USER MOD reduce.3.24.130724 H: found=0, std=0, add=1367, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1367 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 122 GLN : amide:sc= 0.703 K(o=1.2,f=-0.15) USER MOD Set 1.2: A 134 THR OG1 : rot -123:sc= 0.49 USER MOD Set 2.1: A 111 ASN : amide:sc= 0.61 K(o=2.6,f=-3.9) USER MOD Set 2.2: A 113 LYS NZ :NH3+ -109:sc= 1.95 (180deg=-0.783) USER MOD Set 3.1: A 34 SER OG : rot 49:sc= 1.13 USER MOD Set 3.2: A 85 THR OG1 : rot 31:sc= 1.81 USER MOD Set 4.1: A 3 GLN : amide:sc= -0.655! C(o=-0.63!,f=-6.5!) USER MOD Set 4.2: A 151 LYS NZ :NH3+ -109:sc= 0.0214 (180deg=0.00385) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 177:sc=-0.00625 (180deg=-0.0293) USER MOD Single : A 2 SER OG : rot 43:sc= 0.66 USER MOD Single : A 9 SER OG : rot -115:sc= 0.205 USER MOD Single : A 10 SER OG : rot -104:sc= 0.731 USER MOD Single : A 16 LYS NZ :NH3+ -172:sc= 1.22 (180deg=1.14) USER MOD Single : A 23 LYS NZ :NH3+ -139:sc= 1.25 (180deg=1) USER MOD Single : A 25 GLN :FLIP amide:sc= -0.733 F(o=-1.4,f=-0.73) USER MOD Single : A 33 TYR OH : rot 180:sc= -0.0518 USER MOD Single : A 36 GLN : amide:sc= -1.64! C(o=-1.6!,f=-2.8!) USER MOD Single : A 39 LYS NZ :NH3+ 169:sc= -0.0363 (180deg=-0.21) USER MOD Single : A 50 LYS NZ :NH3+ -169:sc= 1.03 (180deg=0.889) USER MOD Single : A 51 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.0068) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -173:sc= 0.84 (180deg=0.56) USER MOD Single : A 67 ASN : amide:sc= 0.53 K(o=0.53,f=-1.2) USER MOD Single : A 75 TYR OH : rot 30:sc= 0.379 USER MOD Single : A 77 GLN : amide:sc= -3.53! C(o=-3.5!,f=-4.1!) USER MOD Single : A 86 THR OG1 : rot -162:sc= 0.653 USER MOD Single : A 89 LYS NZ :NH3+ 160:sc= 1.03 (180deg=0.78) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 177:sc= 1.13 (180deg=1.12) USER MOD Single : A 110 TYR OH : rot 60:sc= -0.194 USER MOD Single : A 112 ASN : amide:sc= -1.32 K(o=-1.3,f=-8.7!) USER MOD Single : A 119 LYS NZ :NH3+ 175:sc= 0.835 (180deg=0.719) USER MOD Single : A 123 GLN :FLIP amide:sc=-0.00779 F(o=-0.89,f=-0.0078) USER MOD Single : A 127 SER OG : rot 180:sc= -0.0112 USER MOD Single : A 136 SER OG : rot 180:sc= -0.31 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 1.09 (180deg=1.09) USER MOD Single : A 144 GLN : amide:sc= -0.119 K(o=-0.12,f=-4.7!) USER MOD Single : A 154 SER OG : rot -45:sc= 0.723 USER MOD Single : A 157 HIS : no HD1:sc= -0.213 X(o=-0.21,f=-0.02) USER MOD Single : A 158 HIS : no HD1:sc= -0.0177 X(o=-0.018,f=-0.047) USER MOD Single : A 159 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 160 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 161 HIS : no HD1:sc= -0.243 X(o=-0.24,f=-0.18) USER MOD Single : A 162 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.176 -5.342 19.247 1.00 65.53 N ATOM 2 CA MET A 1 -0.814 -4.589 18.017 1.00 52.24 C ATOM 3 C MET A 1 -1.423 -5.233 16.755 1.00 23.30 C ATOM 4 O MET A 1 -0.848 -6.143 16.160 1.00 55.42 O ATOM 5 CB MET A 1 0.719 -4.474 17.885 1.00 51.12 C ATOM 6 CG MET A 1 1.455 -5.808 17.901 1.00 53.14 C ATOM 7 SD MET A 1 3.232 -5.623 17.640 1.00 52.04 S ATOM 8 CE MET A 1 3.763 -7.334 17.658 1.00 33.21 C ATOM 0 H1 MET A 1 -0.708 -4.910 20.069 1.00 65.53 H new ATOM 0 H2 MET A 1 -2.207 -5.313 19.381 1.00 65.53 H new ATOM 0 H3 MET A 1 -0.867 -6.330 19.153 1.00 65.53 H new ATOM 0 HA MET A 1 -1.233 -3.587 18.107 1.00 52.24 H new ATOM 0 HB2 MET A 1 0.953 -3.955 16.956 1.00 51.12 H new ATOM 0 HB3 MET A 1 1.096 -3.855 18.699 1.00 51.12 H new ATOM 0 HG2 MET A 1 1.281 -6.303 18.856 1.00 53.14 H new ATOM 0 HG3 MET A 1 1.043 -6.455 17.127 1.00 53.14 H new ATOM 0 HE1 MET A 1 4.842 -7.382 17.508 1.00 33.21 H new ATOM 0 HE2 MET A 1 3.510 -7.784 18.618 1.00 33.21 H new ATOM 0 HE3 MET A 1 3.261 -7.879 16.859 1.00 33.21 H new ATOM 20 N SER A 2 -2.609 -4.771 16.366 1.00 22.34 N ATOM 21 CA SER A 2 -3.251 -5.227 15.125 1.00 20.25 C ATOM 22 C SER A 2 -3.093 -4.166 14.038 1.00 50.32 C ATOM 23 O SER A 2 -4.004 -3.372 13.784 1.00 21.13 O ATOM 24 CB SER A 2 -4.741 -5.540 15.349 1.00 32.31 C ATOM 25 OG SER A 2 -5.450 -4.401 15.820 1.00 3.23 O ATOM 0 H SER A 2 -3.149 -4.081 16.889 1.00 22.34 H new ATOM 0 HA SER A 2 -2.760 -6.146 14.806 1.00 20.25 H new ATOM 0 HB2 SER A 2 -5.185 -5.885 14.415 1.00 32.31 H new ATOM 0 HB3 SER A 2 -4.838 -6.353 16.068 1.00 32.31 H new ATOM 0 HG SER A 2 -5.170 -3.609 15.315 1.00 3.23 H new ATOM 31 N GLN A 3 -1.919 -4.137 13.419 1.00 4.13 N ATOM 32 CA GLN A 3 -1.576 -3.082 12.466 1.00 30.05 C ATOM 33 C GLN A 3 -1.370 -3.636 11.051 1.00 24.01 C ATOM 34 O GLN A 3 -0.761 -4.687 10.866 1.00 70.13 O ATOM 35 CB GLN A 3 -0.307 -2.352 12.936 1.00 43.12 C ATOM 36 CG GLN A 3 0.044 -1.116 12.111 1.00 55.42 C ATOM 37 CD GLN A 3 1.301 -0.403 12.596 1.00 74.14 C ATOM 38 OE1 GLN A 3 2.231 -1.019 13.104 1.00 4.55 O ATOM 39 NE2 GLN A 3 1.340 0.904 12.447 1.00 22.41 N ATOM 0 H GLN A 3 -1.186 -4.832 13.558 1.00 4.13 H new ATOM 0 HA GLN A 3 -2.411 -2.382 12.426 1.00 30.05 H new ATOM 0 HB2 GLN A 3 -0.436 -2.056 13.977 1.00 43.12 H new ATOM 0 HB3 GLN A 3 0.532 -3.047 12.904 1.00 43.12 H new ATOM 0 HG2 GLN A 3 0.180 -1.409 11.070 1.00 55.42 H new ATOM 0 HG3 GLN A 3 -0.794 -0.419 12.139 1.00 55.42 H new ATOM 0 HE21 GLN A 3 0.552 1.392 12.021 1.00 22.41 H new ATOM 0 HE22 GLN A 3 2.158 1.429 12.757 1.00 22.41 H new ATOM 48 N ILE A 4 -1.866 -2.906 10.057 1.00 24.44 N ATOM 49 CA ILE A 4 -1.707 -3.296 8.655 1.00 12.41 C ATOM 50 C ILE A 4 -0.777 -2.320 7.917 1.00 31.51 C ATOM 51 O ILE A 4 -0.929 -1.098 8.010 1.00 71.02 O ATOM 52 CB ILE A 4 -3.080 -3.365 7.933 1.00 3.22 C ATOM 53 CG1 ILE A 4 -2.899 -3.756 6.454 1.00 62.33 C ATOM 54 CG2 ILE A 4 -3.831 -2.038 8.062 1.00 23.35 C ATOM 55 CD1 ILE A 4 -4.201 -3.897 5.693 1.00 21.33 C ATOM 0 H ILE A 4 -2.384 -2.038 10.194 1.00 24.44 H new ATOM 0 HA ILE A 4 -1.258 -4.289 8.640 1.00 12.41 H new ATOM 0 HB ILE A 4 -3.680 -4.137 8.415 1.00 3.22 H new ATOM 0 HG12 ILE A 4 -2.282 -3.004 5.962 1.00 62.33 H new ATOM 0 HG13 ILE A 4 -2.355 -4.699 6.402 1.00 62.33 H new ATOM 0 HG21 ILE A 4 -4.790 -2.111 7.548 1.00 23.35 H new ATOM 0 HG22 ILE A 4 -4.000 -1.816 9.116 1.00 23.35 H new ATOM 0 HG23 ILE A 4 -3.239 -1.240 7.614 1.00 23.35 H new ATOM 0 HD11 ILE A 4 -3.990 -4.174 4.660 1.00 21.33 H new ATOM 0 HD12 ILE A 4 -4.813 -4.670 6.158 1.00 21.33 H new ATOM 0 HD13 ILE A 4 -4.738 -2.949 5.712 1.00 21.33 H new ATOM 67 N PHE A 5 0.197 -2.868 7.201 1.00 10.21 N ATOM 68 CA PHE A 5 1.198 -2.060 6.498 1.00 32.42 C ATOM 69 C PHE A 5 0.761 -1.794 5.047 1.00 62.21 C ATOM 70 O PHE A 5 0.553 -2.728 4.272 1.00 10.24 O ATOM 71 CB PHE A 5 2.549 -2.790 6.525 1.00 21.11 C ATOM 72 CG PHE A 5 3.729 -1.941 6.119 1.00 33.43 C ATOM 73 CD1 PHE A 5 4.385 -1.151 7.050 1.00 44.00 C ATOM 74 CD2 PHE A 5 4.188 -1.944 4.812 1.00 52.30 C ATOM 75 CE1 PHE A 5 5.472 -0.381 6.683 1.00 72.41 C ATOM 76 CE2 PHE A 5 5.274 -1.178 4.442 1.00 0.52 C ATOM 77 CZ PHE A 5 5.917 -0.395 5.378 1.00 4.54 C ATOM 0 H PHE A 5 0.319 -3.874 7.089 1.00 10.21 H new ATOM 0 HA PHE A 5 1.296 -1.098 7.001 1.00 32.42 H new ATOM 0 HB2 PHE A 5 2.721 -3.171 7.532 1.00 21.11 H new ATOM 0 HB3 PHE A 5 2.494 -3.654 5.862 1.00 21.11 H new ATOM 0 HD1 PHE A 5 4.043 -1.137 8.074 1.00 44.00 H new ATOM 0 HD2 PHE A 5 3.689 -2.554 4.073 1.00 52.30 H new ATOM 0 HE1 PHE A 5 5.973 0.232 7.418 1.00 72.41 H new ATOM 0 HE2 PHE A 5 5.621 -1.191 3.419 1.00 0.52 H new ATOM 0 HZ PHE A 5 6.767 0.206 5.089 1.00 4.54 H new ATOM 87 N VAL A 6 0.622 -0.520 4.684 1.00 54.44 N ATOM 88 CA VAL A 6 0.174 -0.143 3.339 1.00 34.11 C ATOM 89 C VAL A 6 1.122 0.882 2.685 1.00 64.13 C ATOM 90 O VAL A 6 1.482 1.897 3.285 1.00 3.34 O ATOM 91 CB VAL A 6 -1.280 0.408 3.364 1.00 54.11 C ATOM 92 CG1 VAL A 6 -1.397 1.642 4.258 1.00 71.50 C ATOM 93 CG2 VAL A 6 -1.781 0.705 1.948 1.00 31.42 C ATOM 0 H VAL A 6 0.812 0.270 5.300 1.00 54.44 H new ATOM 0 HA VAL A 6 0.191 -1.049 2.734 1.00 34.11 H new ATOM 0 HB VAL A 6 -1.916 -0.367 3.790 1.00 54.11 H new ATOM 0 HG11 VAL A 6 -2.427 2.000 4.251 1.00 71.50 H new ATOM 0 HG12 VAL A 6 -1.110 1.382 5.277 1.00 71.50 H new ATOM 0 HG13 VAL A 6 -0.738 2.426 3.884 1.00 71.50 H new ATOM 0 HG21 VAL A 6 -2.800 1.089 1.996 1.00 31.42 H new ATOM 0 HG22 VAL A 6 -1.135 1.449 1.482 1.00 31.42 H new ATOM 0 HG23 VAL A 6 -1.766 -0.211 1.357 1.00 31.42 H new ATOM 103 N VAL A 7 1.533 0.595 1.450 1.00 4.43 N ATOM 104 CA VAL A 7 2.458 1.460 0.709 1.00 50.14 C ATOM 105 C VAL A 7 1.781 2.096 -0.514 1.00 33.45 C ATOM 106 O VAL A 7 1.203 1.398 -1.340 1.00 13.25 O ATOM 107 CB VAL A 7 3.704 0.670 0.226 1.00 44.34 C ATOM 108 CG1 VAL A 7 4.648 1.572 -0.570 1.00 71.32 C ATOM 109 CG2 VAL A 7 4.432 0.033 1.406 1.00 32.14 C ATOM 0 H VAL A 7 1.239 -0.236 0.936 1.00 4.43 H new ATOM 0 HA VAL A 7 2.766 2.245 1.400 1.00 50.14 H new ATOM 0 HB VAL A 7 3.362 -0.127 -0.434 1.00 44.34 H new ATOM 0 HG11 VAL A 7 5.513 0.995 -0.897 1.00 71.32 H new ATOM 0 HG12 VAL A 7 4.125 1.967 -1.441 1.00 71.32 H new ATOM 0 HG13 VAL A 7 4.980 2.398 0.060 1.00 71.32 H new ATOM 0 HG21 VAL A 7 5.302 -0.515 1.044 1.00 32.14 H new ATOM 0 HG22 VAL A 7 4.756 0.811 2.097 1.00 32.14 H new ATOM 0 HG23 VAL A 7 3.759 -0.653 1.921 1.00 32.14 H new ATOM 119 N PHE A 8 1.858 3.418 -0.628 1.00 40.21 N ATOM 120 CA PHE A 8 1.350 4.116 -1.817 1.00 34.05 C ATOM 121 C PHE A 8 2.517 4.573 -2.707 1.00 41.15 C ATOM 122 O PHE A 8 3.405 5.299 -2.259 1.00 40.40 O ATOM 123 CB PHE A 8 0.496 5.329 -1.406 1.00 75.25 C ATOM 124 CG PHE A 8 -0.796 4.972 -0.707 1.00 24.15 C ATOM 125 CD1 PHE A 8 -0.801 4.586 0.626 1.00 12.11 C ATOM 126 CD2 PHE A 8 -2.008 5.032 -1.385 1.00 12.31 C ATOM 127 CE1 PHE A 8 -1.983 4.267 1.268 1.00 22.35 C ATOM 128 CE2 PHE A 8 -3.192 4.712 -0.746 1.00 24.23 C ATOM 129 CZ PHE A 8 -3.180 4.331 0.581 1.00 5.21 C ATOM 0 H PHE A 8 2.264 4.030 0.080 1.00 40.21 H new ATOM 0 HA PHE A 8 0.726 3.423 -2.381 1.00 34.05 H new ATOM 0 HB2 PHE A 8 1.086 5.968 -0.749 1.00 75.25 H new ATOM 0 HB3 PHE A 8 0.264 5.914 -2.296 1.00 75.25 H new ATOM 0 HD1 PHE A 8 0.131 4.534 1.169 1.00 12.11 H new ATOM 0 HD2 PHE A 8 -2.025 5.332 -2.422 1.00 12.31 H new ATOM 0 HE1 PHE A 8 -1.971 3.968 2.306 1.00 22.35 H new ATOM 0 HE2 PHE A 8 -4.126 4.760 -1.285 1.00 24.23 H new ATOM 0 HZ PHE A 8 -4.105 4.083 1.081 1.00 5.21 H new ATOM 139 N SER A 9 2.530 4.129 -3.960 1.00 14.32 N ATOM 140 CA SER A 9 3.574 4.543 -4.910 1.00 21.23 C ATOM 141 C SER A 9 3.016 4.730 -6.321 1.00 10.12 C ATOM 142 O SER A 9 2.330 3.855 -6.850 1.00 65.32 O ATOM 143 CB SER A 9 4.723 3.526 -4.947 1.00 14.33 C ATOM 144 OG SER A 9 5.725 3.916 -5.878 1.00 11.12 O ATOM 0 H SER A 9 1.838 3.487 -4.346 1.00 14.32 H new ATOM 0 HA SER A 9 3.955 5.502 -4.558 1.00 21.23 H new ATOM 0 HB2 SER A 9 5.162 3.433 -3.954 1.00 14.33 H new ATOM 0 HB3 SER A 9 4.334 2.544 -5.217 1.00 14.33 H new ATOM 0 HG SER A 9 5.769 3.260 -6.605 1.00 11.12 H new ATOM 150 N SER A 10 3.314 5.873 -6.929 1.00 70.42 N ATOM 151 CA SER A 10 2.942 6.132 -8.326 1.00 51.21 C ATOM 152 C SER A 10 4.014 5.617 -9.304 1.00 14.14 C ATOM 153 O SER A 10 3.931 5.849 -10.515 1.00 1.31 O ATOM 154 CB SER A 10 2.703 7.636 -8.538 1.00 24.14 C ATOM 155 OG SER A 10 3.782 8.409 -8.030 1.00 44.50 O ATOM 0 H SER A 10 3.813 6.640 -6.480 1.00 70.42 H new ATOM 0 HA SER A 10 2.020 5.589 -8.533 1.00 51.21 H new ATOM 0 HB2 SER A 10 2.577 7.840 -9.601 1.00 24.14 H new ATOM 0 HB3 SER A 10 1.777 7.932 -8.044 1.00 24.14 H new ATOM 0 HG SER A 10 3.518 8.822 -7.181 1.00 44.50 H new ATOM 161 N ASP A 11 5.013 4.905 -8.774 1.00 45.21 N ATOM 162 CA ASP A 11 6.089 4.319 -9.586 1.00 23.23 C ATOM 163 C ASP A 11 6.037 2.778 -9.576 1.00 30.21 C ATOM 164 O ASP A 11 6.391 2.142 -8.578 1.00 62.11 O ATOM 165 CB ASP A 11 7.458 4.794 -9.083 1.00 64.14 C ATOM 166 CG ASP A 11 7.714 6.253 -9.404 1.00 44.51 C ATOM 167 OD1 ASP A 11 8.057 6.553 -10.570 1.00 73.12 O ATOM 168 OD2 ASP A 11 7.567 7.106 -8.508 1.00 45.13 O ATOM 0 H ASP A 11 5.101 4.718 -7.775 1.00 45.21 H new ATOM 0 HA ASP A 11 5.942 4.656 -10.612 1.00 23.23 H new ATOM 0 HB2 ASP A 11 7.518 4.646 -8.005 1.00 64.14 H new ATOM 0 HB3 ASP A 11 8.240 4.183 -9.533 1.00 64.14 H new ATOM 173 N PRO A 12 5.616 2.152 -10.696 1.00 14.24 N ATOM 174 CA PRO A 12 5.538 0.683 -10.802 1.00 62.23 C ATOM 175 C PRO A 12 6.910 0.001 -10.648 1.00 44.11 C ATOM 176 O PRO A 12 7.011 -1.096 -10.096 1.00 44.20 O ATOM 177 CB PRO A 12 4.968 0.452 -12.214 1.00 73.45 C ATOM 178 CG PRO A 12 5.264 1.712 -12.959 1.00 21.25 C ATOM 179 CD PRO A 12 5.186 2.817 -11.943 1.00 2.44 C ATOM 0 HA PRO A 12 4.927 0.253 -10.008 1.00 62.23 H new ATOM 0 HB2 PRO A 12 5.435 -0.409 -12.693 1.00 73.45 H new ATOM 0 HB3 PRO A 12 3.896 0.256 -12.180 1.00 73.45 H new ATOM 0 HG2 PRO A 12 6.252 1.672 -13.418 1.00 21.25 H new ATOM 0 HG3 PRO A 12 4.545 1.869 -13.763 1.00 21.25 H new ATOM 0 HD2 PRO A 12 5.839 3.650 -12.202 1.00 2.44 H new ATOM 0 HD3 PRO A 12 4.176 3.218 -11.859 1.00 2.44 H new ATOM 187 N GLU A 13 7.964 0.662 -11.130 1.00 25.41 N ATOM 188 CA GLU A 13 9.327 0.125 -11.033 1.00 21.32 C ATOM 189 C GLU A 13 9.789 0.014 -9.571 1.00 5.31 C ATOM 190 O GLU A 13 10.482 -0.934 -9.197 1.00 23.45 O ATOM 191 CB GLU A 13 10.296 1.007 -11.831 1.00 45.24 C ATOM 192 CG GLU A 13 9.972 1.076 -13.322 1.00 70.24 C ATOM 193 CD GLU A 13 10.951 1.939 -14.104 1.00 44.44 C ATOM 194 OE1 GLU A 13 11.991 1.414 -14.549 1.00 40.21 O ATOM 195 OE2 GLU A 13 10.683 3.145 -14.280 1.00 52.21 O ATOM 0 H GLU A 13 7.902 1.570 -11.592 1.00 25.41 H new ATOM 0 HA GLU A 13 9.323 -0.880 -11.455 1.00 21.32 H new ATOM 0 HB2 GLU A 13 10.281 2.015 -11.417 1.00 45.24 H new ATOM 0 HB3 GLU A 13 11.309 0.626 -11.705 1.00 45.24 H new ATOM 0 HG2 GLU A 13 9.974 0.068 -13.736 1.00 70.24 H new ATOM 0 HG3 GLU A 13 8.964 1.471 -13.451 1.00 70.24 H new ATOM 202 N ILE A 14 9.376 0.977 -8.744 1.00 52.05 N ATOM 203 CA ILE A 14 9.716 0.979 -7.316 1.00 71.32 C ATOM 204 C ILE A 14 8.814 0.000 -6.561 1.00 72.34 C ATOM 205 O ILE A 14 9.270 -0.761 -5.708 1.00 43.05 O ATOM 206 CB ILE A 14 9.574 2.396 -6.699 1.00 61.41 C ATOM 207 CG1 ILE A 14 10.561 3.370 -7.367 1.00 41.11 C ATOM 208 CG2 ILE A 14 9.788 2.360 -5.182 1.00 60.34 C ATOM 209 CD1 ILE A 14 10.461 4.794 -6.855 1.00 40.15 C ATOM 0 H ILE A 14 8.804 1.768 -9.038 1.00 52.05 H new ATOM 0 HA ILE A 14 10.757 0.669 -7.223 1.00 71.32 H new ATOM 0 HB ILE A 14 8.559 2.749 -6.883 1.00 61.41 H new ATOM 0 HG12 ILE A 14 11.577 3.008 -7.209 1.00 41.11 H new ATOM 0 HG13 ILE A 14 10.386 3.368 -8.443 1.00 41.11 H new ATOM 0 HG21 ILE A 14 9.683 3.366 -4.776 1.00 60.34 H new ATOM 0 HG22 ILE A 14 9.046 1.705 -4.725 1.00 60.34 H new ATOM 0 HG23 ILE A 14 10.787 1.983 -4.964 1.00 60.34 H new ATOM 0 HD11 ILE A 14 11.188 5.419 -7.374 1.00 40.15 H new ATOM 0 HD12 ILE A 14 9.457 5.177 -7.038 1.00 40.15 H new ATOM 0 HD13 ILE A 14 10.666 4.811 -5.785 1.00 40.15 H new ATOM 221 N LEU A 15 7.529 0.030 -6.901 1.00 15.33 N ATOM 222 CA LEU A 15 6.542 -0.906 -6.364 1.00 2.52 C ATOM 223 C LEU A 15 7.005 -2.367 -6.538 1.00 15.31 C ATOM 224 O LEU A 15 6.891 -3.180 -5.617 1.00 21.33 O ATOM 225 CB LEU A 15 5.185 -0.643 -7.059 1.00 33.44 C ATOM 226 CG LEU A 15 4.346 -1.874 -7.434 1.00 63.45 C ATOM 227 CD1 LEU A 15 3.837 -2.609 -6.194 1.00 10.11 C ATOM 228 CD2 LEU A 15 3.182 -1.473 -8.338 1.00 61.32 C ATOM 0 H LEU A 15 7.140 0.706 -7.559 1.00 15.33 H new ATOM 0 HA LEU A 15 6.429 -0.748 -5.292 1.00 2.52 H new ATOM 0 HB2 LEU A 15 4.585 -0.011 -6.404 1.00 33.44 H new ATOM 0 HB3 LEU A 15 5.374 -0.072 -7.968 1.00 33.44 H new ATOM 0 HG LEU A 15 4.993 -2.561 -7.980 1.00 63.45 H new ATOM 0 HD11 LEU A 15 3.248 -3.474 -6.500 1.00 10.11 H new ATOM 0 HD12 LEU A 15 4.685 -2.941 -5.594 1.00 10.11 H new ATOM 0 HD13 LEU A 15 3.215 -1.937 -5.602 1.00 10.11 H new ATOM 0 HD21 LEU A 15 2.598 -2.357 -8.594 1.00 61.32 H new ATOM 0 HD22 LEU A 15 2.546 -0.757 -7.817 1.00 61.32 H new ATOM 0 HD23 LEU A 15 3.569 -1.018 -9.250 1.00 61.32 H new ATOM 240 N LYS A 16 7.544 -2.689 -7.713 1.00 5.52 N ATOM 241 CA LYS A 16 8.023 -4.047 -7.994 1.00 22.03 C ATOM 242 C LYS A 16 9.202 -4.428 -7.076 1.00 43.42 C ATOM 243 O LYS A 16 9.298 -5.565 -6.606 1.00 3.15 O ATOM 244 CB LYS A 16 8.429 -4.173 -9.467 1.00 30.14 C ATOM 245 CG LYS A 16 8.521 -5.615 -9.952 1.00 13.31 C ATOM 246 CD LYS A 16 9.054 -5.707 -11.379 1.00 0.34 C ATOM 247 CE LYS A 16 8.166 -4.963 -12.370 1.00 31.41 C ATOM 248 NZ LYS A 16 8.696 -5.040 -13.754 1.00 61.52 N ATOM 0 H LYS A 16 7.661 -2.033 -8.485 1.00 5.52 H new ATOM 0 HA LYS A 16 7.206 -4.740 -7.792 1.00 22.03 H new ATOM 0 HB2 LYS A 16 7.706 -3.637 -10.082 1.00 30.14 H new ATOM 0 HB3 LYS A 16 9.394 -3.687 -9.612 1.00 30.14 H new ATOM 0 HG2 LYS A 16 9.172 -6.181 -9.285 1.00 13.31 H new ATOM 0 HG3 LYS A 16 7.535 -6.077 -9.903 1.00 13.31 H new ATOM 0 HD2 LYS A 16 10.063 -5.296 -11.416 1.00 0.34 H new ATOM 0 HD3 LYS A 16 9.126 -6.754 -11.672 1.00 0.34 H new ATOM 0 HE2 LYS A 16 7.160 -5.383 -12.342 1.00 31.41 H new ATOM 0 HE3 LYS A 16 8.084 -3.918 -12.070 1.00 31.41 H new ATOM 0 HZ1 LYS A 16 8.143 -4.413 -14.373 1.00 61.52 H new ATOM 0 HZ2 LYS A 16 9.693 -4.743 -13.761 1.00 61.52 H new ATOM 0 HZ3 LYS A 16 8.624 -6.018 -14.099 1.00 61.52 H new ATOM 262 N GLU A 17 10.088 -3.464 -6.822 1.00 12.34 N ATOM 263 CA GLU A 17 11.215 -3.653 -5.899 1.00 33.22 C ATOM 264 C GLU A 17 10.720 -3.935 -4.471 1.00 34.02 C ATOM 265 O GLU A 17 11.258 -4.794 -3.770 1.00 64.45 O ATOM 266 CB GLU A 17 12.111 -2.409 -5.907 1.00 52.04 C ATOM 267 CG GLU A 17 12.905 -2.222 -7.197 1.00 65.43 C ATOM 268 CD GLU A 17 14.060 -3.203 -7.319 1.00 62.51 C ATOM 269 OE1 GLU A 17 15.027 -3.083 -6.539 1.00 34.33 O ATOM 270 OE2 GLU A 17 14.015 -4.087 -8.197 1.00 22.11 O ATOM 0 H GLU A 17 10.048 -2.537 -7.245 1.00 12.34 H new ATOM 0 HA GLU A 17 11.790 -4.515 -6.236 1.00 33.22 H new ATOM 0 HB2 GLU A 17 11.492 -1.527 -5.743 1.00 52.04 H new ATOM 0 HB3 GLU A 17 12.807 -2.470 -5.070 1.00 52.04 H new ATOM 0 HG2 GLU A 17 12.238 -2.343 -8.051 1.00 65.43 H new ATOM 0 HG3 GLU A 17 13.292 -1.204 -7.237 1.00 65.43 H new ATOM 277 N ILE A 18 9.688 -3.206 -4.054 1.00 70.53 N ATOM 278 CA ILE A 18 9.073 -3.409 -2.738 1.00 25.23 C ATOM 279 C ILE A 18 8.592 -4.858 -2.572 1.00 55.10 C ATOM 280 O ILE A 18 8.900 -5.523 -1.582 1.00 34.25 O ATOM 281 CB ILE A 18 7.864 -2.462 -2.536 1.00 31.32 C ATOM 282 CG1 ILE A 18 8.278 -0.998 -2.747 1.00 52.20 C ATOM 283 CG2 ILE A 18 7.255 -2.651 -1.146 1.00 10.14 C ATOM 284 CD1 ILE A 18 7.111 -0.035 -2.750 1.00 33.20 C ATOM 0 H ILE A 18 9.256 -2.466 -4.608 1.00 70.53 H new ATOM 0 HA ILE A 18 9.837 -3.190 -1.992 1.00 25.23 H new ATOM 0 HB ILE A 18 7.108 -2.715 -3.279 1.00 31.32 H new ATOM 0 HG12 ILE A 18 8.975 -0.709 -1.961 1.00 52.20 H new ATOM 0 HG13 ILE A 18 8.812 -0.912 -3.694 1.00 52.20 H new ATOM 0 HG21 ILE A 18 6.407 -1.976 -1.025 1.00 10.14 H new ATOM 0 HG22 ILE A 18 6.917 -3.681 -1.034 1.00 10.14 H new ATOM 0 HG23 ILE A 18 8.005 -2.430 -0.387 1.00 10.14 H new ATOM 0 HD11 ILE A 18 7.477 0.980 -2.904 1.00 33.20 H new ATOM 0 HD12 ILE A 18 6.424 -0.299 -3.554 1.00 33.20 H new ATOM 0 HD13 ILE A 18 6.590 -0.092 -1.794 1.00 33.20 H new ATOM 296 N VAL A 19 7.845 -5.339 -3.564 1.00 62.21 N ATOM 297 CA VAL A 19 7.255 -6.680 -3.522 1.00 12.32 C ATOM 298 C VAL A 19 8.308 -7.788 -3.336 1.00 43.21 C ATOM 299 O VAL A 19 8.174 -8.625 -2.444 1.00 12.51 O ATOM 300 CB VAL A 19 6.422 -6.957 -4.797 1.00 42.12 C ATOM 301 CG1 VAL A 19 5.910 -8.396 -4.826 1.00 35.21 C ATOM 302 CG2 VAL A 19 5.259 -5.971 -4.888 1.00 51.24 C ATOM 0 H VAL A 19 7.632 -4.817 -4.414 1.00 62.21 H new ATOM 0 HA VAL A 19 6.601 -6.700 -2.650 1.00 12.32 H new ATOM 0 HB VAL A 19 7.071 -6.821 -5.662 1.00 42.12 H new ATOM 0 HG11 VAL A 19 5.329 -8.557 -5.734 1.00 35.21 H new ATOM 0 HG12 VAL A 19 6.756 -9.083 -4.809 1.00 35.21 H new ATOM 0 HG13 VAL A 19 5.279 -8.575 -3.955 1.00 35.21 H new ATOM 0 HG21 VAL A 19 4.679 -6.174 -5.788 1.00 51.24 H new ATOM 0 HG22 VAL A 19 4.620 -6.081 -4.012 1.00 51.24 H new ATOM 0 HG23 VAL A 19 5.647 -4.953 -4.929 1.00 51.24 H new ATOM 312 N ARG A 20 9.354 -7.798 -4.168 1.00 21.45 N ATOM 313 CA ARG A 20 10.402 -8.830 -4.062 1.00 74.13 C ATOM 314 C ARG A 20 11.087 -8.815 -2.681 1.00 3.03 C ATOM 315 O ARG A 20 11.532 -9.855 -2.191 1.00 64.20 O ATOM 316 CB ARG A 20 11.433 -8.693 -5.195 1.00 52.13 C ATOM 317 CG ARG A 20 11.951 -7.277 -5.419 1.00 41.21 C ATOM 318 CD ARG A 20 12.896 -7.207 -6.614 1.00 32.44 C ATOM 319 NE ARG A 20 12.337 -7.873 -7.795 1.00 24.32 N ATOM 320 CZ ARG A 20 12.469 -7.445 -9.023 1.00 74.12 C ATOM 321 NH1 ARG A 20 13.079 -6.332 -9.275 1.00 61.30 N ATOM 322 NH2 ARG A 20 11.981 -8.138 -10.001 1.00 62.21 N ATOM 0 H ARG A 20 9.501 -7.117 -4.913 1.00 21.45 H new ATOM 0 HA ARG A 20 9.912 -9.798 -4.168 1.00 74.13 H new ATOM 0 HB2 ARG A 20 12.279 -9.345 -4.978 1.00 52.13 H new ATOM 0 HB3 ARG A 20 10.984 -9.052 -6.121 1.00 52.13 H new ATOM 0 HG2 ARG A 20 11.110 -6.603 -5.580 1.00 41.21 H new ATOM 0 HG3 ARG A 20 12.469 -6.933 -4.524 1.00 41.21 H new ATOM 0 HD2 ARG A 20 13.105 -6.164 -6.851 1.00 32.44 H new ATOM 0 HD3 ARG A 20 13.847 -7.671 -6.352 1.00 32.44 H new ATOM 0 HE ARG A 20 11.807 -8.732 -7.648 1.00 24.32 H new ATOM 0 HH11 ARG A 20 13.464 -5.777 -8.511 1.00 61.30 H new ATOM 0 HH12 ARG A 20 13.175 -6.010 -10.238 1.00 61.30 H new ATOM 0 HH21 ARG A 20 11.495 -9.015 -9.812 1.00 62.21 H new ATOM 0 HH22 ARG A 20 12.082 -7.807 -10.961 1.00 62.21 H new ATOM 336 N GLU A 21 11.158 -7.640 -2.050 1.00 10.24 N ATOM 337 CA GLU A 21 11.608 -7.548 -0.656 1.00 42.12 C ATOM 338 C GLU A 21 10.631 -8.279 0.271 1.00 24.20 C ATOM 339 O GLU A 21 11.008 -9.219 0.969 1.00 33.32 O ATOM 340 CB GLU A 21 11.726 -6.081 -0.211 1.00 24.14 C ATOM 341 CG GLU A 21 12.894 -5.328 -0.828 1.00 33.31 C ATOM 342 CD GLU A 21 14.240 -5.894 -0.407 1.00 74.05 C ATOM 343 OE1 GLU A 21 14.511 -5.972 0.813 1.00 21.02 O ATOM 344 OE2 GLU A 21 15.029 -6.283 -1.286 1.00 52.32 O ATOM 0 H GLU A 21 10.913 -6.746 -2.476 1.00 10.24 H new ATOM 0 HA GLU A 21 12.590 -8.017 -0.593 1.00 42.12 H new ATOM 0 HB2 GLU A 21 10.801 -5.562 -0.464 1.00 24.14 H new ATOM 0 HB3 GLU A 21 11.823 -6.050 0.874 1.00 24.14 H new ATOM 0 HG2 GLU A 21 12.812 -5.364 -1.914 1.00 33.31 H new ATOM 0 HG3 GLU A 21 12.839 -4.278 -0.539 1.00 33.31 H new ATOM 351 N ILE A 22 9.370 -7.840 0.250 1.00 12.34 N ATOM 352 CA ILE A 22 8.307 -8.438 1.072 1.00 54.52 C ATOM 353 C ILE A 22 8.306 -9.971 0.957 1.00 4.01 C ATOM 354 O ILE A 22 8.265 -10.687 1.963 1.00 44.24 O ATOM 355 CB ILE A 22 6.916 -7.908 0.637 1.00 5.14 C ATOM 356 CG1 ILE A 22 6.897 -6.374 0.633 1.00 60.02 C ATOM 357 CG2 ILE A 22 5.813 -8.457 1.544 1.00 15.41 C ATOM 358 CD1 ILE A 22 5.683 -5.786 -0.055 1.00 71.44 C ATOM 0 H ILE A 22 9.055 -7.064 -0.333 1.00 12.34 H new ATOM 0 HA ILE A 22 8.505 -8.156 2.106 1.00 54.52 H new ATOM 0 HB ILE A 22 6.725 -8.257 -0.378 1.00 5.14 H new ATOM 0 HG12 ILE A 22 6.931 -6.016 1.662 1.00 60.02 H new ATOM 0 HG13 ILE A 22 7.797 -6.009 0.139 1.00 60.02 H new ATOM 0 HG21 ILE A 22 4.848 -8.070 1.218 1.00 15.41 H new ATOM 0 HG22 ILE A 22 5.805 -9.546 1.489 1.00 15.41 H new ATOM 0 HG23 ILE A 22 5.999 -8.147 2.572 1.00 15.41 H new ATOM 0 HD11 ILE A 22 5.736 -4.698 -0.020 1.00 71.44 H new ATOM 0 HD12 ILE A 22 5.659 -6.115 -1.094 1.00 71.44 H new ATOM 0 HD13 ILE A 22 4.779 -6.122 0.453 1.00 71.44 H new ATOM 370 N LYS A 23 8.371 -10.460 -0.283 1.00 30.20 N ATOM 371 CA LYS A 23 8.402 -11.897 -0.558 1.00 4.32 C ATOM 372 C LYS A 23 9.561 -12.586 0.178 1.00 74.05 C ATOM 373 O LYS A 23 9.353 -13.570 0.891 1.00 64.21 O ATOM 374 CB LYS A 23 8.518 -12.144 -2.074 1.00 23.33 C ATOM 375 CG LYS A 23 7.350 -11.584 -2.886 1.00 2.51 C ATOM 376 CD LYS A 23 6.033 -12.297 -2.579 1.00 14.31 C ATOM 377 CE LYS A 23 6.031 -13.732 -3.093 1.00 74.10 C ATOM 378 NZ LYS A 23 4.783 -14.452 -2.730 1.00 1.51 N ATOM 0 H LYS A 23 8.403 -9.876 -1.119 1.00 30.20 H new ATOM 0 HA LYS A 23 7.470 -12.327 -0.192 1.00 4.32 H new ATOM 0 HB2 LYS A 23 9.445 -11.698 -2.435 1.00 23.33 H new ATOM 0 HB3 LYS A 23 8.590 -13.217 -2.253 1.00 23.33 H new ATOM 0 HG2 LYS A 23 7.242 -10.520 -2.676 1.00 2.51 H new ATOM 0 HG3 LYS A 23 7.572 -11.678 -3.949 1.00 2.51 H new ATOM 0 HD2 LYS A 23 5.862 -12.297 -1.502 1.00 14.31 H new ATOM 0 HD3 LYS A 23 5.208 -11.748 -3.033 1.00 14.31 H new ATOM 0 HE2 LYS A 23 6.145 -13.729 -4.177 1.00 74.10 H new ATOM 0 HE3 LYS A 23 6.889 -14.265 -2.683 1.00 74.10 H new ATOM 0 HZ1 LYS A 23 5.015 -15.423 -2.439 1.00 1.51 H new ATOM 0 HZ2 LYS A 23 4.313 -13.958 -1.945 1.00 1.51 H new ATOM 0 HZ3 LYS A 23 4.146 -14.479 -3.552 1.00 1.51 H new ATOM 392 N ARG A 24 10.779 -12.050 0.029 1.00 43.04 N ATOM 393 CA ARG A 24 11.962 -12.663 0.646 1.00 32.22 C ATOM 394 C ARG A 24 12.003 -12.436 2.169 1.00 61.43 C ATOM 395 O ARG A 24 12.675 -13.171 2.894 1.00 72.41 O ATOM 396 CB ARG A 24 13.263 -12.166 -0.015 1.00 33.35 C ATOM 397 CG ARG A 24 13.660 -10.725 0.303 1.00 41.33 C ATOM 398 CD ARG A 24 15.037 -10.401 -0.279 1.00 24.10 C ATOM 399 NE ARG A 24 15.438 -9.013 -0.052 1.00 25.23 N ATOM 400 CZ ARG A 24 16.667 -8.630 0.185 1.00 54.11 C ATOM 401 NH1 ARG A 24 17.633 -9.491 0.241 1.00 22.34 N ATOM 402 NH2 ARG A 24 16.927 -7.375 0.330 1.00 45.12 N ATOM 0 H ARG A 24 10.970 -11.203 -0.507 1.00 43.04 H new ATOM 0 HA ARG A 24 11.883 -13.737 0.477 1.00 32.22 H new ATOM 0 HB2 ARG A 24 14.077 -12.823 0.289 1.00 33.35 H new ATOM 0 HB3 ARG A 24 13.160 -12.265 -1.096 1.00 33.35 H new ATOM 0 HG2 ARG A 24 12.917 -10.040 -0.105 1.00 41.33 H new ATOM 0 HG3 ARG A 24 13.672 -10.576 1.383 1.00 41.33 H new ATOM 0 HD2 ARG A 24 15.779 -11.065 0.164 1.00 24.10 H new ATOM 0 HD3 ARG A 24 15.029 -10.601 -1.350 1.00 24.10 H new ATOM 0 HE ARG A 24 14.713 -8.297 -0.080 1.00 25.23 H new ATOM 0 HH11 ARG A 24 17.441 -10.483 0.099 1.00 22.34 H new ATOM 0 HH12 ARG A 24 18.586 -9.177 0.427 1.00 22.34 H new ATOM 0 HH21 ARG A 24 16.177 -6.687 0.260 1.00 45.12 H new ATOM 0 HH22 ARG A 24 17.883 -7.070 0.515 1.00 45.12 H new ATOM 416 N GLN A 25 11.281 -11.422 2.654 1.00 43.30 N ATOM 417 CA GLN A 25 11.143 -11.198 4.101 1.00 32.15 C ATOM 418 C GLN A 25 10.238 -12.266 4.737 1.00 35.13 C ATOM 419 O GLN A 25 10.223 -12.442 5.958 1.00 13.31 O ATOM 420 CB GLN A 25 10.565 -9.800 4.390 1.00 21.03 C ATOM 421 CG GLN A 25 11.433 -8.639 3.911 1.00 1.43 C ATOM 422 CD GLN A 25 12.828 -8.642 4.516 1.00 60.44 C ATOM 423 OE1 GLN A 25 13.789 -8.121 3.782 1.00 64.41 O flip ATOM 424 NE2 GLN A 25 13.039 -9.099 5.635 1.00 50.15 N flip ATOM 0 H GLN A 25 10.785 -10.746 2.073 1.00 43.30 H new ATOM 0 HA GLN A 25 12.139 -11.268 4.539 1.00 32.15 H new ATOM 0 HB2 GLN A 25 9.585 -9.722 3.918 1.00 21.03 H new ATOM 0 HB3 GLN A 25 10.410 -9.701 5.464 1.00 21.03 H new ATOM 0 HG2 GLN A 25 11.515 -8.680 2.825 1.00 1.43 H new ATOM 0 HG3 GLN A 25 10.939 -7.699 4.158 1.00 1.43 H new ATOM 0 HE21 GLN A 25 12.271 -9.495 6.177 1.00 50.15 H new ATOM 0 HE22 GLN A 25 13.982 -9.082 6.023 1.00 50.15 H new ATOM 433 N GLY A 26 9.482 -12.971 3.895 1.00 2.32 N ATOM 434 CA GLY A 26 8.559 -13.995 4.376 1.00 42.51 C ATOM 435 C GLY A 26 7.150 -13.460 4.609 1.00 3.03 C ATOM 436 O GLY A 26 6.317 -14.130 5.219 1.00 20.31 O ATOM 0 H GLY A 26 9.491 -12.852 2.882 1.00 2.32 H new ATOM 0 HA2 GLY A 26 8.518 -14.809 3.653 1.00 42.51 H new ATOM 0 HA3 GLY A 26 8.942 -14.414 5.307 1.00 42.51 H new ATOM 440 N VAL A 27 6.877 -12.258 4.106 1.00 4.43 N ATOM 441 CA VAL A 27 5.569 -11.619 4.281 1.00 30.43 C ATOM 442 C VAL A 27 4.735 -11.692 2.987 1.00 70.44 C ATOM 443 O VAL A 27 5.278 -11.689 1.881 1.00 21.40 O ATOM 444 CB VAL A 27 5.731 -10.136 4.719 1.00 43.45 C ATOM 445 CG1 VAL A 27 4.373 -9.484 4.977 1.00 1.33 C ATOM 446 CG2 VAL A 27 6.627 -10.033 5.955 1.00 52.23 C ATOM 0 H VAL A 27 7.545 -11.703 3.572 1.00 4.43 H new ATOM 0 HA VAL A 27 5.042 -12.164 5.065 1.00 30.43 H new ATOM 0 HB VAL A 27 6.210 -9.595 3.902 1.00 43.45 H new ATOM 0 HG11 VAL A 27 4.519 -8.448 5.282 1.00 1.33 H new ATOM 0 HG12 VAL A 27 3.776 -9.514 4.065 1.00 1.33 H new ATOM 0 HG13 VAL A 27 3.854 -10.025 5.768 1.00 1.33 H new ATOM 0 HG21 VAL A 27 6.728 -8.987 6.245 1.00 52.23 H new ATOM 0 HG22 VAL A 27 6.182 -10.596 6.775 1.00 52.23 H new ATOM 0 HG23 VAL A 27 7.611 -10.442 5.726 1.00 52.23 H new ATOM 456 N ARG A 28 3.416 -11.764 3.139 1.00 12.44 N ATOM 457 CA ARG A 28 2.502 -11.871 1.997 1.00 13.54 C ATOM 458 C ARG A 28 2.178 -10.487 1.402 1.00 31.21 C ATOM 459 O ARG A 28 1.985 -9.514 2.137 1.00 30.13 O ATOM 460 CB ARG A 28 1.219 -12.580 2.443 1.00 74.22 C ATOM 461 CG ARG A 28 0.236 -12.865 1.316 1.00 15.42 C ATOM 462 CD ARG A 28 -0.975 -13.647 1.813 1.00 4.23 C ATOM 463 NE ARG A 28 -1.870 -14.015 0.722 1.00 62.02 N ATOM 464 CZ ARG A 28 -2.773 -14.953 0.793 1.00 12.50 C ATOM 465 NH1 ARG A 28 -2.951 -15.621 1.889 1.00 15.52 N ATOM 466 NH2 ARG A 28 -3.498 -15.220 -0.240 1.00 21.43 N ATOM 0 H ARG A 28 2.950 -11.750 4.046 1.00 12.44 H new ATOM 0 HA ARG A 28 2.988 -12.453 1.214 1.00 13.54 H new ATOM 0 HB2 ARG A 28 1.486 -13.521 2.923 1.00 74.22 H new ATOM 0 HB3 ARG A 28 0.723 -11.968 3.196 1.00 74.22 H new ATOM 0 HG2 ARG A 28 -0.094 -11.925 0.873 1.00 15.42 H new ATOM 0 HG3 ARG A 28 0.737 -13.429 0.529 1.00 15.42 H new ATOM 0 HD2 ARG A 28 -0.639 -14.548 2.327 1.00 4.23 H new ATOM 0 HD3 ARG A 28 -1.519 -13.048 2.543 1.00 4.23 H new ATOM 0 HE ARG A 28 -1.784 -13.504 -0.156 1.00 62.02 H new ATOM 0 HH11 ARG A 28 -2.381 -15.416 2.710 1.00 15.52 H new ATOM 0 HH12 ARG A 28 -3.661 -16.352 1.931 1.00 15.52 H new ATOM 0 HH21 ARG A 28 -3.363 -14.699 -1.106 1.00 21.43 H new ATOM 0 HH22 ARG A 28 -4.206 -15.953 -0.191 1.00 21.43 H new ATOM 480 N VAL A 29 2.114 -10.407 0.070 1.00 21.33 N ATOM 481 CA VAL A 29 1.870 -9.132 -0.621 1.00 25.43 C ATOM 482 C VAL A 29 0.439 -9.041 -1.181 1.00 65.02 C ATOM 483 O VAL A 29 -0.079 -10.001 -1.759 1.00 52.22 O ATOM 484 CB VAL A 29 2.862 -8.930 -1.794 1.00 64.45 C ATOM 485 CG1 VAL A 29 2.754 -7.514 -2.362 1.00 21.33 C ATOM 486 CG2 VAL A 29 4.292 -9.240 -1.367 1.00 42.41 C ATOM 0 H VAL A 29 2.227 -11.207 -0.553 1.00 21.33 H new ATOM 0 HA VAL A 29 2.012 -8.353 0.128 1.00 25.43 H new ATOM 0 HB VAL A 29 2.593 -9.632 -2.583 1.00 64.45 H new ATOM 0 HG11 VAL A 29 3.460 -7.397 -3.184 1.00 21.33 H new ATOM 0 HG12 VAL A 29 1.741 -7.345 -2.727 1.00 21.33 H new ATOM 0 HG13 VAL A 29 2.984 -6.790 -1.580 1.00 21.33 H new ATOM 0 HG21 VAL A 29 4.965 -9.089 -2.211 1.00 42.41 H new ATOM 0 HG22 VAL A 29 4.580 -8.577 -0.551 1.00 42.41 H new ATOM 0 HG23 VAL A 29 4.356 -10.276 -1.033 1.00 42.41 H new ATOM 496 N VAL A 30 -0.191 -7.876 -1.014 1.00 13.41 N ATOM 497 CA VAL A 30 -1.513 -7.602 -1.596 1.00 53.22 C ATOM 498 C VAL A 30 -1.486 -6.284 -2.392 1.00 41.22 C ATOM 499 O VAL A 30 -1.455 -5.196 -1.818 1.00 32.02 O ATOM 500 CB VAL A 30 -2.613 -7.526 -0.502 1.00 30.15 C ATOM 501 CG1 VAL A 30 -3.988 -7.272 -1.123 1.00 43.42 C ATOM 502 CG2 VAL A 30 -2.629 -8.802 0.341 1.00 44.25 C ATOM 0 H VAL A 30 0.194 -7.100 -0.476 1.00 13.41 H new ATOM 0 HA VAL A 30 -1.753 -8.428 -2.266 1.00 53.22 H new ATOM 0 HB VAL A 30 -2.378 -6.687 0.152 1.00 30.15 H new ATOM 0 HG11 VAL A 30 -4.740 -7.223 -0.335 1.00 43.42 H new ATOM 0 HG12 VAL A 30 -3.972 -6.328 -1.668 1.00 43.42 H new ATOM 0 HG13 VAL A 30 -4.233 -8.083 -1.809 1.00 43.42 H new ATOM 0 HG21 VAL A 30 -3.407 -8.726 1.101 1.00 44.25 H new ATOM 0 HG22 VAL A 30 -2.831 -9.660 -0.301 1.00 44.25 H new ATOM 0 HG23 VAL A 30 -1.661 -8.931 0.825 1.00 44.25 H new ATOM 512 N LEU A 31 -1.487 -6.384 -3.718 1.00 43.33 N ATOM 513 CA LEU A 31 -1.360 -5.204 -4.586 1.00 63.52 C ATOM 514 C LEU A 31 -2.725 -4.666 -5.048 1.00 74.31 C ATOM 515 O LEU A 31 -3.457 -5.342 -5.761 1.00 32.40 O ATOM 516 CB LEU A 31 -0.496 -5.549 -5.813 1.00 14.04 C ATOM 517 CG LEU A 31 -0.359 -4.434 -6.866 1.00 53.30 C ATOM 518 CD1 LEU A 31 0.289 -3.189 -6.266 1.00 43.15 C ATOM 519 CD2 LEU A 31 0.435 -4.930 -8.073 1.00 33.43 C ATOM 0 H LEU A 31 -1.574 -7.267 -4.221 1.00 43.33 H new ATOM 0 HA LEU A 31 -0.882 -4.420 -3.999 1.00 63.52 H new ATOM 0 HB2 LEU A 31 0.501 -5.822 -5.467 1.00 14.04 H new ATOM 0 HB3 LEU A 31 -0.918 -6.430 -6.296 1.00 14.04 H new ATOM 0 HG LEU A 31 -1.360 -4.161 -7.201 1.00 53.30 H new ATOM 0 HD11 LEU A 31 0.373 -2.418 -7.032 1.00 43.15 H new ATOM 0 HD12 LEU A 31 -0.325 -2.819 -5.445 1.00 43.15 H new ATOM 0 HD13 LEU A 31 1.282 -3.440 -5.893 1.00 43.15 H new ATOM 0 HD21 LEU A 31 0.521 -4.128 -8.806 1.00 33.43 H new ATOM 0 HD22 LEU A 31 1.430 -5.237 -7.752 1.00 33.43 H new ATOM 0 HD23 LEU A 31 -0.079 -5.779 -8.523 1.00 33.43 H new ATOM 531 N LEU A 32 -3.060 -3.445 -4.643 1.00 34.31 N ATOM 532 CA LEU A 32 -4.264 -2.770 -5.138 1.00 23.42 C ATOM 533 C LEU A 32 -3.901 -1.903 -6.351 1.00 63.13 C ATOM 534 O LEU A 32 -3.473 -0.755 -6.208 1.00 2.32 O ATOM 535 CB LEU A 32 -4.899 -1.905 -4.037 1.00 3.42 C ATOM 536 CG LEU A 32 -5.351 -2.661 -2.773 1.00 12.15 C ATOM 537 CD1 LEU A 32 -5.977 -1.705 -1.761 1.00 4.32 C ATOM 538 CD2 LEU A 32 -6.329 -3.777 -3.131 1.00 22.12 C ATOM 0 H LEU A 32 -2.517 -2.899 -3.973 1.00 34.31 H new ATOM 0 HA LEU A 32 -4.993 -3.524 -5.436 1.00 23.42 H new ATOM 0 HB2 LEU A 32 -4.182 -1.139 -3.743 1.00 3.42 H new ATOM 0 HB3 LEU A 32 -5.762 -1.389 -4.458 1.00 3.42 H new ATOM 0 HG LEU A 32 -4.469 -3.110 -2.317 1.00 12.15 H new ATOM 0 HD11 LEU A 32 -6.288 -2.263 -0.878 1.00 4.32 H new ATOM 0 HD12 LEU A 32 -5.246 -0.949 -1.474 1.00 4.32 H new ATOM 0 HD13 LEU A 32 -6.845 -1.220 -2.208 1.00 4.32 H new ATOM 0 HD21 LEU A 32 -6.635 -4.298 -2.224 1.00 22.12 H new ATOM 0 HD22 LEU A 32 -7.206 -3.350 -3.618 1.00 22.12 H new ATOM 0 HD23 LEU A 32 -5.845 -4.481 -3.808 1.00 22.12 H new ATOM 550 N TYR A 33 -4.059 -2.465 -7.544 1.00 12.53 N ATOM 551 CA TYR A 33 -3.569 -1.827 -8.767 1.00 64.43 C ATOM 552 C TYR A 33 -4.655 -0.965 -9.442 1.00 24.25 C ATOM 553 O TYR A 33 -5.716 -1.461 -9.835 1.00 45.34 O ATOM 554 CB TYR A 33 -3.049 -2.898 -9.739 1.00 44.02 C ATOM 555 CG TYR A 33 -2.064 -2.354 -10.754 1.00 42.33 C ATOM 556 CD1 TYR A 33 -0.700 -2.329 -10.480 1.00 13.52 C ATOM 557 CD2 TYR A 33 -2.495 -1.857 -11.975 1.00 24.40 C ATOM 558 CE1 TYR A 33 0.201 -1.815 -11.393 1.00 12.24 C ATOM 559 CE2 TYR A 33 -1.601 -1.346 -12.895 1.00 62.33 C ATOM 560 CZ TYR A 33 -0.255 -1.327 -12.600 1.00 5.42 C ATOM 561 OH TYR A 33 0.636 -0.807 -13.510 1.00 21.12 O ATOM 0 H TYR A 33 -4.522 -3.361 -7.694 1.00 12.53 H new ATOM 0 HA TYR A 33 -2.753 -1.159 -8.494 1.00 64.43 H new ATOM 0 HB2 TYR A 33 -2.571 -3.695 -9.170 1.00 44.02 H new ATOM 0 HB3 TYR A 33 -3.894 -3.344 -10.264 1.00 44.02 H new ATOM 0 HD1 TYR A 33 -0.340 -2.717 -9.539 1.00 13.52 H new ATOM 0 HD2 TYR A 33 -3.549 -1.870 -12.210 1.00 24.40 H new ATOM 0 HE1 TYR A 33 1.256 -1.795 -11.163 1.00 12.24 H new ATOM 0 HE2 TYR A 33 -1.955 -0.963 -13.841 1.00 62.33 H new ATOM 0 HH TYR A 33 0.152 -0.508 -14.308 1.00 21.12 H new ATOM 571 N SER A 34 -4.368 0.329 -9.576 1.00 1.24 N ATOM 572 CA SER A 34 -5.299 1.288 -10.191 1.00 20.31 C ATOM 573 C SER A 34 -4.762 1.802 -11.538 1.00 31.51 C ATOM 574 O SER A 34 -3.829 2.609 -11.579 1.00 22.52 O ATOM 575 CB SER A 34 -5.534 2.474 -9.242 1.00 1.11 C ATOM 576 OG SER A 34 -4.311 3.118 -8.908 1.00 51.43 O ATOM 0 H SER A 34 -3.490 0.745 -9.265 1.00 1.24 H new ATOM 0 HA SER A 34 -6.242 0.772 -10.373 1.00 20.31 H new ATOM 0 HB2 SER A 34 -6.208 3.190 -9.711 1.00 1.11 H new ATOM 0 HB3 SER A 34 -6.023 2.124 -8.333 1.00 1.11 H new ATOM 0 HG SER A 34 -3.798 3.290 -9.725 1.00 51.43 H new ATOM 582 N ASP A 35 -5.358 1.324 -12.632 1.00 65.34 N ATOM 583 CA ASP A 35 -4.947 1.715 -13.990 1.00 31.33 C ATOM 584 C ASP A 35 -6.171 2.052 -14.864 1.00 24.34 C ATOM 585 O ASP A 35 -7.303 1.698 -14.525 1.00 23.14 O ATOM 586 CB ASP A 35 -4.123 0.587 -14.628 1.00 71.32 C ATOM 587 CG ASP A 35 -3.579 0.948 -16.002 1.00 44.42 C ATOM 588 OD1 ASP A 35 -2.463 1.493 -16.079 1.00 11.05 O ATOM 589 OD2 ASP A 35 -4.277 0.700 -17.007 1.00 44.12 O ATOM 0 H ASP A 35 -6.133 0.661 -12.607 1.00 65.34 H new ATOM 0 HA ASP A 35 -4.331 2.612 -13.921 1.00 31.33 H new ATOM 0 HB2 ASP A 35 -3.292 0.335 -13.969 1.00 71.32 H new ATOM 0 HB3 ASP A 35 -4.744 -0.305 -14.713 1.00 71.32 H new ATOM 594 N GLN A 36 -5.931 2.712 -15.999 1.00 34.52 N ATOM 595 CA GLN A 36 -7.006 3.182 -16.889 1.00 43.15 C ATOM 596 C GLN A 36 -7.781 2.022 -17.541 1.00 3.21 C ATOM 597 O GLN A 36 -9.007 1.944 -17.433 1.00 31.14 O ATOM 598 CB GLN A 36 -6.445 4.084 -18.003 1.00 4.14 C ATOM 599 CG GLN A 36 -5.673 5.314 -17.521 1.00 45.12 C ATOM 600 CD GLN A 36 -4.282 4.984 -17.006 1.00 10.05 C ATOM 601 OE1 GLN A 36 -4.076 4.759 -15.818 1.00 53.25 O ATOM 602 NE2 GLN A 36 -3.317 4.930 -17.900 1.00 51.45 N ATOM 0 H GLN A 36 -4.993 2.937 -16.330 1.00 34.52 H new ATOM 0 HA GLN A 36 -7.693 3.747 -16.259 1.00 43.15 H new ATOM 0 HB2 GLN A 36 -5.787 3.487 -18.635 1.00 4.14 H new ATOM 0 HB3 GLN A 36 -7.272 4.417 -18.629 1.00 4.14 H new ATOM 0 HG2 GLN A 36 -5.590 6.027 -18.341 1.00 45.12 H new ATOM 0 HG3 GLN A 36 -6.240 5.803 -16.729 1.00 45.12 H new ATOM 0 HE21 GLN A 36 -3.519 5.122 -18.881 1.00 51.45 H new ATOM 0 HE22 GLN A 36 -2.367 4.696 -17.612 1.00 51.45 H new ATOM 611 N ASP A 37 -7.062 1.132 -18.226 1.00 62.01 N ATOM 612 CA ASP A 37 -7.696 0.060 -19.011 1.00 64.14 C ATOM 613 C ASP A 37 -7.515 -1.315 -18.353 1.00 63.32 C ATOM 614 O ASP A 37 -6.464 -1.606 -17.795 1.00 73.14 O ATOM 615 CB ASP A 37 -7.112 0.035 -20.428 1.00 35.32 C ATOM 616 CG ASP A 37 -7.691 -1.093 -21.268 1.00 14.21 C ATOM 617 OD1 ASP A 37 -8.837 -0.954 -21.742 1.00 50.20 O ATOM 618 OD2 ASP A 37 -7.014 -2.130 -21.442 1.00 45.13 O ATOM 0 H ASP A 37 -6.042 1.128 -18.256 1.00 62.01 H new ATOM 0 HA ASP A 37 -8.764 0.271 -19.054 1.00 64.14 H new ATOM 0 HB2 ASP A 37 -7.310 0.989 -20.918 1.00 35.32 H new ATOM 0 HB3 ASP A 37 -6.029 -0.076 -20.371 1.00 35.32 H new ATOM 623 N GLU A 38 -8.539 -2.163 -18.450 1.00 72.24 N ATOM 624 CA GLU A 38 -8.514 -3.504 -17.878 1.00 53.14 C ATOM 625 C GLU A 38 -7.311 -4.343 -18.352 1.00 41.33 C ATOM 626 O GLU A 38 -6.586 -4.925 -17.541 1.00 14.22 O ATOM 627 CB GLU A 38 -9.818 -4.218 -18.239 1.00 24.42 C ATOM 628 CG GLU A 38 -10.190 -4.166 -19.724 1.00 53.24 C ATOM 629 CD GLU A 38 -11.415 -5.008 -20.050 1.00 23.52 C ATOM 630 OE1 GLU A 38 -12.550 -4.521 -19.871 1.00 35.51 O ATOM 631 OE2 GLU A 38 -11.249 -6.174 -20.462 1.00 2.00 O ATOM 0 H GLU A 38 -9.410 -1.936 -18.929 1.00 72.24 H new ATOM 0 HA GLU A 38 -8.411 -3.399 -16.798 1.00 53.14 H new ATOM 0 HB2 GLU A 38 -9.740 -5.262 -17.935 1.00 24.42 H new ATOM 0 HB3 GLU A 38 -10.629 -3.777 -17.660 1.00 24.42 H new ATOM 0 HG2 GLU A 38 -10.378 -3.132 -20.012 1.00 53.24 H new ATOM 0 HG3 GLU A 38 -9.346 -4.514 -20.319 1.00 53.24 H new ATOM 638 N LYS A 39 -7.109 -4.407 -19.665 1.00 41.02 N ATOM 639 CA LYS A 39 -6.049 -5.236 -20.248 1.00 13.24 C ATOM 640 C LYS A 39 -4.659 -4.662 -19.960 1.00 51.23 C ATOM 641 O LYS A 39 -3.772 -5.382 -19.508 1.00 42.20 O ATOM 642 CB LYS A 39 -6.258 -5.390 -21.757 1.00 34.43 C ATOM 643 CG LYS A 39 -7.583 -6.054 -22.117 1.00 30.11 C ATOM 644 CD LYS A 39 -7.677 -7.484 -21.586 1.00 72.42 C ATOM 645 CE LYS A 39 -9.042 -8.098 -21.883 1.00 60.04 C ATOM 646 NZ LYS A 39 -9.355 -8.096 -23.339 1.00 12.03 N ATOM 0 H LYS A 39 -7.665 -3.895 -20.350 1.00 41.02 H new ATOM 0 HA LYS A 39 -6.106 -6.219 -19.780 1.00 13.24 H new ATOM 0 HB2 LYS A 39 -6.213 -4.407 -22.225 1.00 34.43 H new ATOM 0 HB3 LYS A 39 -5.440 -5.979 -22.172 1.00 34.43 H new ATOM 0 HG2 LYS A 39 -8.405 -5.463 -21.712 1.00 30.11 H new ATOM 0 HG3 LYS A 39 -7.700 -6.063 -23.201 1.00 30.11 H new ATOM 0 HD2 LYS A 39 -6.895 -8.094 -22.039 1.00 72.42 H new ATOM 0 HD3 LYS A 39 -7.501 -7.487 -20.510 1.00 72.42 H new ATOM 0 HE2 LYS A 39 -9.067 -9.122 -21.509 1.00 60.04 H new ATOM 0 HE3 LYS A 39 -9.812 -7.544 -21.347 1.00 60.04 H new ATOM 0 HZ1 LYS A 39 -10.196 -8.683 -23.514 1.00 12.03 H new ATOM 0 HZ2 LYS A 39 -9.541 -7.122 -23.653 1.00 12.03 H new ATOM 0 HZ3 LYS A 39 -8.547 -8.482 -23.868 1.00 12.03 H new ATOM 660 N ARG A 40 -4.472 -3.366 -20.214 1.00 53.42 N ATOM 661 CA ARG A 40 -3.199 -2.698 -19.903 1.00 52.43 C ATOM 662 C ARG A 40 -2.872 -2.841 -18.411 1.00 72.13 C ATOM 663 O ARG A 40 -1.744 -3.162 -18.036 1.00 42.12 O ATOM 664 CB ARG A 40 -3.249 -1.215 -20.317 1.00 31.33 C ATOM 665 CG ARG A 40 -2.948 -0.983 -21.799 1.00 22.41 C ATOM 666 CD ARG A 40 -3.903 -1.747 -22.713 1.00 64.14 C ATOM 667 NE ARG A 40 -3.367 -1.878 -24.066 1.00 23.54 N ATOM 668 CZ ARG A 40 -3.185 -3.022 -24.670 1.00 31.25 C ATOM 669 NH1 ARG A 40 -3.525 -4.131 -24.092 1.00 61.02 N ATOM 670 NH2 ARG A 40 -2.657 -3.055 -25.849 1.00 62.40 N ATOM 0 H ARG A 40 -5.177 -2.758 -20.631 1.00 53.42 H new ATOM 0 HA ARG A 40 -2.405 -3.180 -20.474 1.00 52.43 H new ATOM 0 HB2 ARG A 40 -4.237 -0.816 -20.089 1.00 31.33 H new ATOM 0 HB3 ARG A 40 -2.532 -0.654 -19.717 1.00 31.33 H new ATOM 0 HG2 ARG A 40 -3.014 0.083 -22.018 1.00 22.41 H new ATOM 0 HG3 ARG A 40 -1.924 -1.289 -22.011 1.00 22.41 H new ATOM 0 HD2 ARG A 40 -4.090 -2.737 -22.298 1.00 64.14 H new ATOM 0 HD3 ARG A 40 -4.862 -1.231 -22.750 1.00 64.14 H new ATOM 0 HE ARG A 40 -3.120 -1.026 -24.569 1.00 23.54 H new ATOM 0 HH11 ARG A 40 -3.938 -4.114 -23.159 1.00 61.02 H new ATOM 0 HH12 ARG A 40 -3.380 -5.020 -24.570 1.00 61.02 H new ATOM 0 HH21 ARG A 40 -2.382 -2.187 -26.309 1.00 62.40 H new ATOM 0 HH22 ARG A 40 -2.515 -3.949 -26.320 1.00 62.40 H new ATOM 684 N ARG A 41 -3.882 -2.623 -17.578 1.00 53.54 N ATOM 685 CA ARG A 41 -3.795 -2.881 -16.140 1.00 5.44 C ATOM 686 C ARG A 41 -3.291 -4.306 -15.868 1.00 45.40 C ATOM 687 O ARG A 41 -2.342 -4.512 -15.103 1.00 4.12 O ATOM 688 CB ARG A 41 -5.186 -2.696 -15.516 1.00 11.23 C ATOM 689 CG ARG A 41 -5.234 -2.837 -14.004 1.00 42.43 C ATOM 690 CD ARG A 41 -6.666 -2.776 -13.485 1.00 55.34 C ATOM 691 NE ARG A 41 -7.335 -1.525 -13.833 1.00 50.24 N ATOM 692 CZ ARG A 41 -8.619 -1.330 -13.712 1.00 3.31 C ATOM 693 NH1 ARG A 41 -9.406 -2.297 -13.376 1.00 52.44 N ATOM 694 NH2 ARG A 41 -9.128 -0.174 -13.967 1.00 54.42 N ATOM 0 H ARG A 41 -4.788 -2.262 -17.878 1.00 53.54 H new ATOM 0 HA ARG A 41 -3.088 -2.180 -15.697 1.00 5.44 H new ATOM 0 HB2 ARG A 41 -5.561 -1.709 -15.786 1.00 11.23 H new ATOM 0 HB3 ARG A 41 -5.865 -3.426 -15.956 1.00 11.23 H new ATOM 0 HG2 ARG A 41 -4.779 -3.783 -13.711 1.00 42.43 H new ATOM 0 HG3 ARG A 41 -4.645 -2.044 -13.544 1.00 42.43 H new ATOM 0 HD2 ARG A 41 -7.233 -3.613 -13.893 1.00 55.34 H new ATOM 0 HD3 ARG A 41 -6.661 -2.892 -12.401 1.00 55.34 H new ATOM 0 HE ARG A 41 -6.765 -0.759 -14.192 1.00 50.24 H new ATOM 0 HH11 ARG A 41 -9.025 -3.227 -13.202 1.00 52.44 H new ATOM 0 HH12 ARG A 41 -10.408 -2.131 -13.285 1.00 52.44 H new ATOM 0 HH21 ARG A 41 -8.526 0.594 -14.265 1.00 54.42 H new ATOM 0 HH22 ARG A 41 -10.133 -0.027 -13.871 1.00 54.42 H new ATOM 708 N ARG A 42 -3.927 -5.280 -16.519 1.00 71.20 N ATOM 709 CA ARG A 42 -3.593 -6.694 -16.336 1.00 51.42 C ATOM 710 C ARG A 42 -2.140 -7.000 -16.739 1.00 52.30 C ATOM 711 O ARG A 42 -1.414 -7.660 -16.001 1.00 24.55 O ATOM 712 CB ARG A 42 -4.552 -7.578 -17.146 1.00 4.54 C ATOM 713 CG ARG A 42 -4.343 -9.070 -16.910 1.00 32.21 C ATOM 714 CD ARG A 42 -4.656 -9.464 -15.471 1.00 2.12 C ATOM 715 NE ARG A 42 -4.224 -10.822 -15.166 1.00 75.45 N ATOM 716 CZ ARG A 42 -4.997 -11.871 -15.193 1.00 71.31 C ATOM 717 NH1 ARG A 42 -6.246 -11.762 -15.515 1.00 12.52 N ATOM 718 NH2 ARG A 42 -4.513 -13.024 -14.876 1.00 35.13 N ATOM 0 H ARG A 42 -4.683 -5.114 -17.183 1.00 71.20 H new ATOM 0 HA ARG A 42 -3.699 -6.916 -15.274 1.00 51.42 H new ATOM 0 HB2 ARG A 42 -5.579 -7.317 -16.890 1.00 4.54 H new ATOM 0 HB3 ARG A 42 -4.424 -7.364 -18.207 1.00 4.54 H new ATOM 0 HG2 ARG A 42 -4.979 -9.638 -17.589 1.00 32.21 H new ATOM 0 HG3 ARG A 42 -3.311 -9.334 -17.143 1.00 32.21 H new ATOM 0 HD2 ARG A 42 -4.166 -8.767 -14.791 1.00 2.12 H new ATOM 0 HD3 ARG A 42 -5.729 -9.378 -15.298 1.00 2.12 H new ATOM 0 HE ARG A 42 -3.246 -10.962 -14.913 1.00 75.45 H new ATOM 0 HH11 ARG A 42 -6.634 -10.849 -15.751 1.00 12.52 H new ATOM 0 HH12 ARG A 42 -6.842 -12.589 -15.533 1.00 12.52 H new ATOM 0 HH21 ARG A 42 -3.533 -13.109 -14.607 1.00 35.13 H new ATOM 0 HH22 ARG A 42 -5.111 -13.850 -14.894 1.00 35.13 H new ATOM 732 N GLU A 43 -1.727 -6.509 -17.907 1.00 64.44 N ATOM 733 CA GLU A 43 -0.371 -6.753 -18.423 1.00 45.33 C ATOM 734 C GLU A 43 0.705 -6.251 -17.444 1.00 4.43 C ATOM 735 O GLU A 43 1.764 -6.865 -17.298 1.00 20.32 O ATOM 736 CB GLU A 43 -0.195 -6.073 -19.792 1.00 53.33 C ATOM 737 CG GLU A 43 -1.221 -6.517 -20.835 1.00 54.05 C ATOM 738 CD GLU A 43 -1.049 -5.819 -22.178 1.00 44.31 C ATOM 739 OE1 GLU A 43 -1.047 -4.570 -22.213 1.00 63.42 O ATOM 740 OE2 GLU A 43 -0.928 -6.519 -23.208 1.00 3.02 O ATOM 0 H GLU A 43 -2.310 -5.938 -18.519 1.00 64.44 H new ATOM 0 HA GLU A 43 -0.246 -7.830 -18.535 1.00 45.33 H new ATOM 0 HB2 GLU A 43 -0.265 -4.993 -19.663 1.00 53.33 H new ATOM 0 HB3 GLU A 43 0.806 -6.285 -20.167 1.00 53.33 H new ATOM 0 HG2 GLU A 43 -1.140 -7.594 -20.979 1.00 54.05 H new ATOM 0 HG3 GLU A 43 -2.224 -6.320 -20.456 1.00 54.05 H new ATOM 747 N ARG A 44 0.425 -5.137 -16.777 1.00 11.25 N ATOM 748 CA ARG A 44 1.363 -4.552 -15.812 1.00 10.00 C ATOM 749 C ARG A 44 1.420 -5.369 -14.508 1.00 23.42 C ATOM 750 O ARG A 44 2.496 -5.752 -14.046 1.00 32.33 O ATOM 751 CB ARG A 44 0.958 -3.104 -15.514 1.00 75.03 C ATOM 752 CG ARG A 44 0.864 -2.227 -16.762 1.00 21.15 C ATOM 753 CD ARG A 44 2.197 -2.122 -17.497 1.00 64.03 C ATOM 754 NE ARG A 44 2.039 -1.570 -18.845 1.00 3.02 N ATOM 755 CZ ARG A 44 2.797 -0.639 -19.358 1.00 13.45 C ATOM 756 NH1 ARG A 44 3.687 -0.041 -18.639 1.00 13.33 N ATOM 757 NH2 ARG A 44 2.638 -0.280 -20.591 1.00 74.23 N ATOM 0 H ARG A 44 -0.445 -4.616 -16.884 1.00 11.25 H new ATOM 0 HA ARG A 44 2.360 -4.570 -16.253 1.00 10.00 H new ATOM 0 HB2 ARG A 44 -0.006 -3.102 -15.005 1.00 75.03 H new ATOM 0 HB3 ARG A 44 1.682 -2.667 -14.826 1.00 75.03 H new ATOM 0 HG2 ARG A 44 0.111 -2.637 -17.436 1.00 21.15 H new ATOM 0 HG3 ARG A 44 0.528 -1.230 -16.478 1.00 21.15 H new ATOM 0 HD2 ARG A 44 2.878 -1.492 -16.925 1.00 64.03 H new ATOM 0 HD3 ARG A 44 2.654 -3.109 -17.561 1.00 64.03 H new ATOM 0 HE ARG A 44 1.284 -1.939 -19.423 1.00 3.02 H new ATOM 0 HH11 ARG A 44 3.804 -0.294 -17.658 1.00 13.33 H new ATOM 0 HH12 ARG A 44 4.273 0.685 -19.052 1.00 13.33 H new ATOM 0 HH21 ARG A 44 1.920 -0.724 -21.163 1.00 74.23 H new ATOM 0 HH22 ARG A 44 3.231 0.447 -20.991 1.00 74.23 H new ATOM 771 N LEU A 45 0.250 -5.637 -13.925 1.00 44.53 N ATOM 772 CA LEU A 45 0.157 -6.418 -12.683 1.00 23.23 C ATOM 773 C LEU A 45 0.541 -7.893 -12.898 1.00 22.15 C ATOM 774 O LEU A 45 0.880 -8.598 -11.944 1.00 24.41 O ATOM 775 CB LEU A 45 -1.238 -6.269 -12.047 1.00 24.42 C ATOM 776 CG LEU A 45 -2.440 -6.810 -12.853 1.00 13.34 C ATOM 777 CD1 LEU A 45 -2.705 -8.283 -12.541 1.00 40.14 C ATOM 778 CD2 LEU A 45 -3.693 -5.978 -12.577 1.00 1.23 C ATOM 0 H LEU A 45 -0.650 -5.326 -14.291 1.00 44.53 H new ATOM 0 HA LEU A 45 0.885 -6.012 -11.981 1.00 23.23 H new ATOM 0 HB2 LEU A 45 -1.225 -6.773 -11.080 1.00 24.42 H new ATOM 0 HB3 LEU A 45 -1.410 -5.210 -11.853 1.00 24.42 H new ATOM 0 HG LEU A 45 -2.189 -6.729 -13.911 1.00 13.34 H new ATOM 0 HD11 LEU A 45 -3.557 -8.631 -13.125 1.00 40.14 H new ATOM 0 HD12 LEU A 45 -1.825 -8.873 -12.796 1.00 40.14 H new ATOM 0 HD13 LEU A 45 -2.923 -8.397 -11.479 1.00 40.14 H new ATOM 0 HD21 LEU A 45 -4.528 -6.375 -13.154 1.00 1.23 H new ATOM 0 HD22 LEU A 45 -3.932 -6.022 -11.515 1.00 1.23 H new ATOM 0 HD23 LEU A 45 -3.513 -4.942 -12.865 1.00 1.23 H new ATOM 790 N GLU A 46 0.463 -8.357 -14.148 1.00 2.23 N ATOM 791 CA GLU A 46 0.916 -9.709 -14.512 1.00 14.33 C ATOM 792 C GLU A 46 2.309 -10.007 -13.935 1.00 4.33 C ATOM 793 O GLU A 46 2.566 -11.108 -13.439 1.00 52.13 O ATOM 794 CB GLU A 46 0.944 -9.874 -16.038 1.00 20.31 C ATOM 795 CG GLU A 46 1.427 -11.247 -16.496 1.00 1.54 C ATOM 796 CD GLU A 46 1.418 -11.402 -18.007 1.00 21.11 C ATOM 797 OE1 GLU A 46 0.316 -11.470 -18.598 1.00 23.53 O ATOM 798 OE2 GLU A 46 2.511 -11.483 -18.613 1.00 45.22 O ATOM 0 H GLU A 46 0.090 -7.817 -14.929 1.00 2.23 H new ATOM 0 HA GLU A 46 0.207 -10.419 -14.085 1.00 14.33 H new ATOM 0 HB2 GLU A 46 -0.057 -9.700 -16.432 1.00 20.31 H new ATOM 0 HB3 GLU A 46 1.592 -9.109 -16.466 1.00 20.31 H new ATOM 0 HG2 GLU A 46 2.438 -11.414 -16.125 1.00 1.54 H new ATOM 0 HG3 GLU A 46 0.794 -12.016 -16.053 1.00 1.54 H new ATOM 805 N GLU A 47 3.195 -9.009 -13.986 1.00 52.33 N ATOM 806 CA GLU A 47 4.537 -9.113 -13.394 1.00 14.12 C ATOM 807 C GLU A 47 4.483 -9.586 -11.933 1.00 62.04 C ATOM 808 O GLU A 47 5.377 -10.282 -11.463 1.00 14.03 O ATOM 809 CB GLU A 47 5.259 -7.756 -13.480 1.00 44.15 C ATOM 810 CG GLU A 47 5.949 -7.497 -14.817 1.00 55.13 C ATOM 811 CD GLU A 47 7.265 -8.255 -14.952 1.00 53.24 C ATOM 812 OE1 GLU A 47 7.260 -9.409 -15.431 1.00 2.22 O ATOM 813 OE2 GLU A 47 8.318 -7.692 -14.576 1.00 34.21 O ATOM 0 H GLU A 47 3.008 -8.112 -14.434 1.00 52.33 H new ATOM 0 HA GLU A 47 5.091 -9.859 -13.964 1.00 14.12 H new ATOM 0 HB2 GLU A 47 4.537 -6.961 -13.297 1.00 44.15 H new ATOM 0 HB3 GLU A 47 6.002 -7.701 -12.684 1.00 44.15 H new ATOM 0 HG2 GLU A 47 5.282 -7.787 -15.629 1.00 55.13 H new ATOM 0 HG3 GLU A 47 6.136 -6.429 -14.924 1.00 55.13 H new ATOM 820 N PHE A 48 3.433 -9.201 -11.221 1.00 42.22 N ATOM 821 CA PHE A 48 3.265 -9.577 -9.814 1.00 24.31 C ATOM 822 C PHE A 48 2.573 -10.937 -9.661 1.00 43.13 C ATOM 823 O PHE A 48 2.820 -11.661 -8.696 1.00 14.44 O ATOM 824 CB PHE A 48 2.499 -8.474 -9.087 1.00 41.54 C ATOM 825 CG PHE A 48 3.235 -7.166 -9.155 1.00 25.34 C ATOM 826 CD1 PHE A 48 4.172 -6.839 -8.192 1.00 4.31 C ATOM 827 CD2 PHE A 48 3.025 -6.285 -10.206 1.00 2.31 C ATOM 828 CE1 PHE A 48 4.889 -5.665 -8.274 1.00 61.05 C ATOM 829 CE2 PHE A 48 3.734 -5.101 -10.288 1.00 53.44 C ATOM 830 CZ PHE A 48 4.670 -4.794 -9.322 1.00 2.24 C ATOM 0 H PHE A 48 2.678 -8.625 -11.593 1.00 42.22 H new ATOM 0 HA PHE A 48 4.251 -9.685 -9.362 1.00 24.31 H new ATOM 0 HB2 PHE A 48 1.510 -8.361 -9.531 1.00 41.54 H new ATOM 0 HB3 PHE A 48 2.350 -8.757 -8.045 1.00 41.54 H new ATOM 0 HD1 PHE A 48 4.344 -7.512 -7.365 1.00 4.31 H new ATOM 0 HD2 PHE A 48 2.300 -6.527 -10.969 1.00 2.31 H new ATOM 0 HE1 PHE A 48 5.622 -5.426 -7.518 1.00 61.05 H new ATOM 0 HE2 PHE A 48 3.556 -4.418 -11.106 1.00 53.44 H new ATOM 0 HZ PHE A 48 5.231 -3.873 -9.386 1.00 2.24 H new ATOM 840 N GLU A 49 1.721 -11.290 -10.619 1.00 31.12 N ATOM 841 CA GLU A 49 1.089 -12.615 -10.628 1.00 51.52 C ATOM 842 C GLU A 49 2.159 -13.713 -10.742 1.00 63.41 C ATOM 843 O GLU A 49 2.158 -14.689 -9.989 1.00 73.34 O ATOM 844 CB GLU A 49 0.110 -12.744 -11.801 1.00 51.55 C ATOM 845 CG GLU A 49 -0.858 -11.577 -11.956 1.00 45.32 C ATOM 846 CD GLU A 49 -1.959 -11.885 -12.958 1.00 31.31 C ATOM 847 OE1 GLU A 49 -1.727 -11.728 -14.175 1.00 32.14 O ATOM 848 OE2 GLU A 49 -3.055 -12.305 -12.536 1.00 72.33 O ATOM 0 H GLU A 49 1.451 -10.686 -11.395 1.00 31.12 H new ATOM 0 HA GLU A 49 0.541 -12.732 -9.693 1.00 51.52 H new ATOM 0 HB2 GLU A 49 0.681 -12.849 -12.723 1.00 51.55 H new ATOM 0 HB3 GLU A 49 -0.466 -13.661 -11.677 1.00 51.55 H new ATOM 0 HG2 GLU A 49 -1.302 -11.343 -10.989 1.00 45.32 H new ATOM 0 HG3 GLU A 49 -0.311 -10.691 -12.278 1.00 45.32 H new ATOM 855 N LYS A 50 3.074 -13.528 -11.693 1.00 24.14 N ATOM 856 CA LYS A 50 4.196 -14.458 -11.904 1.00 45.03 C ATOM 857 C LYS A 50 5.206 -14.427 -10.735 1.00 52.21 C ATOM 858 O LYS A 50 6.069 -15.301 -10.627 1.00 64.12 O ATOM 859 CB LYS A 50 4.888 -14.147 -13.244 1.00 42.33 C ATOM 860 CG LYS A 50 5.247 -12.673 -13.425 1.00 62.03 C ATOM 861 CD LYS A 50 5.534 -12.325 -14.887 1.00 75.40 C ATOM 862 CE LYS A 50 6.897 -12.823 -15.342 1.00 23.21 C ATOM 863 NZ LYS A 50 8.006 -12.063 -14.708 1.00 63.03 N ATOM 0 H LYS A 50 3.064 -12.737 -12.337 1.00 24.14 H new ATOM 0 HA LYS A 50 3.792 -15.470 -11.939 1.00 45.03 H new ATOM 0 HB2 LYS A 50 5.796 -14.745 -13.320 1.00 42.33 H new ATOM 0 HB3 LYS A 50 4.234 -14.455 -14.060 1.00 42.33 H new ATOM 0 HG2 LYS A 50 4.428 -12.054 -13.060 1.00 62.03 H new ATOM 0 HG3 LYS A 50 6.121 -12.436 -12.818 1.00 62.03 H new ATOM 0 HD2 LYS A 50 4.761 -12.760 -15.520 1.00 75.40 H new ATOM 0 HD3 LYS A 50 5.482 -11.244 -15.018 1.00 75.40 H new ATOM 0 HE2 LYS A 50 6.997 -13.881 -15.099 1.00 23.21 H new ATOM 0 HE3 LYS A 50 6.971 -12.737 -16.426 1.00 23.21 H new ATOM 0 HZ1 LYS A 50 8.903 -12.301 -15.177 1.00 63.03 H new ATOM 0 HZ2 LYS A 50 7.826 -11.043 -14.802 1.00 63.03 H new ATOM 0 HZ3 LYS A 50 8.066 -12.312 -13.700 1.00 63.03 H new ATOM 877 N GLN A 51 5.108 -13.409 -9.880 1.00 30.41 N ATOM 878 CA GLN A 51 5.901 -13.349 -8.639 1.00 21.44 C ATOM 879 C GLN A 51 5.175 -14.047 -7.471 1.00 32.23 C ATOM 880 O GLN A 51 5.757 -14.266 -6.407 1.00 22.03 O ATOM 881 CB GLN A 51 6.200 -11.888 -8.258 1.00 34.33 C ATOM 882 CG GLN A 51 7.193 -11.191 -9.181 1.00 51.45 C ATOM 883 CD GLN A 51 7.426 -9.737 -8.799 1.00 71.13 C ATOM 884 OE1 GLN A 51 8.296 -9.420 -7.997 1.00 5.42 O ATOM 885 NE2 GLN A 51 6.650 -8.839 -9.368 1.00 51.41 N ATOM 0 H GLN A 51 4.488 -12.611 -10.019 1.00 30.41 H new ATOM 0 HA GLN A 51 6.838 -13.873 -8.826 1.00 21.44 H new ATOM 0 HB2 GLN A 51 5.266 -11.326 -8.257 1.00 34.33 H new ATOM 0 HB3 GLN A 51 6.588 -11.862 -7.240 1.00 34.33 H new ATOM 0 HG2 GLN A 51 8.143 -11.726 -9.157 1.00 51.45 H new ATOM 0 HG3 GLN A 51 6.826 -11.239 -10.206 1.00 51.45 H new ATOM 0 HE21 GLN A 51 5.934 -9.132 -10.032 1.00 51.41 H new ATOM 0 HE22 GLN A 51 6.765 -7.850 -9.145 1.00 51.41 H new ATOM 894 N GLY A 52 3.903 -14.393 -7.677 1.00 12.02 N ATOM 895 CA GLY A 52 3.106 -15.019 -6.623 1.00 14.22 C ATOM 896 C GLY A 52 2.537 -14.007 -5.632 1.00 52.53 C ATOM 897 O GLY A 52 2.829 -14.061 -4.434 1.00 4.45 O ATOM 0 H GLY A 52 3.407 -14.251 -8.557 1.00 12.02 H new ATOM 0 HA2 GLY A 52 2.287 -15.577 -7.076 1.00 14.22 H new ATOM 0 HA3 GLY A 52 3.723 -15.739 -6.086 1.00 14.22 H new ATOM 901 N VAL A 53 1.731 -13.074 -6.137 1.00 54.41 N ATOM 902 CA VAL A 53 1.138 -12.011 -5.311 1.00 50.02 C ATOM 903 C VAL A 53 -0.387 -11.930 -5.497 1.00 33.15 C ATOM 904 O VAL A 53 -0.889 -12.059 -6.614 1.00 35.52 O ATOM 905 CB VAL A 53 1.755 -10.631 -5.673 1.00 32.31 C ATOM 906 CG1 VAL A 53 1.079 -9.497 -4.901 1.00 55.03 C ATOM 907 CG2 VAL A 53 3.262 -10.634 -5.423 1.00 22.52 C ATOM 0 H VAL A 53 1.469 -13.029 -7.122 1.00 54.41 H new ATOM 0 HA VAL A 53 1.355 -12.258 -4.272 1.00 50.02 H new ATOM 0 HB VAL A 53 1.581 -10.456 -6.735 1.00 32.31 H new ATOM 0 HG11 VAL A 53 1.535 -8.546 -5.178 1.00 55.03 H new ATOM 0 HG12 VAL A 53 0.017 -9.475 -5.143 1.00 55.03 H new ATOM 0 HG13 VAL A 53 1.203 -9.661 -3.831 1.00 55.03 H new ATOM 0 HG21 VAL A 53 3.676 -9.659 -5.682 1.00 22.52 H new ATOM 0 HG22 VAL A 53 3.456 -10.842 -4.371 1.00 22.52 H new ATOM 0 HG23 VAL A 53 3.731 -11.402 -6.037 1.00 22.52 H new ATOM 917 N ASP A 54 -1.121 -11.715 -4.399 1.00 32.33 N ATOM 918 CA ASP A 54 -2.568 -11.479 -4.470 1.00 35.44 C ATOM 919 C ASP A 54 -2.856 -10.067 -5.008 1.00 22.32 C ATOM 920 O ASP A 54 -2.882 -9.090 -4.253 1.00 13.13 O ATOM 921 CB ASP A 54 -3.215 -11.655 -3.090 1.00 23.30 C ATOM 922 CG ASP A 54 -3.084 -13.071 -2.562 1.00 12.34 C ATOM 923 OD1 ASP A 54 -2.004 -13.419 -2.041 1.00 62.21 O ATOM 924 OD2 ASP A 54 -4.066 -13.843 -2.651 1.00 31.14 O ATOM 0 H ASP A 54 -0.738 -11.700 -3.454 1.00 32.33 H new ATOM 0 HA ASP A 54 -2.998 -12.212 -5.152 1.00 35.44 H new ATOM 0 HB2 ASP A 54 -2.753 -10.964 -2.385 1.00 23.30 H new ATOM 0 HB3 ASP A 54 -4.270 -11.390 -3.151 1.00 23.30 H new ATOM 929 N VAL A 55 -3.041 -9.960 -6.319 1.00 11.02 N ATOM 930 CA VAL A 55 -3.272 -8.663 -6.959 1.00 23.22 C ATOM 931 C VAL A 55 -4.767 -8.370 -7.139 1.00 5.31 C ATOM 932 O VAL A 55 -5.508 -9.168 -7.715 1.00 3.22 O ATOM 933 CB VAL A 55 -2.582 -8.574 -8.340 1.00 25.41 C ATOM 934 CG1 VAL A 55 -2.868 -7.221 -8.990 1.00 53.33 C ATOM 935 CG2 VAL A 55 -1.074 -8.809 -8.217 1.00 74.11 C ATOM 0 H VAL A 55 -3.036 -10.752 -6.961 1.00 11.02 H new ATOM 0 HA VAL A 55 -2.839 -7.919 -6.290 1.00 23.22 H new ATOM 0 HB VAL A 55 -2.991 -9.358 -8.977 1.00 25.41 H new ATOM 0 HG11 VAL A 55 -2.376 -7.173 -9.961 1.00 53.33 H new ATOM 0 HG12 VAL A 55 -3.943 -7.101 -9.122 1.00 53.33 H new ATOM 0 HG13 VAL A 55 -2.489 -6.423 -8.351 1.00 53.33 H new ATOM 0 HG21 VAL A 55 -0.614 -8.741 -9.203 1.00 74.11 H new ATOM 0 HG22 VAL A 55 -0.640 -8.054 -7.561 1.00 74.11 H new ATOM 0 HG23 VAL A 55 -0.893 -9.800 -7.800 1.00 74.11 H new ATOM 945 N ARG A 56 -5.198 -7.218 -6.641 1.00 30.03 N ATOM 946 CA ARG A 56 -6.570 -6.750 -6.821 1.00 31.33 C ATOM 947 C ARG A 56 -6.605 -5.558 -7.789 1.00 44.44 C ATOM 948 O ARG A 56 -5.629 -4.820 -7.928 1.00 30.45 O ATOM 949 CB ARG A 56 -7.173 -6.323 -5.474 1.00 42.20 C ATOM 950 CG ARG A 56 -6.768 -7.205 -4.300 1.00 41.12 C ATOM 951 CD ARG A 56 -7.243 -8.649 -4.443 1.00 72.32 C ATOM 952 NE ARG A 56 -6.750 -9.488 -3.346 1.00 1.35 N ATOM 953 CZ ARG A 56 -7.249 -10.652 -3.026 1.00 60.02 C ATOM 954 NH1 ARG A 56 -8.261 -11.137 -3.671 1.00 43.35 N ATOM 955 NH2 ARG A 56 -6.735 -11.329 -2.047 1.00 51.32 N ATOM 0 H ARG A 56 -4.610 -6.582 -6.102 1.00 30.03 H new ATOM 0 HA ARG A 56 -7.156 -7.571 -7.235 1.00 31.33 H new ATOM 0 HB2 ARG A 56 -6.872 -5.297 -5.263 1.00 42.20 H new ATOM 0 HB3 ARG A 56 -8.260 -6.326 -5.558 1.00 42.20 H new ATOM 0 HG2 ARG A 56 -5.682 -7.194 -4.203 1.00 41.12 H new ATOM 0 HG3 ARG A 56 -7.175 -6.785 -3.380 1.00 41.12 H new ATOM 0 HD2 ARG A 56 -8.333 -8.675 -4.461 1.00 72.32 H new ATOM 0 HD3 ARG A 56 -6.899 -9.054 -5.395 1.00 72.32 H new ATOM 0 HE ARG A 56 -5.965 -9.139 -2.796 1.00 1.35 H new ATOM 0 HH11 ARG A 56 -8.677 -10.609 -4.438 1.00 43.35 H new ATOM 0 HH12 ARG A 56 -8.642 -12.047 -3.412 1.00 43.35 H new ATOM 0 HH21 ARG A 56 -5.942 -10.953 -1.528 1.00 51.32 H new ATOM 0 HH22 ARG A 56 -7.124 -12.238 -1.796 1.00 51.32 H new ATOM 969 N THR A 57 -7.735 -5.378 -8.446 1.00 34.53 N ATOM 970 CA THR A 57 -7.932 -4.260 -9.385 1.00 34.44 C ATOM 971 C THR A 57 -8.996 -3.271 -8.878 1.00 5.20 C ATOM 972 O THR A 57 -10.031 -3.677 -8.347 1.00 32.20 O ATOM 973 CB THR A 57 -8.350 -4.776 -10.783 1.00 21.15 C ATOM 974 OG1 THR A 57 -9.504 -5.626 -10.669 1.00 31.43 O ATOM 975 CG2 THR A 57 -7.211 -5.545 -11.445 1.00 52.13 C ATOM 0 H THR A 57 -8.545 -5.991 -8.354 1.00 34.53 H new ATOM 0 HA THR A 57 -6.976 -3.741 -9.458 1.00 34.44 H new ATOM 0 HB THR A 57 -8.592 -3.914 -11.404 1.00 21.15 H new ATOM 0 HG1 THR A 57 -9.763 -5.947 -11.558 1.00 31.43 H new ATOM 0 HG21 THR A 57 -7.531 -5.897 -12.426 1.00 52.13 H new ATOM 0 HG22 THR A 57 -6.347 -4.890 -11.558 1.00 52.13 H new ATOM 0 HG23 THR A 57 -6.940 -6.399 -10.824 1.00 52.13 H new ATOM 983 N VAL A 58 -8.731 -1.968 -9.040 1.00 34.40 N ATOM 984 CA VAL A 58 -9.674 -0.920 -8.608 1.00 20.33 C ATOM 985 C VAL A 58 -9.884 0.171 -9.669 1.00 24.55 C ATOM 986 O VAL A 58 -8.969 0.523 -10.417 1.00 55.22 O ATOM 987 CB VAL A 58 -9.228 -0.242 -7.286 1.00 64.54 C ATOM 988 CG1 VAL A 58 -9.648 -1.077 -6.083 1.00 22.40 C ATOM 989 CG2 VAL A 58 -7.717 0.004 -7.280 1.00 42.55 C ATOM 0 H VAL A 58 -7.875 -1.612 -9.465 1.00 34.40 H new ATOM 0 HA VAL A 58 -10.618 -1.441 -8.451 1.00 20.33 H new ATOM 0 HB VAL A 58 -9.725 0.726 -7.217 1.00 64.54 H new ATOM 0 HG11 VAL A 58 -9.325 -0.583 -5.167 1.00 22.40 H new ATOM 0 HG12 VAL A 58 -10.733 -1.184 -6.075 1.00 22.40 H new ATOM 0 HG13 VAL A 58 -9.187 -2.063 -6.146 1.00 22.40 H new ATOM 0 HG21 VAL A 58 -7.430 0.480 -6.343 1.00 42.55 H new ATOM 0 HG22 VAL A 58 -7.193 -0.947 -7.380 1.00 42.55 H new ATOM 0 HG23 VAL A 58 -7.451 0.654 -8.114 1.00 42.55 H new ATOM 999 N GLU A 59 -11.110 0.700 -9.715 1.00 2.54 N ATOM 1000 CA GLU A 59 -11.465 1.806 -10.616 1.00 2.45 C ATOM 1001 C GLU A 59 -11.298 3.174 -9.936 1.00 64.34 C ATOM 1002 O GLU A 59 -10.614 4.060 -10.446 1.00 2.14 O ATOM 1003 CB GLU A 59 -12.928 1.676 -11.071 1.00 24.15 C ATOM 1004 CG GLU A 59 -13.268 0.357 -11.745 1.00 71.23 C ATOM 1005 CD GLU A 59 -12.486 0.126 -13.032 1.00 35.33 C ATOM 1006 OE1 GLU A 59 -12.645 0.918 -13.989 1.00 71.03 O ATOM 1007 OE2 GLU A 59 -11.718 -0.856 -13.101 1.00 33.31 O ATOM 0 H GLU A 59 -11.883 0.377 -9.133 1.00 2.54 H new ATOM 0 HA GLU A 59 -10.789 1.746 -11.469 1.00 2.45 H new ATOM 0 HB2 GLU A 59 -13.577 1.803 -10.204 1.00 24.15 H new ATOM 0 HB3 GLU A 59 -13.154 2.490 -11.760 1.00 24.15 H new ATOM 0 HG2 GLU A 59 -13.067 -0.461 -11.053 1.00 71.23 H new ATOM 0 HG3 GLU A 59 -14.335 0.333 -11.966 1.00 71.23 H new ATOM 1014 N ASP A 60 -11.935 3.328 -8.773 1.00 52.10 N ATOM 1015 CA ASP A 60 -12.069 4.635 -8.117 1.00 53.21 C ATOM 1016 C ASP A 60 -12.132 4.492 -6.580 1.00 22.33 C ATOM 1017 O ASP A 60 -12.181 3.379 -6.059 1.00 31.22 O ATOM 1018 CB ASP A 60 -13.337 5.318 -8.665 1.00 3.44 C ATOM 1019 CG ASP A 60 -13.683 6.623 -7.970 1.00 25.50 C ATOM 1020 OD1 ASP A 60 -12.873 7.568 -8.031 1.00 30.44 O ATOM 1021 OD2 ASP A 60 -14.757 6.696 -7.338 1.00 62.52 O ATOM 0 H ASP A 60 -12.369 2.560 -8.262 1.00 52.10 H new ATOM 0 HA ASP A 60 -11.193 5.246 -8.335 1.00 53.21 H new ATOM 0 HB2 ASP A 60 -13.203 5.509 -9.730 1.00 3.44 H new ATOM 0 HB3 ASP A 60 -14.178 4.632 -8.568 1.00 3.44 H new ATOM 1026 N LYS A 61 -12.138 5.631 -5.877 1.00 11.33 N ATOM 1027 CA LYS A 61 -12.201 5.680 -4.405 1.00 71.00 C ATOM 1028 C LYS A 61 -13.200 4.663 -3.817 1.00 40.20 C ATOM 1029 O LYS A 61 -12.912 3.998 -2.819 1.00 35.10 O ATOM 1030 CB LYS A 61 -12.597 7.098 -3.966 1.00 34.22 C ATOM 1031 CG LYS A 61 -11.609 8.179 -4.407 1.00 44.54 C ATOM 1032 CD LYS A 61 -12.191 9.585 -4.270 1.00 52.34 C ATOM 1033 CE LYS A 61 -12.583 9.924 -2.837 1.00 61.23 C ATOM 1034 NZ LYS A 61 -13.161 11.291 -2.735 1.00 64.31 N ATOM 0 H LYS A 61 -12.099 6.552 -6.313 1.00 11.33 H new ATOM 0 HA LYS A 61 -11.214 5.417 -4.026 1.00 71.00 H new ATOM 0 HB2 LYS A 61 -13.582 7.332 -4.371 1.00 34.22 H new ATOM 0 HB3 LYS A 61 -12.685 7.121 -2.880 1.00 34.22 H new ATOM 0 HG2 LYS A 61 -10.701 8.104 -3.809 1.00 44.54 H new ATOM 0 HG3 LYS A 61 -11.323 8.006 -5.444 1.00 44.54 H new ATOM 0 HD2 LYS A 61 -11.460 10.312 -4.624 1.00 52.34 H new ATOM 0 HD3 LYS A 61 -13.067 9.675 -4.913 1.00 52.34 H new ATOM 0 HE2 LYS A 61 -13.307 9.194 -2.475 1.00 61.23 H new ATOM 0 HE3 LYS A 61 -11.707 9.850 -2.193 1.00 61.23 H new ATOM 0 HZ1 LYS A 61 -13.306 11.533 -1.734 1.00 64.31 H new ATOM 0 HZ2 LYS A 61 -12.509 11.977 -3.166 1.00 64.31 H new ATOM 0 HZ3 LYS A 61 -14.073 11.320 -3.234 1.00 64.31 H new ATOM 1048 N GLU A 62 -14.366 4.543 -4.447 1.00 65.21 N ATOM 1049 CA GLU A 62 -15.399 3.606 -3.988 1.00 63.20 C ATOM 1050 C GLU A 62 -14.952 2.140 -4.143 1.00 30.45 C ATOM 1051 O GLU A 62 -14.899 1.397 -3.163 1.00 54.13 O ATOM 1052 CB GLU A 62 -16.710 3.851 -4.741 1.00 40.21 C ATOM 1053 CG GLU A 62 -17.264 5.259 -4.552 1.00 31.22 C ATOM 1054 CD GLU A 62 -18.625 5.444 -5.200 1.00 24.21 C ATOM 1055 OE1 GLU A 62 -18.681 5.798 -6.397 1.00 65.33 O ATOM 1056 OE2 GLU A 62 -19.647 5.217 -4.518 1.00 3.33 O ATOM 0 H GLU A 62 -14.623 5.080 -5.275 1.00 65.21 H new ATOM 0 HA GLU A 62 -15.561 3.786 -2.925 1.00 63.20 H new ATOM 0 HB2 GLU A 62 -16.549 3.672 -5.804 1.00 40.21 H new ATOM 0 HB3 GLU A 62 -17.454 3.128 -4.405 1.00 40.21 H new ATOM 0 HG2 GLU A 62 -17.341 5.475 -3.486 1.00 31.22 H new ATOM 0 HG3 GLU A 62 -16.564 5.980 -4.974 1.00 31.22 H new ATOM 1063 N ASP A 63 -14.607 1.731 -5.369 1.00 34.54 N ATOM 1064 CA ASP A 63 -14.129 0.371 -5.626 1.00 31.41 C ATOM 1065 C ASP A 63 -12.858 0.078 -4.796 1.00 51.44 C ATOM 1066 O ASP A 63 -12.549 -1.072 -4.480 1.00 60.34 O ATOM 1067 CB ASP A 63 -13.861 0.220 -7.132 1.00 62.31 C ATOM 1068 CG ASP A 63 -13.742 -1.224 -7.582 1.00 45.34 C ATOM 1069 OD1 ASP A 63 -14.600 -2.046 -7.197 1.00 0.40 O ATOM 1070 OD2 ASP A 63 -12.819 -1.533 -8.363 1.00 51.12 O ATOM 0 H ASP A 63 -14.650 2.324 -6.198 1.00 34.54 H new ATOM 0 HA ASP A 63 -14.886 -0.353 -5.324 1.00 31.41 H new ATOM 0 HB2 ASP A 63 -14.667 0.700 -7.687 1.00 62.31 H new ATOM 0 HB3 ASP A 63 -12.942 0.748 -7.384 1.00 62.31 H new ATOM 1075 N PHE A 64 -12.147 1.148 -4.430 1.00 24.15 N ATOM 1076 CA PHE A 64 -10.942 1.063 -3.599 1.00 53.10 C ATOM 1077 C PHE A 64 -11.263 0.555 -2.181 1.00 72.44 C ATOM 1078 O PHE A 64 -10.720 -0.465 -1.745 1.00 30.11 O ATOM 1079 CB PHE A 64 -10.257 2.440 -3.547 1.00 73.10 C ATOM 1080 CG PHE A 64 -9.047 2.512 -2.652 1.00 34.44 C ATOM 1081 CD1 PHE A 64 -7.960 1.676 -2.862 1.00 1.23 C ATOM 1082 CD2 PHE A 64 -8.995 3.419 -1.601 1.00 22.33 C ATOM 1083 CE1 PHE A 64 -6.850 1.743 -2.044 1.00 23.51 C ATOM 1084 CE2 PHE A 64 -7.885 3.489 -0.783 1.00 13.54 C ATOM 1085 CZ PHE A 64 -6.812 2.650 -1.003 1.00 34.30 C ATOM 0 H PHE A 64 -12.391 2.100 -4.702 1.00 24.15 H new ATOM 0 HA PHE A 64 -10.262 0.340 -4.049 1.00 53.10 H new ATOM 0 HB2 PHE A 64 -9.961 2.721 -4.558 1.00 73.10 H new ATOM 0 HB3 PHE A 64 -10.984 3.179 -3.211 1.00 73.10 H new ATOM 0 HD1 PHE A 64 -7.982 0.965 -3.674 1.00 1.23 H new ATOM 0 HD2 PHE A 64 -9.833 4.077 -1.422 1.00 22.33 H new ATOM 0 HE1 PHE A 64 -6.011 1.086 -2.218 1.00 23.51 H new ATOM 0 HE2 PHE A 64 -7.857 4.200 0.029 1.00 13.54 H new ATOM 0 HZ PHE A 64 -5.944 2.702 -0.362 1.00 34.30 H new ATOM 1095 N ARG A 65 -12.157 1.248 -1.468 1.00 1.43 N ATOM 1096 CA ARG A 65 -12.523 0.839 -0.103 1.00 42.33 C ATOM 1097 C ARG A 65 -13.211 -0.532 -0.079 1.00 74.53 C ATOM 1098 O ARG A 65 -13.107 -1.262 0.905 1.00 63.34 O ATOM 1099 CB ARG A 65 -13.401 1.886 0.600 1.00 61.10 C ATOM 1100 CG ARG A 65 -14.640 2.326 -0.175 1.00 43.23 C ATOM 1101 CD ARG A 65 -15.594 3.117 0.722 1.00 53.01 C ATOM 1102 NE ARG A 65 -14.875 4.005 1.637 1.00 50.35 N ATOM 1103 CZ ARG A 65 -15.301 4.354 2.823 1.00 72.11 C ATOM 1104 NH1 ARG A 65 -16.490 4.029 3.228 1.00 2.03 N ATOM 1105 NH2 ARG A 65 -14.533 5.048 3.592 1.00 23.34 N ATOM 0 H ARG A 65 -12.636 2.083 -1.805 1.00 1.43 H new ATOM 0 HA ARG A 65 -11.587 0.759 0.449 1.00 42.33 H new ATOM 0 HB2 ARG A 65 -13.719 1.483 1.562 1.00 61.10 H new ATOM 0 HB3 ARG A 65 -12.792 2.766 0.809 1.00 61.10 H new ATOM 0 HG2 ARG A 65 -14.343 2.939 -1.026 1.00 43.23 H new ATOM 0 HG3 ARG A 65 -15.153 1.451 -0.576 1.00 43.23 H new ATOM 0 HD2 ARG A 65 -16.271 3.705 0.102 1.00 53.01 H new ATOM 0 HD3 ARG A 65 -16.209 2.425 1.297 1.00 53.01 H new ATOM 0 HE ARG A 65 -13.978 4.378 1.327 1.00 50.35 H new ATOM 0 HH11 ARG A 65 -17.108 3.493 2.618 1.00 2.03 H new ATOM 0 HH12 ARG A 65 -16.807 4.309 4.156 1.00 2.03 H new ATOM 0 HH21 ARG A 65 -13.603 5.320 3.273 1.00 23.34 H new ATOM 0 HH22 ARG A 65 -14.856 5.325 4.519 1.00 23.34 H new ATOM 1119 N GLU A 66 -13.904 -0.885 -1.162 1.00 34.13 N ATOM 1120 CA GLU A 66 -14.508 -2.217 -1.280 1.00 32.14 C ATOM 1121 C GLU A 66 -13.441 -3.318 -1.128 1.00 71.43 C ATOM 1122 O GLU A 66 -13.617 -4.270 -0.365 1.00 34.11 O ATOM 1123 CB GLU A 66 -15.232 -2.365 -2.624 1.00 20.55 C ATOM 1124 CG GLU A 66 -16.385 -1.384 -2.819 1.00 61.14 C ATOM 1125 CD GLU A 66 -17.441 -1.487 -1.727 1.00 2.32 C ATOM 1126 OE1 GLU A 66 -18.139 -2.524 -1.662 1.00 52.53 O ATOM 1127 OE2 GLU A 66 -17.579 -0.539 -0.928 1.00 14.23 O ATOM 0 H GLU A 66 -14.061 -0.275 -1.964 1.00 34.13 H new ATOM 0 HA GLU A 66 -15.236 -2.328 -0.477 1.00 32.14 H new ATOM 0 HB2 GLU A 66 -14.511 -2.228 -3.430 1.00 20.55 H new ATOM 0 HB3 GLU A 66 -15.615 -3.382 -2.709 1.00 20.55 H new ATOM 0 HG2 GLU A 66 -15.991 -0.368 -2.842 1.00 61.14 H new ATOM 0 HG3 GLU A 66 -16.851 -1.567 -3.787 1.00 61.14 H new ATOM 1134 N ASN A 67 -12.328 -3.169 -1.849 1.00 24.44 N ATOM 1135 CA ASN A 67 -11.194 -4.099 -1.734 1.00 24.14 C ATOM 1136 C ASN A 67 -10.561 -4.047 -0.331 1.00 32.11 C ATOM 1137 O ASN A 67 -10.160 -5.076 0.216 1.00 1.02 O ATOM 1138 CB ASN A 67 -10.141 -3.791 -2.808 1.00 2.43 C ATOM 1139 CG ASN A 67 -10.542 -4.319 -4.177 1.00 62.23 C ATOM 1140 OD1 ASN A 67 -10.186 -5.431 -4.550 1.00 43.11 O ATOM 1141 ND2 ASN A 67 -11.292 -3.541 -4.929 1.00 62.14 N ATOM 0 H ASN A 67 -12.184 -2.414 -2.520 1.00 24.44 H new ATOM 0 HA ASN A 67 -11.574 -5.109 -1.889 1.00 24.14 H new ATOM 0 HB2 ASN A 67 -9.990 -2.713 -2.867 1.00 2.43 H new ATOM 0 HB3 ASN A 67 -9.188 -4.231 -2.516 1.00 2.43 H new ATOM 0 HD21 ASN A 67 -11.593 -3.859 -5.850 1.00 62.14 H new ATOM 0 HD22 ASN A 67 -11.572 -2.620 -4.590 1.00 62.14 H new ATOM 1148 N ILE A 68 -10.480 -2.848 0.249 1.00 32.43 N ATOM 1149 CA ILE A 68 -9.986 -2.689 1.624 1.00 4.22 C ATOM 1150 C ILE A 68 -10.833 -3.513 2.609 1.00 1.44 C ATOM 1151 O ILE A 68 -10.305 -4.202 3.485 1.00 31.41 O ATOM 1152 CB ILE A 68 -10.002 -1.202 2.068 1.00 61.33 C ATOM 1153 CG1 ILE A 68 -9.158 -0.342 1.117 1.00 33.41 C ATOM 1154 CG2 ILE A 68 -9.496 -1.062 3.503 1.00 54.42 C ATOM 1155 CD1 ILE A 68 -9.189 1.136 1.450 1.00 22.42 C ATOM 0 H ILE A 68 -10.748 -1.975 -0.206 1.00 32.43 H new ATOM 0 HA ILE A 68 -8.957 -3.049 1.635 1.00 4.22 H new ATOM 0 HB ILE A 68 -11.032 -0.848 2.029 1.00 61.33 H new ATOM 0 HG12 ILE A 68 -8.126 -0.691 1.144 1.00 33.41 H new ATOM 0 HG13 ILE A 68 -9.516 -0.484 0.097 1.00 33.41 H new ATOM 0 HG21 ILE A 68 -9.515 -0.012 3.795 1.00 54.42 H new ATOM 0 HG22 ILE A 68 -10.136 -1.636 4.172 1.00 54.42 H new ATOM 0 HG23 ILE A 68 -8.475 -1.438 3.567 1.00 54.42 H new ATOM 0 HD11 ILE A 68 -8.571 1.683 0.737 1.00 22.42 H new ATOM 0 HD12 ILE A 68 -10.215 1.500 1.395 1.00 22.42 H new ATOM 0 HD13 ILE A 68 -8.803 1.290 2.458 1.00 22.42 H new ATOM 1167 N ARG A 69 -12.152 -3.448 2.442 1.00 60.43 N ATOM 1168 CA ARG A 69 -13.083 -4.189 3.298 1.00 73.24 C ATOM 1169 C ARG A 69 -12.953 -5.706 3.107 1.00 35.04 C ATOM 1170 O ARG A 69 -13.298 -6.485 4.000 1.00 53.00 O ATOM 1171 CB ARG A 69 -14.520 -3.719 3.044 1.00 64.32 C ATOM 1172 CG ARG A 69 -14.738 -2.261 3.436 1.00 43.13 C ATOM 1173 CD ARG A 69 -16.165 -1.791 3.188 1.00 2.42 C ATOM 1174 NE ARG A 69 -16.350 -0.402 3.608 1.00 11.35 N ATOM 1175 CZ ARG A 69 -17.483 0.244 3.545 1.00 72.54 C ATOM 1176 NH1 ARG A 69 -18.554 -0.333 3.104 1.00 52.40 N ATOM 1177 NH2 ARG A 69 -17.541 1.472 3.940 1.00 72.11 N ATOM 0 H ARG A 69 -12.604 -2.888 1.719 1.00 60.43 H new ATOM 0 HA ARG A 69 -12.825 -3.979 4.336 1.00 73.24 H new ATOM 0 HB2 ARG A 69 -14.759 -3.847 1.988 1.00 64.32 H new ATOM 0 HB3 ARG A 69 -15.209 -4.349 3.606 1.00 64.32 H new ATOM 0 HG2 ARG A 69 -14.496 -2.133 4.491 1.00 43.13 H new ATOM 0 HG3 ARG A 69 -14.050 -1.631 2.873 1.00 43.13 H new ATOM 0 HD2 ARG A 69 -16.402 -1.887 2.128 1.00 2.42 H new ATOM 0 HD3 ARG A 69 -16.860 -2.432 3.730 1.00 2.42 H new ATOM 0 HE ARG A 69 -15.539 0.096 3.975 1.00 11.35 H new ATOM 0 HH11 ARG A 69 -18.521 -1.306 2.800 1.00 52.40 H new ATOM 0 HH12 ARG A 69 -19.432 0.185 3.061 1.00 52.40 H new ATOM 0 HH21 ARG A 69 -16.705 1.932 4.299 1.00 72.11 H new ATOM 0 HH22 ARG A 69 -18.423 1.982 3.893 1.00 72.11 H new ATOM 1191 N GLU A 70 -12.463 -6.124 1.942 1.00 5.01 N ATOM 1192 CA GLU A 70 -12.105 -7.530 1.720 1.00 55.34 C ATOM 1193 C GLU A 70 -10.908 -7.924 2.597 1.00 23.11 C ATOM 1194 O GLU A 70 -10.885 -9.000 3.192 1.00 51.54 O ATOM 1195 CB GLU A 70 -11.766 -7.781 0.242 1.00 43.44 C ATOM 1196 CG GLU A 70 -12.942 -7.598 -0.706 1.00 62.31 C ATOM 1197 CD GLU A 70 -14.083 -8.557 -0.410 1.00 34.23 C ATOM 1198 OE1 GLU A 70 -14.038 -9.712 -0.888 1.00 11.11 O ATOM 1199 OE2 GLU A 70 -15.024 -8.163 0.312 1.00 5.14 O ATOM 0 H GLU A 70 -12.304 -5.516 1.139 1.00 5.01 H new ATOM 0 HA GLU A 70 -12.965 -8.142 1.992 1.00 55.34 H new ATOM 0 HB2 GLU A 70 -10.965 -7.104 -0.056 1.00 43.44 H new ATOM 0 HB3 GLU A 70 -11.382 -8.796 0.136 1.00 43.44 H new ATOM 0 HG2 GLU A 70 -13.306 -6.573 -0.635 1.00 62.31 H new ATOM 0 HG3 GLU A 70 -12.604 -7.746 -1.732 1.00 62.31 H new ATOM 1206 N ILE A 71 -9.922 -7.032 2.678 1.00 63.41 N ATOM 1207 CA ILE A 71 -8.719 -7.264 3.485 1.00 43.01 C ATOM 1208 C ILE A 71 -9.064 -7.496 4.969 1.00 13.23 C ATOM 1209 O ILE A 71 -8.573 -8.443 5.586 1.00 51.24 O ATOM 1210 CB ILE A 71 -7.733 -6.072 3.370 1.00 65.24 C ATOM 1211 CG1 ILE A 71 -7.378 -5.815 1.895 1.00 0.42 C ATOM 1212 CG2 ILE A 71 -6.471 -6.325 4.196 1.00 3.03 C ATOM 1213 CD1 ILE A 71 -6.531 -4.580 1.673 1.00 35.24 C ATOM 0 H ILE A 71 -9.931 -6.135 2.192 1.00 63.41 H new ATOM 0 HA ILE A 71 -8.246 -8.164 3.092 1.00 43.01 H new ATOM 0 HB ILE A 71 -8.220 -5.183 3.769 1.00 65.24 H new ATOM 0 HG12 ILE A 71 -6.847 -6.683 1.503 1.00 0.42 H new ATOM 0 HG13 ILE A 71 -8.300 -5.719 1.321 1.00 0.42 H new ATOM 0 HG21 ILE A 71 -5.796 -5.475 4.099 1.00 3.03 H new ATOM 0 HG22 ILE A 71 -6.742 -6.455 5.244 1.00 3.03 H new ATOM 0 HG23 ILE A 71 -5.974 -7.226 3.835 1.00 3.03 H new ATOM 0 HD11 ILE A 71 -6.323 -4.468 0.609 1.00 35.24 H new ATOM 0 HD12 ILE A 71 -7.067 -3.702 2.033 1.00 35.24 H new ATOM 0 HD13 ILE A 71 -5.592 -4.680 2.217 1.00 35.24 H new ATOM 1225 N TRP A 72 -9.923 -6.635 5.525 1.00 3.42 N ATOM 1226 CA TRP A 72 -10.348 -6.751 6.932 1.00 2.50 C ATOM 1227 C TRP A 72 -10.955 -8.135 7.233 1.00 63.44 C ATOM 1228 O TRP A 72 -10.885 -8.629 8.362 1.00 63.42 O ATOM 1229 CB TRP A 72 -11.384 -5.669 7.282 1.00 2.33 C ATOM 1230 CG TRP A 72 -10.948 -4.254 6.996 1.00 61.31 C ATOM 1231 CD1 TRP A 72 -11.686 -3.284 6.375 1.00 62.30 C ATOM 1232 CD2 TRP A 72 -9.686 -3.649 7.316 1.00 24.32 C ATOM 1233 NE1 TRP A 72 -10.963 -2.118 6.292 1.00 71.23 N ATOM 1234 CE2 TRP A 72 -9.733 -2.317 6.861 1.00 41.43 C ATOM 1235 CE3 TRP A 72 -8.521 -4.103 7.944 1.00 52.23 C ATOM 1236 CZ2 TRP A 72 -8.664 -1.436 7.015 1.00 72.53 C ATOM 1237 CZ3 TRP A 72 -7.460 -3.228 8.094 1.00 54.31 C ATOM 1238 CH2 TRP A 72 -7.538 -1.908 7.632 1.00 25.41 C ATOM 0 H TRP A 72 -10.340 -5.849 5.026 1.00 3.42 H new ATOM 0 HA TRP A 72 -9.454 -6.618 7.542 1.00 2.50 H new ATOM 0 HB2 TRP A 72 -12.300 -5.871 6.726 1.00 2.33 H new ATOM 0 HB3 TRP A 72 -11.629 -5.751 8.341 1.00 2.33 H new ATOM 0 HD1 TRP A 72 -12.692 -3.415 6.004 1.00 62.30 H new ATOM 0 HE1 TRP A 72 -11.289 -1.246 5.875 1.00 71.23 H new ATOM 0 HE3 TRP A 72 -8.451 -5.118 8.305 1.00 52.23 H new ATOM 0 HZ2 TRP A 72 -8.723 -0.418 6.660 1.00 72.53 H new ATOM 0 HZ3 TRP A 72 -6.556 -3.569 8.576 1.00 54.31 H new ATOM 0 HH2 TRP A 72 -6.692 -1.250 7.766 1.00 25.41 H new ATOM 1249 N GLU A 73 -11.560 -8.742 6.217 1.00 21.11 N ATOM 1250 CA GLU A 73 -12.232 -10.039 6.357 1.00 11.13 C ATOM 1251 C GLU A 73 -11.281 -11.215 6.069 1.00 65.34 C ATOM 1252 O GLU A 73 -11.245 -12.198 6.812 1.00 61.43 O ATOM 1253 CB GLU A 73 -13.430 -10.090 5.397 1.00 11.33 C ATOM 1254 CG GLU A 73 -14.169 -11.425 5.388 1.00 71.13 C ATOM 1255 CD GLU A 73 -15.309 -11.454 4.380 1.00 61.22 C ATOM 1256 OE1 GLU A 73 -15.050 -11.736 3.187 1.00 31.43 O ATOM 1257 OE2 GLU A 73 -16.467 -11.192 4.773 1.00 25.25 O ATOM 0 H GLU A 73 -11.601 -8.354 5.274 1.00 21.11 H new ATOM 0 HA GLU A 73 -12.568 -10.138 7.389 1.00 11.13 H new ATOM 0 HB2 GLU A 73 -14.132 -9.301 5.668 1.00 11.33 H new ATOM 0 HB3 GLU A 73 -13.081 -9.874 4.387 1.00 11.33 H new ATOM 0 HG2 GLU A 73 -13.465 -12.225 5.158 1.00 71.13 H new ATOM 0 HG3 GLU A 73 -14.564 -11.625 6.384 1.00 71.13 H new ATOM 1264 N ARG A 74 -10.508 -11.099 4.994 1.00 33.44 N ATOM 1265 CA ARG A 74 -9.673 -12.204 4.508 1.00 12.32 C ATOM 1266 C ARG A 74 -8.359 -12.348 5.295 1.00 24.22 C ATOM 1267 O ARG A 74 -7.825 -13.452 5.424 1.00 43.02 O ATOM 1268 CB ARG A 74 -9.371 -12.003 3.016 1.00 4.40 C ATOM 1269 CG ARG A 74 -10.623 -11.959 2.142 1.00 55.41 C ATOM 1270 CD ARG A 74 -10.288 -11.845 0.658 1.00 72.42 C ATOM 1271 NE ARG A 74 -11.488 -11.650 -0.152 1.00 62.12 N ATOM 1272 CZ ARG A 74 -12.129 -12.602 -0.774 1.00 23.01 C ATOM 1273 NH1 ARG A 74 -11.728 -13.832 -0.705 1.00 51.31 N ATOM 1274 NH2 ARG A 74 -13.181 -12.322 -1.462 1.00 24.23 N ATOM 0 H ARG A 74 -10.439 -10.248 4.437 1.00 33.44 H new ATOM 0 HA ARG A 74 -10.235 -13.126 4.658 1.00 12.32 H new ATOM 0 HB2 ARG A 74 -8.815 -11.074 2.888 1.00 4.40 H new ATOM 0 HB3 ARG A 74 -8.725 -12.811 2.672 1.00 4.40 H new ATOM 0 HG2 ARG A 74 -11.213 -12.860 2.311 1.00 55.41 H new ATOM 0 HG3 ARG A 74 -11.241 -11.112 2.439 1.00 55.41 H new ATOM 0 HD2 ARG A 74 -9.604 -11.011 0.502 1.00 72.42 H new ATOM 0 HD3 ARG A 74 -9.771 -12.747 0.331 1.00 72.42 H new ATOM 0 HE ARG A 74 -11.851 -10.701 -0.238 1.00 62.12 H new ATOM 0 HH11 ARG A 74 -10.900 -14.069 -0.159 1.00 51.31 H new ATOM 0 HH12 ARG A 74 -12.240 -14.564 -1.197 1.00 51.31 H new ATOM 0 HH21 ARG A 74 -13.511 -11.359 -1.520 1.00 24.23 H new ATOM 0 HH22 ARG A 74 -13.684 -13.064 -1.949 1.00 24.23 H new ATOM 1288 N TYR A 75 -7.834 -11.237 5.811 1.00 1.03 N ATOM 1289 CA TYR A 75 -6.556 -11.249 6.540 1.00 63.43 C ATOM 1290 C TYR A 75 -6.736 -10.742 7.986 1.00 13.01 C ATOM 1291 O TYR A 75 -6.577 -9.553 8.257 1.00 43.34 O ATOM 1292 CB TYR A 75 -5.523 -10.382 5.800 1.00 22.22 C ATOM 1293 CG TYR A 75 -5.428 -10.670 4.308 1.00 75.45 C ATOM 1294 CD1 TYR A 75 -4.616 -11.689 3.816 1.00 74.02 C ATOM 1295 CD2 TYR A 75 -6.150 -9.912 3.388 1.00 64.51 C ATOM 1296 CE1 TYR A 75 -4.528 -11.940 2.457 1.00 13.33 C ATOM 1297 CE2 TYR A 75 -6.068 -10.160 2.032 1.00 14.03 C ATOM 1298 CZ TYR A 75 -5.256 -11.172 1.570 1.00 63.14 C ATOM 1299 OH TYR A 75 -5.173 -11.417 0.215 1.00 35.04 O ATOM 0 H TYR A 75 -8.269 -10.317 5.741 1.00 1.03 H new ATOM 0 HA TYR A 75 -6.198 -12.277 6.585 1.00 63.43 H new ATOM 0 HB2 TYR A 75 -5.778 -9.332 5.941 1.00 22.22 H new ATOM 0 HB3 TYR A 75 -4.543 -10.536 6.253 1.00 22.22 H new ATOM 0 HD1 TYR A 75 -4.046 -12.293 4.506 1.00 74.02 H new ATOM 0 HD2 TYR A 75 -6.786 -9.115 3.743 1.00 64.51 H new ATOM 0 HE1 TYR A 75 -3.892 -12.733 2.092 1.00 13.33 H new ATOM 0 HE2 TYR A 75 -6.639 -9.563 1.336 1.00 14.03 H new ATOM 0 HH TYR A 75 -4.990 -12.368 0.065 1.00 35.04 H new ATOM 1309 N PRO A 76 -7.070 -11.638 8.939 1.00 4.43 N ATOM 1310 CA PRO A 76 -7.385 -11.243 10.327 1.00 1.33 C ATOM 1311 C PRO A 76 -6.178 -10.714 11.123 1.00 11.21 C ATOM 1312 O PRO A 76 -6.338 -9.869 12.005 1.00 14.23 O ATOM 1313 CB PRO A 76 -7.919 -12.540 10.954 1.00 21.33 C ATOM 1314 CG PRO A 76 -7.318 -13.636 10.140 1.00 42.24 C ATOM 1315 CD PRO A 76 -7.183 -13.096 8.738 1.00 11.33 C ATOM 0 HA PRO A 76 -8.089 -10.411 10.343 1.00 1.33 H new ATOM 0 HB2 PRO A 76 -7.629 -12.621 12.001 1.00 21.33 H new ATOM 0 HB3 PRO A 76 -9.008 -12.575 10.921 1.00 21.33 H new ATOM 0 HG2 PRO A 76 -6.347 -13.929 10.539 1.00 42.24 H new ATOM 0 HG3 PRO A 76 -7.950 -14.524 10.156 1.00 42.24 H new ATOM 0 HD2 PRO A 76 -6.305 -13.501 8.235 1.00 11.33 H new ATOM 0 HD3 PRO A 76 -8.047 -13.351 8.125 1.00 11.33 H new ATOM 1323 N GLN A 77 -4.973 -11.209 10.829 1.00 63.22 N ATOM 1324 CA GLN A 77 -3.775 -10.767 11.559 1.00 63.41 C ATOM 1325 C GLN A 77 -3.258 -9.418 11.024 1.00 74.02 C ATOM 1326 O GLN A 77 -2.471 -8.746 11.687 1.00 34.00 O ATOM 1327 CB GLN A 77 -2.638 -11.804 11.481 1.00 52.44 C ATOM 1328 CG GLN A 77 -3.038 -13.238 11.832 1.00 25.01 C ATOM 1329 CD GLN A 77 -3.673 -14.003 10.673 1.00 63.12 C ATOM 1330 OE1 GLN A 77 -4.521 -14.865 10.877 1.00 12.24 O ATOM 1331 NE2 GLN A 77 -3.251 -13.723 9.452 1.00 14.33 N ATOM 0 H GLN A 77 -4.799 -11.905 10.104 1.00 63.22 H new ATOM 0 HA GLN A 77 -4.077 -10.653 12.600 1.00 63.41 H new ATOM 0 HB2 GLN A 77 -2.229 -11.795 10.471 1.00 52.44 H new ATOM 0 HB3 GLN A 77 -1.837 -11.493 12.152 1.00 52.44 H new ATOM 0 HG2 GLN A 77 -2.154 -13.779 12.171 1.00 25.01 H new ATOM 0 HG3 GLN A 77 -3.738 -13.216 12.667 1.00 25.01 H new ATOM 0 HE21 GLN A 77 -2.545 -13.001 9.310 1.00 14.33 H new ATOM 0 HE22 GLN A 77 -3.632 -14.229 8.652 1.00 14.33 H new ATOM 1340 N LEU A 78 -3.702 -9.043 9.817 1.00 24.54 N ATOM 1341 CA LEU A 78 -3.253 -7.803 9.151 1.00 73.42 C ATOM 1342 C LEU A 78 -1.737 -7.816 8.870 1.00 15.04 C ATOM 1343 O LEU A 78 -1.143 -6.785 8.555 1.00 51.23 O ATOM 1344 CB LEU A 78 -3.630 -6.568 9.989 1.00 14.24 C ATOM 1345 CG LEU A 78 -5.132 -6.398 10.276 1.00 13.53 C ATOM 1346 CD1 LEU A 78 -5.383 -5.125 11.082 1.00 64.55 C ATOM 1347 CD2 LEU A 78 -5.932 -6.389 8.974 1.00 13.43 C ATOM 0 H LEU A 78 -4.377 -9.582 9.275 1.00 24.54 H new ATOM 0 HA LEU A 78 -3.766 -7.749 8.191 1.00 73.42 H new ATOM 0 HB2 LEU A 78 -3.099 -6.619 10.940 1.00 14.24 H new ATOM 0 HB3 LEU A 78 -3.273 -5.677 9.473 1.00 14.24 H new ATOM 0 HG LEU A 78 -5.468 -7.247 10.871 1.00 13.53 H new ATOM 0 HD11 LEU A 78 -6.451 -5.021 11.275 1.00 64.55 H new ATOM 0 HD12 LEU A 78 -4.846 -5.182 12.029 1.00 64.55 H new ATOM 0 HD13 LEU A 78 -5.031 -4.262 10.517 1.00 64.55 H new ATOM 0 HD21 LEU A 78 -6.992 -6.268 9.199 1.00 13.43 H new ATOM 0 HD22 LEU A 78 -5.597 -5.563 8.347 1.00 13.43 H new ATOM 0 HD23 LEU A 78 -5.778 -7.330 8.446 1.00 13.43 H new ATOM 1359 N ASP A 79 -1.136 -9.003 8.927 1.00 32.03 N ATOM 1360 CA ASP A 79 0.317 -9.171 8.771 1.00 34.42 C ATOM 1361 C ASP A 79 0.756 -9.144 7.293 1.00 52.32 C ATOM 1362 O ASP A 79 1.856 -9.585 6.953 1.00 4.04 O ATOM 1363 CB ASP A 79 0.739 -10.495 9.421 1.00 0.04 C ATOM 1364 CG ASP A 79 0.112 -11.705 8.740 1.00 25.41 C ATOM 1365 OD1 ASP A 79 -1.132 -11.806 8.713 1.00 40.21 O ATOM 1366 OD2 ASP A 79 0.862 -12.563 8.224 1.00 51.12 O ATOM 0 H ASP A 79 -1.637 -9.878 9.082 1.00 32.03 H new ATOM 0 HA ASP A 79 0.808 -8.332 9.263 1.00 34.42 H new ATOM 0 HB2 ASP A 79 1.825 -10.584 9.385 1.00 0.04 H new ATOM 0 HB3 ASP A 79 0.455 -10.486 10.473 1.00 0.04 H new ATOM 1371 N VAL A 80 -0.101 -8.614 6.424 1.00 1.24 N ATOM 1372 CA VAL A 80 0.178 -8.557 4.987 1.00 14.45 C ATOM 1373 C VAL A 80 0.466 -7.119 4.527 1.00 3.41 C ATOM 1374 O VAL A 80 -0.107 -6.159 5.048 1.00 30.44 O ATOM 1375 CB VAL A 80 -1.003 -9.134 4.160 1.00 65.45 C ATOM 1376 CG1 VAL A 80 -1.265 -10.591 4.541 1.00 73.40 C ATOM 1377 CG2 VAL A 80 -2.267 -8.290 4.341 1.00 50.22 C ATOM 0 H VAL A 80 -1.001 -8.215 6.690 1.00 1.24 H new ATOM 0 HA VAL A 80 1.065 -9.167 4.814 1.00 14.45 H new ATOM 0 HB VAL A 80 -0.726 -9.099 3.106 1.00 65.45 H new ATOM 0 HG11 VAL A 80 -2.096 -10.978 3.951 1.00 73.40 H new ATOM 0 HG12 VAL A 80 -0.373 -11.185 4.344 1.00 73.40 H new ATOM 0 HG13 VAL A 80 -1.514 -10.651 5.601 1.00 73.40 H new ATOM 0 HG21 VAL A 80 -3.077 -8.717 3.751 1.00 50.22 H new ATOM 0 HG22 VAL A 80 -2.551 -8.281 5.393 1.00 50.22 H new ATOM 0 HG23 VAL A 80 -2.074 -7.270 4.008 1.00 50.22 H new ATOM 1387 N VAL A 81 1.360 -6.973 3.555 1.00 3.20 N ATOM 1388 CA VAL A 81 1.695 -5.652 3.015 1.00 72.02 C ATOM 1389 C VAL A 81 0.831 -5.312 1.796 1.00 61.11 C ATOM 1390 O VAL A 81 0.939 -5.941 0.740 1.00 43.13 O ATOM 1391 CB VAL A 81 3.187 -5.549 2.625 1.00 35.25 C ATOM 1392 CG1 VAL A 81 3.481 -4.191 1.984 1.00 11.31 C ATOM 1393 CG2 VAL A 81 4.081 -5.780 3.842 1.00 45.30 C ATOM 0 H VAL A 81 1.866 -7.747 3.124 1.00 3.20 H new ATOM 0 HA VAL A 81 1.493 -4.935 3.810 1.00 72.02 H new ATOM 0 HB VAL A 81 3.405 -6.327 1.893 1.00 35.25 H new ATOM 0 HG11 VAL A 81 4.536 -4.136 1.716 1.00 11.31 H new ATOM 0 HG12 VAL A 81 2.872 -4.072 1.088 1.00 11.31 H new ATOM 0 HG13 VAL A 81 3.245 -3.396 2.691 1.00 11.31 H new ATOM 0 HG21 VAL A 81 5.127 -5.703 3.545 1.00 45.30 H new ATOM 0 HG22 VAL A 81 3.863 -5.029 4.601 1.00 45.30 H new ATOM 0 HG23 VAL A 81 3.892 -6.773 4.249 1.00 45.30 H new ATOM 1403 N VAL A 82 -0.027 -4.312 1.953 1.00 53.54 N ATOM 1404 CA VAL A 82 -0.906 -3.855 0.876 1.00 73.30 C ATOM 1405 C VAL A 82 -0.302 -2.643 0.152 1.00 72.44 C ATOM 1406 O VAL A 82 0.054 -1.654 0.780 1.00 10.20 O ATOM 1407 CB VAL A 82 -2.302 -3.482 1.431 1.00 12.21 C ATOM 1408 CG1 VAL A 82 -3.249 -3.065 0.306 1.00 13.50 C ATOM 1409 CG2 VAL A 82 -2.884 -4.645 2.234 1.00 32.14 C ATOM 0 H VAL A 82 -0.136 -3.795 2.825 1.00 53.54 H new ATOM 0 HA VAL A 82 -1.011 -4.674 0.165 1.00 73.30 H new ATOM 0 HB VAL A 82 -2.187 -2.628 2.098 1.00 12.21 H new ATOM 0 HG11 VAL A 82 -4.222 -2.809 0.726 1.00 13.50 H new ATOM 0 HG12 VAL A 82 -2.838 -2.199 -0.213 1.00 13.50 H new ATOM 0 HG13 VAL A 82 -3.363 -3.889 -0.398 1.00 13.50 H new ATOM 0 HG21 VAL A 82 -3.866 -4.367 2.618 1.00 32.14 H new ATOM 0 HG22 VAL A 82 -2.980 -5.519 1.590 1.00 32.14 H new ATOM 0 HG23 VAL A 82 -2.222 -4.879 3.068 1.00 32.14 H new ATOM 1419 N ILE A 83 -0.184 -2.717 -1.170 1.00 62.24 N ATOM 1420 CA ILE A 83 0.410 -1.619 -1.946 1.00 10.12 C ATOM 1421 C ILE A 83 -0.596 -1.017 -2.940 1.00 4.44 C ATOM 1422 O ILE A 83 -1.189 -1.731 -3.741 1.00 10.11 O ATOM 1423 CB ILE A 83 1.671 -2.087 -2.718 1.00 70.04 C ATOM 1424 CG1 ILE A 83 2.663 -2.776 -1.763 1.00 71.32 C ATOM 1425 CG2 ILE A 83 2.335 -0.899 -3.416 1.00 3.42 C ATOM 1426 CD1 ILE A 83 3.899 -3.321 -2.448 1.00 74.25 C ATOM 0 H ILE A 83 -0.487 -3.515 -1.728 1.00 62.24 H new ATOM 0 HA ILE A 83 0.697 -0.852 -1.226 1.00 10.12 H new ATOM 0 HB ILE A 83 1.367 -2.809 -3.476 1.00 70.04 H new ATOM 0 HG12 ILE A 83 2.969 -2.063 -0.997 1.00 71.32 H new ATOM 0 HG13 ILE A 83 2.153 -3.593 -1.253 1.00 71.32 H new ATOM 0 HG21 ILE A 83 3.219 -1.241 -3.954 1.00 3.42 H new ATOM 0 HG22 ILE A 83 1.633 -0.451 -4.119 1.00 3.42 H new ATOM 0 HG23 ILE A 83 2.627 -0.157 -2.673 1.00 3.42 H new ATOM 0 HD11 ILE A 83 4.548 -3.791 -1.709 1.00 74.25 H new ATOM 0 HD12 ILE A 83 3.606 -4.059 -3.194 1.00 74.25 H new ATOM 0 HD13 ILE A 83 4.435 -2.506 -2.935 1.00 74.25 H new ATOM 1438 N VAL A 84 -0.780 0.301 -2.878 1.00 63.53 N ATOM 1439 CA VAL A 84 -1.690 1.014 -3.783 1.00 75.21 C ATOM 1440 C VAL A 84 -0.902 1.896 -4.768 1.00 55.31 C ATOM 1441 O VAL A 84 0.019 2.618 -4.377 1.00 45.24 O ATOM 1442 CB VAL A 84 -2.685 1.898 -2.991 1.00 13.04 C ATOM 1443 CG1 VAL A 84 -3.733 2.509 -3.919 1.00 74.14 C ATOM 1444 CG2 VAL A 84 -3.342 1.095 -1.868 1.00 32.13 C ATOM 0 H VAL A 84 -0.307 0.904 -2.205 1.00 63.53 H new ATOM 0 HA VAL A 84 -2.249 0.262 -4.340 1.00 75.21 H new ATOM 0 HB VAL A 84 -2.127 2.718 -2.538 1.00 13.04 H new ATOM 0 HG11 VAL A 84 -4.419 3.125 -3.338 1.00 74.14 H new ATOM 0 HG12 VAL A 84 -3.239 3.126 -4.670 1.00 74.14 H new ATOM 0 HG13 VAL A 84 -4.290 1.713 -4.413 1.00 74.14 H new ATOM 0 HG21 VAL A 84 -4.038 1.733 -1.323 1.00 32.13 H new ATOM 0 HG22 VAL A 84 -3.883 0.249 -2.293 1.00 32.13 H new ATOM 0 HG23 VAL A 84 -2.575 0.729 -1.186 1.00 32.13 H new ATOM 1454 N THR A 85 -1.272 1.849 -6.044 1.00 2.10 N ATOM 1455 CA THR A 85 -0.519 2.550 -7.097 1.00 44.01 C ATOM 1456 C THR A 85 -0.993 3.999 -7.316 1.00 53.32 C ATOM 1457 O THR A 85 -1.595 4.308 -8.349 1.00 72.12 O ATOM 1458 CB THR A 85 -0.609 1.787 -8.442 1.00 22.13 C ATOM 1459 OG1 THR A 85 -1.978 1.691 -8.871 1.00 44.30 O ATOM 1460 CG2 THR A 85 -0.031 0.385 -8.312 1.00 31.52 C ATOM 0 H THR A 85 -2.086 1.336 -6.381 1.00 2.10 H new ATOM 0 HA THR A 85 0.514 2.583 -6.750 1.00 44.01 H new ATOM 0 HB THR A 85 -0.031 2.344 -9.179 1.00 22.13 H new ATOM 0 HG1 THR A 85 -2.475 2.476 -8.558 1.00 44.30 H new ATOM 0 HG21 THR A 85 -0.106 -0.130 -9.270 1.00 31.52 H new ATOM 0 HG22 THR A 85 1.016 0.449 -8.016 1.00 31.52 H new ATOM 0 HG23 THR A 85 -0.588 -0.170 -7.557 1.00 31.52 H new ATOM 1468 N THR A 86 -0.727 4.884 -6.346 1.00 2.50 N ATOM 1469 CA THR A 86 -1.064 6.319 -6.484 1.00 12.13 C ATOM 1470 C THR A 86 -0.712 7.143 -5.230 1.00 21.24 C ATOM 1471 O THR A 86 -0.450 6.592 -4.162 1.00 30.11 O ATOM 1472 CB THR A 86 -2.565 6.545 -6.796 1.00 43.54 C ATOM 1473 OG1 THR A 86 -2.804 7.944 -7.000 1.00 33.31 O ATOM 1474 CG2 THR A 86 -3.457 6.028 -5.665 1.00 74.45 C ATOM 0 H THR A 86 -0.283 4.640 -5.461 1.00 2.50 H new ATOM 0 HA THR A 86 -0.456 6.662 -7.321 1.00 12.13 H new ATOM 0 HB THR A 86 -2.813 5.988 -7.700 1.00 43.54 H new ATOM 0 HG1 THR A 86 -3.763 8.128 -6.915 1.00 33.31 H new ATOM 0 HG21 THR A 86 -4.503 6.203 -5.918 1.00 74.45 H new ATOM 0 HG22 THR A 86 -3.290 4.959 -5.530 1.00 74.45 H new ATOM 0 HG23 THR A 86 -3.214 6.553 -4.741 1.00 74.45 H new ATOM 1482 N ASP A 87 -0.722 8.474 -5.381 1.00 45.23 N ATOM 1483 CA ASP A 87 -0.472 9.408 -4.269 1.00 21.22 C ATOM 1484 C ASP A 87 -1.750 10.154 -3.831 1.00 15.43 C ATOM 1485 O ASP A 87 -1.679 11.071 -3.008 1.00 63.31 O ATOM 1486 CB ASP A 87 0.589 10.443 -4.670 1.00 61.32 C ATOM 1487 CG ASP A 87 1.998 9.887 -4.661 1.00 41.21 C ATOM 1488 OD1 ASP A 87 2.407 9.277 -5.672 1.00 22.20 O ATOM 1489 OD2 ASP A 87 2.707 10.090 -3.649 1.00 25.02 O ATOM 0 H ASP A 87 -0.903 8.935 -6.273 1.00 45.23 H new ATOM 0 HA ASP A 87 -0.120 8.808 -3.430 1.00 21.22 H new ATOM 0 HB2 ASP A 87 0.361 10.820 -5.667 1.00 61.32 H new ATOM 0 HB3 ASP A 87 0.536 11.291 -3.988 1.00 61.32 H new ATOM 1494 N ASP A 88 -2.905 9.782 -4.388 1.00 15.40 N ATOM 1495 CA ASP A 88 -4.179 10.428 -4.028 1.00 65.13 C ATOM 1496 C ASP A 88 -4.400 10.467 -2.502 1.00 21.41 C ATOM 1497 O ASP A 88 -4.637 9.436 -1.866 1.00 20.32 O ATOM 1498 CB ASP A 88 -5.357 9.725 -4.717 1.00 13.52 C ATOM 1499 CG ASP A 88 -5.535 10.155 -6.163 1.00 43.13 C ATOM 1500 OD1 ASP A 88 -4.815 9.645 -7.039 1.00 50.14 O ATOM 1501 OD2 ASP A 88 -6.390 11.024 -6.428 1.00 12.31 O ATOM 0 H ASP A 88 -2.989 9.043 -5.086 1.00 15.40 H new ATOM 0 HA ASP A 88 -4.125 11.459 -4.378 1.00 65.13 H new ATOM 0 HB2 ASP A 88 -5.203 8.647 -4.680 1.00 13.52 H new ATOM 0 HB3 ASP A 88 -6.273 9.935 -4.165 1.00 13.52 H new ATOM 1506 N LYS A 89 -4.340 11.672 -1.932 1.00 4.04 N ATOM 1507 CA LYS A 89 -4.475 11.868 -0.485 1.00 71.52 C ATOM 1508 C LYS A 89 -5.814 11.336 0.051 1.00 11.52 C ATOM 1509 O LYS A 89 -5.875 10.808 1.161 1.00 43.24 O ATOM 1510 CB LYS A 89 -4.323 13.355 -0.128 1.00 71.44 C ATOM 1511 CG LYS A 89 -2.914 13.905 -0.344 1.00 42.13 C ATOM 1512 CD LYS A 89 -2.792 15.359 0.115 1.00 43.11 C ATOM 1513 CE LYS A 89 -3.668 16.293 -0.711 1.00 33.41 C ATOM 1514 NZ LYS A 89 -3.586 17.703 -0.241 1.00 75.22 N ATOM 0 H LYS A 89 -4.197 12.536 -2.456 1.00 4.04 H new ATOM 0 HA LYS A 89 -3.678 11.296 -0.009 1.00 71.52 H new ATOM 0 HB2 LYS A 89 -5.024 13.936 -0.727 1.00 71.44 H new ATOM 0 HB3 LYS A 89 -4.602 13.498 0.916 1.00 71.44 H new ATOM 0 HG2 LYS A 89 -2.197 13.291 0.201 1.00 42.13 H new ATOM 0 HG3 LYS A 89 -2.655 13.835 -1.400 1.00 42.13 H new ATOM 0 HD2 LYS A 89 -3.073 15.433 1.166 1.00 43.11 H new ATOM 0 HD3 LYS A 89 -1.752 15.677 0.041 1.00 43.11 H new ATOM 0 HE2 LYS A 89 -3.365 16.242 -1.757 1.00 33.41 H new ATOM 0 HE3 LYS A 89 -4.703 15.955 -0.662 1.00 33.41 H new ATOM 0 HZ1 LYS A 89 -3.904 18.341 -0.999 1.00 75.22 H new ATOM 0 HZ2 LYS A 89 -4.194 17.827 0.593 1.00 75.22 H new ATOM 0 HZ3 LYS A 89 -2.603 17.928 0.011 1.00 75.22 H new ATOM 1528 N GLU A 90 -6.884 11.475 -0.733 1.00 25.32 N ATOM 1529 CA GLU A 90 -8.199 10.967 -0.320 1.00 42.20 C ATOM 1530 C GLU A 90 -8.193 9.436 -0.195 1.00 42.41 C ATOM 1531 O GLU A 90 -8.848 8.878 0.682 1.00 34.32 O ATOM 1532 CB GLU A 90 -9.302 11.417 -1.289 1.00 65.04 C ATOM 1533 CG GLU A 90 -9.489 12.930 -1.346 1.00 3.21 C ATOM 1534 CD GLU A 90 -10.809 13.332 -1.990 1.00 75.41 C ATOM 1535 OE1 GLU A 90 -11.000 13.057 -3.194 1.00 61.41 O ATOM 1536 OE2 GLU A 90 -11.675 13.896 -1.287 1.00 62.02 O ATOM 0 H GLU A 90 -6.871 11.929 -1.647 1.00 25.32 H new ATOM 0 HA GLU A 90 -8.413 11.390 0.662 1.00 42.20 H new ATOM 0 HB2 GLU A 90 -9.067 11.051 -2.288 1.00 65.04 H new ATOM 0 HB3 GLU A 90 -10.244 10.954 -0.994 1.00 65.04 H new ATOM 0 HG2 GLU A 90 -9.443 13.337 -0.336 1.00 3.21 H new ATOM 0 HG3 GLU A 90 -8.666 13.374 -1.906 1.00 3.21 H new ATOM 1543 N TRP A 91 -7.444 8.762 -1.071 1.00 13.23 N ATOM 1544 CA TRP A 91 -7.266 7.306 -0.976 1.00 64.30 C ATOM 1545 C TRP A 91 -6.490 6.947 0.300 1.00 35.31 C ATOM 1546 O TRP A 91 -6.863 6.032 1.038 1.00 14.31 O ATOM 1547 CB TRP A 91 -6.523 6.763 -2.207 1.00 14.53 C ATOM 1548 CG TRP A 91 -7.297 6.865 -3.492 1.00 25.01 C ATOM 1549 CD1 TRP A 91 -8.031 7.930 -3.934 1.00 12.52 C ATOM 1550 CD2 TRP A 91 -7.401 5.859 -4.511 1.00 60.43 C ATOM 1551 NE1 TRP A 91 -8.585 7.647 -5.155 1.00 12.45 N ATOM 1552 CE2 TRP A 91 -8.215 6.383 -5.532 1.00 44.34 C ATOM 1553 CE3 TRP A 91 -6.889 4.565 -4.655 1.00 14.41 C ATOM 1554 CZ2 TRP A 91 -8.524 5.661 -6.683 1.00 12.33 C ATOM 1555 CZ3 TRP A 91 -7.196 3.849 -5.800 1.00 35.02 C ATOM 1556 CH2 TRP A 91 -8.010 4.399 -6.800 1.00 70.14 C ATOM 0 H TRP A 91 -6.952 9.196 -1.852 1.00 13.23 H new ATOM 0 HA TRP A 91 -8.254 6.847 -0.936 1.00 64.30 H new ATOM 0 HB2 TRP A 91 -5.584 7.305 -2.318 1.00 14.53 H new ATOM 0 HB3 TRP A 91 -6.269 5.718 -2.032 1.00 14.53 H new ATOM 0 HD1 TRP A 91 -8.156 8.860 -3.399 1.00 12.52 H new ATOM 0 HE1 TRP A 91 -9.178 8.276 -5.696 1.00 12.45 H new ATOM 0 HE3 TRP A 91 -6.265 4.132 -3.887 1.00 14.41 H new ATOM 0 HZ2 TRP A 91 -9.148 6.084 -7.456 1.00 12.33 H new ATOM 0 HZ3 TRP A 91 -6.802 2.851 -5.924 1.00 35.02 H new ATOM 0 HH2 TRP A 91 -8.236 3.815 -7.680 1.00 70.14 H new ATOM 1567 N ILE A 92 -5.412 7.691 0.553 1.00 71.33 N ATOM 1568 CA ILE A 92 -4.609 7.518 1.769 1.00 11.21 C ATOM 1569 C ILE A 92 -5.462 7.714 3.033 1.00 25.11 C ATOM 1570 O ILE A 92 -5.371 6.937 3.987 1.00 23.35 O ATOM 1571 CB ILE A 92 -3.415 8.513 1.796 1.00 75.53 C ATOM 1572 CG1 ILE A 92 -2.521 8.313 0.557 1.00 71.21 C ATOM 1573 CG2 ILE A 92 -2.603 8.355 3.084 1.00 51.33 C ATOM 1574 CD1 ILE A 92 -1.351 9.275 0.479 1.00 11.12 C ATOM 0 H ILE A 92 -5.072 8.423 -0.070 1.00 71.33 H new ATOM 0 HA ILE A 92 -4.224 6.498 1.756 1.00 11.21 H new ATOM 0 HB ILE A 92 -3.813 9.527 1.773 1.00 75.53 H new ATOM 0 HG12 ILE A 92 -2.139 7.292 0.558 1.00 71.21 H new ATOM 0 HG13 ILE A 92 -3.130 8.425 -0.340 1.00 71.21 H new ATOM 0 HG21 ILE A 92 -1.773 9.062 3.080 1.00 51.33 H new ATOM 0 HG22 ILE A 92 -3.243 8.552 3.944 1.00 51.33 H new ATOM 0 HG23 ILE A 92 -2.214 7.339 3.146 1.00 51.33 H new ATOM 0 HD11 ILE A 92 -0.771 9.070 -0.420 1.00 11.12 H new ATOM 0 HD12 ILE A 92 -1.723 10.299 0.445 1.00 11.12 H new ATOM 0 HD13 ILE A 92 -0.717 9.149 1.357 1.00 11.12 H new ATOM 1586 N LYS A 93 -6.299 8.753 3.028 1.00 41.32 N ATOM 1587 CA LYS A 93 -7.166 9.051 4.171 1.00 74.21 C ATOM 1588 C LYS A 93 -8.254 7.980 4.347 1.00 11.23 C ATOM 1589 O LYS A 93 -8.451 7.464 5.444 1.00 75.24 O ATOM 1590 CB LYS A 93 -7.840 10.419 4.005 1.00 13.25 C ATOM 1591 CG LYS A 93 -8.584 10.879 5.259 1.00 42.35 C ATOM 1592 CD LYS A 93 -9.490 12.078 4.997 1.00 43.04 C ATOM 1593 CE LYS A 93 -10.650 11.727 4.068 1.00 0.32 C ATOM 1594 NZ LYS A 93 -11.626 12.843 3.957 1.00 21.42 N ATOM 0 H LYS A 93 -6.395 9.402 2.247 1.00 41.32 H new ATOM 0 HA LYS A 93 -6.530 9.061 5.056 1.00 74.21 H new ATOM 0 HB2 LYS A 93 -7.084 11.160 3.746 1.00 13.25 H new ATOM 0 HB3 LYS A 93 -8.540 10.373 3.171 1.00 13.25 H new ATOM 0 HG2 LYS A 93 -9.182 10.054 5.645 1.00 42.35 H new ATOM 0 HG3 LYS A 93 -7.860 11.137 6.032 1.00 42.35 H new ATOM 0 HD2 LYS A 93 -9.883 12.449 5.944 1.00 43.04 H new ATOM 0 HD3 LYS A 93 -8.905 12.885 4.557 1.00 43.04 H new ATOM 0 HE2 LYS A 93 -10.262 11.483 3.079 1.00 0.32 H new ATOM 0 HE3 LYS A 93 -11.157 10.837 4.440 1.00 0.32 H new ATOM 0 HZ1 LYS A 93 -12.398 12.566 3.318 1.00 21.42 H new ATOM 0 HZ2 LYS A 93 -12.015 13.059 4.897 1.00 21.42 H new ATOM 0 HZ3 LYS A 93 -11.148 13.686 3.578 1.00 21.42 H new ATOM 1608 N ASP A 94 -8.954 7.660 3.256 1.00 62.31 N ATOM 1609 CA ASP A 94 -10.082 6.719 3.293 1.00 12.01 C ATOM 1610 C ASP A 94 -9.677 5.386 3.945 1.00 73.11 C ATOM 1611 O ASP A 94 -10.414 4.833 4.765 1.00 61.43 O ATOM 1612 CB ASP A 94 -10.610 6.484 1.874 1.00 52.11 C ATOM 1613 CG ASP A 94 -11.982 5.834 1.867 1.00 34.02 C ATOM 1614 OD1 ASP A 94 -12.069 4.597 1.948 1.00 72.31 O ATOM 1615 OD2 ASP A 94 -12.991 6.569 1.801 1.00 11.30 O ATOM 0 H ASP A 94 -8.760 8.040 2.330 1.00 62.31 H new ATOM 0 HA ASP A 94 -10.874 7.157 3.901 1.00 12.01 H new ATOM 0 HB2 ASP A 94 -10.659 7.436 1.345 1.00 52.11 H new ATOM 0 HB3 ASP A 94 -9.909 5.852 1.328 1.00 52.11 H new ATOM 1620 N PHE A 95 -8.492 4.891 3.585 1.00 52.21 N ATOM 1621 CA PHE A 95 -7.941 3.672 4.187 1.00 41.15 C ATOM 1622 C PHE A 95 -7.876 3.798 5.722 1.00 62.42 C ATOM 1623 O PHE A 95 -8.217 2.867 6.455 1.00 62.25 O ATOM 1624 CB PHE A 95 -6.536 3.405 3.614 1.00 23.14 C ATOM 1625 CG PHE A 95 -5.975 2.037 3.941 1.00 65.54 C ATOM 1626 CD1 PHE A 95 -5.369 1.783 5.165 1.00 40.51 C ATOM 1627 CD2 PHE A 95 -6.048 1.006 3.013 1.00 5.34 C ATOM 1628 CE1 PHE A 95 -4.853 0.534 5.454 1.00 44.23 C ATOM 1629 CE2 PHE A 95 -5.534 -0.244 3.299 1.00 31.22 C ATOM 1630 CZ PHE A 95 -4.937 -0.480 4.521 1.00 13.20 C ATOM 0 H PHE A 95 -7.892 5.316 2.878 1.00 52.21 H new ATOM 0 HA PHE A 95 -8.596 2.835 3.945 1.00 41.15 H new ATOM 0 HB2 PHE A 95 -6.571 3.520 2.531 1.00 23.14 H new ATOM 0 HB3 PHE A 95 -5.852 4.164 3.993 1.00 23.14 H new ATOM 0 HD1 PHE A 95 -5.300 2.571 5.900 1.00 40.51 H new ATOM 0 HD2 PHE A 95 -6.513 1.184 2.055 1.00 5.34 H new ATOM 0 HE1 PHE A 95 -4.384 0.351 6.410 1.00 44.23 H new ATOM 0 HE2 PHE A 95 -5.599 -1.036 2.567 1.00 31.22 H new ATOM 0 HZ PHE A 95 -4.536 -1.457 4.747 1.00 13.20 H new ATOM 1640 N ILE A 96 -7.442 4.968 6.193 1.00 13.43 N ATOM 1641 CA ILE A 96 -7.336 5.248 7.629 1.00 73.05 C ATOM 1642 C ILE A 96 -8.724 5.416 8.278 1.00 74.43 C ATOM 1643 O ILE A 96 -8.972 4.908 9.373 1.00 11.22 O ATOM 1644 CB ILE A 96 -6.487 6.522 7.887 1.00 1.11 C ATOM 1645 CG1 ILE A 96 -5.097 6.375 7.243 1.00 44.22 C ATOM 1646 CG2 ILE A 96 -6.361 6.797 9.386 1.00 2.13 C ATOM 1647 CD1 ILE A 96 -4.232 7.612 7.365 1.00 24.31 C ATOM 0 H ILE A 96 -7.156 5.744 5.596 1.00 13.43 H new ATOM 0 HA ILE A 96 -6.841 4.390 8.084 1.00 73.05 H new ATOM 0 HB ILE A 96 -6.994 7.372 7.430 1.00 1.11 H new ATOM 0 HG12 ILE A 96 -4.580 5.534 7.706 1.00 44.22 H new ATOM 0 HG13 ILE A 96 -5.220 6.132 6.188 1.00 44.22 H new ATOM 0 HG21 ILE A 96 -5.762 7.694 9.542 1.00 2.13 H new ATOM 0 HG22 ILE A 96 -7.353 6.944 9.814 1.00 2.13 H new ATOM 0 HG23 ILE A 96 -5.878 5.949 9.872 1.00 2.13 H new ATOM 0 HD11 ILE A 96 -3.269 7.431 6.888 1.00 24.31 H new ATOM 0 HD12 ILE A 96 -4.727 8.452 6.877 1.00 24.31 H new ATOM 0 HD13 ILE A 96 -4.077 7.845 8.418 1.00 24.31 H new ATOM 1659 N GLU A 97 -9.624 6.125 7.594 1.00 15.51 N ATOM 1660 CA GLU A 97 -10.995 6.325 8.082 1.00 52.51 C ATOM 1661 C GLU A 97 -11.728 4.984 8.245 1.00 44.11 C ATOM 1662 O GLU A 97 -12.446 4.766 9.230 1.00 25.42 O ATOM 1663 CB GLU A 97 -11.762 7.245 7.122 1.00 24.33 C ATOM 1664 CG GLU A 97 -11.103 8.608 6.922 1.00 24.22 C ATOM 1665 CD GLU A 97 -11.083 9.454 8.188 1.00 44.54 C ATOM 1666 OE1 GLU A 97 -10.146 9.312 9.000 1.00 33.12 O ATOM 1667 OE2 GLU A 97 -12.010 10.272 8.374 1.00 65.14 O ATOM 0 H GLU A 97 -9.430 6.572 6.698 1.00 15.51 H new ATOM 0 HA GLU A 97 -10.945 6.797 9.063 1.00 52.51 H new ATOM 0 HB2 GLU A 97 -11.855 6.751 6.155 1.00 24.33 H new ATOM 0 HB3 GLU A 97 -12.773 7.392 7.503 1.00 24.33 H new ATOM 0 HG2 GLU A 97 -10.081 8.463 6.573 1.00 24.22 H new ATOM 0 HG3 GLU A 97 -11.633 9.150 6.139 1.00 24.22 H new ATOM 1674 N GLU A 98 -11.548 4.094 7.270 1.00 54.24 N ATOM 1675 CA GLU A 98 -12.018 2.711 7.385 1.00 24.32 C ATOM 1676 C GLU A 98 -11.400 2.037 8.617 1.00 73.24 C ATOM 1677 O GLU A 98 -12.110 1.494 9.456 1.00 12.21 O ATOM 1678 CB GLU A 98 -11.669 1.917 6.112 1.00 14.05 C ATOM 1679 CG GLU A 98 -12.667 2.088 4.966 1.00 52.03 C ATOM 1680 CD GLU A 98 -13.993 1.387 5.239 1.00 71.31 C ATOM 1681 OE1 GLU A 98 -13.978 0.174 5.531 1.00 10.14 O ATOM 1682 OE2 GLU A 98 -15.060 2.030 5.142 1.00 63.40 O ATOM 0 H GLU A 98 -11.079 4.305 6.389 1.00 54.24 H new ATOM 0 HA GLU A 98 -13.102 2.723 7.501 1.00 24.32 H new ATOM 0 HB2 GLU A 98 -10.682 2.224 5.766 1.00 14.05 H new ATOM 0 HB3 GLU A 98 -11.603 0.859 6.365 1.00 14.05 H new ATOM 0 HG2 GLU A 98 -12.848 3.150 4.801 1.00 52.03 H new ATOM 0 HG3 GLU A 98 -12.233 1.693 4.048 1.00 52.03 H new ATOM 1689 N ALA A 99 -10.072 2.108 8.728 1.00 62.14 N ATOM 1690 CA ALA A 99 -9.347 1.507 9.855 1.00 13.40 C ATOM 1691 C ALA A 99 -9.923 1.934 11.216 1.00 24.41 C ATOM 1692 O ALA A 99 -10.225 1.089 12.063 1.00 53.44 O ATOM 1693 CB ALA A 99 -7.874 1.870 9.772 1.00 2.54 C ATOM 0 H ALA A 99 -9.472 2.577 8.049 1.00 62.14 H new ATOM 0 HA ALA A 99 -9.465 0.426 9.782 1.00 13.40 H new ATOM 0 HB1 ALA A 99 -7.341 1.422 10.610 1.00 2.54 H new ATOM 0 HB2 ALA A 99 -7.459 1.495 8.836 1.00 2.54 H new ATOM 0 HB3 ALA A 99 -7.764 2.954 9.810 1.00 2.54 H new ATOM 1699 N LYS A 100 -10.079 3.244 11.414 1.00 4.33 N ATOM 1700 CA LYS A 100 -10.692 3.785 12.636 1.00 25.35 C ATOM 1701 C LYS A 100 -12.051 3.121 12.903 1.00 51.35 C ATOM 1702 O LYS A 100 -12.334 2.664 14.014 1.00 64.44 O ATOM 1703 CB LYS A 100 -10.893 5.302 12.501 1.00 62.24 C ATOM 1704 CG LYS A 100 -9.607 6.108 12.317 1.00 0.14 C ATOM 1705 CD LYS A 100 -9.916 7.579 12.043 1.00 20.33 C ATOM 1706 CE LYS A 100 -8.655 8.423 11.902 1.00 73.42 C ATOM 1707 NZ LYS A 100 -8.976 9.822 11.515 1.00 23.24 N ATOM 0 H LYS A 100 -9.789 3.955 10.743 1.00 4.33 H new ATOM 0 HA LYS A 100 -10.022 3.575 13.470 1.00 25.35 H new ATOM 0 HB2 LYS A 100 -11.549 5.493 11.651 1.00 62.24 H new ATOM 0 HB3 LYS A 100 -11.409 5.666 13.390 1.00 62.24 H new ATOM 0 HG2 LYS A 100 -8.990 6.023 13.211 1.00 0.14 H new ATOM 0 HG3 LYS A 100 -9.030 5.694 11.490 1.00 0.14 H new ATOM 0 HD2 LYS A 100 -10.507 7.659 11.131 1.00 20.33 H new ATOM 0 HD3 LYS A 100 -10.526 7.976 12.854 1.00 20.33 H new ATOM 0 HE2 LYS A 100 -8.108 8.422 12.845 1.00 73.42 H new ATOM 0 HE3 LYS A 100 -8.000 7.978 11.153 1.00 73.42 H new ATOM 0 HZ1 LYS A 100 -8.100 10.381 11.477 1.00 23.24 H new ATOM 0 HZ2 LYS A 100 -9.431 9.828 10.580 1.00 23.24 H new ATOM 0 HZ3 LYS A 100 -9.622 10.237 12.217 1.00 23.24 H new ATOM 1721 N GLU A 101 -12.874 3.060 11.856 1.00 14.32 N ATOM 1722 CA GLU A 101 -14.219 2.476 11.929 1.00 65.35 C ATOM 1723 C GLU A 101 -14.171 0.960 12.206 1.00 33.54 C ATOM 1724 O GLU A 101 -15.040 0.412 12.886 1.00 64.55 O ATOM 1725 CB GLU A 101 -14.959 2.757 10.612 1.00 34.44 C ATOM 1726 CG GLU A 101 -16.444 2.414 10.630 1.00 64.12 C ATOM 1727 CD GLU A 101 -17.144 2.805 9.338 1.00 23.25 C ATOM 1728 OE1 GLU A 101 -17.012 3.974 8.913 1.00 1.43 O ATOM 1729 OE2 GLU A 101 -17.824 1.950 8.734 1.00 43.52 O ATOM 0 H GLU A 101 -12.629 3.414 10.931 1.00 14.32 H new ATOM 0 HA GLU A 101 -14.752 2.937 12.761 1.00 65.35 H new ATOM 0 HB2 GLU A 101 -14.847 3.813 10.366 1.00 34.44 H new ATOM 0 HB3 GLU A 101 -14.479 2.191 9.813 1.00 34.44 H new ATOM 0 HG2 GLU A 101 -16.565 1.344 10.796 1.00 64.12 H new ATOM 0 HG3 GLU A 101 -16.922 2.923 11.467 1.00 64.12 H new ATOM 1736 N ARG A 102 -13.147 0.286 11.682 1.00 62.20 N ATOM 1737 CA ARG A 102 -12.971 -1.159 11.905 1.00 21.22 C ATOM 1738 C ARG A 102 -12.230 -1.427 13.224 1.00 61.21 C ATOM 1739 O ARG A 102 -12.113 -2.572 13.657 1.00 0.02 O ATOM 1740 CB ARG A 102 -12.195 -1.799 10.740 1.00 23.13 C ATOM 1741 CG ARG A 102 -12.725 -1.430 9.355 1.00 14.23 C ATOM 1742 CD ARG A 102 -14.188 -1.810 9.158 1.00 64.42 C ATOM 1743 NE ARG A 102 -14.732 -1.225 7.934 1.00 13.43 N ATOM 1744 CZ ARG A 102 -15.976 -1.318 7.564 1.00 62.05 C ATOM 1745 NH1 ARG A 102 -16.814 -2.025 8.244 1.00 12.32 N ATOM 1746 NH2 ARG A 102 -16.377 -0.707 6.501 1.00 33.34 N ATOM 0 H ARG A 102 -12.425 0.712 11.100 1.00 62.20 H new ATOM 0 HA ARG A 102 -13.963 -1.606 11.962 1.00 21.22 H new ATOM 0 HB2 ARG A 102 -11.149 -1.500 10.808 1.00 23.13 H new ATOM 0 HB3 ARG A 102 -12.225 -2.883 10.851 1.00 23.13 H new ATOM 0 HG2 ARG A 102 -12.610 -0.357 9.202 1.00 14.23 H new ATOM 0 HG3 ARG A 102 -12.121 -1.927 8.596 1.00 14.23 H new ATOM 0 HD2 ARG A 102 -14.281 -2.895 9.117 1.00 64.42 H new ATOM 0 HD3 ARG A 102 -14.771 -1.473 10.015 1.00 64.42 H new ATOM 0 HE ARG A 102 -14.093 -0.709 7.329 1.00 13.43 H new ATOM 0 HH11 ARG A 102 -16.504 -2.518 9.081 1.00 12.32 H new ATOM 0 HH12 ARG A 102 -17.787 -2.091 7.944 1.00 12.32 H new ATOM 0 HH21 ARG A 102 -15.719 -0.153 5.953 1.00 33.34 H new ATOM 0 HH22 ARG A 102 -17.352 -0.778 6.209 1.00 33.34 H new ATOM 1760 N GLY A 103 -11.725 -0.363 13.850 1.00 72.01 N ATOM 1761 CA GLY A 103 -11.005 -0.493 15.114 1.00 74.43 C ATOM 1762 C GLY A 103 -9.650 -1.184 14.974 1.00 63.32 C ATOM 1763 O GLY A 103 -9.283 -2.021 15.803 1.00 42.33 O ATOM 0 H GLY A 103 -11.801 0.593 13.503 1.00 72.01 H new ATOM 0 HA2 GLY A 103 -10.856 0.498 15.542 1.00 74.43 H new ATOM 0 HA3 GLY A 103 -11.620 -1.055 15.817 1.00 74.43 H new ATOM 1767 N VAL A 104 -8.903 -0.833 13.927 1.00 34.33 N ATOM 1768 CA VAL A 104 -7.583 -1.433 13.671 1.00 53.34 C ATOM 1769 C VAL A 104 -6.498 -0.370 13.435 1.00 42.15 C ATOM 1770 O VAL A 104 -6.790 0.794 13.151 1.00 32.34 O ATOM 1771 CB VAL A 104 -7.622 -2.401 12.457 1.00 13.25 C ATOM 1772 CG1 VAL A 104 -8.372 -3.687 12.808 1.00 41.11 C ATOM 1773 CG2 VAL A 104 -8.251 -1.718 11.246 1.00 31.02 C ATOM 0 H VAL A 104 -9.186 -0.136 13.238 1.00 34.33 H new ATOM 0 HA VAL A 104 -7.328 -1.995 14.570 1.00 53.34 H new ATOM 0 HB VAL A 104 -6.597 -2.670 12.203 1.00 13.25 H new ATOM 0 HG11 VAL A 104 -8.386 -4.348 11.942 1.00 41.11 H new ATOM 0 HG12 VAL A 104 -7.871 -4.186 13.637 1.00 41.11 H new ATOM 0 HG13 VAL A 104 -9.395 -3.445 13.095 1.00 41.11 H new ATOM 0 HG21 VAL A 104 -8.269 -2.412 10.406 1.00 31.02 H new ATOM 0 HG22 VAL A 104 -9.269 -1.414 11.488 1.00 31.02 H new ATOM 0 HG23 VAL A 104 -7.664 -0.839 10.978 1.00 31.02 H new ATOM 1783 N GLU A 105 -5.243 -0.796 13.554 1.00 75.05 N ATOM 1784 CA GLU A 105 -4.086 0.096 13.412 1.00 75.13 C ATOM 1785 C GLU A 105 -3.517 0.039 11.983 1.00 12.33 C ATOM 1786 O GLU A 105 -3.650 -0.971 11.290 1.00 20.22 O ATOM 1787 CB GLU A 105 -3.010 -0.311 14.431 1.00 43.43 C ATOM 1788 CG GLU A 105 -3.492 -0.267 15.878 1.00 54.00 C ATOM 1789 CD GLU A 105 -2.560 -0.996 16.835 1.00 73.24 C ATOM 1790 OE1 GLU A 105 -1.450 -0.490 17.099 1.00 35.01 O ATOM 1791 OE2 GLU A 105 -2.944 -2.079 17.338 1.00 5.01 O ATOM 0 H GLU A 105 -4.996 -1.766 13.751 1.00 75.05 H new ATOM 0 HA GLU A 105 -4.403 1.121 13.602 1.00 75.13 H new ATOM 0 HB2 GLU A 105 -2.667 -1.320 14.201 1.00 43.43 H new ATOM 0 HB3 GLU A 105 -2.150 0.350 14.323 1.00 43.43 H new ATOM 0 HG2 GLU A 105 -3.587 0.772 16.193 1.00 54.00 H new ATOM 0 HG3 GLU A 105 -4.486 -0.710 15.938 1.00 54.00 H new ATOM 1798 N VAL A 106 -2.873 1.122 11.545 1.00 73.22 N ATOM 1799 CA VAL A 106 -2.354 1.211 10.167 1.00 53.14 C ATOM 1800 C VAL A 106 -0.937 1.801 10.119 1.00 24.32 C ATOM 1801 O VAL A 106 -0.540 2.580 10.981 1.00 14.52 O ATOM 1802 CB VAL A 106 -3.289 2.069 9.267 1.00 61.03 C ATOM 1803 CG1 VAL A 106 -2.724 2.221 7.854 1.00 2.04 C ATOM 1804 CG2 VAL A 106 -4.688 1.465 9.213 1.00 31.52 C ATOM 0 H VAL A 106 -2.696 1.949 12.116 1.00 73.22 H new ATOM 0 HA VAL A 106 -2.319 0.189 9.788 1.00 53.14 H new ATOM 0 HB VAL A 106 -3.351 3.062 9.713 1.00 61.03 H new ATOM 0 HG11 VAL A 106 -3.403 2.826 7.254 1.00 2.04 H new ATOM 0 HG12 VAL A 106 -1.750 2.708 7.902 1.00 2.04 H new ATOM 0 HG13 VAL A 106 -2.615 1.237 7.398 1.00 2.04 H new ATOM 0 HG21 VAL A 106 -5.326 2.080 8.578 1.00 31.52 H new ATOM 0 HG22 VAL A 106 -4.633 0.456 8.803 1.00 31.52 H new ATOM 0 HG23 VAL A 106 -5.106 1.426 10.219 1.00 31.52 H new ATOM 1814 N PHE A 107 -0.169 1.401 9.113 1.00 22.43 N ATOM 1815 CA PHE A 107 1.145 1.988 8.856 1.00 31.40 C ATOM 1816 C PHE A 107 1.257 2.370 7.369 1.00 41.02 C ATOM 1817 O PHE A 107 1.440 1.512 6.509 1.00 40.42 O ATOM 1818 CB PHE A 107 2.251 0.996 9.262 1.00 52.25 C ATOM 1819 CG PHE A 107 3.660 1.558 9.274 1.00 3.22 C ATOM 1820 CD1 PHE A 107 3.946 2.818 8.762 1.00 3.11 C ATOM 1821 CD2 PHE A 107 4.706 0.806 9.794 1.00 54.24 C ATOM 1822 CE1 PHE A 107 5.233 3.309 8.767 1.00 43.12 C ATOM 1823 CE2 PHE A 107 5.998 1.294 9.795 1.00 55.31 C ATOM 1824 CZ PHE A 107 6.260 2.549 9.281 1.00 63.03 C ATOM 0 H PHE A 107 -0.434 0.667 8.456 1.00 22.43 H new ATOM 0 HA PHE A 107 1.267 2.892 9.453 1.00 31.40 H new ATOM 0 HB2 PHE A 107 2.023 0.612 10.256 1.00 52.25 H new ATOM 0 HB3 PHE A 107 2.223 0.148 8.578 1.00 52.25 H new ATOM 0 HD1 PHE A 107 3.148 3.421 8.354 1.00 3.11 H new ATOM 0 HD2 PHE A 107 4.506 -0.173 10.203 1.00 54.24 H new ATOM 0 HE1 PHE A 107 5.437 4.291 8.367 1.00 43.12 H new ATOM 0 HE2 PHE A 107 6.802 0.695 10.197 1.00 55.31 H new ATOM 0 HZ PHE A 107 7.269 2.934 9.282 1.00 63.03 H new ATOM 1834 N VAL A 108 1.128 3.664 7.082 1.00 33.02 N ATOM 1835 CA VAL A 108 1.155 4.174 5.707 1.00 55.34 C ATOM 1836 C VAL A 108 2.547 4.702 5.317 1.00 75.30 C ATOM 1837 O VAL A 108 3.040 5.675 5.894 1.00 52.43 O ATOM 1838 CB VAL A 108 0.127 5.317 5.516 1.00 5.35 C ATOM 1839 CG1 VAL A 108 0.077 5.774 4.059 1.00 41.14 C ATOM 1840 CG2 VAL A 108 -1.259 4.897 6.001 1.00 44.00 C ATOM 0 H VAL A 108 1.002 4.387 7.790 1.00 33.02 H new ATOM 0 HA VAL A 108 0.900 3.332 5.063 1.00 55.34 H new ATOM 0 HB VAL A 108 0.454 6.161 6.123 1.00 5.35 H new ATOM 0 HG11 VAL A 108 -0.653 6.577 3.954 1.00 41.14 H new ATOM 0 HG12 VAL A 108 1.060 6.136 3.757 1.00 41.14 H new ATOM 0 HG13 VAL A 108 -0.212 4.936 3.425 1.00 41.14 H new ATOM 0 HG21 VAL A 108 -1.960 5.719 5.855 1.00 44.00 H new ATOM 0 HG22 VAL A 108 -1.595 4.028 5.435 1.00 44.00 H new ATOM 0 HG23 VAL A 108 -1.213 4.644 7.060 1.00 44.00 H new ATOM 1850 N VAL A 109 3.173 4.057 4.337 1.00 31.41 N ATOM 1851 CA VAL A 109 4.449 4.526 3.782 1.00 11.12 C ATOM 1852 C VAL A 109 4.310 4.805 2.278 1.00 55.34 C ATOM 1853 O VAL A 109 4.040 3.895 1.498 1.00 14.35 O ATOM 1854 CB VAL A 109 5.588 3.493 3.999 1.00 11.12 C ATOM 1855 CG1 VAL A 109 6.914 4.015 3.438 1.00 42.52 C ATOM 1856 CG2 VAL A 109 5.723 3.134 5.474 1.00 12.24 C ATOM 0 H VAL A 109 2.819 3.203 3.906 1.00 31.41 H new ATOM 0 HA VAL A 109 4.707 5.444 4.310 1.00 11.12 H new ATOM 0 HB VAL A 109 5.328 2.585 3.455 1.00 11.12 H new ATOM 0 HG11 VAL A 109 7.696 3.273 3.602 1.00 42.52 H new ATOM 0 HG12 VAL A 109 6.809 4.201 2.369 1.00 42.52 H new ATOM 0 HG13 VAL A 109 7.182 4.943 3.943 1.00 42.52 H new ATOM 0 HG21 VAL A 109 6.527 2.409 5.600 1.00 12.24 H new ATOM 0 HG22 VAL A 109 5.951 4.032 6.048 1.00 12.24 H new ATOM 0 HG23 VAL A 109 4.787 2.703 5.831 1.00 12.24 H new ATOM 1866 N TYR A 110 4.493 6.057 1.863 1.00 42.12 N ATOM 1867 CA TYR A 110 4.338 6.409 0.444 1.00 21.00 C ATOM 1868 C TYR A 110 5.562 7.142 -0.125 1.00 53.42 C ATOM 1869 O TYR A 110 6.257 7.883 0.582 1.00 22.42 O ATOM 1870 CB TYR A 110 3.054 7.224 0.215 1.00 22.22 C ATOM 1871 CG TYR A 110 2.860 8.407 1.144 1.00 22.45 C ATOM 1872 CD1 TYR A 110 2.304 8.234 2.407 1.00 23.11 C ATOM 1873 CD2 TYR A 110 3.202 9.696 0.752 1.00 11.02 C ATOM 1874 CE1 TYR A 110 2.098 9.305 3.250 1.00 51.33 C ATOM 1875 CE2 TYR A 110 3.000 10.772 1.592 1.00 4.31 C ATOM 1876 CZ TYR A 110 2.446 10.571 2.838 1.00 54.14 C ATOM 1877 OH TYR A 110 2.248 11.642 3.680 1.00 61.43 O ATOM 0 H TYR A 110 4.744 6.835 2.472 1.00 42.12 H new ATOM 0 HA TYR A 110 4.255 5.469 -0.102 1.00 21.00 H new ATOM 0 HB2 TYR A 110 3.053 7.587 -0.813 1.00 22.22 H new ATOM 0 HB3 TYR A 110 2.198 6.558 0.319 1.00 22.22 H new ATOM 0 HD1 TYR A 110 2.029 7.242 2.733 1.00 23.11 H new ATOM 0 HD2 TYR A 110 3.633 9.858 -0.225 1.00 11.02 H new ATOM 0 HE1 TYR A 110 1.666 9.151 4.228 1.00 51.33 H new ATOM 0 HE2 TYR A 110 3.275 11.767 1.275 1.00 4.31 H new ATOM 0 HH TYR A 110 2.761 11.509 4.504 1.00 61.43 H new ATOM 1887 N ASN A 111 5.814 6.921 -1.417 1.00 13.24 N ATOM 1888 CA ASN A 111 6.979 7.485 -2.107 1.00 42.53 C ATOM 1889 C ASN A 111 6.584 8.615 -3.060 1.00 21.32 C ATOM 1890 O ASN A 111 5.736 8.440 -3.933 1.00 60.11 O ATOM 1891 CB ASN A 111 7.707 6.396 -2.904 1.00 63.23 C ATOM 1892 CG ASN A 111 8.886 6.943 -3.695 1.00 13.21 C ATOM 1893 OD1 ASN A 111 8.736 7.419 -4.819 1.00 43.23 O ATOM 1894 ND2 ASN A 111 10.069 6.876 -3.122 1.00 31.11 N ATOM 0 H ASN A 111 5.218 6.348 -2.014 1.00 13.24 H new ATOM 0 HA ASN A 111 7.638 7.891 -1.340 1.00 42.53 H new ATOM 0 HB2 ASN A 111 8.059 5.624 -2.220 1.00 63.23 H new ATOM 0 HB3 ASN A 111 7.004 5.920 -3.588 1.00 63.23 H new ATOM 0 HD21 ASN A 111 10.893 7.225 -3.611 1.00 31.11 H new ATOM 0 HD22 ASN A 111 10.162 6.476 -2.188 1.00 31.11 H new ATOM 1901 N ASN A 112 7.230 9.762 -2.904 1.00 4.44 N ATOM 1902 CA ASN A 112 7.045 10.886 -3.818 1.00 23.12 C ATOM 1903 C ASN A 112 8.265 11.809 -3.758 1.00 20.21 C ATOM 1904 O ASN A 112 8.879 11.980 -2.704 1.00 22.02 O ATOM 1905 CB ASN A 112 5.771 11.660 -3.471 1.00 73.20 C ATOM 1906 CG ASN A 112 5.285 12.543 -4.608 1.00 41.33 C ATOM 1907 OD1 ASN A 112 6.064 13.004 -5.433 1.00 45.31 O ATOM 1908 ND2 ASN A 112 3.992 12.782 -4.657 1.00 14.41 N ATOM 0 H ASN A 112 7.892 9.941 -2.149 1.00 4.44 H new ATOM 0 HA ASN A 112 6.941 10.500 -4.832 1.00 23.12 H new ATOM 0 HB2 ASN A 112 4.984 10.954 -3.205 1.00 73.20 H new ATOM 0 HB3 ASN A 112 5.956 12.278 -2.592 1.00 73.20 H new ATOM 0 HD21 ASN A 112 3.609 13.368 -5.399 1.00 14.41 H new ATOM 0 HD22 ASN A 112 3.372 12.381 -3.953 1.00 14.41 H new ATOM 1915 N LYS A 113 8.594 12.418 -4.885 1.00 71.21 N ATOM 1916 CA LYS A 113 9.821 13.205 -5.018 1.00 63.42 C ATOM 1917 C LYS A 113 9.606 14.663 -4.569 1.00 43.52 C ATOM 1918 O LYS A 113 9.948 15.611 -5.279 1.00 64.51 O ATOM 1919 CB LYS A 113 10.314 13.127 -6.474 1.00 60.25 C ATOM 1920 CG LYS A 113 11.095 11.848 -6.811 1.00 35.11 C ATOM 1921 CD LYS A 113 10.338 10.553 -6.479 1.00 4.42 C ATOM 1922 CE LYS A 113 9.063 10.382 -7.300 1.00 53.42 C ATOM 1923 NZ LYS A 113 8.396 9.076 -7.028 1.00 65.50 N ATOM 0 H LYS A 113 8.026 12.385 -5.732 1.00 71.21 H new ATOM 0 HA LYS A 113 10.586 12.789 -4.362 1.00 63.42 H new ATOM 0 HB2 LYS A 113 9.454 13.200 -7.140 1.00 60.25 H new ATOM 0 HB3 LYS A 113 10.948 13.990 -6.677 1.00 60.25 H new ATOM 0 HG2 LYS A 113 11.340 11.852 -7.873 1.00 35.11 H new ATOM 0 HG3 LYS A 113 12.039 11.856 -6.266 1.00 35.11 H new ATOM 0 HD2 LYS A 113 10.994 9.700 -6.654 1.00 4.42 H new ATOM 0 HD3 LYS A 113 10.085 10.548 -5.419 1.00 4.42 H new ATOM 0 HE2 LYS A 113 8.374 11.196 -7.073 1.00 53.42 H new ATOM 0 HE3 LYS A 113 9.302 10.453 -8.361 1.00 53.42 H new ATOM 0 HZ1 LYS A 113 8.502 8.453 -7.854 1.00 65.50 H new ATOM 0 HZ2 LYS A 113 8.835 8.628 -6.198 1.00 65.50 H new ATOM 0 HZ3 LYS A 113 7.385 9.235 -6.842 1.00 65.50 H new ATOM 1937 N ASP A 114 9.066 14.818 -3.359 1.00 35.43 N ATOM 1938 CA ASP A 114 8.749 16.135 -2.789 1.00 34.14 C ATOM 1939 C ASP A 114 9.070 16.198 -1.289 1.00 54.32 C ATOM 1940 O ASP A 114 9.509 15.218 -0.680 1.00 44.23 O ATOM 1941 CB ASP A 114 7.263 16.463 -2.990 1.00 3.23 C ATOM 1942 CG ASP A 114 6.958 16.997 -4.373 1.00 40.13 C ATOM 1943 OD1 ASP A 114 6.865 16.199 -5.320 1.00 52.12 O ATOM 1944 OD2 ASP A 114 6.775 18.225 -4.509 1.00 25.44 O ATOM 0 H ASP A 114 8.835 14.037 -2.745 1.00 35.43 H new ATOM 0 HA ASP A 114 9.368 16.865 -3.311 1.00 34.14 H new ATOM 0 HB2 ASP A 114 6.671 15.565 -2.815 1.00 3.23 H new ATOM 0 HB3 ASP A 114 6.955 17.198 -2.246 1.00 3.23 H new ATOM 1949 N ASP A 115 8.838 17.370 -0.702 1.00 54.13 N ATOM 1950 CA ASP A 115 8.980 17.565 0.742 1.00 34.13 C ATOM 1951 C ASP A 115 7.700 18.170 1.348 1.00 71.05 C ATOM 1952 O ASP A 115 6.952 17.483 2.044 1.00 31.34 O ATOM 1953 CB ASP A 115 10.188 18.461 1.035 1.00 21.33 C ATOM 1954 CG ASP A 115 10.385 18.692 2.523 1.00 0.32 C ATOM 1955 OD1 ASP A 115 10.955 17.811 3.195 1.00 42.33 O ATOM 1956 OD2 ASP A 115 9.963 19.756 3.025 1.00 13.34 O ATOM 0 H ASP A 115 8.548 18.207 -1.208 1.00 54.13 H new ATOM 0 HA ASP A 115 9.141 16.591 1.205 1.00 34.13 H new ATOM 0 HB2 ASP A 115 11.086 18.005 0.618 1.00 21.33 H new ATOM 0 HB3 ASP A 115 10.056 19.420 0.535 1.00 21.33 H new ATOM 1961 N ASP A 116 7.431 19.445 1.053 1.00 52.51 N ATOM 1962 CA ASP A 116 6.277 20.149 1.628 1.00 75.14 C ATOM 1963 C ASP A 116 4.948 19.422 1.335 1.00 61.11 C ATOM 1964 O ASP A 116 4.105 19.285 2.224 1.00 31.32 O ATOM 1965 CB ASP A 116 6.225 21.591 1.113 1.00 61.35 C ATOM 1966 CG ASP A 116 5.160 22.421 1.813 1.00 54.45 C ATOM 1967 OD1 ASP A 116 5.466 23.026 2.862 1.00 31.42 O ATOM 1968 OD2 ASP A 116 4.012 22.472 1.325 1.00 72.33 O ATOM 0 H ASP A 116 7.995 20.012 0.420 1.00 52.51 H new ATOM 0 HA ASP A 116 6.406 20.160 2.710 1.00 75.14 H new ATOM 0 HB2 ASP A 116 7.199 22.060 1.256 1.00 61.35 H new ATOM 0 HB3 ASP A 116 6.029 21.584 0.041 1.00 61.35 H new ATOM 1973 N ARG A 117 4.768 18.941 0.099 1.00 40.22 N ATOM 1974 CA ARG A 117 3.553 18.187 -0.262 1.00 64.52 C ATOM 1975 C ARG A 117 3.378 16.928 0.609 1.00 44.04 C ATOM 1976 O ARG A 117 2.264 16.447 0.806 1.00 10.32 O ATOM 1977 CB ARG A 117 3.549 17.802 -1.756 1.00 21.25 C ATOM 1978 CG ARG A 117 3.457 19.002 -2.698 1.00 64.11 C ATOM 1979 CD ARG A 117 2.942 18.624 -4.085 1.00 14.02 C ATOM 1980 NE ARG A 117 3.871 17.778 -4.832 1.00 23.54 N ATOM 1981 CZ ARG A 117 3.627 17.299 -6.024 1.00 43.21 C ATOM 1982 NH1 ARG A 117 2.515 17.572 -6.629 1.00 61.41 N ATOM 1983 NH2 ARG A 117 4.506 16.559 -6.614 1.00 4.35 N ATOM 0 H ARG A 117 5.437 19.056 -0.662 1.00 40.22 H new ATOM 0 HA ARG A 117 2.708 18.850 -0.073 1.00 64.52 H new ATOM 0 HB2 ARG A 117 4.458 17.243 -1.981 1.00 21.25 H new ATOM 0 HB3 ARG A 117 2.709 17.135 -1.948 1.00 21.25 H new ATOM 0 HG2 ARG A 117 2.797 19.752 -2.262 1.00 64.11 H new ATOM 0 HG3 ARG A 117 4.441 19.461 -2.793 1.00 64.11 H new ATOM 0 HD2 ARG A 117 1.989 18.105 -3.983 1.00 14.02 H new ATOM 0 HD3 ARG A 117 2.750 19.533 -4.655 1.00 14.02 H new ATOM 0 HE ARG A 117 4.764 17.547 -4.397 1.00 23.54 H new ATOM 0 HH11 ARG A 117 1.820 18.166 -6.176 1.00 61.41 H new ATOM 0 HH12 ARG A 117 2.334 17.194 -7.559 1.00 61.41 H new ATOM 0 HH21 ARG A 117 5.390 16.349 -6.150 1.00 4.35 H new ATOM 0 HH22 ARG A 117 4.316 16.185 -7.544 1.00 4.35 H new ATOM 1997 N ARG A 118 4.479 16.381 1.107 1.00 32.44 N ATOM 1998 CA ARG A 118 4.423 15.256 2.053 1.00 31.44 C ATOM 1999 C ARG A 118 4.213 15.751 3.497 1.00 1.14 C ATOM 2000 O ARG A 118 3.514 15.117 4.291 1.00 24.13 O ATOM 2001 CB ARG A 118 5.702 14.411 1.940 1.00 32.53 C ATOM 2002 CG ARG A 118 5.575 13.178 1.038 1.00 64.43 C ATOM 2003 CD ARG A 118 5.111 13.500 -0.385 1.00 61.33 C ATOM 2004 NE ARG A 118 3.665 13.747 -0.489 1.00 11.15 N ATOM 2005 CZ ARG A 118 2.840 13.011 -1.202 1.00 31.12 C ATOM 2006 NH1 ARG A 118 3.246 11.908 -1.750 1.00 24.14 N ATOM 2007 NH2 ARG A 118 1.603 13.371 -1.339 1.00 4.20 N ATOM 0 H ARG A 118 5.423 16.691 0.877 1.00 32.44 H new ATOM 0 HA ARG A 118 3.568 14.631 1.796 1.00 31.44 H new ATOM 0 HB2 ARG A 118 6.506 15.042 1.560 1.00 32.53 H new ATOM 0 HB3 ARG A 118 5.996 14.086 2.938 1.00 32.53 H new ATOM 0 HG2 ARG A 118 6.540 12.673 0.990 1.00 64.43 H new ATOM 0 HG3 ARG A 118 4.871 12.479 1.490 1.00 64.43 H new ATOM 0 HD2 ARG A 118 5.648 14.378 -0.744 1.00 61.33 H new ATOM 0 HD3 ARG A 118 5.378 12.672 -1.042 1.00 61.33 H new ATOM 0 HE ARG A 118 3.277 14.539 0.024 1.00 11.15 H new ATOM 0 HH11 ARG A 118 4.212 11.604 -1.630 1.00 24.14 H new ATOM 0 HH12 ARG A 118 2.599 11.344 -2.301 1.00 24.14 H new ATOM 0 HH21 ARG A 118 1.268 14.226 -0.894 1.00 4.20 H new ATOM 0 HH22 ARG A 118 0.964 12.800 -1.892 1.00 4.20 H new ATOM 2021 N LYS A 119 4.818 16.892 3.818 1.00 13.34 N ATOM 2022 CA LYS A 119 4.691 17.512 5.142 1.00 5.31 C ATOM 2023 C LYS A 119 3.218 17.830 5.473 1.00 41.31 C ATOM 2024 O LYS A 119 2.735 17.522 6.566 1.00 33.22 O ATOM 2025 CB LYS A 119 5.564 18.784 5.182 1.00 3.20 C ATOM 2026 CG LYS A 119 5.615 19.508 6.533 1.00 72.11 C ATOM 2027 CD LYS A 119 4.478 20.519 6.714 1.00 33.53 C ATOM 2028 CE LYS A 119 4.464 21.572 5.606 1.00 35.40 C ATOM 2029 NZ LYS A 119 5.766 22.286 5.485 1.00 42.53 N ATOM 0 H LYS A 119 5.410 17.415 3.172 1.00 13.34 H new ATOM 0 HA LYS A 119 5.039 16.813 5.903 1.00 5.31 H new ATOM 0 HB2 LYS A 119 6.581 18.515 4.895 1.00 3.20 H new ATOM 0 HB3 LYS A 119 5.194 19.481 4.430 1.00 3.20 H new ATOM 0 HG2 LYS A 119 5.570 18.772 7.335 1.00 72.11 H new ATOM 0 HG3 LYS A 119 6.571 20.024 6.627 1.00 72.11 H new ATOM 0 HD2 LYS A 119 3.524 19.993 6.725 1.00 33.53 H new ATOM 0 HD3 LYS A 119 4.582 21.012 7.681 1.00 33.53 H new ATOM 0 HE2 LYS A 119 4.226 21.093 4.656 1.00 35.40 H new ATOM 0 HE3 LYS A 119 3.673 22.295 5.806 1.00 35.40 H new ATOM 0 HZ1 LYS A 119 5.735 22.929 4.668 1.00 42.53 H new ATOM 0 HZ2 LYS A 119 5.943 22.835 6.351 1.00 42.53 H new ATOM 0 HZ3 LYS A 119 6.531 21.594 5.352 1.00 42.53 H new ATOM 2043 N GLU A 120 2.506 18.441 4.521 1.00 33.00 N ATOM 2044 CA GLU A 120 1.079 18.757 4.697 1.00 10.02 C ATOM 2045 C GLU A 120 0.245 17.491 4.969 1.00 54.14 C ATOM 2046 O GLU A 120 -0.737 17.525 5.716 1.00 32.41 O ATOM 2047 CB GLU A 120 0.532 19.476 3.454 1.00 34.54 C ATOM 2048 CG GLU A 120 0.683 18.672 2.166 1.00 43.21 C ATOM 2049 CD GLU A 120 -0.010 19.309 0.972 1.00 44.43 C ATOM 2050 OE1 GLU A 120 0.503 20.319 0.446 1.00 71.31 O ATOM 2051 OE2 GLU A 120 -1.067 18.792 0.545 1.00 0.45 O ATOM 0 H GLU A 120 2.891 18.728 3.621 1.00 33.00 H new ATOM 0 HA GLU A 120 0.996 19.413 5.564 1.00 10.02 H new ATOM 0 HB2 GLU A 120 -0.523 19.701 3.610 1.00 34.54 H new ATOM 0 HB3 GLU A 120 1.048 20.429 3.340 1.00 34.54 H new ATOM 0 HG2 GLU A 120 1.743 18.555 1.942 1.00 43.21 H new ATOM 0 HG3 GLU A 120 0.278 17.672 2.321 1.00 43.21 H new ATOM 2058 N ALA A 121 0.648 16.377 4.359 1.00 24.41 N ATOM 2059 CA ALA A 121 -0.052 15.100 4.522 1.00 61.41 C ATOM 2060 C ALA A 121 0.154 14.521 5.931 1.00 23.20 C ATOM 2061 O ALA A 121 -0.808 14.150 6.604 1.00 44.14 O ATOM 2062 CB ALA A 121 0.408 14.109 3.457 1.00 1.52 C ATOM 0 H ALA A 121 1.460 16.332 3.744 1.00 24.41 H new ATOM 0 HA ALA A 121 -1.120 15.281 4.397 1.00 61.41 H new ATOM 0 HB1 ALA A 121 -0.119 13.164 3.588 1.00 1.52 H new ATOM 0 HB2 ALA A 121 0.191 14.511 2.468 1.00 1.52 H new ATOM 0 HB3 ALA A 121 1.481 13.943 3.554 1.00 1.52 H new ATOM 2068 N GLN A 122 1.408 14.464 6.384 1.00 62.32 N ATOM 2069 CA GLN A 122 1.721 13.951 7.728 1.00 11.10 C ATOM 2070 C GLN A 122 1.057 14.802 8.826 1.00 12.30 C ATOM 2071 O GLN A 122 0.787 14.316 9.924 1.00 74.24 O ATOM 2072 CB GLN A 122 3.241 13.890 7.949 1.00 71.33 C ATOM 2073 CG GLN A 122 3.954 12.903 7.030 1.00 72.02 C ATOM 2074 CD GLN A 122 5.445 12.772 7.320 1.00 43.25 C ATOM 2075 OE1 GLN A 122 6.268 13.489 6.759 1.00 25.44 O ATOM 2076 NE2 GLN A 122 5.808 11.837 8.177 1.00 1.14 N ATOM 0 H GLN A 122 2.222 14.764 5.847 1.00 62.32 H new ATOM 0 HA GLN A 122 1.317 12.941 7.794 1.00 11.10 H new ATOM 0 HB2 GLN A 122 3.662 14.884 7.797 1.00 71.33 H new ATOM 0 HB3 GLN A 122 3.438 13.616 8.985 1.00 71.33 H new ATOM 0 HG2 GLN A 122 3.485 11.924 7.128 1.00 72.02 H new ATOM 0 HG3 GLN A 122 3.819 13.219 5.996 1.00 72.02 H new ATOM 0 HE21 GLN A 122 5.101 11.256 8.628 1.00 1.14 H new ATOM 0 HE22 GLN A 122 6.796 11.695 8.389 1.00 1.14 H new ATOM 2085 N GLN A 123 0.797 16.069 8.525 1.00 24.13 N ATOM 2086 CA GLN A 123 0.094 16.957 9.459 1.00 33.42 C ATOM 2087 C GLN A 123 -1.398 16.584 9.581 1.00 55.12 C ATOM 2088 O GLN A 123 -2.014 16.766 10.633 1.00 44.44 O ATOM 2089 CB GLN A 123 0.228 18.415 8.991 1.00 70.43 C ATOM 2090 CG GLN A 123 -0.380 19.434 9.953 1.00 71.44 C ATOM 2091 CD GLN A 123 -0.322 20.865 9.433 1.00 12.40 C ATOM 2092 OE1 GLN A 123 -0.457 21.040 8.132 1.00 24.23 O flip ATOM 2093 NE2 GLN A 123 -0.184 21.809 10.200 1.00 74.24 N flip ATOM 0 H GLN A 123 1.060 16.509 7.643 1.00 24.13 H new ATOM 0 HA GLN A 123 0.551 16.841 10.442 1.00 33.42 H new ATOM 0 HB2 GLN A 123 1.284 18.646 8.853 1.00 70.43 H new ATOM 0 HB3 GLN A 123 -0.251 18.519 8.017 1.00 70.43 H new ATOM 0 HG2 GLN A 123 -1.419 19.167 10.145 1.00 71.44 H new ATOM 0 HG3 GLN A 123 0.144 19.380 10.907 1.00 71.44 H new ATOM 0 HE21 GLN A 123 -0.082 21.642 11.201 1.00 74.24 H new ATOM 0 HE22 GLN A 123 -0.171 22.763 9.838 1.00 74.24 H new ATOM 2102 N GLU A 124 -1.965 16.053 8.500 1.00 14.34 N ATOM 2103 CA GLU A 124 -3.405 15.771 8.429 1.00 71.50 C ATOM 2104 C GLU A 124 -3.745 14.311 8.800 1.00 14.13 C ATOM 2105 O GLU A 124 -4.641 14.057 9.608 1.00 12.35 O ATOM 2106 CB GLU A 124 -3.908 16.077 7.007 1.00 44.31 C ATOM 2107 CG GLU A 124 -5.414 15.892 6.810 1.00 71.31 C ATOM 2108 CD GLU A 124 -6.249 16.845 7.654 1.00 12.03 C ATOM 2109 OE1 GLU A 124 -6.147 18.071 7.446 1.00 1.14 O ATOM 2110 OE2 GLU A 124 -7.005 16.370 8.531 1.00 74.41 O ATOM 0 H GLU A 124 -1.450 15.807 7.655 1.00 14.34 H new ATOM 0 HA GLU A 124 -3.903 16.409 9.159 1.00 71.50 H new ATOM 0 HB2 GLU A 124 -3.646 17.105 6.756 1.00 44.31 H new ATOM 0 HB3 GLU A 124 -3.381 15.433 6.303 1.00 44.31 H new ATOM 0 HG2 GLU A 124 -5.657 16.040 5.758 1.00 71.31 H new ATOM 0 HG3 GLU A 124 -5.683 14.865 7.058 1.00 71.31 H new ATOM 2117 N PHE A 125 -3.024 13.358 8.211 1.00 5.55 N ATOM 2118 CA PHE A 125 -3.394 11.933 8.296 1.00 22.21 C ATOM 2119 C PHE A 125 -2.728 11.192 9.473 1.00 25.43 C ATOM 2120 O PHE A 125 -3.151 10.095 9.836 1.00 33.14 O ATOM 2121 CB PHE A 125 -3.039 11.230 6.978 1.00 70.43 C ATOM 2122 CG PHE A 125 -3.588 11.931 5.759 1.00 52.33 C ATOM 2123 CD1 PHE A 125 -4.942 12.218 5.656 1.00 10.24 C ATOM 2124 CD2 PHE A 125 -2.748 12.307 4.719 1.00 73.20 C ATOM 2125 CE1 PHE A 125 -5.443 12.863 4.543 1.00 32.13 C ATOM 2126 CE2 PHE A 125 -3.248 12.951 3.605 1.00 21.25 C ATOM 2127 CZ PHE A 125 -4.597 13.230 3.517 1.00 42.31 C ATOM 0 H PHE A 125 -2.180 13.540 7.668 1.00 5.55 H new ATOM 0 HA PHE A 125 -4.469 11.900 8.476 1.00 22.21 H new ATOM 0 HB2 PHE A 125 -1.955 11.162 6.892 1.00 70.43 H new ATOM 0 HB3 PHE A 125 -3.421 10.210 7.004 1.00 70.43 H new ATOM 0 HD1 PHE A 125 -5.611 11.934 6.455 1.00 10.24 H new ATOM 0 HD2 PHE A 125 -1.691 12.093 4.782 1.00 73.20 H new ATOM 0 HE1 PHE A 125 -6.499 13.081 4.475 1.00 32.13 H new ATOM 0 HE2 PHE A 125 -2.584 13.236 2.803 1.00 21.25 H new ATOM 0 HZ PHE A 125 -4.989 13.735 2.647 1.00 42.31 H new ATOM 2137 N ARG A 126 -1.691 11.776 10.065 1.00 74.43 N ATOM 2138 CA ARG A 126 -0.969 11.112 11.161 1.00 71.42 C ATOM 2139 C ARG A 126 -1.784 11.146 12.466 1.00 13.45 C ATOM 2140 O ARG A 126 -2.107 12.214 12.987 1.00 2.33 O ATOM 2141 CB ARG A 126 0.413 11.764 11.365 1.00 33.21 C ATOM 2142 CG ARG A 126 1.421 10.945 12.194 1.00 55.31 C ATOM 2143 CD ARG A 126 1.053 10.844 13.678 1.00 4.23 C ATOM 2144 NE ARG A 126 0.835 12.156 14.289 1.00 24.05 N ATOM 2145 CZ ARG A 126 0.346 12.337 15.489 1.00 34.42 C ATOM 2146 NH1 ARG A 126 0.054 11.326 16.249 1.00 43.14 N ATOM 2147 NH2 ARG A 126 0.154 13.535 15.933 1.00 1.22 N ATOM 0 H ARG A 126 -1.330 12.696 9.813 1.00 74.43 H new ATOM 0 HA ARG A 126 -0.824 10.067 10.887 1.00 71.42 H new ATOM 0 HB2 ARG A 126 0.850 11.960 10.386 1.00 33.21 H new ATOM 0 HB3 ARG A 126 0.271 12.730 11.850 1.00 33.21 H new ATOM 0 HG2 ARG A 126 1.492 9.941 11.776 1.00 55.31 H new ATOM 0 HG3 ARG A 126 2.408 11.399 12.103 1.00 55.31 H new ATOM 0 HD2 ARG A 126 0.151 10.242 13.786 1.00 4.23 H new ATOM 0 HD3 ARG A 126 1.849 10.325 14.212 1.00 4.23 H new ATOM 0 HE ARG A 126 1.080 12.983 13.744 1.00 24.05 H new ATOM 0 HH11 ARG A 126 0.205 10.375 15.913 1.00 43.14 H new ATOM 0 HH12 ARG A 126 -0.327 11.483 17.182 1.00 43.14 H new ATOM 0 HH21 ARG A 126 0.384 14.339 15.348 1.00 1.22 H new ATOM 0 HH22 ARG A 126 -0.227 13.677 16.868 1.00 1.22 H new ATOM 2161 N SER A 127 -2.096 9.965 12.988 1.00 21.10 N ATOM 2162 CA SER A 127 -2.797 9.827 14.272 1.00 32.45 C ATOM 2163 C SER A 127 -2.151 8.721 15.110 1.00 61.42 C ATOM 2164 O SER A 127 -1.467 7.853 14.572 1.00 73.23 O ATOM 2165 CB SER A 127 -4.282 9.505 14.048 1.00 41.33 C ATOM 2166 OG SER A 127 -4.966 9.344 15.283 1.00 54.05 O ATOM 0 H SER A 127 -1.874 9.076 12.540 1.00 21.10 H new ATOM 0 HA SER A 127 -2.720 10.774 14.806 1.00 32.45 H new ATOM 0 HB2 SER A 127 -4.748 10.306 13.473 1.00 41.33 H new ATOM 0 HB3 SER A 127 -4.374 8.594 13.457 1.00 41.33 H new ATOM 0 HG SER A 127 -5.909 9.142 15.111 1.00 54.05 H new ATOM 2172 N ASP A 128 -2.354 8.753 16.423 1.00 0.15 N ATOM 2173 CA ASP A 128 -1.797 7.721 17.304 1.00 5.31 C ATOM 2174 C ASP A 128 -2.486 6.368 17.064 1.00 41.55 C ATOM 2175 O ASP A 128 -3.672 6.194 17.353 1.00 41.35 O ATOM 2176 CB ASP A 128 -1.917 8.149 18.766 1.00 4.52 C ATOM 2177 CG ASP A 128 -1.142 9.424 19.038 1.00 31.41 C ATOM 2178 OD1 ASP A 128 0.104 9.374 19.050 1.00 4.42 O ATOM 2179 OD2 ASP A 128 -1.771 10.484 19.228 1.00 41.12 O ATOM 0 H ASP A 128 -2.894 9.474 16.902 1.00 0.15 H new ATOM 0 HA ASP A 128 -0.739 7.600 17.071 1.00 5.31 H new ATOM 0 HB2 ASP A 128 -2.967 8.300 19.017 1.00 4.52 H new ATOM 0 HB3 ASP A 128 -1.546 7.352 19.411 1.00 4.52 H new ATOM 2184 N GLY A 129 -1.723 5.422 16.527 1.00 63.21 N ATOM 2185 CA GLY A 129 -2.279 4.152 16.068 1.00 43.41 C ATOM 2186 C GLY A 129 -2.120 3.986 14.559 1.00 4.43 C ATOM 2187 O GLY A 129 -2.322 2.901 14.007 1.00 71.41 O ATOM 0 H GLY A 129 -0.715 5.510 16.398 1.00 63.21 H new ATOM 0 HA2 GLY A 129 -1.781 3.329 16.580 1.00 43.41 H new ATOM 0 HA3 GLY A 129 -3.335 4.099 16.332 1.00 43.41 H new ATOM 2191 N VAL A 130 -1.766 5.086 13.890 1.00 33.10 N ATOM 2192 CA VAL A 130 -1.481 5.080 12.453 1.00 21.50 C ATOM 2193 C VAL A 130 -0.137 5.770 12.162 1.00 2.41 C ATOM 2194 O VAL A 130 -0.008 6.990 12.299 1.00 65.44 O ATOM 2195 CB VAL A 130 -2.600 5.796 11.648 1.00 2.42 C ATOM 2196 CG1 VAL A 130 -2.299 5.767 10.149 1.00 31.40 C ATOM 2197 CG2 VAL A 130 -3.966 5.175 11.939 1.00 10.32 C ATOM 0 H VAL A 130 -1.669 6.003 14.327 1.00 33.10 H new ATOM 0 HA VAL A 130 -1.434 4.037 12.141 1.00 21.50 H new ATOM 0 HB VAL A 130 -2.628 6.838 11.967 1.00 2.42 H new ATOM 0 HG11 VAL A 130 -3.097 6.275 9.608 1.00 31.40 H new ATOM 0 HG12 VAL A 130 -1.353 6.273 9.958 1.00 31.40 H new ATOM 0 HG13 VAL A 130 -2.232 4.733 9.811 1.00 31.40 H new ATOM 0 HG21 VAL A 130 -4.732 5.694 11.363 1.00 10.32 H new ATOM 0 HG22 VAL A 130 -3.954 4.122 11.659 1.00 10.32 H new ATOM 0 HG23 VAL A 130 -4.188 5.266 13.002 1.00 10.32 H new ATOM 2207 N ASP A 131 0.856 4.990 11.746 1.00 53.51 N ATOM 2208 CA ASP A 131 2.173 5.535 11.406 1.00 31.32 C ATOM 2209 C ASP A 131 2.194 6.057 9.964 1.00 73.43 C ATOM 2210 O ASP A 131 1.812 5.352 9.035 1.00 4.01 O ATOM 2211 CB ASP A 131 3.263 4.472 11.587 1.00 74.02 C ATOM 2212 CG ASP A 131 3.445 4.053 13.032 1.00 55.44 C ATOM 2213 OD1 ASP A 131 4.109 4.789 13.789 1.00 21.41 O ATOM 2214 OD2 ASP A 131 2.950 2.973 13.412 1.00 2.15 O ATOM 0 H ASP A 131 0.777 3.979 11.635 1.00 53.51 H new ATOM 0 HA ASP A 131 2.373 6.366 12.083 1.00 31.32 H new ATOM 0 HB2 ASP A 131 3.012 3.596 10.989 1.00 74.02 H new ATOM 0 HB3 ASP A 131 4.208 4.859 11.205 1.00 74.02 H new ATOM 2219 N VAL A 132 2.637 7.297 9.780 1.00 1.12 N ATOM 2220 CA VAL A 132 2.728 7.892 8.439 1.00 20.31 C ATOM 2221 C VAL A 132 4.177 8.278 8.100 1.00 21.23 C ATOM 2222 O VAL A 132 4.717 9.254 8.626 1.00 31.50 O ATOM 2223 CB VAL A 132 1.811 9.137 8.305 1.00 42.53 C ATOM 2224 CG1 VAL A 132 1.912 9.743 6.904 1.00 30.22 C ATOM 2225 CG2 VAL A 132 0.363 8.775 8.635 1.00 31.33 C ATOM 0 H VAL A 132 2.939 7.912 10.536 1.00 1.12 H new ATOM 0 HA VAL A 132 2.390 7.135 7.732 1.00 20.31 H new ATOM 0 HB VAL A 132 2.150 9.886 9.020 1.00 42.53 H new ATOM 0 HG11 VAL A 132 1.260 10.614 6.836 1.00 30.22 H new ATOM 0 HG12 VAL A 132 2.942 10.045 6.711 1.00 30.22 H new ATOM 0 HG13 VAL A 132 1.607 9.003 6.164 1.00 30.22 H new ATOM 0 HG21 VAL A 132 -0.265 9.660 8.536 1.00 31.33 H new ATOM 0 HG22 VAL A 132 0.015 8.004 7.947 1.00 31.33 H new ATOM 0 HG23 VAL A 132 0.305 8.402 9.658 1.00 31.33 H new ATOM 2235 N ARG A 133 4.797 7.499 7.217 1.00 22.05 N ATOM 2236 CA ARG A 133 6.179 7.738 6.783 1.00 22.31 C ATOM 2237 C ARG A 133 6.230 8.257 5.340 1.00 24.31 C ATOM 2238 O ARG A 133 5.471 7.813 4.475 1.00 52.00 O ATOM 2239 CB ARG A 133 6.999 6.447 6.902 1.00 31.43 C ATOM 2240 CG ARG A 133 7.356 6.068 8.337 1.00 61.31 C ATOM 2241 CD ARG A 133 8.459 6.960 8.900 1.00 10.24 C ATOM 2242 NE ARG A 133 8.856 6.562 10.252 1.00 43.45 N ATOM 2243 CZ ARG A 133 10.085 6.318 10.613 1.00 13.41 C ATOM 2244 NH1 ARG A 133 11.048 6.377 9.747 1.00 62.21 N ATOM 2245 NH2 ARG A 133 10.344 5.991 11.837 1.00 73.44 N ATOM 0 H ARG A 133 4.361 6.686 6.781 1.00 22.05 H new ATOM 0 HA ARG A 133 6.607 8.501 7.433 1.00 22.31 H new ATOM 0 HB2 ARG A 133 6.438 5.629 6.450 1.00 31.43 H new ATOM 0 HB3 ARG A 133 7.918 6.558 6.327 1.00 31.43 H new ATOM 0 HG2 ARG A 133 6.469 6.146 8.965 1.00 61.31 H new ATOM 0 HG3 ARG A 133 7.678 5.027 8.369 1.00 61.31 H new ATOM 0 HD2 ARG A 133 9.327 6.921 8.242 1.00 10.24 H new ATOM 0 HD3 ARG A 133 8.116 7.994 8.914 1.00 10.24 H new ATOM 0 HE ARG A 133 8.124 6.470 10.957 1.00 43.45 H new ATOM 0 HH11 ARG A 133 10.847 6.616 8.776 1.00 62.21 H new ATOM 0 HH12 ARG A 133 12.007 6.185 10.037 1.00 62.21 H new ATOM 0 HH21 ARG A 133 9.588 5.924 12.518 1.00 73.44 H new ATOM 0 HH22 ARG A 133 11.305 5.800 12.121 1.00 73.44 H new ATOM 2259 N THR A 134 7.136 9.194 5.084 1.00 53.53 N ATOM 2260 CA THR A 134 7.291 9.782 3.749 1.00 60.24 C ATOM 2261 C THR A 134 8.723 9.616 3.236 1.00 1.45 C ATOM 2262 O THR A 134 9.685 9.927 3.942 1.00 31.14 O ATOM 2263 CB THR A 134 6.932 11.285 3.749 1.00 21.22 C ATOM 2264 OG1 THR A 134 7.789 12.008 4.651 1.00 35.21 O ATOM 2265 CG2 THR A 134 5.480 11.488 4.158 1.00 14.12 C ATOM 0 H THR A 134 7.779 9.567 5.783 1.00 53.53 H new ATOM 0 HA THR A 134 6.605 9.250 3.090 1.00 60.24 H new ATOM 0 HB THR A 134 7.074 11.665 2.738 1.00 21.22 H new ATOM 0 HG1 THR A 134 7.242 12.487 5.308 1.00 35.21 H new ATOM 0 HG21 THR A 134 5.246 12.553 4.152 1.00 14.12 H new ATOM 0 HG22 THR A 134 4.828 10.969 3.455 1.00 14.12 H new ATOM 0 HG23 THR A 134 5.325 11.088 5.160 1.00 14.12 H new ATOM 2273 N VAL A 135 8.863 9.109 2.011 1.00 64.32 N ATOM 2274 CA VAL A 135 10.186 8.889 1.404 1.00 4.24 C ATOM 2275 C VAL A 135 10.225 9.361 -0.060 1.00 20.13 C ATOM 2276 O VAL A 135 9.216 9.316 -0.766 1.00 15.11 O ATOM 2277 CB VAL A 135 10.591 7.388 1.458 1.00 24.33 C ATOM 2278 CG1 VAL A 135 10.637 6.879 2.901 1.00 3.23 C ATOM 2279 CG2 VAL A 135 9.641 6.538 0.614 1.00 22.20 C ATOM 0 H VAL A 135 8.079 8.841 1.415 1.00 64.32 H new ATOM 0 HA VAL A 135 10.895 9.477 1.987 1.00 4.24 H new ATOM 0 HB VAL A 135 11.593 7.298 1.039 1.00 24.33 H new ATOM 0 HG11 VAL A 135 10.923 5.827 2.907 1.00 3.23 H new ATOM 0 HG12 VAL A 135 11.367 7.457 3.467 1.00 3.23 H new ATOM 0 HG13 VAL A 135 9.654 6.990 3.358 1.00 3.23 H new ATOM 0 HG21 VAL A 135 9.944 5.492 0.667 1.00 22.20 H new ATOM 0 HG22 VAL A 135 8.625 6.641 0.995 1.00 22.20 H new ATOM 0 HG23 VAL A 135 9.676 6.874 -0.422 1.00 22.20 H new ATOM 2289 N SER A 136 11.391 9.822 -0.506 1.00 74.12 N ATOM 2290 CA SER A 136 11.590 10.202 -1.915 1.00 4.53 C ATOM 2291 C SER A 136 12.337 9.105 -2.682 1.00 72.02 C ATOM 2292 O SER A 136 12.064 8.847 -3.857 1.00 75.45 O ATOM 2293 CB SER A 136 12.373 11.518 -2.014 1.00 74.41 C ATOM 2294 OG SER A 136 12.568 11.906 -3.369 1.00 2.43 O ATOM 0 H SER A 136 12.216 9.944 0.082 1.00 74.12 H new ATOM 0 HA SER A 136 10.605 10.335 -2.362 1.00 4.53 H new ATOM 0 HB2 SER A 136 11.836 12.304 -1.483 1.00 74.41 H new ATOM 0 HB3 SER A 136 13.340 11.406 -1.523 1.00 74.41 H new ATOM 0 HG SER A 136 13.068 12.748 -3.399 1.00 2.43 H new ATOM 2300 N ASP A 137 13.272 8.448 -2.003 1.00 63.41 N ATOM 2301 CA ASP A 137 14.111 7.422 -2.629 1.00 10.15 C ATOM 2302 C ASP A 137 13.532 6.008 -2.447 1.00 22.43 C ATOM 2303 O ASP A 137 12.694 5.768 -1.572 1.00 43.42 O ATOM 2304 CB ASP A 137 15.519 7.482 -2.038 1.00 41.32 C ATOM 2305 CG ASP A 137 16.143 8.853 -2.202 1.00 15.43 C ATOM 2306 OD1 ASP A 137 15.908 9.723 -1.339 1.00 71.44 O ATOM 2307 OD2 ASP A 137 16.861 9.072 -3.202 1.00 23.11 O ATOM 0 H ASP A 137 13.471 8.606 -1.015 1.00 63.41 H new ATOM 0 HA ASP A 137 14.142 7.628 -3.699 1.00 10.15 H new ATOM 0 HB2 ASP A 137 15.480 7.225 -0.979 1.00 41.32 H new ATOM 0 HB3 ASP A 137 16.149 6.736 -2.523 1.00 41.32 H new ATOM 2312 N LYS A 138 14.001 5.075 -3.276 1.00 33.33 N ATOM 2313 CA LYS A 138 13.571 3.675 -3.199 1.00 31.03 C ATOM 2314 C LYS A 138 14.095 3.002 -1.922 1.00 32.30 C ATOM 2315 O LYS A 138 13.325 2.429 -1.150 1.00 62.44 O ATOM 2316 CB LYS A 138 14.074 2.894 -4.424 1.00 32.32 C ATOM 2317 CG LYS A 138 13.548 1.462 -4.496 1.00 45.34 C ATOM 2318 CD LYS A 138 14.260 0.641 -5.568 1.00 60.24 C ATOM 2319 CE LYS A 138 15.696 0.307 -5.173 1.00 42.45 C ATOM 2320 NZ LYS A 138 16.358 -0.577 -6.169 1.00 70.14 N ATOM 0 H LYS A 138 14.682 5.263 -4.012 1.00 33.33 H new ATOM 0 HA LYS A 138 12.481 3.666 -3.179 1.00 31.03 H new ATOM 0 HB2 LYS A 138 13.780 3.426 -5.329 1.00 32.32 H new ATOM 0 HB3 LYS A 138 15.164 2.871 -4.407 1.00 32.32 H new ATOM 0 HG2 LYS A 138 13.676 0.980 -3.527 1.00 45.34 H new ATOM 0 HG3 LYS A 138 12.478 1.479 -4.704 1.00 45.34 H new ATOM 0 HD2 LYS A 138 13.708 -0.282 -5.743 1.00 60.24 H new ATOM 0 HD3 LYS A 138 14.262 1.195 -6.507 1.00 60.24 H new ATOM 0 HE2 LYS A 138 16.268 1.230 -5.071 1.00 42.45 H new ATOM 0 HE3 LYS A 138 15.700 -0.180 -4.198 1.00 42.45 H new ATOM 0 HZ1 LYS A 138 17.331 -0.779 -5.862 1.00 70.14 H new ATOM 0 HZ2 LYS A 138 15.828 -1.468 -6.248 1.00 70.14 H new ATOM 0 HZ3 LYS A 138 16.379 -0.103 -7.094 1.00 70.14 H new ATOM 2334 N GLU A 139 15.411 3.087 -1.708 1.00 2.43 N ATOM 2335 CA GLU A 139 16.070 2.450 -0.556 1.00 55.32 C ATOM 2336 C GLU A 139 15.404 2.856 0.771 1.00 14.44 C ATOM 2337 O GLU A 139 15.217 2.032 1.668 1.00 43.24 O ATOM 2338 CB GLU A 139 17.560 2.825 -0.530 1.00 71.32 C ATOM 2339 CG GLU A 139 18.397 1.988 0.435 1.00 30.22 C ATOM 2340 CD GLU A 139 18.537 0.536 -0.010 1.00 11.22 C ATOM 2341 OE1 GLU A 139 19.466 0.240 -0.792 1.00 2.34 O ATOM 2342 OE2 GLU A 139 17.722 -0.312 0.412 1.00 62.41 O ATOM 0 H GLU A 139 16.049 3.595 -2.321 1.00 2.43 H new ATOM 0 HA GLU A 139 15.968 1.370 -0.667 1.00 55.32 H new ATOM 0 HB2 GLU A 139 17.968 2.718 -1.535 1.00 71.32 H new ATOM 0 HB3 GLU A 139 17.654 3.876 -0.258 1.00 71.32 H new ATOM 0 HG2 GLU A 139 19.388 2.432 0.528 1.00 30.22 H new ATOM 0 HG3 GLU A 139 17.940 2.018 1.424 1.00 30.22 H new ATOM 2349 N GLU A 140 15.044 4.135 0.882 1.00 54.10 N ATOM 2350 CA GLU A 140 14.327 4.645 2.057 1.00 12.33 C ATOM 2351 C GLU A 140 12.993 3.906 2.263 1.00 72.32 C ATOM 2352 O GLU A 140 12.627 3.564 3.390 1.00 63.22 O ATOM 2353 CB GLU A 140 14.076 6.151 1.898 1.00 43.20 C ATOM 2354 CG GLU A 140 15.348 6.997 1.882 1.00 22.21 C ATOM 2355 CD GLU A 140 16.031 7.066 3.243 1.00 1.03 C ATOM 2356 OE1 GLU A 140 16.749 6.111 3.613 1.00 45.41 O ATOM 2357 OE2 GLU A 140 15.843 8.071 3.957 1.00 10.21 O ATOM 0 H GLU A 140 15.237 4.841 0.171 1.00 54.10 H new ATOM 0 HA GLU A 140 14.946 4.470 2.937 1.00 12.33 H new ATOM 0 HB2 GLU A 140 13.528 6.321 0.972 1.00 43.20 H new ATOM 0 HB3 GLU A 140 13.437 6.490 2.713 1.00 43.20 H new ATOM 0 HG2 GLU A 140 16.044 6.584 1.152 1.00 22.21 H new ATOM 0 HG3 GLU A 140 15.103 8.007 1.552 1.00 22.21 H new ATOM 2364 N LEU A 141 12.279 3.654 1.165 1.00 60.40 N ATOM 2365 CA LEU A 141 11.003 2.933 1.214 1.00 42.43 C ATOM 2366 C LEU A 141 11.242 1.473 1.629 1.00 15.31 C ATOM 2367 O LEU A 141 10.558 0.942 2.507 1.00 14.41 O ATOM 2368 CB LEU A 141 10.309 3.000 -0.163 1.00 24.31 C ATOM 2369 CG LEU A 141 8.767 2.911 -0.162 1.00 44.41 C ATOM 2370 CD1 LEU A 141 8.229 3.061 -1.581 1.00 73.12 C ATOM 2371 CD2 LEU A 141 8.276 1.603 0.455 1.00 75.13 C ATOM 0 H LEU A 141 12.562 3.939 0.228 1.00 60.40 H new ATOM 0 HA LEU A 141 10.353 3.401 1.953 1.00 42.43 H new ATOM 0 HB2 LEU A 141 10.597 3.934 -0.645 1.00 24.31 H new ATOM 0 HB3 LEU A 141 10.697 2.190 -0.781 1.00 24.31 H new ATOM 0 HG LEU A 141 8.389 3.728 0.453 1.00 44.41 H new ATOM 0 HD11 LEU A 141 7.141 2.996 -1.566 1.00 73.12 H new ATOM 0 HD12 LEU A 141 8.530 4.028 -1.984 1.00 73.12 H new ATOM 0 HD13 LEU A 141 8.631 2.266 -2.209 1.00 73.12 H new ATOM 0 HD21 LEU A 141 7.186 1.579 0.437 1.00 75.13 H new ATOM 0 HD22 LEU A 141 8.667 0.762 -0.117 1.00 75.13 H new ATOM 0 HD23 LEU A 141 8.624 1.534 1.486 1.00 75.13 H new ATOM 2383 N ILE A 142 12.229 0.839 0.994 1.00 43.32 N ATOM 2384 CA ILE A 142 12.608 -0.541 1.315 1.00 54.13 C ATOM 2385 C ILE A 142 12.848 -0.711 2.819 1.00 5.25 C ATOM 2386 O ILE A 142 12.280 -1.602 3.452 1.00 1.22 O ATOM 2387 CB ILE A 142 13.888 -0.973 0.558 1.00 62.54 C ATOM 2388 CG1 ILE A 142 13.695 -0.835 -0.967 1.00 13.11 C ATOM 2389 CG2 ILE A 142 14.288 -2.401 0.938 1.00 14.32 C ATOM 2390 CD1 ILE A 142 12.536 -1.635 -1.532 1.00 24.03 C ATOM 0 H ILE A 142 12.784 1.261 0.250 1.00 43.32 H new ATOM 0 HA ILE A 142 11.777 -1.173 1.001 1.00 54.13 H new ATOM 0 HB ILE A 142 14.700 -0.309 0.853 1.00 62.54 H new ATOM 0 HG12 ILE A 142 13.544 0.217 -1.207 1.00 13.11 H new ATOM 0 HG13 ILE A 142 14.612 -1.147 -1.466 1.00 13.11 H new ATOM 0 HG21 ILE A 142 15.190 -2.683 0.394 1.00 14.32 H new ATOM 0 HG22 ILE A 142 14.480 -2.452 2.010 1.00 14.32 H new ATOM 0 HG23 ILE A 142 13.480 -3.086 0.681 1.00 14.32 H new ATOM 0 HD11 ILE A 142 12.476 -1.478 -2.609 1.00 24.03 H new ATOM 0 HD12 ILE A 142 12.691 -2.694 -1.328 1.00 24.03 H new ATOM 0 HD13 ILE A 142 11.607 -1.308 -1.065 1.00 24.03 H new ATOM 2402 N GLU A 143 13.697 0.155 3.376 1.00 32.02 N ATOM 2403 CA GLU A 143 13.974 0.166 4.817 1.00 2.15 C ATOM 2404 C GLU A 143 12.679 0.145 5.637 1.00 42.15 C ATOM 2405 O GLU A 143 12.526 -0.671 6.540 1.00 63.13 O ATOM 2406 CB GLU A 143 14.818 1.402 5.187 1.00 24.15 C ATOM 2407 CG GLU A 143 16.252 1.080 5.597 1.00 33.54 C ATOM 2408 CD GLU A 143 16.343 0.396 6.955 1.00 43.25 C ATOM 2409 OE1 GLU A 143 16.248 -0.846 7.017 1.00 62.22 O ATOM 2410 OE2 GLU A 143 16.508 1.105 7.972 1.00 52.52 O ATOM 0 H GLU A 143 14.208 0.863 2.849 1.00 32.02 H new ATOM 0 HA GLU A 143 14.536 -0.737 5.056 1.00 2.15 H new ATOM 0 HB2 GLU A 143 14.839 2.082 4.335 1.00 24.15 H new ATOM 0 HB3 GLU A 143 14.328 1.931 6.005 1.00 24.15 H new ATOM 0 HG2 GLU A 143 16.705 0.438 4.842 1.00 33.54 H new ATOM 0 HG3 GLU A 143 16.833 2.002 5.621 1.00 33.54 H new ATOM 2417 N GLN A 144 11.741 1.032 5.304 1.00 25.14 N ATOM 2418 CA GLN A 144 10.453 1.097 6.013 1.00 2.32 C ATOM 2419 C GLN A 144 9.723 -0.262 5.970 1.00 62.10 C ATOM 2420 O GLN A 144 9.177 -0.723 6.976 1.00 42.13 O ATOM 2421 CB GLN A 144 9.548 2.186 5.411 1.00 24.20 C ATOM 2422 CG GLN A 144 10.174 3.580 5.343 1.00 63.42 C ATOM 2423 CD GLN A 144 10.717 4.067 6.677 1.00 4.43 C ATOM 2424 OE1 GLN A 144 9.998 4.640 7.482 1.00 64.04 O ATOM 2425 NE2 GLN A 144 12.001 3.883 6.900 1.00 55.10 N ATOM 0 H GLN A 144 11.843 1.714 4.553 1.00 25.14 H new ATOM 0 HA GLN A 144 10.668 1.347 7.052 1.00 2.32 H new ATOM 0 HB2 GLN A 144 9.261 1.883 4.404 1.00 24.20 H new ATOM 0 HB3 GLN A 144 8.633 2.243 6.000 1.00 24.20 H new ATOM 0 HG2 GLN A 144 10.983 3.571 4.612 1.00 63.42 H new ATOM 0 HG3 GLN A 144 9.427 4.288 4.984 1.00 63.42 H new ATOM 0 HE21 GLN A 144 12.575 3.401 6.208 1.00 55.10 H new ATOM 0 HE22 GLN A 144 12.422 4.223 7.765 1.00 55.10 H new ATOM 2434 N VAL A 145 9.735 -0.899 4.798 1.00 23.11 N ATOM 2435 CA VAL A 145 9.082 -2.202 4.609 1.00 21.11 C ATOM 2436 C VAL A 145 9.703 -3.291 5.503 1.00 35.10 C ATOM 2437 O VAL A 145 8.993 -3.999 6.218 1.00 42.11 O ATOM 2438 CB VAL A 145 9.149 -2.654 3.129 1.00 51.43 C ATOM 2439 CG1 VAL A 145 8.463 -4.009 2.933 1.00 1.04 C ATOM 2440 CG2 VAL A 145 8.528 -1.593 2.223 1.00 41.35 C ATOM 0 H VAL A 145 10.190 -0.535 3.961 1.00 23.11 H new ATOM 0 HA VAL A 145 8.039 -2.070 4.897 1.00 21.11 H new ATOM 0 HB VAL A 145 10.197 -2.773 2.855 1.00 51.43 H new ATOM 0 HG11 VAL A 145 8.526 -4.300 1.885 1.00 1.04 H new ATOM 0 HG12 VAL A 145 8.958 -4.760 3.549 1.00 1.04 H new ATOM 0 HG13 VAL A 145 7.416 -3.932 3.226 1.00 1.04 H new ATOM 0 HG21 VAL A 145 8.582 -1.924 1.186 1.00 41.35 H new ATOM 0 HG22 VAL A 145 7.485 -1.441 2.502 1.00 41.35 H new ATOM 0 HG23 VAL A 145 9.073 -0.656 2.334 1.00 41.35 H new ATOM 2450 N ARG A 146 11.030 -3.421 5.463 1.00 35.41 N ATOM 2451 CA ARG A 146 11.723 -4.398 6.317 1.00 43.43 C ATOM 2452 C ARG A 146 11.621 -4.016 7.806 1.00 52.34 C ATOM 2453 O ARG A 146 11.642 -4.885 8.678 1.00 20.31 O ATOM 2454 CB ARG A 146 13.194 -4.594 5.887 1.00 4.24 C ATOM 2455 CG ARG A 146 13.848 -3.385 5.231 1.00 72.34 C ATOM 2456 CD ARG A 146 15.299 -3.672 4.860 1.00 34.41 C ATOM 2457 NE ARG A 146 15.405 -4.693 3.813 1.00 54.10 N ATOM 2458 CZ ARG A 146 15.997 -5.847 3.962 1.00 73.14 C ATOM 2459 NH1 ARG A 146 16.496 -6.198 5.100 1.00 63.11 N ATOM 2460 NH2 ARG A 146 16.064 -6.669 2.968 1.00 41.04 N ATOM 0 H ARG A 146 11.643 -2.873 4.859 1.00 35.41 H new ATOM 0 HA ARG A 146 11.218 -5.355 6.186 1.00 43.43 H new ATOM 0 HB2 ARG A 146 13.778 -4.870 6.765 1.00 4.24 H new ATOM 0 HB3 ARG A 146 13.244 -5.434 5.194 1.00 4.24 H new ATOM 0 HG2 ARG A 146 13.290 -3.108 4.337 1.00 72.34 H new ATOM 0 HG3 ARG A 146 13.806 -2.533 5.910 1.00 72.34 H new ATOM 0 HD2 ARG A 146 15.775 -2.752 4.520 1.00 34.41 H new ATOM 0 HD3 ARG A 146 15.841 -4.003 5.746 1.00 34.41 H new ATOM 0 HE ARG A 146 14.987 -4.487 2.905 1.00 54.10 H new ATOM 0 HH11 ARG A 146 16.431 -5.570 5.901 1.00 63.11 H new ATOM 0 HH12 ARG A 146 16.955 -7.104 5.198 1.00 63.11 H new ATOM 0 HH21 ARG A 146 15.655 -6.416 2.069 1.00 41.04 H new ATOM 0 HH22 ARG A 146 16.526 -7.571 3.082 1.00 41.04 H new ATOM 2474 N ARG A 147 11.496 -2.719 8.095 1.00 1.32 N ATOM 2475 CA ARG A 147 11.249 -2.260 9.470 1.00 22.43 C ATOM 2476 C ARG A 147 9.892 -2.746 9.995 1.00 52.35 C ATOM 2477 O ARG A 147 9.732 -2.967 11.196 1.00 2.20 O ATOM 2478 CB ARG A 147 11.338 -0.734 9.576 1.00 73.21 C ATOM 2479 CG ARG A 147 12.760 -0.209 9.441 1.00 41.11 C ATOM 2480 CD ARG A 147 12.851 1.289 9.690 1.00 60.32 C ATOM 2481 NE ARG A 147 14.216 1.768 9.499 1.00 42.13 N ATOM 2482 CZ ARG A 147 14.706 2.858 10.014 1.00 60.50 C ATOM 2483 NH1 ARG A 147 13.985 3.634 10.757 1.00 31.03 N ATOM 2484 NH2 ARG A 147 15.935 3.162 9.780 1.00 22.24 N ATOM 0 H ARG A 147 11.560 -1.971 7.404 1.00 1.32 H new ATOM 0 HA ARG A 147 12.031 -2.696 10.092 1.00 22.43 H new ATOM 0 HB2 ARG A 147 10.716 -0.285 8.802 1.00 73.21 H new ATOM 0 HB3 ARG A 147 10.930 -0.418 10.536 1.00 73.21 H new ATOM 0 HG2 ARG A 147 13.406 -0.732 10.146 1.00 41.11 H new ATOM 0 HG3 ARG A 147 13.133 -0.432 8.441 1.00 41.11 H new ATOM 0 HD2 ARG A 147 12.179 1.816 9.013 1.00 60.32 H new ATOM 0 HD3 ARG A 147 12.521 1.514 10.704 1.00 60.32 H new ATOM 0 HE ARG A 147 14.835 1.204 8.916 1.00 42.13 H new ATOM 0 HH11 ARG A 147 13.012 3.396 10.949 1.00 31.03 H new ATOM 0 HH12 ARG A 147 14.390 4.484 11.150 1.00 31.03 H new ATOM 0 HH21 ARG A 147 16.509 2.552 9.198 1.00 22.24 H new ATOM 0 HH22 ARG A 147 16.334 4.013 10.176 1.00 22.24 H new ATOM 2498 N PHE A 148 8.917 -2.904 9.099 1.00 72.54 N ATOM 2499 CA PHE A 148 7.634 -3.516 9.466 1.00 2.44 C ATOM 2500 C PHE A 148 7.855 -4.922 10.043 1.00 21.54 C ATOM 2501 O PHE A 148 7.355 -5.254 11.121 1.00 41.45 O ATOM 2502 CB PHE A 148 6.700 -3.583 8.249 1.00 40.40 C ATOM 2503 CG PHE A 148 5.428 -4.360 8.499 1.00 45.51 C ATOM 2504 CD1 PHE A 148 4.479 -3.895 9.400 1.00 72.52 C ATOM 2505 CD2 PHE A 148 5.186 -5.557 7.837 1.00 21.44 C ATOM 2506 CE1 PHE A 148 3.317 -4.608 9.633 1.00 24.24 C ATOM 2507 CE2 PHE A 148 4.025 -6.272 8.067 1.00 4.54 C ATOM 2508 CZ PHE A 148 3.091 -5.798 8.966 1.00 42.12 C ATOM 0 H PHE A 148 8.987 -2.620 8.122 1.00 72.54 H new ATOM 0 HA PHE A 148 7.165 -2.895 10.229 1.00 2.44 H new ATOM 0 HB2 PHE A 148 6.441 -2.569 7.945 1.00 40.40 H new ATOM 0 HB3 PHE A 148 7.236 -4.039 7.416 1.00 40.40 H new ATOM 0 HD1 PHE A 148 4.650 -2.967 9.924 1.00 72.52 H new ATOM 0 HD2 PHE A 148 5.914 -5.934 7.134 1.00 21.44 H new ATOM 0 HE1 PHE A 148 2.586 -4.235 10.336 1.00 24.24 H new ATOM 0 HE2 PHE A 148 3.849 -7.200 7.544 1.00 4.54 H new ATOM 0 HZ PHE A 148 2.185 -6.356 9.148 1.00 42.12 H new ATOM 2518 N VAL A 149 8.619 -5.735 9.321 1.00 73.31 N ATOM 2519 CA VAL A 149 8.990 -7.076 9.787 1.00 45.31 C ATOM 2520 C VAL A 149 9.711 -7.011 11.146 1.00 42.51 C ATOM 2521 O VAL A 149 9.476 -7.834 12.034 1.00 24.54 O ATOM 2522 CB VAL A 149 9.899 -7.793 8.755 1.00 41.32 C ATOM 2523 CG1 VAL A 149 10.189 -9.232 9.183 1.00 44.40 C ATOM 2524 CG2 VAL A 149 9.273 -7.752 7.362 1.00 61.45 C ATOM 0 H VAL A 149 8.997 -5.491 8.406 1.00 73.31 H new ATOM 0 HA VAL A 149 8.067 -7.645 9.903 1.00 45.31 H new ATOM 0 HB VAL A 149 10.849 -7.260 8.715 1.00 41.32 H new ATOM 0 HG11 VAL A 149 10.828 -9.710 8.441 1.00 44.40 H new ATOM 0 HG12 VAL A 149 10.694 -9.230 10.149 1.00 44.40 H new ATOM 0 HG13 VAL A 149 9.252 -9.783 9.264 1.00 44.40 H new ATOM 0 HG21 VAL A 149 9.927 -8.261 6.654 1.00 61.45 H new ATOM 0 HG22 VAL A 149 8.304 -8.251 7.384 1.00 61.45 H new ATOM 0 HG23 VAL A 149 9.140 -6.715 7.053 1.00 61.45 H new ATOM 2534 N ARG A 150 10.578 -6.013 11.301 1.00 54.13 N ATOM 2535 CA ARG A 150 11.326 -5.811 12.549 1.00 61.44 C ATOM 2536 C ARG A 150 10.402 -5.474 13.735 1.00 14.42 C ATOM 2537 O ARG A 150 10.537 -6.049 14.813 1.00 33.52 O ATOM 2538 CB ARG A 150 12.363 -4.695 12.371 1.00 61.00 C ATOM 2539 CG ARG A 150 13.440 -5.008 11.335 1.00 33.23 C ATOM 2540 CD ARG A 150 14.378 -3.825 11.119 1.00 61.22 C ATOM 2541 NE ARG A 150 15.421 -4.122 10.139 1.00 51.04 N ATOM 2542 CZ ARG A 150 15.967 -3.235 9.350 1.00 50.12 C ATOM 2543 NH1 ARG A 150 15.619 -1.989 9.412 1.00 24.21 N ATOM 2544 NH2 ARG A 150 16.881 -3.599 8.514 1.00 44.21 N ATOM 0 H ARG A 150 10.784 -5.326 10.576 1.00 54.13 H new ATOM 0 HA ARG A 150 11.829 -6.751 12.777 1.00 61.44 H new ATOM 0 HB2 ARG A 150 11.849 -3.779 12.081 1.00 61.00 H new ATOM 0 HB3 ARG A 150 12.842 -4.501 13.331 1.00 61.00 H new ATOM 0 HG2 ARG A 150 14.016 -5.874 11.660 1.00 33.23 H new ATOM 0 HG3 ARG A 150 12.968 -5.275 10.389 1.00 33.23 H new ATOM 0 HD2 ARG A 150 13.802 -2.962 10.784 1.00 61.22 H new ATOM 0 HD3 ARG A 150 14.840 -3.551 12.068 1.00 61.22 H new ATOM 0 HE ARG A 150 15.744 -5.087 10.066 1.00 51.04 H new ATOM 0 HH11 ARG A 150 14.911 -1.690 10.083 1.00 24.21 H new ATOM 0 HH12 ARG A 150 16.053 -1.307 8.790 1.00 24.21 H new ATOM 0 HH21 ARG A 150 17.174 -4.575 8.472 1.00 44.21 H new ATOM 0 HH22 ARG A 150 17.310 -2.910 7.896 1.00 44.21 H new ATOM 2558 N LYS A 151 9.464 -4.547 13.534 1.00 23.13 N ATOM 2559 CA LYS A 151 8.579 -4.106 14.624 1.00 42.01 C ATOM 2560 C LYS A 151 7.560 -5.188 15.026 1.00 1.40 C ATOM 2561 O LYS A 151 7.199 -5.299 16.200 1.00 61.54 O ATOM 2562 CB LYS A 151 7.862 -2.790 14.262 1.00 65.10 C ATOM 2563 CG LYS A 151 7.075 -2.827 12.955 1.00 4.41 C ATOM 2564 CD LYS A 151 6.478 -1.461 12.615 1.00 5.44 C ATOM 2565 CE LYS A 151 5.331 -1.085 13.549 1.00 4.33 C ATOM 2566 NZ LYS A 151 5.008 0.366 13.477 1.00 74.14 N ATOM 0 H LYS A 151 9.295 -4.089 12.639 1.00 23.13 H new ATOM 0 HA LYS A 151 9.216 -3.926 15.490 1.00 42.01 H new ATOM 0 HB2 LYS A 151 7.181 -2.529 15.072 1.00 65.10 H new ATOM 0 HB3 LYS A 151 8.604 -1.994 14.200 1.00 65.10 H new ATOM 0 HG2 LYS A 151 7.729 -3.150 12.145 1.00 4.41 H new ATOM 0 HG3 LYS A 151 6.276 -3.564 13.032 1.00 4.41 H new ATOM 0 HD2 LYS A 151 7.257 -0.701 12.675 1.00 5.44 H new ATOM 0 HD3 LYS A 151 6.119 -1.469 11.586 1.00 5.44 H new ATOM 0 HE2 LYS A 151 4.446 -1.667 13.290 1.00 4.33 H new ATOM 0 HE3 LYS A 151 5.596 -1.347 14.573 1.00 4.33 H new ATOM 0 HZ1 LYS A 151 5.310 0.833 14.356 1.00 74.14 H new ATOM 0 HZ2 LYS A 151 5.505 0.793 12.669 1.00 74.14 H new ATOM 0 HZ3 LYS A 151 3.982 0.488 13.355 1.00 74.14 H new ATOM 2580 N VAL A 152 7.101 -5.992 14.066 1.00 32.11 N ATOM 2581 CA VAL A 152 6.151 -7.071 14.374 1.00 41.43 C ATOM 2582 C VAL A 152 6.851 -8.306 14.973 1.00 21.44 C ATOM 2583 O VAL A 152 6.321 -8.950 15.879 1.00 62.10 O ATOM 2584 CB VAL A 152 5.329 -7.498 13.133 1.00 34.53 C ATOM 2585 CG1 VAL A 152 4.491 -6.333 12.609 1.00 72.31 C ATOM 2586 CG2 VAL A 152 6.230 -8.057 12.032 1.00 24.31 C ATOM 0 H VAL A 152 7.364 -5.922 13.083 1.00 32.11 H new ATOM 0 HA VAL A 152 5.469 -6.660 15.119 1.00 41.43 H new ATOM 0 HB VAL A 152 4.652 -8.294 13.443 1.00 34.53 H new ATOM 0 HG11 VAL A 152 3.922 -6.657 11.737 1.00 72.31 H new ATOM 0 HG12 VAL A 152 3.804 -6.000 13.387 1.00 72.31 H new ATOM 0 HG13 VAL A 152 5.148 -5.510 12.328 1.00 72.31 H new ATOM 0 HG21 VAL A 152 5.621 -8.347 11.176 1.00 24.31 H new ATOM 0 HG22 VAL A 152 6.946 -7.295 11.726 1.00 24.31 H new ATOM 0 HG23 VAL A 152 6.766 -8.929 12.408 1.00 24.31 H new ATOM 2596 N GLY A 153 8.034 -8.639 14.455 1.00 34.13 N ATOM 2597 CA GLY A 153 8.791 -9.770 14.980 1.00 3.22 C ATOM 2598 C GLY A 153 9.488 -9.450 16.298 1.00 33.01 C ATOM 2599 O GLY A 153 9.434 -10.234 17.247 1.00 13.13 O ATOM 0 H GLY A 153 8.482 -8.147 13.682 1.00 34.13 H new ATOM 0 HA2 GLY A 153 8.119 -10.616 15.125 1.00 3.22 H new ATOM 0 HA3 GLY A 153 9.535 -10.076 14.245 1.00 3.22 H new ATOM 2603 N SER A 154 10.147 -8.289 16.346 1.00 52.01 N ATOM 2604 CA SER A 154 10.871 -7.821 17.546 1.00 60.33 C ATOM 2605 C SER A 154 11.806 -8.902 18.125 1.00 1.52 C ATOM 2606 O SER A 154 12.043 -8.952 19.333 1.00 73.33 O ATOM 2607 CB SER A 154 9.868 -7.365 18.620 1.00 34.44 C ATOM 2608 OG SER A 154 10.529 -6.753 19.719 1.00 53.41 O ATOM 0 H SER A 154 10.198 -7.643 15.558 1.00 52.01 H new ATOM 0 HA SER A 154 11.495 -6.981 17.242 1.00 60.33 H new ATOM 0 HB2 SER A 154 9.159 -6.662 18.183 1.00 34.44 H new ATOM 0 HB3 SER A 154 9.293 -8.222 18.971 1.00 34.44 H new ATOM 0 HG SER A 154 11.307 -7.292 19.974 1.00 53.41 H new ATOM 2614 N LEU A 155 12.367 -9.738 17.250 1.00 62.52 N ATOM 2615 CA LEU A 155 13.158 -10.904 17.674 1.00 71.11 C ATOM 2616 C LEU A 155 14.474 -10.523 18.371 1.00 21.04 C ATOM 2617 O LEU A 155 15.536 -10.524 17.754 1.00 72.44 O ATOM 2618 CB LEU A 155 13.447 -11.813 16.476 1.00 72.24 C ATOM 2619 CG LEU A 155 12.209 -12.401 15.784 1.00 20.20 C ATOM 2620 CD1 LEU A 155 12.631 -13.295 14.629 1.00 74.33 C ATOM 2621 CD2 LEU A 155 11.340 -13.173 16.779 1.00 42.23 C ATOM 0 H LEU A 155 12.290 -9.632 16.238 1.00 62.52 H new ATOM 0 HA LEU A 155 12.554 -11.436 18.409 1.00 71.11 H new ATOM 0 HB2 LEU A 155 14.019 -11.247 15.741 1.00 72.24 H new ATOM 0 HB3 LEU A 155 14.081 -12.635 16.809 1.00 72.24 H new ATOM 0 HG LEU A 155 11.612 -11.579 15.389 1.00 20.20 H new ATOM 0 HD11 LEU A 155 11.745 -13.707 14.145 1.00 74.33 H new ATOM 0 HD12 LEU A 155 13.201 -12.711 13.906 1.00 74.33 H new ATOM 0 HD13 LEU A 155 13.250 -14.109 15.006 1.00 74.33 H new ATOM 0 HD21 LEU A 155 10.470 -13.579 16.263 1.00 42.23 H new ATOM 0 HD22 LEU A 155 11.919 -13.989 17.211 1.00 42.23 H new ATOM 0 HD23 LEU A 155 11.011 -12.502 17.572 1.00 42.23 H new ATOM 2633 N GLU A 156 14.361 -10.177 19.657 1.00 51.44 N ATOM 2634 CA GLU A 156 15.500 -9.919 20.581 1.00 40.31 C ATOM 2635 C GLU A 156 16.679 -9.099 19.991 1.00 45.43 C ATOM 2636 O GLU A 156 17.729 -8.984 20.630 1.00 11.33 O ATOM 2637 CB GLU A 156 16.027 -11.246 21.165 1.00 63.45 C ATOM 2638 CG GLU A 156 16.554 -12.233 20.126 1.00 51.45 C ATOM 2639 CD GLU A 156 17.065 -13.524 20.742 1.00 24.31 C ATOM 2640 OE1 GLU A 156 16.237 -14.325 21.221 1.00 10.25 O ATOM 2641 OE2 GLU A 156 18.292 -13.749 20.735 1.00 63.20 O ATOM 0 H GLU A 156 13.454 -10.062 20.109 1.00 51.44 H new ATOM 0 HA GLU A 156 15.078 -9.285 21.361 1.00 40.31 H new ATOM 0 HB2 GLU A 156 16.825 -11.024 21.874 1.00 63.45 H new ATOM 0 HB3 GLU A 156 15.225 -11.724 21.727 1.00 63.45 H new ATOM 0 HG2 GLU A 156 15.759 -12.465 19.417 1.00 51.45 H new ATOM 0 HG3 GLU A 156 17.359 -11.763 19.561 1.00 51.45 H new ATOM 2648 N HIS A 157 16.517 -8.504 18.814 1.00 70.52 N ATOM 2649 CA HIS A 157 17.601 -7.730 18.195 1.00 2.21 C ATOM 2650 C HIS A 157 17.518 -6.248 18.585 1.00 31.45 C ATOM 2651 O HIS A 157 16.605 -5.531 18.172 1.00 61.41 O ATOM 2652 CB HIS A 157 17.578 -7.885 16.666 1.00 73.03 C ATOM 2653 CG HIS A 157 17.859 -9.284 16.197 1.00 24.44 C ATOM 2654 ND1 HIS A 157 17.624 -9.708 14.907 1.00 61.30 N ATOM 2655 CD2 HIS A 157 18.361 -10.360 16.852 1.00 61.40 C ATOM 2656 CE1 HIS A 157 17.962 -10.976 14.791 1.00 45.31 C ATOM 2657 NE2 HIS A 157 18.411 -11.396 15.955 1.00 34.54 N ATOM 0 H HIS A 157 15.656 -8.539 18.269 1.00 70.52 H new ATOM 0 HA HIS A 157 18.546 -8.125 18.569 1.00 2.21 H new ATOM 0 HB2 HIS A 157 16.602 -7.575 16.293 1.00 73.03 H new ATOM 0 HB3 HIS A 157 18.315 -7.210 16.230 1.00 73.03 H new ATOM 0 HD2 HIS A 157 18.665 -10.395 17.888 1.00 61.40 H new ATOM 0 HE1 HIS A 157 17.884 -11.570 13.893 1.00 45.31 H new ATOM 0 HE2 HIS A 157 18.742 -12.339 16.157 1.00 34.54 H new ATOM 2666 N HIS A 158 18.475 -5.799 19.394 1.00 10.05 N ATOM 2667 CA HIS A 158 18.520 -4.407 19.854 1.00 25.35 C ATOM 2668 C HIS A 158 19.792 -3.700 19.362 1.00 45.42 C ATOM 2669 O HIS A 158 20.862 -4.304 19.291 1.00 71.13 O ATOM 2670 CB HIS A 158 18.418 -4.349 21.387 1.00 64.32 C ATOM 2671 CG HIS A 158 19.274 -5.358 22.094 1.00 3.21 C ATOM 2672 ND1 HIS A 158 18.817 -6.611 22.441 1.00 71.44 N ATOM 2673 CD2 HIS A 158 20.560 -5.301 22.519 1.00 52.23 C ATOM 2674 CE1 HIS A 158 19.776 -7.275 23.053 1.00 4.42 C ATOM 2675 NE2 HIS A 158 20.845 -6.506 23.111 1.00 33.04 N ATOM 0 H HIS A 158 19.235 -6.380 19.748 1.00 10.05 H new ATOM 0 HA HIS A 158 17.666 -3.880 19.430 1.00 25.35 H new ATOM 0 HB2 HIS A 158 18.699 -3.351 21.722 1.00 64.32 H new ATOM 0 HB3 HIS A 158 17.379 -4.502 21.678 1.00 64.32 H new ATOM 0 HD2 HIS A 158 21.234 -4.464 22.412 1.00 52.23 H new ATOM 0 HE1 HIS A 158 19.699 -8.280 23.442 1.00 4.42 H new ATOM 0 HE2 HIS A 158 21.739 -6.765 23.528 1.00 33.04 H new ATOM 2684 N HIS A 159 19.666 -2.422 19.020 1.00 3.45 N ATOM 2685 CA HIS A 159 20.783 -1.661 18.448 1.00 62.01 C ATOM 2686 C HIS A 159 21.525 -0.843 19.513 1.00 44.01 C ATOM 2687 O HIS A 159 21.075 -0.738 20.657 1.00 15.51 O ATOM 2688 CB HIS A 159 20.269 -0.747 17.332 1.00 72.34 C ATOM 2689 CG HIS A 159 19.564 -1.499 16.242 1.00 42.01 C ATOM 2690 ND1 HIS A 159 20.226 -2.223 15.275 1.00 54.10 N ATOM 2691 CD2 HIS A 159 18.244 -1.654 15.979 1.00 20.12 C ATOM 2692 CE1 HIS A 159 19.351 -2.785 14.469 1.00 71.33 C ATOM 2693 NE2 HIS A 159 18.142 -2.459 14.873 1.00 40.54 N ATOM 0 H HIS A 159 18.804 -1.887 19.127 1.00 3.45 H new ATOM 0 HA HIS A 159 21.497 -2.373 18.034 1.00 62.01 H new ATOM 0 HB2 HIS A 159 19.588 -0.010 17.757 1.00 72.34 H new ATOM 0 HB3 HIS A 159 21.107 -0.197 16.904 1.00 72.34 H new ATOM 0 HD2 HIS A 159 17.425 -1.224 16.536 1.00 20.12 H new ATOM 0 HE1 HIS A 159 19.586 -3.409 13.619 1.00 71.33 H new ATOM 0 HE2 HIS A 159 17.270 -2.757 14.435 1.00 40.54 H new ATOM 2702 N HIS A 160 22.667 -0.269 19.122 1.00 64.12 N ATOM 2703 CA HIS A 160 23.497 0.535 20.031 1.00 12.11 C ATOM 2704 C HIS A 160 23.869 -0.260 21.295 1.00 64.42 C ATOM 2705 O HIS A 160 23.668 0.207 22.416 1.00 12.50 O ATOM 2706 CB HIS A 160 22.768 1.833 20.411 1.00 75.33 C ATOM 2707 CG HIS A 160 22.360 2.656 19.228 1.00 32.45 C ATOM 2708 ND1 HIS A 160 21.056 2.764 18.799 1.00 61.34 N ATOM 2709 CD2 HIS A 160 23.092 3.420 18.382 1.00 2.32 C ATOM 2710 CE1 HIS A 160 21.004 3.553 17.745 1.00 54.15 C ATOM 2711 NE2 HIS A 160 22.222 3.965 17.472 1.00 15.51 N ATOM 0 H HIS A 160 23.041 -0.346 18.176 1.00 64.12 H new ATOM 0 HA HIS A 160 24.420 0.788 19.509 1.00 12.11 H new ATOM 0 HB2 HIS A 160 21.881 1.585 20.995 1.00 75.33 H new ATOM 0 HB3 HIS A 160 23.416 2.430 21.053 1.00 75.33 H new ATOM 0 HD2 HIS A 160 24.161 3.572 18.417 1.00 2.32 H new ATOM 0 HE1 HIS A 160 20.111 3.817 17.198 1.00 54.15 H new ATOM 0 HE2 HIS A 160 22.479 4.589 16.707 1.00 15.51 H new ATOM 2720 N HIS A 161 24.401 -1.469 21.098 1.00 30.15 N ATOM 2721 CA HIS A 161 24.760 -2.361 22.209 1.00 62.41 C ATOM 2722 C HIS A 161 25.613 -1.643 23.276 1.00 22.33 C ATOM 2723 O HIS A 161 26.706 -1.145 22.992 1.00 43.12 O ATOM 2724 CB HIS A 161 25.498 -3.604 21.681 1.00 31.03 C ATOM 2725 CG HIS A 161 26.837 -3.312 21.067 1.00 10.21 C ATOM 2726 ND1 HIS A 161 26.999 -2.868 19.772 1.00 21.23 N ATOM 2727 CD2 HIS A 161 28.086 -3.401 21.584 1.00 65.40 C ATOM 2728 CE1 HIS A 161 28.281 -2.697 19.522 1.00 12.24 C ATOM 2729 NE2 HIS A 161 28.961 -3.011 20.602 1.00 11.02 N ATOM 0 H HIS A 161 24.594 -1.856 20.174 1.00 30.15 H new ATOM 0 HA HIS A 161 23.832 -2.673 22.689 1.00 62.41 H new ATOM 0 HB2 HIS A 161 25.633 -4.308 22.502 1.00 31.03 H new ATOM 0 HB3 HIS A 161 24.870 -4.097 20.939 1.00 31.03 H new ATOM 0 HD2 HIS A 161 28.345 -3.720 22.583 1.00 65.40 H new ATOM 0 HE1 HIS A 161 28.702 -2.356 18.588 1.00 12.24 H new ATOM 0 HE2 HIS A 161 29.976 -2.971 20.695 1.00 11.02 H new ATOM 2738 N HIS A 162 25.096 -1.588 24.497 1.00 53.42 N ATOM 2739 CA HIS A 162 25.790 -0.932 25.612 1.00 33.32 C ATOM 2740 C HIS A 162 26.566 -1.952 26.468 1.00 65.33 C ATOM 2741 O HIS A 162 25.919 -2.796 27.129 1.00 36.90 O ATOM 2742 CB HIS A 162 24.786 -0.163 26.482 1.00 22.43 C ATOM 2743 CG HIS A 162 24.037 0.899 25.734 1.00 2.04 C ATOM 2744 ND1 HIS A 162 22.721 0.768 25.358 1.00 24.10 N ATOM 2745 CD2 HIS A 162 24.422 2.127 25.307 1.00 10.20 C ATOM 2746 CE1 HIS A 162 22.328 1.860 24.737 1.00 62.44 C ATOM 2747 NE2 HIS A 162 23.338 2.701 24.693 1.00 3.14 N ATOM 2748 OXT HIS A 162 27.815 -1.888 26.496 1.00 36.90 O ATOM 0 H HIS A 162 24.193 -1.991 24.747 1.00 53.42 H new ATOM 0 HA HIS A 162 26.510 -0.230 25.193 1.00 33.32 H new ATOM 0 HB2 HIS A 162 24.072 -0.868 26.908 1.00 22.43 H new ATOM 0 HB3 HIS A 162 25.317 0.297 27.316 1.00 22.43 H new ATOM 0 HD2 HIS A 162 25.399 2.570 25.428 1.00 10.20 H new ATOM 0 HE1 HIS A 162 21.342 2.036 24.332 1.00 62.44 H new ATOM 0 HE2 HIS A 162 23.318 3.629 24.271 1.00 3.14 H new TER 2757 HIS A 162