115 -9.949 5.494 -0.832 1.00 45.43 C ATOM 1893 C ALA A 115 -10.351 4.694 0.417 1.00 12.20 C ATOM 1894 O ALA A 115 -10.208 3.473 0.451 1.00 34.24 O ATOM 1895 CB ALA A 115 -8.583 6.162 -0.627 1.00 15.13 C ATOM 0 H ALA A 115 -10.600 7.467 -1.169 1.00 32.32 H new ATOM 0 HA ALA A 115 -9.884 4.787 -1.659 1.00 45.43 H new ATOM 0 HB1 ALA A 115 -7.844 5.405 -0.365 1.00 15.13 H new ATOM 0 HB2 ALA A 115 -8.280 6.661 -1.547 1.00 15.13 H new ATOM 0 HB3 ALA A 115 -8.653 6.895 0.177 1.00 15.13 H new ATOM 1901 N LYS A 116 -10.907 5.422 1.395 1.00 62.03 N ATOM 1902 CA LYS A 116 -11.400 4.899 2.683 1.00 45.01 C ATOM 1903 C LYS A 116 -12.353 3.695 2.494 1.00 74.25 C ATOM 1904 O LYS A 116 -12.206 2.647 3.134 1.00 33.31 O ATOM 1905 CB LYS A 116 -12.149 6.083 3.353 1.00 61.32 C ATOM 1906 CG LYS A 116 -13.001 5.757 4.598 1.00 43.32 C ATOM 1907 CD LYS A 116 -14.114 6.807 4.822 1.00 40.54 C ATOM 1908 CE LYS A 116 -13.587 8.240 5.021 1.00 15.20 C ATOM 1909 NZ LYS A 116 -14.706 9.210 5.191 1.00 12.52 N ATOM 0 H LYS A 116 -11.032 6.431 1.310 1.00 62.03 H new ATOM 0 HA LYS A 116 -10.574 4.533 3.293 1.00 45.01 H new ATOM 0 HB2 LYS A 116 -11.412 6.835 3.634 1.00 61.32 H new ATOM 0 HB3 LYS A 116 -12.800 6.538 2.607 1.00 61.32 H new ATOM 0 HG2 LYS A 116 -13.450 4.770 4.483 1.00 43.32 H new ATOM 0 HG3 LYS A 116 -12.358 5.715 5.477 1.00 43.32 H new ATOM 0 HD2 LYS A 116 -14.790 6.794 3.967 1.00 40.54 H new ATOM 0 HD3 LYS A 116 -14.700 6.521 5.696 1.00 40.54 H new ATOM 0 HE2 LYS A 116 -12.938 8.273 5.896 1.00 15.20 H new ATOM 0 HE3 LYS A 116 -12.980 8.529 4.163 1.00 15.20 H new ATOM 0 HZ1 LYS A 116 -14.350 10.073 5.649 1.00 12.52 H new ATOM 0 HZ2 LYS A 116 -15.102 9.450 4.260 1.00 12.52 H new ATOM 0 HZ3 LYS A 116 -15.448 8.784 5.783 1.00 12.52 H new ATOM 1923 N LYS A 117 -13.295 3.876 1.562 1.00 15.43 N ATOM 1924 CA LYS A 117 -14.395 2.933 1.296 1.00 13.41 C ATOM 1925 C LYS A 117 -13.882 1.663 0.595 1.00 14.14 C ATOM 1926 O LYS A 117 -14.316 0.547 0.901 1.00 2.54 O ATOM 1927 CB LYS A 117 -15.446 3.662 0.423 1.00 21.14 C ATOM 1928 CG LYS A 117 -15.999 4.947 1.078 1.00 74.21 C ATOM 1929 CD LYS A 117 -16.753 5.867 0.092 1.00 54.41 C ATOM 1930 CE LYS A 117 -17.340 7.097 0.803 1.00 22.31 C ATOM 1931 NZ LYS A 117 -18.012 8.037 -0.132 1.00 55.11 N ATOM 0 H LYS A 117 -13.318 4.697 0.958 1.00 15.43 H new ATOM 0 HA LYS A 117 -14.845 2.613 2.236 1.00 13.41 H new ATOM 0 HB2 LYS A 117 -14.997 3.916 -0.537 1.00 21.14 H new ATOM 0 HB3 LYS A 117 -16.273 2.982 0.218 1.00 21.14 H new ATOM 0 HG2 LYS A 117 -16.671 4.671 1.891 1.00 74.21 H new ATOM 0 HG3 LYS A 117 -15.173 5.503 1.522 1.00 74.21 H new ATOM 0 HD2 LYS A 117 -16.074 6.191 -0.696 1.00 54.41 H new ATOM 0 HD3 LYS A 117 -17.555 5.307 -0.389 1.00 54.41 H new ATOM 0 HE2 LYS A 117 -18.055 6.768 1.557 1.00 22.31 H new ATOM 0 HE3 LYS A 117 -16.542 7.622 1.328 1.00 22.31 H new ATOM 0 HZ1 LYS A 117 -17.590 8.983 -0.036 1.00 55.11 H new ATOM 0 HZ2 LYS A 117 -17.891 7.701 -1.109 1.00 55.11 H new ATOM 0 HZ3 LYS A 117 -19.026 8.086 0.094 1.00 55.11 H new ATOM 1945 N ARG A 118 -12.931 1.866 -0.335 1.00 14.32 N ATOM 1946 CA ARG A 118 -12.303 0.785 -1.115 1.00 41.11 C ATOM 1947 C ARG A 118 -11.430 -0.106 -0.206 1.00 3.14 C ATOM 1948 O ARG A 118 -11.386 -1.324 -0.398 1.00 60.01 O ATOM 1949 CB ARG A 118 -11.468 1.381 -2.299 1.00 54.32 C ATOM 1950 CG ARG A 118 -12.248 1.684 -3.616 1.00 44.31 C ATOM 1951 CD ARG A 118 -13.527 2.537 -3.437 1.00 24.21 C ATOM 1952 NE ARG A 118 -14.695 1.724 -3.022 1.00 40.24 N ATOM 1953 CZ ARG A 118 -15.950 2.175 -2.818 1.00 52.53 C ATOM 1954 NH1 ARG A 118 -16.261 3.454 -2.966 1.00 72.14 N ATOM 1955 NH2 ARG A 118 -16.903 1.329 -2.461 1.00 40.31 N ATOM 0 H ARG A 118 -12.574 2.793 -0.568 1.00 14.32 H new ATOM 0 HA ARG A 118 -13.088 0.158 -1.538 1.00 41.11 H new ATOM 0 HB2 ARG A 118 -11.003 2.306 -1.957 1.00 54.32 H new ATOM 0 HB3 ARG A 118 -10.662 0.686 -2.532 1.00 54.32 H new ATOM 0 HG2 ARG A 118 -11.580 2.199 -4.306 1.00 44.31 H new ATOM 0 HG3 ARG A 118 -12.522 0.738 -4.084 1.00 44.31 H new ATOM 0 HD2 ARG A 118 -13.343 3.311 -2.692 1.00 24.21 H new ATOM 0 HD3 ARG A 118 -13.756 3.045 -4.374 1.00 24.21 H new ATOM 0 HE ARG A 118 -14.534 0.727 -2.877 1.00 40.24 H new ATOM 0 HH11 ARG A 118 -15.543 4.125 -3.241 1.00 72.14 H new ATOM 0 HH12 ARG A 118 -17.218 3.768 -2.805 1.00 72.14 H new ATOM 0 HH21 ARG A 118 -16.688 0.339 -2.341 1.00 40.31 H new ATOM 0 HH22 ARG A 118 -17.853 1.667 -2.306 1.00 40.31 H new ATOM 1969 N LEU A 119 -10.771 0.521 0.797 1.00 24.41 N ATOM 1970 CA LEU A 119 -9.876 -0.172 1.752 1.00 62.45 C ATOM 1971 C LEU A 119 -10.595 -1.288 2.511 1.00 31.33 C ATOM 1972 O LEU A 119 -10.111 -2.424 2.550 1.00 50.34 O ATOM 1973 CB LEU A 119 -9.246 0.836 2.760 1.00 3.51 C ATOM 1974 CG LEU A 119 -8.151 1.763 2.168 1.00 65.52 C ATOM 1975 CD1 LEU A 119 -7.589 2.719 3.235 1.00 72.41 C ATOM 1976 CD2 LEU A 119 -7.034 0.929 1.513 1.00 11.30 C ATOM 0 H LEU A 119 -10.846 1.524 0.966 1.00 24.41 H new ATOM 0 HA LEU A 119 -9.082 -0.628 1.161 1.00 62.45 H new ATOM 0 HB2 LEU A 119 -10.041 1.457 3.174 1.00 3.51 H new ATOM 0 HB3 LEU A 119 -8.815 0.275 3.589 1.00 3.51 H new ATOM 0 HG LEU A 119 -8.609 2.379 1.395 1.00 65.52 H new ATOM 0 HD11 LEU A 119 -6.824 3.354 2.788 1.00 72.41 H new ATOM 0 HD12 LEU A 119 -8.394 3.341 3.627 1.00 72.41 H new ATOM 0 HD13 LEU A 119 -7.150 2.140 4.047 1.00 72.41 H new ATOM 0 HD21 LEU A 119 -6.275 1.595 1.103 1.00 11.30 H new ATOM 0 HD22 LEU A 119 -6.580 0.278 2.260 1.00 11.30 H new ATOM 0 HD23 LEU A 119 -7.455 0.323 0.711 1.00 11.30 H new ATOM 1988 N LYS A 120 -11.762 -0.957 3.085 1.00 12.43 N ATOM 1989 CA LYS A 120 -12.549 -1.909 3.887 1.00 12.21 C ATOM 1990 C LYS A 120 -12.950 -3.141 3.043 1.00 1.11 C ATOM 1991 O LYS A 120 -12.848 -4.276 3.513 1.00 54.23 O ATOM 1992 CB LYS A 120 -13.810 -1.226 4.474 1.00 43.43 C ATOM 1993 CG LYS A 120 -14.692 -2.174 5.319 1.00 2.10 C ATOM 1994 CD LYS A 120 -15.969 -1.503 5.865 1.00 23.44 C ATOM 1995 CE LYS A 120 -16.890 -2.514 6.563 1.00 23.03 C ATOM 1996 NZ LYS A 120 -18.099 -1.877 7.144 1.00 23.22 N ATOM 0 H LYS A 120 -12.184 -0.032 3.008 1.00 12.43 H new ATOM 0 HA LYS A 120 -11.923 -2.246 4.713 1.00 12.21 H new ATOM 0 HB2 LYS A 120 -13.502 -0.383 5.092 1.00 43.43 H new ATOM 0 HB3 LYS A 120 -14.407 -0.820 3.657 1.00 43.43 H new ATOM 0 HG2 LYS A 120 -14.974 -3.033 4.711 1.00 2.10 H new ATOM 0 HG3 LYS A 120 -14.105 -2.554 6.155 1.00 2.10 H new ATOM 0 HD2 LYS A 120 -15.694 -0.716 6.567 1.00 23.44 H new ATOM 0 HD3 LYS A 120 -16.507 -1.026 5.046 1.00 23.44 H new ATOM 0 HE2 LYS A 120 -17.194 -3.278 5.847 1.00 23.03 H new ATOM 0 HE3 LYS A 120 -16.335 -3.021 7.353 1.00 23.03 H new ATOM 0 HZ1 LYS A 120 -18.687 -2.602 7.603 1.00 23.22 H new ATOM 0 HZ2 LYS A 120 -17.813 -1.167 7.848 1.00 23.22 H new ATOM 0 HZ3 LYS A 120 -18.645 -1.416 6.389 1.00 23.22 H new ATOM 2010 N GLU A 121 -13.349 -2.891 1.780 1.00 34.10 N ATOM 2011 CA GLU A 121 -13.767 -3.944 0.826 1.00 15.24 C ATOM 2012 C GLU A 121 -12.601 -4.882 0.486 1.00 33.22 C ATOM 2013 O GLU A 121 -12.793 -6.080 0.281 1.00 43.25 O ATOM 2014 CB GLU A 121 -14.323 -3.303 -0.462 1.00 34.32 C ATOM 2015 CG GLU A 121 -15.499 -2.342 -0.223 1.00 34.23 C ATOM 2016 CD GLU A 121 -15.958 -1.641 -1.503 1.00 21.33 C ATOM 2017 OE1 GLU A 121 -15.097 -1.124 -2.246 1.00 11.44 O ATOM 2018 OE2 GLU A 121 -17.175 -1.602 -1.785 1.00 70.14 O ATOM 0 H GLU A 121 -13.391 -1.950 1.389 1.00 34.10 H new ATOM 0 HA GLU A 121 -14.550 -4.536 1.300 1.00 15.24 H new ATOM 0 HB2 GLU A 121 -13.520 -2.761 -0.962 1.00 34.32 H new ATOM 0 HB3 GLU A 121 -14.645 -4.094 -1.140 1.00 34.32 H new ATOM 0 HG2 GLU A 121 -16.335 -2.897 0.203 1.00 34.23 H new ATOM 0 HG3 GLU A 121 -15.207 -1.592 0.512 1.00 34.23 H new ATOM 2025 N LEU A 122 -11.392 -4.308 0.436 1.00 62.43 N ATOM 2026 CA LEU A 122 -10.146 -5.050 0.179 1.00 42.21 C ATOM 2027 C LEU A 122 -9.756 -5.921 1.378 1.00 34.22 C ATOM 2028 O LEU A 122 -9.135 -6.966 1.213 1.00 64.12 O ATOM 2029 CB LEU A 122 -9.021 -4.055 -0.179 1.00 45.53 C ATOM 2030 CG LEU A 122 -9.228 -3.319 -1.532 1.00 54.15 C ATOM 2031 CD1 LEU A 122 -8.199 -2.210 -1.734 1.00 43.33 C ATOM 2032 CD2 LEU A 122 -9.202 -4.311 -2.700 1.00 54.22 C ATOM 0 H LEU A 122 -11.248 -3.308 0.574 1.00 62.43 H new ATOM 0 HA LEU A 122 -10.305 -5.723 -0.663 1.00 42.21 H new ATOM 0 HB2 LEU A 122 -8.940 -3.314 0.616 1.00 45.53 H new ATOM 0 HB3 LEU A 122 -8.073 -4.592 -0.212 1.00 45.53 H new ATOM 0 HG LEU A 122 -10.211 -2.849 -1.504 1.00 54.15 H new ATOM 0 HD11 LEU A 122 -8.376 -1.719 -2.691 1.00 43.33 H new ATOM 0 HD12 LEU A 122 -8.288 -1.480 -0.929 1.00 43.33 H new ATOM 0 HD13 LEU A 122 -7.197 -2.638 -1.726 1.00 43.33 H new ATOM 0 HD21 LEU A 122 -9.349 -3.774 -3.637 1.00 54.22 H new ATOM 0 HD22 LEU A 122 -8.240 -4.822 -2.722 1.00 54.22 H new ATOM 0 HD23 LEU A 122 -9.999 -5.044 -2.573 1.00 54.22 H new ATOM 2044 N LEU A 123 -10.127 -5.476 2.581 1.00 31.00 N ATOM 2045 CA LEU A 123 -9.951 -6.263 3.815 1.00 42.43 C ATOM 2046 C LEU A 123 -10.982 -7.406 3.878 1.00 35.11 C ATOM 2047 O LEU A 123 -10.689 -8.484 4.401 1.00 54.32 O ATOM 2048 CB LEU A 123 -10.045 -5.343 5.061 1.00 45.45 C ATOM 2049 CG LEU A 123 -8.708 -4.691 5.534 1.00 30.21 C ATOM 2050 CD1 LEU A 123 -8.060 -3.775 4.470 1.00 50.11 C ATOM 2051 CD2 LEU A 123 -8.932 -3.944 6.844 1.00 44.20 C ATOM 0 H LEU A 123 -10.557 -4.564 2.732 1.00 31.00 H new ATOM 0 HA LEU A 123 -8.958 -6.713 3.807 1.00 42.43 H new ATOM 0 HB2 LEU A 123 -10.758 -4.547 4.847 1.00 45.45 H new ATOM 0 HB3 LEU A 123 -10.455 -5.924 5.887 1.00 45.45 H new ATOM 0 HG LEU A 123 -7.996 -5.501 5.695 1.00 30.21 H new ATOM 0 HD11 LEU A 123 -7.135 -3.356 4.866 1.00 50.11 H new ATOM 0 HD12 LEU A 123 -7.841 -4.356 3.574 1.00 50.11 H new ATOM 0 HD13 LEU A 123 -8.747 -2.967 4.219 1.00 50.11 H new ATOM 0 HD21 LEU A 123 -7.995 -3.491 7.169 1.00 44.20 H new ATOM 0 HD22 LEU A 123 -9.680 -3.165 6.695 1.00 44.20 H new ATOM 0 HD23 LEU A 123 -9.281 -4.641 7.605 1.00 44.20 H new ATOM 2063 N GLU A 124 -12.181 -7.152 3.330 1.00 73.32 N ATOM 2064 CA GLU A 124 -13.241 -8.171 3.179 1.00 53.53 C ATOM 2065 C GLU A 124 -12.846 -9.209 2.099 1.00 51.45 C ATOM 2066 O GLU A 124 -13.303 -10.357 2.118 1.00 53.45 O ATOM 2067 CB GLU A 124 -14.590 -7.473 2.841 1.00 33.04 C ATOM 2068 CG GLU A 124 -15.080 -6.516 3.954 1.00 32.24 C ATOM 2069 CD GLU A 124 -16.376 -5.762 3.612 1.00 34.31 C ATOM 2070 OE1 GLU A 124 -17.476 -6.285 3.900 1.00 61.05 O ATOM 2071 OE2 GLU A 124 -16.303 -4.645 3.052 1.00 32.35 O ATOM 0 H GLU A 124 -12.447 -6.233 2.977 1.00 73.32 H new ATOM 0 HA GLU A 124 -13.363 -8.712 4.118 1.00 53.53 H new ATOM 0 HB2 GLU A 124 -14.479 -6.913 1.913 1.00 33.04 H new ATOM 0 HB3 GLU A 124 -15.351 -8.234 2.665 1.00 33.04 H new ATOM 0 HG2 GLU A 124 -15.237 -7.089 4.868 1.00 32.24 H new ATOM 0 HG3 GLU A 124 -14.295 -5.790 4.165 1.00 32.24 H new ATOM 2078 N LYS A 125 -11.978 -8.778 1.166 1.00 23.43 N ATOM 2079 CA LYS A 125 -11.360 -9.629 0.128 1.00 51.51 C ATOM 2080 C LYS A 125 -9.896 -9.947 0.528 1.00 62.04 C ATOM 2081 O LYS A 125 -9.537 -9.818 1.702 1.00 63.30 O ATOM 2082 CB LYS A 125 -11.440 -8.880 -1.237 1.00 5.13 C ATOM 2083 CG LYS A 125 -12.889 -8.611 -1.701 1.00 33.41 C ATOM 2084 CD LYS A 125 -12.975 -7.782 -3.003 1.00 62.34 C ATOM 2085 CE LYS A 125 -14.428 -7.540 -3.448 1.00 12.31 C ATOM 2086 NZ LYS A 125 -15.194 -8.811 -3.603 1.00 54.02 N ATOM 0 H LYS A 125 -11.678 -7.805 1.110 1.00 23.43 H new ATOM 0 HA LYS A 125 -11.889 -10.577 0.033 1.00 51.51 H new ATOM 0 HB2 LYS A 125 -10.910 -7.931 -1.155 1.00 5.13 H new ATOM 0 HB3 LYS A 125 -10.925 -9.468 -1.997 1.00 5.13 H new ATOM 0 HG2 LYS A 125 -13.397 -9.564 -1.852 1.00 33.41 H new ATOM 0 HG3 LYS A 125 -13.424 -8.086 -0.909 1.00 33.41 H new ATOM 0 HD2 LYS A 125 -12.479 -6.823 -2.854 1.00 62.34 H new ATOM 0 HD3 LYS A 125 -12.436 -8.300 -3.797 1.00 62.34 H new ATOM 0 HE2 LYS A 125 -14.928 -6.904 -2.717 1.00 12.31 H new ATOM 0 HE3 LYS A 125 -14.430 -7.000 -4.395 1.00 12.31 H new ATOM 0 HZ1 LYS A 125 -16.106 -8.613 -4.063 1.00 54.02 H new ATOM 0 HZ2 LYS A 125 -14.649 -9.476 -4.188 1.00 54.02 H new ATOM 0 HZ3 LYS A 125 -15.363 -9.231 -2.667 1.00 54.02 H new ATOM 2100 N VAL A 126 -9.058 -10.389 -0.442 1.00 2.22 N ATOM 2101 CA VAL A 126 -7.602 -10.613 -0.222 1.00 73.42 C ATOM 2102 C VAL A 126 -6.798 -9.433 -0.843 1.00 53.22 C ATOM 2103 O VAL A 126 -5.805 -9.621 -1.559 1.00 65.04 O ATOM 2104 CB VAL A 126 -7.133 -12.014 -0.808 1.00 63.32 C ATOM 2105 CG1 VAL A 126 -5.685 -12.364 -0.372 1.00 63.12 C ATOM 2106 CG2 VAL A 126 -8.113 -13.147 -0.408 1.00 52.15 C ATOM 0 H VAL A 126 -9.366 -10.599 -1.391 1.00 2.22 H new ATOM 0 HA VAL A 126 -7.407 -10.644 0.850 1.00 73.42 H new ATOM 0 HB VAL A 126 -7.140 -11.925 -1.894 1.00 63.32 H new ATOM 0 HG11 VAL A 126 -5.401 -13.329 -0.793 1.00 63.12 H new ATOM 0 HG12 VAL A 126 -5.001 -11.596 -0.732 1.00 63.12 H new ATOM 0 HG13 VAL A 126 -5.634 -12.414 0.716 1.00 63.12 H new ATOM 0 HG21 VAL A 126 -7.765 -14.093 -0.824 1.00 52.15 H new ATOM 0 HG22 VAL A 126 -8.158 -13.223 0.678 1.00 52.15 H new ATOM 0 HG23 VAL A 126 -9.106 -12.923 -0.797 1.00 52.15 H new ATOM 2116 N GLY A 127 -7.267 -8.207 -0.545 1.00 53.34 N ATOM 2117 CA GLY A 127 -6.625 -6.957 -0.987 1.00 40.51 C ATOM 2118 C GLY A 127 -6.449 -6.856 -2.500 1.00 31.03 C ATOM 2119 O GLY A 127 -5.402 -6.427 -2.977 1.00 54.54 O ATOM 0 H GLY A 127 -8.107 -8.056 0.013 1.00 53.34 H new ATOM 0 HA2 GLY A 127 -7.221 -6.112 -0.643 1.00 40.51 H new ATOM 0 HA3 GLY A 127 -5.648 -6.873 -0.511 1.00 40.51 H new