USER MOD reduce.3.24.130724 H: found=0, std=0, add=1343, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1340 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 NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 202 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 202 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD21 : A 97 ASN OD1 : A 203 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD22 : A 97 ASN OD1 : A 203 CACA :(metal ligand) USER MOD Set 1.1: A 144 MET CE :methyl -121:sc= -6.82! (180deg=-12.1!) USER MOD Set 1.2: A 145 MET CE :methyl -143:sc= -12.3! (180deg=-12.2!) USER MOD Single : A 1 ALA N :NH3+ -171:sc=-4.98e-05 (180deg=-0.0766) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.354 USER MOD Single : A 8 GLN : amide:sc= -6.66! C(o=-6.7!,f=-13!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 170:sc= -0.434 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 106:sc= 1.21 USER MOD Single : A 36 MET CE :methyl 143:sc= -0.262 (180deg=-1.88) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.31 K(o=-1.3,f=-2!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0151 X(o=-0.015,f=-0.28) USER MOD Single : A 51 MET CE :methyl -126:sc= -0.538 (180deg=-1.57!) USER MOD Single : A 53 ASN : amide:sc= -0.0447 X(o=-0.045,f=0) USER MOD Single : A 62 THR OG1 : rot -53:sc= 0.298 USER MOD Single : A 70 THR OG1 : rot 82:sc= 0.995 USER MOD Single : A 71 MET CE :methyl -160:sc= -3.06 (180deg=-4.59!) USER MOD Single : A 72 MET CE :methyl -111:sc= -1.73 (180deg=-4.86!) USER MOD Single : A 75 LYS NZ :NH3+ 165:sc= 0.134 (180deg=0.086) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc=-0.00681 USER MOD Single : A 81 SER OG : rot 29:sc= 0.135 USER MOD Single : A 94 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.0911) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -52:sc= 0.943 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl 145:sc= -0.0673 (180deg=-1.44!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc= -0.857 F(o=-1.8,f=-0.86) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -162:sc= -0.274 (180deg=-0.993) USER MOD Single : A 135 GLN :FLIP amide:sc= -0.341 F(o=-1.1,f=-0.34) USER MOD Single : A 137 ASN : amide:sc= -3.99! C(o=-4!,f=-5.4!) USER MOD Single : A 138 TYR OH : rot -151:sc= -1.04 USER MOD Single : A 143 GLN : amide:sc= -5.23 X(o=-5.2,f=-5.3) USER MOD Single : A 146 THR OG1 : rot 97:sc= 0.223 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 29:sc= 0.352 USER MOD Single : B 69 GLN : amide:sc= -3.38! C(o=-3.4!,f=-9!) USER MOD Single : B 83 ASN : amide:sc= -0.105 X(o=-0.1,f=0) USER MOD Single : B 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 85 ASN :FLIP amide:sc= -1.21 F(o=-4.5!,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 22.430 4.273 -5.151 1.00 0.00 N ATOM 2 CA ALA A 1 21.750 5.541 -5.523 1.00 0.00 C ATOM 3 C ALA A 1 20.290 5.292 -5.888 1.00 0.00 C ATOM 4 O ALA A 1 19.409 6.074 -5.531 1.00 0.00 O ATOM 5 CB ALA A 1 22.476 6.210 -6.680 1.00 0.00 C ATOM 0 H1 ALA A 1 23.371 4.485 -4.762 1.00 0.00 H new ATOM 0 H2 ALA A 1 21.865 3.773 -4.436 1.00 0.00 H new ATOM 0 H3 ALA A 1 22.531 3.673 -5.994 1.00 0.00 H new ATOM 0 HA ALA A 1 21.776 6.205 -4.659 1.00 0.00 H new ATOM 0 HB1 ALA A 1 21.967 7.138 -6.942 1.00 0.00 H new ATOM 0 HB2 ALA A 1 23.503 6.430 -6.387 1.00 0.00 H new ATOM 0 HB3 ALA A 1 22.480 5.543 -7.542 1.00 0.00 H new ATOM 10 N ASP A 2 20.042 4.199 -6.601 1.00 0.00 N ATOM 11 CA ASP A 2 18.689 3.847 -7.015 1.00 0.00 C ATOM 12 C ASP A 2 18.155 2.679 -6.192 1.00 0.00 C ATOM 13 O ASP A 2 18.142 1.537 -6.651 1.00 0.00 O ATOM 14 CB ASP A 2 18.664 3.492 -8.503 1.00 0.00 C ATOM 15 CG ASP A 2 19.593 2.341 -8.838 1.00 0.00 C ATOM 16 OD1 ASP A 2 20.813 2.476 -8.607 1.00 0.00 O ATOM 17 OD2 ASP A 2 19.100 1.305 -9.332 1.00 0.00 O ATOM 0 H ASP A 2 20.760 3.541 -6.904 1.00 0.00 H new ATOM 0 HA ASP A 2 18.047 4.711 -6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 2 17.647 3.231 -8.794 1.00 0.00 H new ATOM 0 HB3 ASP A 2 18.948 4.367 -9.087 1.00 0.00 H new ATOM 22 N GLN A 3 17.714 2.973 -4.973 1.00 0.00 N ATOM 23 CA GLN A 3 17.179 1.948 -4.085 1.00 0.00 C ATOM 24 C GLN A 3 16.678 2.564 -2.783 1.00 0.00 C ATOM 25 O GLN A 3 16.725 3.781 -2.602 1.00 0.00 O ATOM 26 CB GLN A 3 18.247 0.892 -3.789 1.00 0.00 C ATOM 27 CG GLN A 3 17.759 -0.535 -3.972 1.00 0.00 C ATOM 28 CD GLN A 3 18.898 -1.529 -4.091 1.00 0.00 C ATOM 29 OE1 GLN A 3 19.050 -2.197 -5.114 1.00 0.00 O ATOM 30 NE2 GLN A 3 19.705 -1.633 -3.042 1.00 0.00 N ATOM 0 H GLN A 3 17.717 3.913 -4.578 1.00 0.00 H new ATOM 0 HA GLN A 3 16.337 1.471 -4.586 1.00 0.00 H new ATOM 0 HB2 GLN A 3 19.103 1.061 -4.442 1.00 0.00 H new ATOM 0 HB3 GLN A 3 18.597 1.019 -2.765 1.00 0.00 H new ATOM 0 HG2 GLN A 3 17.128 -0.811 -3.127 1.00 0.00 H new ATOM 0 HG3 GLN A 3 17.138 -0.591 -4.866 1.00 0.00 H new ATOM 0 HE21 GLN A 3 19.542 -1.060 -2.214 1.00 0.00 H new ATOM 0 HE22 GLN A 3 20.488 -2.286 -3.064 1.00 0.00 H new ATOM 39 N LEU A 4 16.199 1.717 -1.877 1.00 0.00 N ATOM 40 CA LEU A 4 15.689 2.181 -0.591 1.00 0.00 C ATOM 41 C LEU A 4 16.274 1.361 0.553 1.00 0.00 C ATOM 42 O LEU A 4 16.847 0.293 0.337 1.00 0.00 O ATOM 43 CB LEU A 4 14.161 2.114 -0.549 1.00 0.00 C ATOM 44 CG LEU A 4 13.464 2.048 -1.908 1.00 0.00 C ATOM 45 CD1 LEU A 4 12.045 1.531 -1.743 1.00 0.00 C ATOM 46 CD2 LEU A 4 13.461 3.417 -2.571 1.00 0.00 C ATOM 0 H LEU A 4 16.153 0.707 -2.009 1.00 0.00 H new ATOM 0 HA LEU A 4 15.995 3.220 -0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 4 13.870 1.239 0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 4 13.792 2.989 -0.014 1.00 0.00 H new ATOM 0 HG LEU A 4 14.013 1.359 -2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 4 11.558 1.488 -2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.070 0.533 -1.305 1.00 0.00 H new ATOM 0 HD13 LEU A 4 11.488 2.201 -1.088 1.00 0.00 H new ATOM 0 HD21 LEU A 4 12.961 3.352 -3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 4 12.932 4.128 -1.936 1.00 0.00 H new ATOM 0 HD23 LEU A 4 14.488 3.754 -2.715 1.00 0.00 H new ATOM 58 N THR A 5 16.128 1.871 1.771 1.00 0.00 N ATOM 59 CA THR A 5 16.644 1.189 2.953 1.00 0.00 C ATOM 60 C THR A 5 15.836 -0.069 3.258 1.00 0.00 C ATOM 61 O THR A 5 14.855 -0.371 2.578 1.00 0.00 O ATOM 62 CB THR A 5 16.622 2.128 4.160 1.00 0.00 C ATOM 63 OG1 THR A 5 17.080 1.461 5.323 1.00 0.00 O ATOM 64 CG2 THR A 5 15.248 2.683 4.462 1.00 0.00 C ATOM 0 H THR A 5 15.657 2.754 1.966 1.00 0.00 H new ATOM 0 HA THR A 5 17.673 0.894 2.748 1.00 0.00 H new ATOM 0 HB THR A 5 17.280 2.955 3.893 1.00 0.00 H new ATOM 0 HG1 THR A 5 17.060 2.079 6.084 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.304 3.341 5.329 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.886 3.246 3.602 1.00 0.00 H new ATOM 0 HG23 THR A 5 14.562 1.862 4.673 1.00 0.00 H new ATOM 72 N GLU A 6 16.260 -0.802 4.283 1.00 0.00 N ATOM 73 CA GLU A 6 15.585 -2.032 4.681 1.00 0.00 C ATOM 74 C GLU A 6 14.125 -1.770 5.044 1.00 0.00 C ATOM 75 O GLU A 6 13.249 -2.580 4.746 1.00 0.00 O ATOM 76 CB GLU A 6 16.312 -2.669 5.866 1.00 0.00 C ATOM 77 CG GLU A 6 16.223 -1.851 7.144 1.00 0.00 C ATOM 78 CD GLU A 6 17.021 -2.457 8.281 1.00 0.00 C ATOM 79 OE1 GLU A 6 18.094 -3.038 8.011 1.00 0.00 O ATOM 80 OE2 GLU A 6 16.574 -2.351 9.443 1.00 0.00 O ATOM 0 H GLU A 6 17.071 -0.564 4.855 1.00 0.00 H new ATOM 0 HA GLU A 6 15.605 -2.717 3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 6 15.894 -3.659 6.048 1.00 0.00 H new ATOM 0 HB3 GLU A 6 17.361 -2.808 5.606 1.00 0.00 H new ATOM 0 HG2 GLU A 6 16.584 -0.841 6.950 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.179 -1.765 7.444 1.00 0.00 H new ATOM 87 N GLU A 7 13.872 -0.638 5.693 1.00 0.00 N ATOM 88 CA GLU A 7 12.519 -0.275 6.100 1.00 0.00 C ATOM 89 C GLU A 7 11.686 0.159 4.898 1.00 0.00 C ATOM 90 O GLU A 7 10.628 -0.408 4.626 1.00 0.00 O ATOM 91 CB GLU A 7 12.562 0.848 7.139 1.00 0.00 C ATOM 92 CG GLU A 7 11.674 0.593 8.347 1.00 0.00 C ATOM 93 CD GLU A 7 11.153 1.874 8.968 1.00 0.00 C ATOM 94 OE1 GLU A 7 10.216 2.471 8.399 1.00 0.00 O ATOM 95 OE2 GLU A 7 11.683 2.280 10.024 1.00 0.00 O ATOM 0 H GLU A 7 14.586 0.044 5.948 1.00 0.00 H new ATOM 0 HA GLU A 7 12.051 -1.154 6.543 1.00 0.00 H new ATOM 0 HB2 GLU A 7 13.590 0.981 7.476 1.00 0.00 H new ATOM 0 HB3 GLU A 7 12.258 1.782 6.666 1.00 0.00 H new ATOM 0 HG2 GLU A 7 10.831 -0.031 8.049 1.00 0.00 H new ATOM 0 HG3 GLU A 7 12.236 0.033 9.095 1.00 0.00 H new ATOM 102 N GLN A 8 12.171 1.167 4.180 1.00 0.00 N ATOM 103 CA GLN A 8 11.473 1.675 3.006 1.00 0.00 C ATOM 104 C GLN A 8 11.261 0.566 1.981 1.00 0.00 C ATOM 105 O GLN A 8 10.200 0.467 1.368 1.00 0.00 O ATOM 106 CB GLN A 8 12.265 2.823 2.382 1.00 0.00 C ATOM 107 CG GLN A 8 11.391 3.875 1.726 1.00 0.00 C ATOM 108 CD GLN A 8 12.132 4.674 0.672 1.00 0.00 C ATOM 109 OE1 GLN A 8 11.655 4.835 -0.451 1.00 0.00 O ATOM 110 NE2 GLN A 8 13.307 5.178 1.031 1.00 0.00 N ATOM 0 H GLN A 8 13.045 1.648 4.391 1.00 0.00 H new ATOM 0 HA GLN A 8 10.496 2.044 3.319 1.00 0.00 H new ATOM 0 HB2 GLN A 8 12.872 3.296 3.153 1.00 0.00 H new ATOM 0 HB3 GLN A 8 12.952 2.418 1.639 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.527 3.391 1.270 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.010 4.553 2.490 1.00 0.00 H new ATOM 0 HE21 GLN A 8 13.664 5.019 1.973 1.00 0.00 H new ATOM 0 HE22 GLN A 8 13.853 5.724 0.364 1.00 0.00 H new ATOM 119 N ILE A 9 12.278 -0.270 1.807 1.00 0.00 N ATOM 120 CA ILE A 9 12.211 -1.376 0.869 1.00 0.00 C ATOM 121 C ILE A 9 11.289 -2.480 1.389 1.00 0.00 C ATOM 122 O ILE A 9 10.722 -3.249 0.612 1.00 0.00 O ATOM 123 CB ILE A 9 13.615 -1.950 0.588 1.00 0.00 C ATOM 124 CG1 ILE A 9 13.628 -2.679 -0.753 1.00 0.00 C ATOM 125 CG2 ILE A 9 14.063 -2.872 1.712 1.00 0.00 C ATOM 126 CD1 ILE A 9 15.000 -2.756 -1.387 1.00 0.00 C ATOM 0 H ILE A 9 13.163 -0.199 2.309 1.00 0.00 H new ATOM 0 HA ILE A 9 11.801 -0.990 -0.064 1.00 0.00 H new ATOM 0 HB ILE A 9 14.322 -1.122 0.539 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.245 -3.690 -0.611 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.948 -2.174 -1.439 1.00 0.00 H new ATOM 0 HG21 ILE A 9 15.056 -3.263 1.488 1.00 0.00 H new ATOM 0 HG22 ILE A 9 14.095 -2.315 2.649 1.00 0.00 H new ATOM 0 HG23 ILE A 9 13.360 -3.700 1.806 1.00 0.00 H new ATOM 0 HD11 ILE A 9 14.933 -3.287 -2.336 1.00 0.00 H new ATOM 0 HD12 ILE A 9 15.378 -1.748 -1.561 1.00 0.00 H new ATOM 0 HD13 ILE A 9 15.679 -3.288 -0.721 1.00 0.00 H new ATOM 138 N ALA A 10 11.158 -2.557 2.713 1.00 0.00 N ATOM 139 CA ALA A 10 10.323 -3.570 3.350 1.00 0.00 C ATOM 140 C ALA A 10 8.921 -3.591 2.758 1.00 0.00 C ATOM 141 O ALA A 10 8.365 -4.657 2.493 1.00 0.00 O ATOM 142 CB ALA A 10 10.249 -3.315 4.842 1.00 0.00 C ATOM 0 H ALA A 10 11.622 -1.926 3.366 1.00 0.00 H new ATOM 0 HA ALA A 10 10.779 -4.543 3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.624 -4.075 5.310 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.251 -3.356 5.268 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.818 -2.330 5.022 1.00 0.00 H new ATOM 148 N GLU A 11 8.353 -2.411 2.553 1.00 0.00 N ATOM 149 CA GLU A 11 7.013 -2.300 1.993 1.00 0.00 C ATOM 150 C GLU A 11 6.986 -2.752 0.536 1.00 0.00 C ATOM 151 O GLU A 11 5.987 -3.294 0.067 1.00 0.00 O ATOM 152 CB GLU A 11 6.508 -0.861 2.097 1.00 0.00 C ATOM 153 CG GLU A 11 7.526 0.178 1.660 1.00 0.00 C ATOM 154 CD GLU A 11 6.879 1.464 1.184 1.00 0.00 C ATOM 155 OE1 GLU A 11 6.525 1.544 -0.011 1.00 0.00 O ATOM 156 OE2 GLU A 11 6.728 2.392 2.006 1.00 0.00 O ATOM 0 H GLU A 11 8.798 -1.518 2.766 1.00 0.00 H new ATOM 0 HA GLU A 11 6.357 -2.953 2.569 1.00 0.00 H new ATOM 0 HB2 GLU A 11 5.610 -0.756 1.488 1.00 0.00 H new ATOM 0 HB3 GLU A 11 6.218 -0.661 3.129 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.195 0.398 2.492 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.139 -0.234 0.859 1.00 0.00 H new ATOM 163 N PHE A 12 8.083 -2.517 -0.179 1.00 0.00 N ATOM 164 CA PHE A 12 8.172 -2.894 -1.588 1.00 0.00 C ATOM 165 C PHE A 12 8.167 -4.415 -1.756 1.00 0.00 C ATOM 166 O PHE A 12 7.395 -4.955 -2.552 1.00 0.00 O ATOM 167 CB PHE A 12 9.434 -2.281 -2.215 1.00 0.00 C ATOM 168 CG PHE A 12 10.154 -3.188 -3.178 1.00 0.00 C ATOM 169 CD1 PHE A 12 9.699 -3.345 -4.477 1.00 0.00 C ATOM 170 CD2 PHE A 12 11.284 -3.883 -2.778 1.00 0.00 C ATOM 171 CE1 PHE A 12 10.358 -4.179 -5.360 1.00 0.00 C ATOM 172 CE2 PHE A 12 11.947 -4.718 -3.656 1.00 0.00 C ATOM 173 CZ PHE A 12 11.484 -4.867 -4.949 1.00 0.00 C ATOM 0 H PHE A 12 8.921 -2.069 0.192 1.00 0.00 H new ATOM 0 HA PHE A 12 7.295 -2.504 -2.105 1.00 0.00 H new ATOM 0 HB2 PHE A 12 9.158 -1.364 -2.736 1.00 0.00 H new ATOM 0 HB3 PHE A 12 10.121 -1.999 -1.417 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.820 -2.810 -4.803 1.00 0.00 H new ATOM 0 HD2 PHE A 12 11.650 -3.771 -1.768 1.00 0.00 H new ATOM 0 HE1 PHE A 12 9.994 -4.293 -6.370 1.00 0.00 H new ATOM 0 HE2 PHE A 12 12.827 -5.254 -3.332 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.001 -5.520 -5.637 1.00 0.00 H new ATOM 183 N LYS A 13 9.018 -5.107 -1.000 1.00 0.00 N ATOM 184 CA LYS A 13 9.082 -6.563 -1.081 1.00 0.00 C ATOM 185 C LYS A 13 7.730 -7.161 -0.727 1.00 0.00 C ATOM 186 O LYS A 13 7.232 -8.058 -1.406 1.00 0.00 O ATOM 187 CB LYS A 13 10.156 -7.109 -0.141 1.00 0.00 C ATOM 188 CG LYS A 13 11.504 -6.432 -0.308 1.00 0.00 C ATOM 189 CD LYS A 13 12.098 -6.033 1.031 1.00 0.00 C ATOM 190 CE LYS A 13 12.294 -7.236 1.941 1.00 0.00 C ATOM 191 NZ LYS A 13 13.722 -7.652 2.012 1.00 0.00 N ATOM 0 H LYS A 13 9.665 -4.688 -0.332 1.00 0.00 H new ATOM 0 HA LYS A 13 9.342 -6.842 -2.102 1.00 0.00 H new ATOM 0 HB2 LYS A 13 9.822 -6.988 0.889 1.00 0.00 H new ATOM 0 HB3 LYS A 13 10.271 -8.179 -0.315 1.00 0.00 H new ATOM 0 HG2 LYS A 13 12.188 -7.105 -0.824 1.00 0.00 H new ATOM 0 HG3 LYS A 13 11.393 -5.548 -0.935 1.00 0.00 H new ATOM 0 HD2 LYS A 13 13.056 -5.538 0.871 1.00 0.00 H new ATOM 0 HD3 LYS A 13 11.443 -5.311 1.519 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.936 -6.996 2.942 1.00 0.00 H new ATOM 0 HE3 LYS A 13 11.691 -8.068 1.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 13.813 -8.475 2.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 14.057 -7.906 1.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 14.294 -6.867 2.383 1.00 0.00 H new ATOM 205 N GLU A 14 7.141 -6.641 0.340 1.00 0.00 N ATOM 206 CA GLU A 14 5.840 -7.096 0.798 1.00 0.00 C ATOM 207 C GLU A 14 4.777 -6.803 -0.249 1.00 0.00 C ATOM 208 O GLU A 14 3.975 -7.667 -0.603 1.00 0.00 O ATOM 209 CB GLU A 14 5.485 -6.404 2.110 1.00 0.00 C ATOM 210 CG GLU A 14 6.433 -6.745 3.247 1.00 0.00 C ATOM 211 CD GLU A 14 6.076 -8.048 3.934 1.00 0.00 C ATOM 212 OE1 GLU A 14 4.905 -8.472 3.832 1.00 0.00 O ATOM 213 OE2 GLU A 14 6.966 -8.646 4.574 1.00 0.00 O ATOM 0 H GLU A 14 7.549 -5.898 0.907 1.00 0.00 H new ATOM 0 HA GLU A 14 5.880 -8.173 0.959 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.488 -5.325 1.956 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.471 -6.682 2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 14 7.450 -6.810 2.860 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.421 -5.938 3.979 1.00 0.00 H new ATOM 220 N ALA A 15 4.787 -5.573 -0.740 1.00 0.00 N ATOM 221 CA ALA A 15 3.842 -5.134 -1.750 1.00 0.00 C ATOM 222 C ALA A 15 3.829 -6.079 -2.942 1.00 0.00 C ATOM 223 O ALA A 15 2.772 -6.407 -3.482 1.00 0.00 O ATOM 224 CB ALA A 15 4.215 -3.742 -2.206 1.00 0.00 C ATOM 0 H ALA A 15 5.450 -4.854 -0.449 1.00 0.00 H new ATOM 0 HA ALA A 15 2.843 -5.131 -1.313 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.509 -3.406 -2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.185 -3.060 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 15 5.221 -3.754 -2.626 1.00 0.00 H new ATOM 230 N PHE A 16 5.016 -6.509 -3.347 1.00 0.00 N ATOM 231 CA PHE A 16 5.150 -7.415 -4.481 1.00 0.00 C ATOM 232 C PHE A 16 4.315 -8.675 -4.277 1.00 0.00 C ATOM 233 O PHE A 16 3.709 -9.188 -5.218 1.00 0.00 O ATOM 234 CB PHE A 16 6.615 -7.786 -4.697 1.00 0.00 C ATOM 235 CG PHE A 16 7.025 -7.748 -6.139 1.00 0.00 C ATOM 236 CD1 PHE A 16 6.521 -8.671 -7.039 1.00 0.00 C ATOM 237 CD2 PHE A 16 7.912 -6.788 -6.594 1.00 0.00 C ATOM 238 CE1 PHE A 16 6.894 -8.638 -8.369 1.00 0.00 C ATOM 239 CE2 PHE A 16 8.290 -6.748 -7.923 1.00 0.00 C ATOM 240 CZ PHE A 16 7.780 -7.675 -8.811 1.00 0.00 C ATOM 0 H PHE A 16 5.899 -6.246 -2.909 1.00 0.00 H new ATOM 0 HA PHE A 16 4.781 -6.900 -5.368 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.245 -7.102 -4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.793 -8.786 -4.301 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.828 -9.426 -6.698 1.00 0.00 H new ATOM 0 HD2 PHE A 16 8.313 -6.062 -5.903 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.494 -9.364 -9.061 1.00 0.00 H new ATOM 0 HE2 PHE A 16 8.983 -5.994 -8.266 1.00 0.00 H new ATOM 0 HZ PHE A 16 8.074 -7.647 -9.850 1.00 0.00 H new ATOM 250 N SER A 17 4.284 -9.165 -3.044 1.00 0.00 N ATOM 251 CA SER A 17 3.518 -10.362 -2.721 1.00 0.00 C ATOM 252 C SER A 17 2.022 -10.061 -2.694 1.00 0.00 C ATOM 253 O SER A 17 1.197 -10.974 -2.734 1.00 0.00 O ATOM 254 CB SER A 17 3.962 -10.932 -1.373 1.00 0.00 C ATOM 255 OG SER A 17 5.059 -11.815 -1.529 1.00 0.00 O ATOM 0 H SER A 17 4.779 -8.753 -2.253 1.00 0.00 H new ATOM 0 HA SER A 17 3.706 -11.103 -3.498 1.00 0.00 H new ATOM 0 HB2 SER A 17 4.239 -10.117 -0.704 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.130 -11.459 -0.906 1.00 0.00 H new ATOM 0 HG SER A 17 5.325 -12.164 -0.653 1.00 0.00 H new ATOM 261 N LEU A 18 1.674 -8.778 -2.635 1.00 0.00 N ATOM 262 CA LEU A 18 0.277 -8.369 -2.614 1.00 0.00 C ATOM 263 C LEU A 18 -0.252 -8.226 -4.035 1.00 0.00 C ATOM 264 O LEU A 18 -1.394 -8.584 -4.324 1.00 0.00 O ATOM 265 CB LEU A 18 0.112 -7.050 -1.855 1.00 0.00 C ATOM 266 CG LEU A 18 0.882 -6.951 -0.535 1.00 0.00 C ATOM 267 CD1 LEU A 18 0.364 -5.787 0.295 1.00 0.00 C ATOM 268 CD2 LEU A 18 0.778 -8.251 0.251 1.00 0.00 C ATOM 0 H LEU A 18 2.341 -8.007 -2.601 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.298 -9.138 -2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.431 -6.235 -2.504 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.948 -6.898 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 18 1.933 -6.775 -0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.921 -5.730 1.230 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.492 -4.858 -0.261 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.694 -5.937 0.512 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.333 -8.157 1.185 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.269 -8.461 0.470 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.196 -9.067 -0.339 1.00 0.00 H new ATOM 280 N PHE A 19 0.593 -7.709 -4.921 1.00 0.00 N ATOM 281 CA PHE A 19 0.217 -7.530 -6.316 1.00 0.00 C ATOM 282 C PHE A 19 0.057 -8.886 -6.999 1.00 0.00 C ATOM 283 O PHE A 19 -1.045 -9.264 -7.395 1.00 0.00 O ATOM 284 CB PHE A 19 1.264 -6.686 -7.046 1.00 0.00 C ATOM 285 CG PHE A 19 0.684 -5.524 -7.801 1.00 0.00 C ATOM 286 CD1 PHE A 19 -0.482 -5.667 -8.535 1.00 0.00 C ATOM 287 CD2 PHE A 19 1.306 -4.289 -7.773 1.00 0.00 C ATOM 288 CE1 PHE A 19 -1.017 -4.597 -9.227 1.00 0.00 C ATOM 289 CE2 PHE A 19 0.777 -3.215 -8.463 1.00 0.00 C ATOM 290 CZ PHE A 19 -0.386 -3.369 -9.190 1.00 0.00 C ATOM 0 H PHE A 19 1.541 -7.407 -4.697 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.738 -7.006 -6.355 1.00 0.00 H new ATOM 0 HB2 PHE A 19 1.986 -6.312 -6.320 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.811 -7.323 -7.741 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.979 -6.626 -8.567 1.00 0.00 H new ATOM 0 HD2 PHE A 19 2.216 -4.163 -7.205 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.927 -4.721 -9.796 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.273 -2.256 -8.433 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.802 -2.531 -9.729 1.00 0.00 H new ATOM 300 N ASP A 20 1.161 -9.620 -7.124 1.00 0.00 N ATOM 301 CA ASP A 20 1.127 -10.939 -7.749 1.00 0.00 C ATOM 302 C ASP A 20 0.315 -11.915 -6.904 1.00 0.00 C ATOM 303 O ASP A 20 0.479 -11.983 -5.686 1.00 0.00 O ATOM 304 CB ASP A 20 2.543 -11.485 -7.941 1.00 0.00 C ATOM 305 CG ASP A 20 2.612 -12.523 -9.043 1.00 0.00 C ATOM 306 OD1 ASP A 20 2.301 -12.183 -10.204 1.00 0.00 O ATOM 307 OD2 ASP A 20 2.975 -13.681 -8.749 1.00 0.00 O ATOM 0 H ASP A 20 2.083 -9.326 -6.803 1.00 0.00 H new ATOM 0 HA ASP A 20 0.653 -10.833 -8.725 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.219 -10.663 -8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.890 -11.926 -7.007 1.00 0.00 H new ATOM 312 N LYS A 21 -0.560 -12.668 -7.560 1.00 0.00 N ATOM 313 CA LYS A 21 -1.400 -13.643 -6.870 1.00 0.00 C ATOM 314 C LYS A 21 -0.574 -14.820 -6.356 1.00 0.00 C ATOM 315 O LYS A 21 -0.828 -15.339 -5.269 1.00 0.00 O ATOM 316 CB LYS A 21 -2.498 -14.150 -7.804 1.00 0.00 C ATOM 317 CG LYS A 21 -1.981 -14.586 -9.165 1.00 0.00 C ATOM 318 CD LYS A 21 -2.262 -16.057 -9.428 1.00 0.00 C ATOM 319 CE LYS A 21 -3.755 -16.335 -9.494 1.00 0.00 C ATOM 320 NZ LYS A 21 -4.058 -17.557 -10.290 1.00 0.00 N ATOM 0 H LYS A 21 -0.707 -12.623 -8.568 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.855 -13.145 -6.014 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -3.007 -14.990 -7.331 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.240 -13.363 -7.941 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.448 -13.982 -9.943 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.908 -14.405 -9.222 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.793 -16.356 -10.365 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.813 -16.661 -8.640 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.147 -16.453 -8.484 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.265 -15.479 -9.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.086 -17.712 -10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -3.707 -17.435 -11.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -3.593 -18.379 -9.855 1.00 0.00 H new ATOM 334 N ASP A 22 0.414 -15.237 -7.142 1.00 0.00 N ATOM 335 CA ASP A 22 1.274 -16.348 -6.767 1.00 0.00 C ATOM 336 C ASP A 22 2.539 -15.846 -6.078 1.00 0.00 C ATOM 337 O ASP A 22 3.282 -16.622 -5.478 1.00 0.00 O ATOM 338 CB ASP A 22 1.637 -17.161 -8.010 1.00 0.00 C ATOM 339 CG ASP A 22 2.081 -16.286 -9.168 1.00 0.00 C ATOM 340 OD1 ASP A 22 1.326 -15.363 -9.540 1.00 0.00 O ATOM 341 OD2 ASP A 22 3.182 -16.519 -9.708 1.00 0.00 O ATOM 0 H ASP A 22 0.637 -14.819 -8.045 1.00 0.00 H new ATOM 0 HA ASP A 22 0.735 -16.984 -6.065 1.00 0.00 H new ATOM 0 HB2 ASP A 22 2.434 -17.862 -7.762 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.775 -17.754 -8.317 1.00 0.00 H new ATOM 346 N GLY A 23 2.769 -14.538 -6.158 1.00 0.00 N ATOM 347 CA GLY A 23 3.937 -13.951 -5.526 1.00 0.00 C ATOM 348 C GLY A 23 5.234 -14.559 -6.015 1.00 0.00 C ATOM 349 O GLY A 23 6.178 -14.726 -5.243 1.00 0.00 O ATOM 0 H GLY A 23 2.168 -13.876 -6.648 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.948 -12.878 -5.718 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.864 -14.081 -4.446 1.00 0.00 H new ATOM 353 N ASP A 24 5.283 -14.889 -7.300 1.00 0.00 N ATOM 354 CA ASP A 24 6.483 -15.481 -7.884 1.00 0.00 C ATOM 355 C ASP A 24 7.585 -14.438 -8.075 1.00 0.00 C ATOM 356 O ASP A 24 8.705 -14.775 -8.458 1.00 0.00 O ATOM 357 CB ASP A 24 6.162 -16.150 -9.222 1.00 0.00 C ATOM 358 CG ASP A 24 5.486 -15.210 -10.199 1.00 0.00 C ATOM 359 OD1 ASP A 24 5.152 -14.074 -9.804 1.00 0.00 O ATOM 360 OD2 ASP A 24 5.270 -15.613 -11.361 1.00 0.00 O ATOM 0 H ASP A 24 4.512 -14.758 -7.955 1.00 0.00 H new ATOM 0 HA ASP A 24 6.845 -16.237 -7.187 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.084 -16.527 -9.665 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.517 -17.011 -9.047 1.00 0.00 H new ATOM 365 N GLY A 25 7.268 -13.173 -7.804 1.00 0.00 N ATOM 366 CA GLY A 25 8.254 -12.118 -7.952 1.00 0.00 C ATOM 367 C GLY A 25 8.041 -11.276 -9.197 1.00 0.00 C ATOM 368 O GLY A 25 8.836 -10.382 -9.487 1.00 0.00 O ATOM 0 H GLY A 25 6.350 -12.862 -7.486 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.222 -11.473 -7.074 1.00 0.00 H new ATOM 0 HA3 GLY A 25 9.249 -12.561 -7.986 1.00 0.00 H new ATOM 372 N THR A 26 6.967 -11.551 -9.931 1.00 0.00 N ATOM 373 CA THR A 26 6.662 -10.797 -11.142 1.00 0.00 C ATOM 374 C THR A 26 5.157 -10.729 -11.375 1.00 0.00 C ATOM 375 O THR A 26 4.460 -11.741 -11.295 1.00 0.00 O ATOM 376 CB THR A 26 7.349 -11.435 -12.350 1.00 0.00 C ATOM 377 OG1 THR A 26 6.984 -12.798 -12.473 1.00 0.00 O ATOM 378 CG2 THR A 26 8.860 -11.368 -12.284 1.00 0.00 C ATOM 0 H THR A 26 6.296 -12.287 -9.710 1.00 0.00 H new ATOM 0 HA THR A 26 7.037 -9.782 -11.013 1.00 0.00 H new ATOM 0 HB THR A 26 7.013 -10.857 -13.211 1.00 0.00 H new ATOM 0 HG1 THR A 26 7.432 -13.188 -13.252 1.00 0.00 H new ATOM 0 HG21 THR A 26 9.284 -11.838 -13.171 1.00 0.00 H new ATOM 0 HG22 THR A 26 9.176 -10.326 -12.239 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.209 -11.892 -11.394 1.00 0.00 H new ATOM 386 N ILE A 27 4.662 -9.530 -11.664 1.00 0.00 N ATOM 387 CA ILE A 27 3.239 -9.326 -11.909 1.00 0.00 C ATOM 388 C ILE A 27 2.973 -8.995 -13.372 1.00 0.00 C ATOM 389 O ILE A 27 3.571 -8.075 -13.930 1.00 0.00 O ATOM 390 CB ILE A 27 2.687 -8.190 -11.030 1.00 0.00 C ATOM 391 CG1 ILE A 27 3.102 -8.403 -9.577 1.00 0.00 C ATOM 392 CG2 ILE A 27 1.173 -8.097 -11.150 1.00 0.00 C ATOM 393 CD1 ILE A 27 3.916 -7.261 -9.015 1.00 0.00 C ATOM 0 H ILE A 27 5.227 -8.683 -11.734 1.00 0.00 H new ATOM 0 HA ILE A 27 2.733 -10.258 -11.656 1.00 0.00 H new ATOM 0 HB ILE A 27 3.108 -7.247 -11.379 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.209 -8.538 -8.967 1.00 0.00 H new ATOM 0 HG13 ILE A 27 3.681 -9.324 -9.503 1.00 0.00 H new ATOM 0 HG21 ILE A 27 0.807 -7.287 -10.519 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.902 -7.900 -12.187 1.00 0.00 H new ATOM 0 HG23 ILE A 27 0.724 -9.037 -10.829 1.00 0.00 H new ATOM 0 HD11 ILE A 27 4.178 -7.476 -7.979 1.00 0.00 H new ATOM 0 HD12 ILE A 27 4.826 -7.140 -9.602 1.00 0.00 H new ATOM 0 HD13 ILE A 27 3.332 -6.342 -9.058 1.00 0.00 H new ATOM 405 N THR A 28 2.070 -9.749 -13.986 1.00 0.00 N ATOM 406 CA THR A 28 1.721 -9.536 -15.386 1.00 0.00 C ATOM 407 C THR A 28 0.414 -8.759 -15.507 1.00 0.00 C ATOM 408 O THR A 28 -0.303 -8.579 -14.526 1.00 0.00 O ATOM 409 CB THR A 28 1.605 -10.875 -16.119 1.00 0.00 C ATOM 410 OG1 THR A 28 0.977 -10.704 -17.377 1.00 0.00 O ATOM 411 CG2 THR A 28 0.819 -11.915 -15.351 1.00 0.00 C ATOM 0 H THR A 28 1.566 -10.514 -13.537 1.00 0.00 H new ATOM 0 HA THR A 28 2.516 -8.950 -15.847 1.00 0.00 H new ATOM 0 HB THR A 28 2.629 -11.231 -16.232 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.055 -11.531 -17.897 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.776 -12.839 -15.928 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.306 -12.107 -14.395 1.00 0.00 H new ATOM 0 HG23 THR A 28 -0.193 -11.550 -15.175 1.00 0.00 H new ATOM 419 N THR A 29 0.116 -8.295 -16.717 1.00 0.00 N ATOM 420 CA THR A 29 -1.101 -7.528 -16.970 1.00 0.00 C ATOM 421 C THR A 29 -2.344 -8.283 -16.503 1.00 0.00 C ATOM 422 O THR A 29 -3.340 -7.672 -16.113 1.00 0.00 O ATOM 423 CB THR A 29 -1.220 -7.204 -18.460 1.00 0.00 C ATOM 424 OG1 THR A 29 -1.538 -8.367 -19.202 1.00 0.00 O ATOM 425 CG2 THR A 29 0.045 -6.616 -19.047 1.00 0.00 C ATOM 0 H THR A 29 0.702 -8.437 -17.540 1.00 0.00 H new ATOM 0 HA THR A 29 -1.034 -6.601 -16.401 1.00 0.00 H new ATOM 0 HB THR A 29 -2.014 -6.461 -18.532 1.00 0.00 H new ATOM 0 HG1 THR A 29 -1.611 -8.139 -20.152 1.00 0.00 H new ATOM 0 HG21 THR A 29 -0.107 -6.409 -20.106 1.00 0.00 H new ATOM 0 HG22 THR A 29 0.290 -5.689 -18.528 1.00 0.00 H new ATOM 0 HG23 THR A 29 0.864 -7.325 -18.930 1.00 0.00 H new ATOM 433 N LYS A 30 -2.284 -9.609 -16.549 1.00 0.00 N ATOM 434 CA LYS A 30 -3.411 -10.440 -16.134 1.00 0.00 C ATOM 435 C LYS A 30 -3.708 -10.264 -14.648 1.00 0.00 C ATOM 436 O LYS A 30 -4.850 -10.026 -14.257 1.00 0.00 O ATOM 437 CB LYS A 30 -3.123 -11.911 -16.437 1.00 0.00 C ATOM 438 CG LYS A 30 -2.888 -12.194 -17.912 1.00 0.00 C ATOM 439 CD LYS A 30 -1.769 -13.203 -18.116 1.00 0.00 C ATOM 440 CE LYS A 30 -2.095 -14.536 -17.463 1.00 0.00 C ATOM 441 NZ LYS A 30 -0.969 -15.503 -17.580 1.00 0.00 N ATOM 0 H LYS A 30 -1.469 -10.132 -16.869 1.00 0.00 H new ATOM 0 HA LYS A 30 -4.288 -10.122 -16.698 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.246 -12.225 -15.871 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.960 -12.516 -16.088 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.806 -12.572 -18.362 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -2.640 -11.266 -18.426 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.601 -13.351 -19.183 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.842 -12.809 -17.699 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -2.329 -14.377 -16.410 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.986 -14.959 -17.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.232 -16.399 -17.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.762 -15.675 -18.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.125 -15.111 -17.115 1.00 0.00 H new ATOM 455 N GLU A 31 -2.672 -10.385 -13.825 1.00 0.00 N ATOM 456 CA GLU A 31 -2.817 -10.243 -12.380 1.00 0.00 C ATOM 457 C GLU A 31 -2.944 -8.777 -11.988 1.00 0.00 C ATOM 458 O GLU A 31 -3.665 -8.429 -11.053 1.00 0.00 O ATOM 459 CB GLU A 31 -1.614 -10.862 -11.668 1.00 0.00 C ATOM 460 CG GLU A 31 -1.344 -12.312 -12.050 1.00 0.00 C ATOM 461 CD GLU A 31 -2.612 -13.126 -12.234 1.00 0.00 C ATOM 462 OE1 GLU A 31 -3.584 -12.890 -11.486 1.00 0.00 O ATOM 463 OE2 GLU A 31 -2.632 -14.000 -13.127 1.00 0.00 O ATOM 0 H GLU A 31 -1.720 -10.582 -14.135 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.725 -10.764 -12.078 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.728 -10.268 -11.891 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.774 -10.805 -10.591 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.767 -12.336 -12.974 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.730 -12.776 -11.278 1.00 0.00 H new ATOM 470 N LEU A 32 -2.233 -7.926 -12.714 1.00 0.00 N ATOM 471 CA LEU A 32 -2.249 -6.488 -12.457 1.00 0.00 C ATOM 472 C LEU A 32 -3.674 -5.953 -12.466 1.00 0.00 C ATOM 473 O LEU A 32 -4.145 -5.374 -11.488 1.00 0.00 O ATOM 474 CB LEU A 32 -1.427 -5.754 -13.523 1.00 0.00 C ATOM 475 CG LEU A 32 -0.328 -4.844 -12.984 1.00 0.00 C ATOM 476 CD1 LEU A 32 1.002 -5.567 -12.997 1.00 0.00 C ATOM 477 CD2 LEU A 32 -0.246 -3.557 -13.797 1.00 0.00 C ATOM 0 H LEU A 32 -1.634 -8.206 -13.491 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.813 -6.315 -11.473 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.973 -6.494 -14.182 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.104 -5.157 -14.133 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.571 -4.580 -11.955 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.779 -4.907 -12.610 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.938 -6.458 -12.372 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.248 -5.857 -14.018 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.544 -2.923 -13.395 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.025 -3.797 -14.837 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.198 -3.030 -13.741 1.00 0.00 H new ATOM 489 N GLY A 33 -4.345 -6.155 -13.587 1.00 0.00 N ATOM 490 CA GLY A 33 -5.713 -5.693 -13.735 1.00 0.00 C ATOM 491 C GLY A 33 -6.671 -6.377 -12.779 1.00 0.00 C ATOM 492 O GLY A 33 -7.697 -5.810 -12.410 1.00 0.00 O ATOM 0 H GLY A 33 -3.966 -6.634 -14.404 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.748 -4.616 -13.569 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.042 -5.868 -14.759 1.00 0.00 H new ATOM 496 N THR A 34 -6.336 -7.601 -12.383 1.00 0.00 N ATOM 497 CA THR A 34 -7.173 -8.371 -11.468 1.00 0.00 C ATOM 498 C THR A 34 -7.207 -7.733 -10.082 1.00 0.00 C ATOM 499 O THR A 34 -8.269 -7.356 -9.587 1.00 0.00 O ATOM 500 CB THR A 34 -6.657 -9.808 -11.368 1.00 0.00 C ATOM 501 OG1 THR A 34 -6.685 -10.438 -12.636 1.00 0.00 O ATOM 502 CG2 THR A 34 -7.454 -10.669 -10.411 1.00 0.00 C ATOM 0 H THR A 34 -5.488 -8.083 -12.682 1.00 0.00 H new ATOM 0 HA THR A 34 -8.188 -8.378 -11.864 1.00 0.00 H new ATOM 0 HB THR A 34 -5.639 -9.722 -10.989 1.00 0.00 H new ATOM 0 HG1 THR A 34 -5.772 -10.512 -12.984 1.00 0.00 H new ATOM 0 HG21 THR A 34 -7.033 -11.674 -10.389 1.00 0.00 H new ATOM 0 HG22 THR A 34 -7.412 -10.237 -9.411 1.00 0.00 H new ATOM 0 HG23 THR A 34 -8.491 -10.717 -10.742 1.00 0.00 H new ATOM 510 N VAL A 35 -6.040 -7.619 -9.459 1.00 0.00 N ATOM 511 CA VAL A 35 -5.940 -7.030 -8.132 1.00 0.00 C ATOM 512 C VAL A 35 -6.208 -5.530 -8.179 1.00 0.00 C ATOM 513 O VAL A 35 -6.716 -4.949 -7.219 1.00 0.00 O ATOM 514 CB VAL A 35 -4.551 -7.281 -7.514 1.00 0.00 C ATOM 515 CG1 VAL A 35 -3.460 -6.705 -8.404 1.00 0.00 C ATOM 516 CG2 VAL A 35 -4.472 -6.698 -6.111 1.00 0.00 C ATOM 0 H VAL A 35 -5.151 -7.927 -9.853 1.00 0.00 H new ATOM 0 HA VAL A 35 -6.696 -7.509 -7.509 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.397 -8.357 -7.440 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.486 -6.891 -7.952 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.502 -7.179 -9.384 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.609 -5.631 -8.514 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -3.483 -6.887 -5.694 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -4.649 -5.623 -6.153 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.227 -7.166 -5.480 1.00 0.00 H new ATOM 526 N MET A 36 -5.867 -4.907 -9.302 1.00 0.00 N ATOM 527 CA MET A 36 -6.074 -3.475 -9.473 1.00 0.00 C ATOM 528 C MET A 36 -7.558 -3.131 -9.392 1.00 0.00 C ATOM 529 O MET A 36 -7.952 -2.196 -8.695 1.00 0.00 O ATOM 530 CB MET A 36 -5.502 -3.010 -10.814 1.00 0.00 C ATOM 531 CG MET A 36 -5.661 -1.519 -11.060 1.00 0.00 C ATOM 532 SD MET A 36 -4.962 -0.997 -12.637 1.00 0.00 S ATOM 533 CE MET A 36 -5.092 0.784 -12.493 1.00 0.00 C ATOM 0 H MET A 36 -5.446 -5.372 -10.107 1.00 0.00 H new ATOM 0 HA MET A 36 -5.553 -2.958 -8.668 1.00 0.00 H new ATOM 0 HB2 MET A 36 -4.443 -3.266 -10.856 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.994 -3.557 -11.618 1.00 0.00 H new ATOM 0 HG2 MET A 36 -6.720 -1.261 -11.033 1.00 0.00 H new ATOM 0 HG3 MET A 36 -5.178 -0.968 -10.253 1.00 0.00 H new ATOM 0 HE1 MET A 36 -4.220 1.251 -12.952 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.995 1.125 -13.000 1.00 0.00 H new ATOM 0 HE3 MET A 36 -5.140 1.061 -11.440 1.00 0.00 H new ATOM 543 N ARG A 37 -8.376 -3.896 -10.108 1.00 0.00 N ATOM 544 CA ARG A 37 -9.817 -3.677 -10.116 1.00 0.00 C ATOM 545 C ARG A 37 -10.464 -4.248 -8.857 1.00 0.00 C ATOM 546 O ARG A 37 -11.525 -3.792 -8.431 1.00 0.00 O ATOM 547 CB ARG A 37 -10.446 -4.310 -11.360 1.00 0.00 C ATOM 548 CG ARG A 37 -10.265 -5.818 -11.439 1.00 0.00 C ATOM 549 CD ARG A 37 -11.354 -6.553 -10.673 1.00 0.00 C ATOM 550 NE ARG A 37 -12.258 -7.276 -11.566 1.00 0.00 N ATOM 551 CZ ARG A 37 -13.454 -7.731 -11.200 1.00 0.00 C ATOM 552 NH1 ARG A 37 -13.894 -7.541 -9.962 1.00 0.00 N ATOM 553 NH2 ARG A 37 -14.213 -8.378 -12.074 1.00 0.00 N ATOM 0 H ARG A 37 -8.065 -4.673 -10.690 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.993 -2.602 -10.136 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -11.511 -4.080 -11.374 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -10.010 -3.854 -12.249 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.278 -6.132 -12.483 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -9.289 -6.090 -11.036 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -10.896 -7.254 -9.975 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -11.925 -5.839 -10.079 1.00 0.00 H new ATOM 0 HE ARG A 37 -11.954 -7.441 -12.526 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.315 -7.044 -9.285 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.811 -7.892 -9.687 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -13.880 -8.527 -13.027 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -15.130 -8.727 -11.794 1.00 0.00 H new ATOM 567 N SER A 38 -9.818 -5.249 -8.265 1.00 0.00 N ATOM 568 CA SER A 38 -10.331 -5.882 -7.055 1.00 0.00 C ATOM 569 C SER A 38 -10.513 -4.859 -5.937 1.00 0.00 C ATOM 570 O SER A 38 -11.456 -4.946 -5.151 1.00 0.00 O ATOM 571 CB SER A 38 -9.384 -6.992 -6.595 1.00 0.00 C ATOM 572 OG SER A 38 -10.058 -7.931 -5.775 1.00 0.00 O ATOM 0 H SER A 38 -8.938 -5.639 -8.604 1.00 0.00 H new ATOM 0 HA SER A 38 -11.304 -6.315 -7.288 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.964 -7.499 -7.464 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.549 -6.557 -6.045 1.00 0.00 H new ATOM 0 HG SER A 38 -9.431 -8.631 -5.496 1.00 0.00 H new ATOM 578 N LEU A 39 -9.604 -3.892 -5.873 1.00 0.00 N ATOM 579 CA LEU A 39 -9.664 -2.852 -4.852 1.00 0.00 C ATOM 580 C LEU A 39 -10.984 -2.092 -4.924 1.00 0.00 C ATOM 581 O LEU A 39 -11.767 -2.094 -3.974 1.00 0.00 O ATOM 582 CB LEU A 39 -8.494 -1.880 -5.014 1.00 0.00 C ATOM 583 CG LEU A 39 -7.164 -2.365 -4.436 1.00 0.00 C ATOM 584 CD1 LEU A 39 -5.997 -1.720 -5.168 1.00 0.00 C ATOM 585 CD2 LEU A 39 -7.091 -2.067 -2.946 1.00 0.00 C ATOM 0 H LEU A 39 -8.817 -3.807 -6.516 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.596 -3.333 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.357 -1.674 -6.076 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.757 -0.936 -4.537 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.101 -3.444 -4.574 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.059 -2.077 -4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.040 -1.983 -6.225 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.055 -0.637 -5.061 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.138 -2.419 -2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.176 -0.992 -2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.907 -2.576 -2.433 1.00 0.00 H new ATOM 597 N GLY A 40 -11.225 -1.443 -6.059 1.00 0.00 N ATOM 598 CA GLY A 40 -12.452 -0.688 -6.235 1.00 0.00 C ATOM 599 C GLY A 40 -12.420 0.187 -7.472 1.00 0.00 C ATOM 600 O GLY A 40 -12.882 1.328 -7.446 1.00 0.00 O ATOM 0 H GLY A 40 -10.593 -1.427 -6.859 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -13.293 -1.378 -6.303 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -12.621 -0.065 -5.357 1.00 0.00 H new ATOM 604 N GLN A 41 -11.874 -0.348 -8.559 1.00 0.00 N ATOM 605 CA GLN A 41 -11.783 0.392 -9.812 1.00 0.00 C ATOM 606 C GLN A 41 -12.019 -0.527 -11.006 1.00 0.00 C ATOM 607 O GLN A 41 -11.920 -1.749 -10.891 1.00 0.00 O ATOM 608 CB GLN A 41 -10.414 1.065 -9.933 1.00 0.00 C ATOM 609 CG GLN A 41 -9.993 1.816 -8.681 1.00 0.00 C ATOM 610 CD GLN A 41 -10.782 3.094 -8.475 1.00 0.00 C ATOM 611 OE1 GLN A 41 -11.369 3.310 -7.415 1.00 0.00 O ATOM 612 NE2 GLN A 41 -10.800 3.949 -9.491 1.00 0.00 N ATOM 0 H GLN A 41 -11.488 -1.291 -8.597 1.00 0.00 H new ATOM 0 HA GLN A 41 -12.558 1.159 -9.809 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.665 0.307 -10.161 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.432 1.758 -10.774 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.123 1.169 -7.813 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.931 2.055 -8.745 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.299 3.729 -10.352 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.315 4.826 -9.411 1.00 0.00 H new ATOM 621 N ASN A 42 -12.330 0.069 -12.152 1.00 0.00 N ATOM 622 CA ASN A 42 -12.580 -0.696 -13.368 1.00 0.00 C ATOM 623 C ASN A 42 -11.768 -0.140 -14.537 1.00 0.00 C ATOM 624 O ASN A 42 -12.328 0.284 -15.549 1.00 0.00 O ATOM 625 CB ASN A 42 -14.072 -0.678 -13.709 1.00 0.00 C ATOM 626 CG ASN A 42 -14.854 -1.722 -12.938 1.00 0.00 C ATOM 627 OD1 ASN A 42 -15.109 -2.818 -13.437 1.00 0.00 O ATOM 628 ND2 ASN A 42 -15.241 -1.386 -11.712 1.00 0.00 N ATOM 0 H ASN A 42 -12.415 1.079 -12.264 1.00 0.00 H new ATOM 0 HA ASN A 42 -12.269 -1.726 -13.192 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -14.479 0.310 -13.493 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -14.200 -0.849 -14.778 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -15.771 -2.048 -11.145 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -15.008 -0.466 -11.338 1.00 0.00 H new ATOM 635 N PRO A 43 -10.430 -0.134 -14.412 1.00 0.00 N ATOM 636 CA PRO A 43 -9.541 0.373 -15.462 1.00 0.00 C ATOM 637 C PRO A 43 -9.518 -0.534 -16.688 1.00 0.00 C ATOM 638 O PRO A 43 -10.324 -1.457 -16.804 1.00 0.00 O ATOM 639 CB PRO A 43 -8.168 0.393 -14.786 1.00 0.00 C ATOM 640 CG PRO A 43 -8.255 -0.642 -13.719 1.00 0.00 C ATOM 641 CD PRO A 43 -9.680 -0.622 -13.238 1.00 0.00 C ATOM 0 HA PRO A 43 -9.862 1.346 -15.833 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -7.374 0.163 -15.496 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -7.947 1.375 -14.368 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -7.988 -1.625 -14.106 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -7.565 -0.422 -12.904 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -10.014 -1.613 -12.931 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -9.805 0.037 -12.379 1.00 0.00 H new ATOM 649 N THR A 44 -8.590 -0.263 -17.600 1.00 0.00 N ATOM 650 CA THR A 44 -8.463 -1.055 -18.818 1.00 0.00 C ATOM 651 C THR A 44 -7.106 -1.749 -18.875 1.00 0.00 C ATOM 652 O THR A 44 -6.200 -1.428 -18.107 1.00 0.00 O ATOM 653 CB THR A 44 -8.646 -0.166 -20.049 1.00 0.00 C ATOM 654 OG1 THR A 44 -7.646 0.836 -20.098 1.00 0.00 O ATOM 655 CG2 THR A 44 -9.992 0.525 -20.094 1.00 0.00 C ATOM 0 H THR A 44 -7.916 0.498 -17.519 1.00 0.00 H new ATOM 0 HA THR A 44 -9.241 -1.818 -18.810 1.00 0.00 H new ATOM 0 HB THR A 44 -8.573 -0.838 -20.904 1.00 0.00 H new ATOM 0 HG1 THR A 44 -7.780 1.393 -20.893 1.00 0.00 H new ATOM 0 HG21 THR A 44 -10.056 1.139 -20.992 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.785 -0.223 -20.109 1.00 0.00 H new ATOM 0 HG23 THR A 44 -10.106 1.157 -19.213 1.00 0.00 H new ATOM 663 N GLU A 45 -6.972 -2.695 -19.798 1.00 0.00 N ATOM 664 CA GLU A 45 -5.725 -3.428 -19.965 1.00 0.00 C ATOM 665 C GLU A 45 -4.647 -2.506 -20.514 1.00 0.00 C ATOM 666 O GLU A 45 -3.464 -2.655 -20.210 1.00 0.00 O ATOM 667 CB GLU A 45 -5.925 -4.622 -20.899 1.00 0.00 C ATOM 668 CG GLU A 45 -6.254 -4.231 -22.331 1.00 0.00 C ATOM 669 CD GLU A 45 -6.903 -5.358 -23.109 1.00 0.00 C ATOM 670 OE1 GLU A 45 -7.966 -5.846 -22.672 1.00 0.00 O ATOM 671 OE2 GLU A 45 -6.347 -5.754 -24.155 1.00 0.00 O ATOM 0 H GLU A 45 -7.713 -2.972 -20.442 1.00 0.00 H new ATOM 0 HA GLU A 45 -5.409 -3.801 -18.991 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.020 -5.229 -20.897 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.729 -5.246 -20.509 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -6.920 -3.369 -22.324 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.340 -3.923 -22.839 1.00 0.00 H new ATOM 678 N ALA A 46 -5.078 -1.546 -21.324 1.00 0.00 N ATOM 679 CA ALA A 46 -4.186 -0.580 -21.927 1.00 0.00 C ATOM 680 C ALA A 46 -3.284 0.071 -20.882 1.00 0.00 C ATOM 681 O ALA A 46 -2.075 0.197 -21.080 1.00 0.00 O ATOM 682 CB ALA A 46 -5.021 0.461 -22.642 1.00 0.00 C ATOM 0 H ALA A 46 -6.058 -1.421 -21.577 1.00 0.00 H new ATOM 0 HA ALA A 46 -3.533 -1.085 -22.639 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.365 1.199 -23.104 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.623 -0.022 -23.412 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -5.677 0.956 -21.926 1.00 0.00 H new ATOM 688 N GLU A 47 -3.881 0.474 -19.766 1.00 0.00 N ATOM 689 CA GLU A 47 -3.131 1.103 -18.684 1.00 0.00 C ATOM 690 C GLU A 47 -2.122 0.123 -18.103 1.00 0.00 C ATOM 691 O GLU A 47 -0.966 0.468 -17.867 1.00 0.00 O ATOM 692 CB GLU A 47 -4.075 1.588 -17.578 1.00 0.00 C ATOM 693 CG GLU A 47 -5.394 2.145 -18.092 1.00 0.00 C ATOM 694 CD GLU A 47 -5.657 3.560 -17.613 1.00 0.00 C ATOM 695 OE1 GLU A 47 -6.221 3.719 -16.510 1.00 0.00 O ATOM 696 OE2 GLU A 47 -5.299 4.509 -18.342 1.00 0.00 O ATOM 0 H GLU A 47 -4.880 0.377 -19.586 1.00 0.00 H new ATOM 0 HA GLU A 47 -2.602 1.963 -19.094 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.281 0.759 -16.901 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.570 2.358 -16.995 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.390 2.129 -19.182 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.209 1.498 -17.767 1.00 0.00 H new ATOM 703 N LEU A 48 -2.574 -1.105 -17.879 1.00 0.00 N ATOM 704 CA LEU A 48 -1.724 -2.154 -17.327 1.00 0.00 C ATOM 705 C LEU A 48 -0.447 -2.316 -18.144 1.00 0.00 C ATOM 706 O LEU A 48 0.654 -2.330 -17.595 1.00 0.00 O ATOM 707 CB LEU A 48 -2.488 -3.480 -17.297 1.00 0.00 C ATOM 708 CG LEU A 48 -3.921 -3.389 -16.773 1.00 0.00 C ATOM 709 CD1 LEU A 48 -4.534 -4.774 -16.646 1.00 0.00 C ATOM 710 CD2 LEU A 48 -3.955 -2.661 -15.439 1.00 0.00 C ATOM 0 H LEU A 48 -3.531 -1.400 -18.073 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.447 -1.867 -16.313 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.512 -3.891 -18.306 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.935 -4.187 -16.678 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.514 -2.819 -17.489 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.554 -4.687 -16.272 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.546 -5.258 -17.623 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.942 -5.372 -15.952 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.983 -2.605 -15.081 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.347 -3.202 -14.714 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.560 -1.653 -15.564 1.00 0.00 H new ATOM 722 N GLN A 49 -0.606 -2.447 -19.455 1.00 0.00 N ATOM 723 CA GLN A 49 0.530 -2.621 -20.355 1.00 0.00 C ATOM 724 C GLN A 49 1.429 -1.387 -20.368 1.00 0.00 C ATOM 725 O GLN A 49 2.639 -1.489 -20.168 1.00 0.00 O ATOM 726 CB GLN A 49 0.040 -2.921 -21.772 1.00 0.00 C ATOM 727 CG GLN A 49 1.109 -3.519 -22.672 1.00 0.00 C ATOM 728 CD GLN A 49 0.563 -4.593 -23.592 1.00 0.00 C ATOM 729 OE1 GLN A 49 -0.582 -4.522 -24.037 1.00 0.00 O ATOM 730 NE2 GLN A 49 1.383 -5.597 -23.880 1.00 0.00 N ATOM 0 H GLN A 49 -1.513 -2.436 -19.921 1.00 0.00 H new ATOM 0 HA GLN A 49 1.117 -3.463 -19.988 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -0.804 -3.609 -21.718 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.329 -2.000 -22.223 1.00 0.00 H new ATOM 0 HG2 GLN A 49 1.559 -2.727 -23.271 1.00 0.00 H new ATOM 0 HG3 GLN A 49 1.902 -3.942 -22.056 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.325 -5.615 -23.488 1.00 0.00 H new ATOM 0 HE22 GLN A 49 1.071 -6.350 -24.493 1.00 0.00 H new ATOM 739 N ASP A 50 0.834 -0.224 -20.616 1.00 0.00 N ATOM 740 CA ASP A 50 1.590 1.024 -20.666 1.00 0.00 C ATOM 741 C ASP A 50 2.350 1.263 -19.366 1.00 0.00 C ATOM 742 O ASP A 50 3.553 1.523 -19.380 1.00 0.00 O ATOM 743 CB ASP A 50 0.653 2.200 -20.947 1.00 0.00 C ATOM 744 CG ASP A 50 1.300 3.259 -21.819 1.00 0.00 C ATOM 745 OD1 ASP A 50 2.022 2.887 -22.767 1.00 0.00 O ATOM 746 OD2 ASP A 50 1.082 4.460 -21.554 1.00 0.00 O ATOM 0 H ASP A 50 -0.166 -0.119 -20.785 1.00 0.00 H new ATOM 0 HA ASP A 50 2.317 0.943 -21.474 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.250 1.833 -21.435 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.345 2.649 -20.003 1.00 0.00 H new ATOM 751 N MET A 51 1.644 1.172 -18.245 1.00 0.00 N ATOM 752 CA MET A 51 2.258 1.377 -16.939 1.00 0.00 C ATOM 753 C MET A 51 3.390 0.381 -16.714 1.00 0.00 C ATOM 754 O MET A 51 4.484 0.755 -16.310 1.00 0.00 O ATOM 755 CB MET A 51 1.214 1.236 -15.830 1.00 0.00 C ATOM 756 CG MET A 51 0.574 2.554 -15.425 1.00 0.00 C ATOM 757 SD MET A 51 -1.119 2.722 -16.023 1.00 0.00 S ATOM 758 CE MET A 51 -1.204 4.489 -16.305 1.00 0.00 C ATOM 0 H MET A 51 0.647 0.958 -18.214 1.00 0.00 H new ATOM 0 HA MET A 51 2.669 2.386 -16.912 1.00 0.00 H new ATOM 0 HB2 MET A 51 0.434 0.550 -16.162 1.00 0.00 H new ATOM 0 HB3 MET A 51 1.684 0.786 -14.955 1.00 0.00 H new ATOM 0 HG2 MET A 51 0.580 2.637 -14.338 1.00 0.00 H new ATOM 0 HG3 MET A 51 1.174 3.378 -15.811 1.00 0.00 H new ATOM 0 HE1 MET A 51 -2.058 4.903 -15.768 1.00 0.00 H new ATOM 0 HE2 MET A 51 -0.288 4.959 -15.947 1.00 0.00 H new ATOM 0 HE3 MET A 51 -1.318 4.682 -17.372 1.00 0.00 H new ATOM 768 N ILE A 52 3.107 -0.887 -16.983 1.00 0.00 N ATOM 769 CA ILE A 52 4.083 -1.956 -16.819 1.00 0.00 C ATOM 770 C ILE A 52 5.309 -1.718 -17.686 1.00 0.00 C ATOM 771 O ILE A 52 6.434 -1.895 -17.242 1.00 0.00 O ATOM 772 CB ILE A 52 3.460 -3.329 -17.168 1.00 0.00 C ATOM 773 CG1 ILE A 52 2.966 -4.018 -15.900 1.00 0.00 C ATOM 774 CG2 ILE A 52 4.441 -4.231 -17.913 1.00 0.00 C ATOM 775 CD1 ILE A 52 1.800 -4.948 -16.142 1.00 0.00 C ATOM 0 H ILE A 52 2.197 -1.203 -17.320 1.00 0.00 H new ATOM 0 HA ILE A 52 4.389 -1.960 -15.773 1.00 0.00 H new ATOM 0 HB ILE A 52 2.616 -3.147 -17.834 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.787 -4.583 -15.458 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.673 -3.260 -15.173 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.961 -5.184 -18.137 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.744 -3.749 -18.843 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.319 -4.405 -17.291 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.498 -5.405 -15.200 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.964 -4.384 -16.556 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.096 -5.727 -16.845 1.00 0.00 H new ATOM 787 N ASN A 53 5.080 -1.315 -18.922 1.00 0.00 N ATOM 788 CA ASN A 53 6.175 -1.053 -19.852 1.00 0.00 C ATOM 789 C ASN A 53 7.092 0.022 -19.283 1.00 0.00 C ATOM 790 O ASN A 53 8.281 0.085 -19.594 1.00 0.00 O ATOM 791 CB ASN A 53 5.624 -0.624 -21.210 1.00 0.00 C ATOM 792 CG ASN A 53 6.719 -0.342 -22.220 1.00 0.00 C ATOM 793 OD1 ASN A 53 7.189 -1.245 -22.912 1.00 0.00 O ATOM 794 ND2 ASN A 53 7.133 0.917 -22.309 1.00 0.00 N ATOM 0 H ASN A 53 4.149 -1.161 -19.310 1.00 0.00 H new ATOM 0 HA ASN A 53 6.751 -1.968 -19.989 1.00 0.00 H new ATOM 0 HB2 ASN A 53 4.971 -1.406 -21.597 1.00 0.00 H new ATOM 0 HB3 ASN A 53 5.012 0.269 -21.084 1.00 0.00 H new ATOM 0 HD21 ASN A 53 7.868 1.167 -22.970 1.00 0.00 H new ATOM 0 HD22 ASN A 53 6.716 1.634 -21.716 1.00 0.00 H new ATOM 801 N GLU A 54 6.507 0.857 -18.442 1.00 0.00 N ATOM 802 CA GLU A 54 7.210 1.947 -17.790 1.00 0.00 C ATOM 803 C GLU A 54 7.956 1.473 -16.551 1.00 0.00 C ATOM 804 O GLU A 54 8.608 2.268 -15.874 1.00 0.00 O ATOM 805 CB GLU A 54 6.200 3.000 -17.369 1.00 0.00 C ATOM 806 CG GLU A 54 5.563 3.729 -18.534 1.00 0.00 C ATOM 807 CD GLU A 54 5.541 5.233 -18.345 1.00 0.00 C ATOM 808 OE1 GLU A 54 6.568 5.883 -18.635 1.00 0.00 O ATOM 809 OE2 GLU A 54 4.498 5.761 -17.907 1.00 0.00 O ATOM 0 H GLU A 54 5.520 0.796 -18.190 1.00 0.00 H new ATOM 0 HA GLU A 54 7.935 2.353 -18.496 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.418 2.525 -16.777 1.00 0.00 H new ATOM 0 HB3 GLU A 54 6.693 3.726 -16.722 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.107 3.490 -19.448 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.543 3.369 -18.668 1.00 0.00 H new ATOM 816 N VAL A 55 7.827 0.194 -16.226 1.00 0.00 N ATOM 817 CA VAL A 55 8.461 -0.335 -15.031 1.00 0.00 C ATOM 818 C VAL A 55 9.322 -1.554 -15.331 1.00 0.00 C ATOM 819 O VAL A 55 10.348 -1.774 -14.690 1.00 0.00 O ATOM 820 CB VAL A 55 7.409 -0.732 -13.970 1.00 0.00 C ATOM 821 CG1 VAL A 55 7.738 -0.081 -12.637 1.00 0.00 C ATOM 822 CG2 VAL A 55 5.975 -0.397 -14.411 1.00 0.00 C ATOM 0 H VAL A 55 7.295 -0.488 -16.767 1.00 0.00 H new ATOM 0 HA VAL A 55 9.096 0.463 -14.647 1.00 0.00 H new ATOM 0 HB VAL A 55 7.452 -1.815 -13.855 1.00 0.00 H new ATOM 0 HG11 VAL A 55 6.990 -0.368 -11.898 1.00 0.00 H new ATOM 0 HG12 VAL A 55 8.722 -0.410 -12.304 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.738 1.003 -12.752 1.00 0.00 H new ATOM 0 HG21 VAL A 55 5.275 -0.696 -13.631 1.00 0.00 H new ATOM 0 HG22 VAL A 55 5.889 0.676 -14.584 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.743 -0.933 -15.331 1.00 0.00 H new ATOM 832 N ASP A 56 8.897 -2.341 -16.302 1.00 0.00 N ATOM 833 CA ASP A 56 9.626 -3.542 -16.684 1.00 0.00 C ATOM 834 C ASP A 56 10.937 -3.193 -17.375 1.00 0.00 C ATOM 835 O ASP A 56 11.073 -2.128 -17.978 1.00 0.00 O ATOM 836 CB ASP A 56 8.775 -4.419 -17.603 1.00 0.00 C ATOM 837 CG ASP A 56 9.413 -5.772 -17.854 1.00 0.00 C ATOM 838 OD1 ASP A 56 10.336 -6.145 -17.099 1.00 0.00 O ATOM 839 OD2 ASP A 56 8.987 -6.470 -18.798 1.00 0.00 O ATOM 0 H ASP A 56 8.049 -2.172 -16.843 1.00 0.00 H new ATOM 0 HA ASP A 56 9.852 -4.095 -15.772 1.00 0.00 H new ATOM 0 HB2 ASP A 56 7.790 -4.560 -17.158 1.00 0.00 H new ATOM 0 HB3 ASP A 56 8.625 -3.908 -18.554 1.00 0.00 H new ATOM 844 N ALA A 57 11.895 -4.104 -17.285 1.00 0.00 N ATOM 845 CA ALA A 57 13.200 -3.915 -17.898 1.00 0.00 C ATOM 846 C ALA A 57 13.154 -4.244 -19.380 1.00 0.00 C ATOM 847 O ALA A 57 13.546 -3.441 -20.227 1.00 0.00 O ATOM 848 CB ALA A 57 14.216 -4.799 -17.208 1.00 0.00 C ATOM 0 H ALA A 57 11.790 -4.989 -16.788 1.00 0.00 H new ATOM 0 HA ALA A 57 13.488 -2.870 -17.788 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.194 -4.657 -17.668 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.270 -4.535 -16.152 1.00 0.00 H new ATOM 0 HB3 ALA A 57 13.917 -5.843 -17.307 1.00 0.00 H new ATOM 854 N ASP A 58 12.669 -5.440 -19.678 1.00 0.00 N ATOM 855 CA ASP A 58 12.561 -5.906 -21.056 1.00 0.00 C ATOM 856 C ASP A 58 11.214 -5.523 -21.670 1.00 0.00 C ATOM 857 O ASP A 58 11.004 -5.687 -22.872 1.00 0.00 O ATOM 858 CB ASP A 58 12.746 -7.423 -21.109 1.00 0.00 C ATOM 859 CG ASP A 58 11.833 -8.145 -20.139 1.00 0.00 C ATOM 860 OD1 ASP A 58 10.601 -8.118 -20.345 1.00 0.00 O ATOM 861 OD2 ASP A 58 12.344 -8.733 -19.162 1.00 0.00 O ATOM 0 H ASP A 58 12.342 -6.110 -18.982 1.00 0.00 H new ATOM 0 HA ASP A 58 13.346 -5.423 -21.638 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.550 -7.776 -22.121 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.783 -7.669 -20.881 1.00 0.00 H new ATOM 866 N GLY A 59 10.308 -5.007 -20.843 1.00 0.00 N ATOM 867 CA GLY A 59 9.000 -4.607 -21.331 1.00 0.00 C ATOM 868 C GLY A 59 8.228 -5.754 -21.956 1.00 0.00 C ATOM 869 O GLY A 59 7.742 -5.640 -23.081 1.00 0.00 O ATOM 0 H GLY A 59 10.457 -4.859 -19.845 1.00 0.00 H new ATOM 0 HA2 GLY A 59 8.421 -4.193 -20.506 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.120 -3.812 -22.067 1.00 0.00 H new ATOM 873 N ASN A 60 8.110 -6.859 -21.226 1.00 0.00 N ATOM 874 CA ASN A 60 7.384 -8.025 -21.722 1.00 0.00 C ATOM 875 C ASN A 60 5.957 -8.073 -21.169 1.00 0.00 C ATOM 876 O ASN A 60 5.196 -8.989 -21.479 1.00 0.00 O ATOM 877 CB ASN A 60 8.131 -9.312 -21.360 1.00 0.00 C ATOM 878 CG ASN A 60 8.097 -9.610 -19.874 1.00 0.00 C ATOM 879 OD1 ASN A 60 7.933 -8.708 -19.052 1.00 0.00 O ATOM 880 ND2 ASN A 60 8.252 -10.881 -19.521 1.00 0.00 N ATOM 0 H ASN A 60 8.506 -6.972 -20.293 1.00 0.00 H new ATOM 0 HA ASN A 60 7.323 -7.940 -22.807 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.691 -10.148 -21.904 1.00 0.00 H new ATOM 0 HB3 ASN A 60 9.168 -9.229 -21.686 1.00 0.00 H new ATOM 0 HD21 ASN A 60 8.238 -11.142 -18.535 1.00 0.00 H new ATOM 0 HD22 ASN A 60 8.385 -11.596 -20.236 1.00 0.00 H new ATOM 887 N GLY A 61 5.600 -7.084 -20.352 1.00 0.00 N ATOM 888 CA GLY A 61 4.267 -7.041 -19.777 1.00 0.00 C ATOM 889 C GLY A 61 4.241 -7.453 -18.317 1.00 0.00 C ATOM 890 O GLY A 61 3.175 -7.709 -17.758 1.00 0.00 O ATOM 0 H GLY A 61 6.210 -6.313 -20.079 1.00 0.00 H new ATOM 0 HA2 GLY A 61 3.868 -6.031 -19.872 1.00 0.00 H new ATOM 0 HA3 GLY A 61 3.610 -7.698 -20.347 1.00 0.00 H new ATOM 894 N THR A 62 5.414 -7.502 -17.693 1.00 0.00 N ATOM 895 CA THR A 62 5.514 -7.868 -16.284 1.00 0.00 C ATOM 896 C THR A 62 6.710 -7.179 -15.633 1.00 0.00 C ATOM 897 O THR A 62 7.776 -7.078 -16.235 1.00 0.00 O ATOM 898 CB THR A 62 5.644 -9.387 -16.133 1.00 0.00 C ATOM 899 OG1 THR A 62 6.985 -9.798 -16.334 1.00 0.00 O ATOM 900 CG2 THR A 62 4.778 -10.167 -17.100 1.00 0.00 C ATOM 0 H THR A 62 6.307 -7.293 -18.140 1.00 0.00 H new ATOM 0 HA THR A 62 4.604 -7.539 -15.783 1.00 0.00 H new ATOM 0 HB THR A 62 5.309 -9.602 -15.118 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.310 -9.448 -17.190 1.00 0.00 H new ATOM 0 HG21 THR A 62 4.921 -11.235 -16.936 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.731 -9.912 -16.938 1.00 0.00 H new ATOM 0 HG23 THR A 62 5.058 -9.916 -18.123 1.00 0.00 H new ATOM 908 N ILE A 63 6.533 -6.713 -14.402 1.00 0.00 N ATOM 909 CA ILE A 63 7.611 -6.042 -13.684 1.00 0.00 C ATOM 910 C ILE A 63 8.357 -7.005 -12.771 1.00 0.00 C ATOM 911 O ILE A 63 7.781 -7.960 -12.249 1.00 0.00 O ATOM 912 CB ILE A 63 7.093 -4.867 -12.832 1.00 0.00 C ATOM 913 CG1 ILE A 63 6.007 -4.080 -13.573 1.00 0.00 C ATOM 914 CG2 ILE A 63 8.247 -3.952 -12.443 1.00 0.00 C ATOM 915 CD1 ILE A 63 6.299 -3.851 -15.037 1.00 0.00 C ATOM 0 H ILE A 63 5.658 -6.787 -13.882 1.00 0.00 H new ATOM 0 HA ILE A 63 8.288 -5.660 -14.448 1.00 0.00 H new ATOM 0 HB ILE A 63 6.646 -5.275 -11.926 1.00 0.00 H new ATOM 0 HG12 ILE A 63 5.061 -4.614 -13.482 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.877 -3.114 -13.085 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.869 -3.125 -11.841 1.00 0.00 H new ATOM 0 HG22 ILE A 63 8.980 -4.516 -11.866 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.719 -3.559 -13.343 1.00 0.00 H new ATOM 0 HD11 ILE A 63 5.482 -3.287 -15.487 1.00 0.00 H new ATOM 0 HD12 ILE A 63 7.227 -3.289 -15.139 1.00 0.00 H new ATOM 0 HD13 ILE A 63 6.399 -4.811 -15.543 1.00 0.00 H new ATOM 927 N ASP A 64 9.642 -6.738 -12.577 1.00 0.00 N ATOM 928 CA ASP A 64 10.481 -7.568 -11.720 1.00 0.00 C ATOM 929 C ASP A 64 10.694 -6.901 -10.363 1.00 0.00 C ATOM 930 O ASP A 64 10.211 -5.795 -10.121 1.00 0.00 O ATOM 931 CB ASP A 64 11.831 -7.830 -12.391 1.00 0.00 C ATOM 932 CG ASP A 64 11.685 -8.267 -13.835 1.00 0.00 C ATOM 933 OD1 ASP A 64 11.563 -9.487 -14.077 1.00 0.00 O ATOM 934 OD2 ASP A 64 11.692 -7.390 -14.724 1.00 0.00 O ATOM 0 H ASP A 64 10.129 -5.949 -13.003 1.00 0.00 H new ATOM 0 HA ASP A 64 9.972 -8.519 -11.563 1.00 0.00 H new ATOM 0 HB2 ASP A 64 12.437 -6.925 -12.348 1.00 0.00 H new ATOM 0 HB3 ASP A 64 12.367 -8.599 -11.834 1.00 0.00 H new ATOM 939 N PHE A 65 11.417 -7.584 -9.480 1.00 0.00 N ATOM 940 CA PHE A 65 11.692 -7.063 -8.144 1.00 0.00 C ATOM 941 C PHE A 65 12.467 -5.746 -8.204 1.00 0.00 C ATOM 942 O PHE A 65 11.984 -4.714 -7.738 1.00 0.00 O ATOM 943 CB PHE A 65 12.472 -8.094 -7.325 1.00 0.00 C ATOM 944 CG PHE A 65 11.612 -8.888 -6.384 1.00 0.00 C ATOM 945 CD1 PHE A 65 11.269 -8.379 -5.142 1.00 0.00 C ATOM 946 CD2 PHE A 65 11.147 -10.143 -6.742 1.00 0.00 C ATOM 947 CE1 PHE A 65 10.478 -9.108 -4.274 1.00 0.00 C ATOM 948 CE2 PHE A 65 10.356 -10.876 -5.878 1.00 0.00 C ATOM 949 CZ PHE A 65 10.021 -10.358 -4.642 1.00 0.00 C ATOM 0 H PHE A 65 11.824 -8.501 -9.666 1.00 0.00 H new ATOM 0 HA PHE A 65 10.735 -6.867 -7.660 1.00 0.00 H new ATOM 0 HB2 PHE A 65 12.979 -8.778 -8.005 1.00 0.00 H new ATOM 0 HB3 PHE A 65 13.245 -7.582 -6.753 1.00 0.00 H new ATOM 0 HD1 PHE A 65 11.624 -7.402 -4.849 1.00 0.00 H new ATOM 0 HD2 PHE A 65 11.406 -10.553 -7.707 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.218 -8.700 -3.308 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.000 -11.853 -6.169 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.403 -10.929 -3.965 1.00 0.00 H new ATOM 959 N PRO A 66 13.686 -5.763 -8.774 1.00 0.00 N ATOM 960 CA PRO A 66 14.523 -4.561 -8.881 1.00 0.00 C ATOM 961 C PRO A 66 13.932 -3.521 -9.828 1.00 0.00 C ATOM 962 O PRO A 66 14.096 -2.318 -9.625 1.00 0.00 O ATOM 963 CB PRO A 66 15.848 -5.093 -9.434 1.00 0.00 C ATOM 964 CG PRO A 66 15.491 -6.362 -10.128 1.00 0.00 C ATOM 965 CD PRO A 66 14.346 -6.948 -9.351 1.00 0.00 C ATOM 0 HA PRO A 66 14.620 -4.051 -7.923 1.00 0.00 H new ATOM 0 HB2 PRO A 66 16.303 -4.381 -10.122 1.00 0.00 H new ATOM 0 HB3 PRO A 66 16.568 -5.269 -8.635 1.00 0.00 H new ATOM 0 HG2 PRO A 66 15.205 -6.174 -11.163 1.00 0.00 H new ATOM 0 HG3 PRO A 66 16.339 -7.047 -10.151 1.00 0.00 H new ATOM 0 HD2 PRO A 66 13.670 -7.512 -9.994 1.00 0.00 H new ATOM 0 HD3 PRO A 66 14.694 -7.632 -8.577 1.00 0.00 H new ATOM 973 N GLU A 67 13.245 -3.993 -10.861 1.00 0.00 N ATOM 974 CA GLU A 67 12.629 -3.109 -11.842 1.00 0.00 C ATOM 975 C GLU A 67 11.526 -2.271 -11.205 1.00 0.00 C ATOM 976 O GLU A 67 11.381 -1.088 -11.512 1.00 0.00 O ATOM 977 CB GLU A 67 12.080 -3.932 -13.007 1.00 0.00 C ATOM 978 CG GLU A 67 13.156 -4.415 -13.964 1.00 0.00 C ATOM 979 CD GLU A 67 14.285 -5.140 -13.259 1.00 0.00 C ATOM 980 OE1 GLU A 67 15.108 -4.465 -12.605 1.00 0.00 O ATOM 981 OE2 GLU A 67 14.348 -6.383 -13.362 1.00 0.00 O ATOM 0 H GLU A 67 13.100 -4.986 -11.041 1.00 0.00 H new ATOM 0 HA GLU A 67 13.388 -2.424 -12.220 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.542 -4.794 -12.612 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.357 -3.331 -13.558 1.00 0.00 H new ATOM 0 HG2 GLU A 67 12.708 -5.080 -14.702 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.562 -3.562 -14.508 1.00 0.00 H new ATOM 988 N PHE A 68 10.762 -2.880 -10.305 1.00 0.00 N ATOM 989 CA PHE A 68 9.689 -2.170 -9.618 1.00 0.00 C ATOM 990 C PHE A 68 10.273 -1.243 -8.552 1.00 0.00 C ATOM 991 O PHE A 68 9.818 -0.112 -8.376 1.00 0.00 O ATOM 992 CB PHE A 68 8.712 -3.167 -8.977 1.00 0.00 C ATOM 993 CG PHE A 68 7.809 -2.568 -7.926 1.00 0.00 C ATOM 994 CD1 PHE A 68 7.364 -1.258 -8.030 1.00 0.00 C ATOM 995 CD2 PHE A 68 7.406 -3.320 -6.834 1.00 0.00 C ATOM 996 CE1 PHE A 68 6.536 -0.713 -7.068 1.00 0.00 C ATOM 997 CE2 PHE A 68 6.579 -2.780 -5.868 1.00 0.00 C ATOM 998 CZ PHE A 68 6.143 -1.475 -5.985 1.00 0.00 C ATOM 0 H PHE A 68 10.864 -3.858 -10.035 1.00 0.00 H new ATOM 0 HA PHE A 68 9.144 -1.570 -10.347 1.00 0.00 H new ATOM 0 HB2 PHE A 68 8.095 -3.607 -9.760 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.284 -3.979 -8.527 1.00 0.00 H new ATOM 0 HD1 PHE A 68 7.669 -0.657 -8.874 1.00 0.00 H new ATOM 0 HD2 PHE A 68 7.743 -4.342 -6.737 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.196 0.308 -7.163 1.00 0.00 H new ATOM 0 HE2 PHE A 68 6.274 -3.378 -5.022 1.00 0.00 H new ATOM 0 HZ PHE A 68 5.496 -1.051 -5.231 1.00 0.00 H new ATOM 1008 N LEU A 69 11.279 -1.741 -7.842 1.00 0.00 N ATOM 1009 CA LEU A 69 11.935 -0.980 -6.784 1.00 0.00 C ATOM 1010 C LEU A 69 12.725 0.196 -7.351 1.00 0.00 C ATOM 1011 O LEU A 69 12.516 1.342 -6.957 1.00 0.00 O ATOM 1012 CB LEU A 69 12.863 -1.901 -5.984 1.00 0.00 C ATOM 1013 CG LEU A 69 13.860 -1.198 -5.060 1.00 0.00 C ATOM 1014 CD1 LEU A 69 13.197 -0.828 -3.744 1.00 0.00 C ATOM 1015 CD2 LEU A 69 15.072 -2.084 -4.818 1.00 0.00 C ATOM 0 H LEU A 69 11.661 -2.676 -7.981 1.00 0.00 H new ATOM 0 HA LEU A 69 11.164 -0.578 -6.126 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.249 -2.572 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.421 -2.522 -6.685 1.00 0.00 H new ATOM 0 HG LEU A 69 14.194 -0.281 -5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 69 13.921 -0.329 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 69 12.359 -0.158 -3.935 1.00 0.00 H new ATOM 0 HD13 LEU A 69 12.835 -1.731 -3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 69 15.772 -1.571 -4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 69 14.754 -3.017 -4.353 1.00 0.00 H new ATOM 0 HD23 LEU A 69 15.560 -2.300 -5.768 1.00 0.00 H new ATOM 1027 N THR A 70 13.645 -0.099 -8.262 1.00 0.00 N ATOM 1028 CA THR A 70 14.485 0.931 -8.870 1.00 0.00 C ATOM 1029 C THR A 70 13.647 2.080 -9.428 1.00 0.00 C ATOM 1030 O THR A 70 13.963 3.249 -9.208 1.00 0.00 O ATOM 1031 CB THR A 70 15.343 0.319 -9.981 1.00 0.00 C ATOM 1032 OG1 THR A 70 16.219 -0.661 -9.454 1.00 0.00 O ATOM 1033 CG2 THR A 70 16.186 1.336 -10.721 1.00 0.00 C ATOM 0 H THR A 70 13.830 -1.044 -8.598 1.00 0.00 H new ATOM 0 HA THR A 70 15.133 1.337 -8.093 1.00 0.00 H new ATOM 0 HB THR A 70 14.634 -0.119 -10.683 1.00 0.00 H new ATOM 0 HG1 THR A 70 15.736 -1.507 -9.345 1.00 0.00 H new ATOM 0 HG21 THR A 70 16.768 0.833 -11.493 1.00 0.00 H new ATOM 0 HG22 THR A 70 15.537 2.080 -11.182 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.861 1.828 -10.021 1.00 0.00 H new ATOM 1041 N MET A 71 12.583 1.746 -10.149 1.00 0.00 N ATOM 1042 CA MET A 71 11.710 2.757 -10.733 1.00 0.00 C ATOM 1043 C MET A 71 11.178 3.708 -9.663 1.00 0.00 C ATOM 1044 O MET A 71 11.243 4.928 -9.815 1.00 0.00 O ATOM 1045 CB MET A 71 10.546 2.087 -11.465 1.00 0.00 C ATOM 1046 CG MET A 71 10.339 2.601 -12.878 1.00 0.00 C ATOM 1047 SD MET A 71 11.819 2.452 -13.899 1.00 0.00 S ATOM 1048 CE MET A 71 11.532 0.869 -14.685 1.00 0.00 C ATOM 0 H MET A 71 12.304 0.784 -10.343 1.00 0.00 H new ATOM 0 HA MET A 71 12.294 3.339 -11.446 1.00 0.00 H new ATOM 0 HB2 MET A 71 10.721 1.012 -11.501 1.00 0.00 H new ATOM 0 HB3 MET A 71 9.631 2.242 -10.893 1.00 0.00 H new ATOM 0 HG2 MET A 71 9.524 2.049 -13.345 1.00 0.00 H new ATOM 0 HG3 MET A 71 10.034 3.647 -12.838 1.00 0.00 H new ATOM 0 HE1 MET A 71 12.476 0.470 -15.055 1.00 0.00 H new ATOM 0 HE2 MET A 71 11.104 0.176 -13.961 1.00 0.00 H new ATOM 0 HE3 MET A 71 10.841 0.996 -15.518 1.00 0.00 H new ATOM 1058 N MET A 72 10.650 3.141 -8.583 1.00 0.00 N ATOM 1059 CA MET A 72 10.104 3.938 -7.489 1.00 0.00 C ATOM 1060 C MET A 72 11.208 4.437 -6.556 1.00 0.00 C ATOM 1061 O MET A 72 10.976 5.316 -5.726 1.00 0.00 O ATOM 1062 CB MET A 72 9.085 3.118 -6.696 1.00 0.00 C ATOM 1063 CG MET A 72 8.039 2.441 -7.566 1.00 0.00 C ATOM 1064 SD MET A 72 7.148 3.607 -8.614 1.00 0.00 S ATOM 1065 CE MET A 72 5.842 2.560 -9.250 1.00 0.00 C ATOM 0 H MET A 72 10.588 2.133 -8.441 1.00 0.00 H new ATOM 0 HA MET A 72 9.610 4.807 -7.925 1.00 0.00 H new ATOM 0 HB2 MET A 72 9.612 2.358 -6.119 1.00 0.00 H new ATOM 0 HB3 MET A 72 8.584 3.770 -5.981 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.523 1.692 -8.192 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.328 1.914 -6.929 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.999 2.388 -10.315 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.852 1.606 -8.723 1.00 0.00 H new ATOM 0 HE3 MET A 72 4.879 3.048 -9.099 1.00 0.00 H new ATOM 1075 N ALA A 73 12.406 3.874 -6.693 1.00 0.00 N ATOM 1076 CA ALA A 73 13.534 4.269 -5.858 1.00 0.00 C ATOM 1077 C ALA A 73 14.259 5.470 -6.453 1.00 0.00 C ATOM 1078 O ALA A 73 14.755 6.332 -5.728 1.00 0.00 O ATOM 1079 CB ALA A 73 14.496 3.103 -5.686 1.00 0.00 C ATOM 0 H ALA A 73 12.619 3.144 -7.373 1.00 0.00 H new ATOM 0 HA ALA A 73 13.149 4.556 -4.879 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.334 3.412 -5.060 1.00 0.00 H new ATOM 0 HB2 ALA A 73 13.977 2.270 -5.212 1.00 0.00 H new ATOM 0 HB3 ALA A 73 14.868 2.791 -6.662 1.00 0.00 H new ATOM 1085 N ARG A 74 14.316 5.518 -7.779 1.00 0.00 N ATOM 1086 CA ARG A 74 14.981 6.610 -8.479 1.00 0.00 C ATOM 1087 C ARG A 74 14.251 7.930 -8.248 1.00 0.00 C ATOM 1088 O ARG A 74 14.878 8.978 -8.092 1.00 0.00 O ATOM 1089 CB ARG A 74 15.053 6.309 -9.977 1.00 0.00 C ATOM 1090 CG ARG A 74 16.347 5.632 -10.400 1.00 0.00 C ATOM 1091 CD ARG A 74 17.561 6.470 -10.035 1.00 0.00 C ATOM 1092 NE ARG A 74 18.587 6.430 -11.074 1.00 0.00 N ATOM 1093 CZ ARG A 74 18.434 6.957 -12.287 1.00 0.00 C ATOM 1094 NH1 ARG A 74 17.300 7.564 -12.617 1.00 0.00 N ATOM 1095 NH2 ARG A 74 19.417 6.877 -13.173 1.00 0.00 N ATOM 0 H ARG A 74 13.909 4.812 -8.392 1.00 0.00 H new ATOM 0 HA ARG A 74 15.992 6.702 -8.083 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.213 5.672 -10.252 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.942 7.240 -10.532 1.00 0.00 H new ATOM 0 HG2 ARG A 74 16.421 4.655 -9.921 1.00 0.00 H new ATOM 0 HG3 ARG A 74 16.333 5.459 -11.476 1.00 0.00 H new ATOM 0 HD2 ARG A 74 17.252 7.502 -9.870 1.00 0.00 H new ATOM 0 HD3 ARG A 74 17.982 6.109 -9.096 1.00 0.00 H new ATOM 0 HE ARG A 74 19.472 5.972 -10.858 1.00 0.00 H new ATOM 0 HH11 ARG A 74 16.540 7.628 -11.940 1.00 0.00 H new ATOM 0 HH12 ARG A 74 17.189 7.966 -13.548 1.00 0.00 H new ATOM 0 HH21 ARG A 74 20.290 6.412 -12.925 1.00 0.00 H new ATOM 0 HH22 ARG A 74 19.300 7.281 -14.102 1.00 0.00 H new ATOM 1109 N LYS A 75 12.924 7.870 -8.227 1.00 0.00 N ATOM 1110 CA LYS A 75 12.109 9.061 -8.015 1.00 0.00 C ATOM 1111 C LYS A 75 11.027 8.803 -6.972 1.00 0.00 C ATOM 1112 O LYS A 75 10.352 7.774 -7.004 1.00 0.00 O ATOM 1113 CB LYS A 75 11.468 9.513 -9.329 1.00 0.00 C ATOM 1114 CG LYS A 75 10.990 8.364 -10.201 1.00 0.00 C ATOM 1115 CD LYS A 75 9.704 7.756 -9.667 1.00 0.00 C ATOM 1116 CE LYS A 75 8.803 7.279 -10.794 1.00 0.00 C ATOM 1117 NZ LYS A 75 7.490 6.792 -10.287 1.00 0.00 N ATOM 0 H LYS A 75 12.390 7.010 -8.354 1.00 0.00 H new ATOM 0 HA LYS A 75 12.762 9.853 -7.648 1.00 0.00 H new ATOM 0 HB2 LYS A 75 10.623 10.164 -9.106 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.189 10.108 -9.890 1.00 0.00 H new ATOM 0 HG2 LYS A 75 10.830 8.721 -11.219 1.00 0.00 H new ATOM 0 HG3 LYS A 75 11.763 7.597 -10.250 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.941 6.919 -9.011 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.175 8.494 -9.064 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.640 8.095 -11.499 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.300 6.479 -11.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.819 6.717 -11.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.613 5.858 -9.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.120 7.461 -9.582 1.00 0.00 H new ATOM 1131 N MET A 76 10.866 9.745 -6.048 1.00 0.00 N ATOM 1132 CA MET A 76 9.864 9.621 -4.995 1.00 0.00 C ATOM 1133 C MET A 76 10.082 8.349 -4.180 1.00 0.00 C ATOM 1134 O MET A 76 9.364 7.363 -4.346 1.00 0.00 O ATOM 1135 CB MET A 76 8.458 9.620 -5.599 1.00 0.00 C ATOM 1136 CG MET A 76 7.841 11.005 -5.705 1.00 0.00 C ATOM 1137 SD MET A 76 8.288 11.850 -7.233 1.00 0.00 S ATOM 1138 CE MET A 76 7.040 11.215 -8.349 1.00 0.00 C ATOM 0 H MET A 76 11.417 10.603 -6.007 1.00 0.00 H new ATOM 0 HA MET A 76 9.966 10.478 -4.329 1.00 0.00 H new ATOM 0 HB2 MET A 76 8.498 9.172 -6.592 1.00 0.00 H new ATOM 0 HB3 MET A 76 7.811 8.988 -4.991 1.00 0.00 H new ATOM 0 HG2 MET A 76 6.756 10.920 -5.645 1.00 0.00 H new ATOM 0 HG3 MET A 76 8.161 11.607 -4.855 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.184 11.647 -9.339 1.00 0.00 H new ATOM 0 HE2 MET A 76 7.125 10.130 -8.410 1.00 0.00 H new ATOM 0 HE3 MET A 76 6.050 11.481 -7.978 1.00 0.00 H new ATOM 1148 N LYS A 77 11.077 8.379 -3.300 1.00 0.00 N ATOM 1149 CA LYS A 77 11.388 7.229 -2.460 1.00 0.00 C ATOM 1150 C LYS A 77 10.350 7.068 -1.354 1.00 0.00 C ATOM 1151 O LYS A 77 9.653 6.055 -1.286 1.00 0.00 O ATOM 1152 CB LYS A 77 12.783 7.377 -1.849 1.00 0.00 C ATOM 1153 CG LYS A 77 13.900 6.887 -2.755 1.00 0.00 C ATOM 1154 CD LYS A 77 15.168 7.705 -2.570 1.00 0.00 C ATOM 1155 CE LYS A 77 15.323 8.749 -3.664 1.00 0.00 C ATOM 1156 NZ LYS A 77 16.400 9.728 -3.349 1.00 0.00 N ATOM 0 H LYS A 77 11.681 9.187 -3.150 1.00 0.00 H new ATOM 0 HA LYS A 77 11.368 6.337 -3.087 1.00 0.00 H new ATOM 0 HB2 LYS A 77 12.956 8.426 -1.609 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.820 6.825 -0.910 1.00 0.00 H new ATOM 0 HG2 LYS A 77 14.108 5.838 -2.543 1.00 0.00 H new ATOM 0 HG3 LYS A 77 13.578 6.944 -3.795 1.00 0.00 H new ATOM 0 HD2 LYS A 77 15.146 8.196 -1.597 1.00 0.00 H new ATOM 0 HD3 LYS A 77 16.033 7.042 -2.573 1.00 0.00 H new ATOM 0 HE2 LYS A 77 15.547 8.254 -4.609 1.00 0.00 H new ATOM 0 HE3 LYS A 77 14.379 9.278 -3.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 16.474 10.423 -4.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 16.174 10.219 -2.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 17.306 9.227 -3.247 1.00 0.00 H new ATOM 1170 N ASP A 78 10.252 8.073 -0.490 1.00 0.00 N ATOM 1171 CA ASP A 78 9.298 8.042 0.613 1.00 0.00 C ATOM 1172 C ASP A 78 8.538 9.361 0.713 1.00 0.00 C ATOM 1173 O ASP A 78 9.129 10.437 0.630 1.00 0.00 O ATOM 1174 CB ASP A 78 10.020 7.755 1.931 1.00 0.00 C ATOM 1175 CG ASP A 78 9.183 6.920 2.879 1.00 0.00 C ATOM 1176 OD1 ASP A 78 7.939 6.981 2.784 1.00 0.00 O ATOM 1177 OD2 ASP A 78 9.771 6.203 3.717 1.00 0.00 O ATOM 0 H ASP A 78 10.821 8.918 -0.532 1.00 0.00 H new ATOM 0 HA ASP A 78 8.581 7.245 0.418 1.00 0.00 H new ATOM 0 HB2 ASP A 78 10.956 7.236 1.724 1.00 0.00 H new ATOM 0 HB3 ASP A 78 10.278 8.698 2.413 1.00 0.00 H new ATOM 1182 N THR A 79 7.224 9.268 0.892 1.00 0.00 N ATOM 1183 CA THR A 79 6.381 10.453 1.004 1.00 0.00 C ATOM 1184 C THR A 79 4.930 10.065 1.268 1.00 0.00 C ATOM 1185 O THR A 79 4.505 8.957 0.944 1.00 0.00 O ATOM 1186 CB THR A 79 6.473 11.292 -0.271 1.00 0.00 C ATOM 1187 OG1 THR A 79 5.690 12.468 -0.156 1.00 0.00 O ATOM 1188 CG2 THR A 79 6.011 10.553 -1.509 1.00 0.00 C ATOM 0 H THR A 79 6.720 8.384 0.963 1.00 0.00 H new ATOM 0 HA THR A 79 6.739 11.045 1.846 1.00 0.00 H new ATOM 0 HB THR A 79 7.531 11.531 -0.383 1.00 0.00 H new ATOM 0 HG1 THR A 79 5.763 12.992 -0.981 1.00 0.00 H new ATOM 0 HG21 THR A 79 6.102 11.205 -2.377 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.628 9.666 -1.655 1.00 0.00 H new ATOM 0 HG23 THR A 79 4.970 10.255 -1.387 1.00 0.00 H new ATOM 1196 N ASP A 80 4.174 10.986 1.858 1.00 0.00 N ATOM 1197 CA ASP A 80 2.770 10.739 2.165 1.00 0.00 C ATOM 1198 C ASP A 80 1.891 11.872 1.645 1.00 0.00 C ATOM 1199 O ASP A 80 2.369 12.980 1.401 1.00 0.00 O ATOM 1200 CB ASP A 80 2.575 10.579 3.674 1.00 0.00 C ATOM 1201 CG ASP A 80 3.581 9.626 4.289 1.00 0.00 C ATOM 1202 OD1 ASP A 80 3.395 8.399 4.155 1.00 0.00 O ATOM 1203 OD2 ASP A 80 4.555 10.108 4.905 1.00 0.00 O ATOM 0 H ASP A 80 4.510 11.909 2.133 1.00 0.00 H new ATOM 0 HA ASP A 80 2.474 9.815 1.668 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.661 11.554 4.154 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.567 10.215 3.871 1.00 0.00 H new ATOM 1208 N SER A 81 0.604 11.587 1.479 1.00 0.00 N ATOM 1209 CA SER A 81 -0.344 12.581 0.989 1.00 0.00 C ATOM 1210 C SER A 81 -1.739 12.320 1.547 1.00 0.00 C ATOM 1211 O SER A 81 -2.080 11.188 1.887 1.00 0.00 O ATOM 1212 CB SER A 81 -0.383 12.570 -0.540 1.00 0.00 C ATOM 1213 OG SER A 81 0.587 13.450 -1.082 1.00 0.00 O ATOM 0 H SER A 81 0.193 10.675 1.677 1.00 0.00 H new ATOM 0 HA SER A 81 -0.013 13.562 1.329 1.00 0.00 H new ATOM 0 HB2 SER A 81 -0.204 11.558 -0.904 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.375 12.862 -0.884 1.00 0.00 H new ATOM 0 HG SER A 81 1.347 13.518 -0.467 1.00 0.00 H new ATOM 1219 N GLU A 82 -2.543 13.375 1.639 1.00 0.00 N ATOM 1220 CA GLU A 82 -3.902 13.259 2.158 1.00 0.00 C ATOM 1221 C GLU A 82 -4.699 12.210 1.385 1.00 0.00 C ATOM 1222 O GLU A 82 -5.635 11.613 1.916 1.00 0.00 O ATOM 1223 CB GLU A 82 -4.615 14.612 2.090 1.00 0.00 C ATOM 1224 CG GLU A 82 -4.847 15.111 0.673 1.00 0.00 C ATOM 1225 CD GLU A 82 -3.660 15.876 0.122 1.00 0.00 C ATOM 1226 OE1 GLU A 82 -2.983 16.570 0.910 1.00 0.00 O ATOM 1227 OE2 GLU A 82 -3.407 15.783 -1.097 1.00 0.00 O ATOM 0 H GLU A 82 -2.277 14.320 1.361 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.837 12.941 3.199 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.575 14.532 2.599 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.026 15.351 2.634 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.061 14.262 0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.727 15.754 0.658 1.00 0.00 H new ATOM 1234 N GLU A 83 -4.320 11.990 0.129 1.00 0.00 N ATOM 1235 CA GLU A 83 -5.000 11.012 -0.713 1.00 0.00 C ATOM 1236 C GLU A 83 -4.661 9.590 -0.279 1.00 0.00 C ATOM 1237 O GLU A 83 -5.494 8.688 -0.367 1.00 0.00 O ATOM 1238 CB GLU A 83 -4.614 11.216 -2.180 1.00 0.00 C ATOM 1239 CG GLU A 83 -4.874 12.626 -2.686 1.00 0.00 C ATOM 1240 CD GLU A 83 -4.033 12.973 -3.899 1.00 0.00 C ATOM 1241 OE1 GLU A 83 -2.892 12.474 -3.993 1.00 0.00 O ATOM 1242 OE2 GLU A 83 -4.516 13.744 -4.755 1.00 0.00 O ATOM 0 H GLU A 83 -3.547 12.475 -0.327 1.00 0.00 H new ATOM 0 HA GLU A 83 -6.074 11.159 -0.603 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -3.556 10.983 -2.305 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -5.171 10.509 -2.795 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -5.929 12.729 -2.938 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -4.666 13.339 -1.888 1.00 0.00 H new ATOM 1249 N GLU A 84 -3.432 9.396 0.189 1.00 0.00 N ATOM 1250 CA GLU A 84 -2.983 8.083 0.638 1.00 0.00 C ATOM 1251 C GLU A 84 -3.737 7.649 1.890 1.00 0.00 C ATOM 1252 O GLU A 84 -3.986 6.463 2.096 1.00 0.00 O ATOM 1253 CB GLU A 84 -1.479 8.102 0.916 1.00 0.00 C ATOM 1254 CG GLU A 84 -0.654 8.660 -0.233 1.00 0.00 C ATOM 1255 CD GLU A 84 0.810 8.819 0.124 1.00 0.00 C ATOM 1256 OE1 GLU A 84 1.321 7.997 0.914 1.00 0.00 O ATOM 1257 OE2 GLU A 84 1.446 9.765 -0.385 1.00 0.00 O ATOM 0 H GLU A 84 -2.729 10.131 0.267 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.190 7.366 -0.156 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.291 8.697 1.810 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -1.145 7.087 1.132 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -0.744 7.999 -1.095 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.059 9.627 -0.530 1.00 0.00 H new ATOM 1264 N ILE A 85 -4.102 8.623 2.718 1.00 0.00 N ATOM 1265 CA ILE A 85 -4.837 8.353 3.954 1.00 0.00 C ATOM 1266 C ILE A 85 -6.289 8.007 3.641 1.00 0.00 C ATOM 1267 O ILE A 85 -6.875 7.114 4.256 1.00 0.00 O ATOM 1268 CB ILE A 85 -4.778 9.554 4.937 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -3.543 10.424 4.683 1.00 0.00 C ATOM 1270 CG2 ILE A 85 -4.767 9.066 6.370 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -2.256 9.635 4.577 1.00 0.00 C ATOM 0 H ILE A 85 -3.901 9.610 2.557 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.358 7.503 4.439 1.00 0.00 H new ATOM 0 HB ILE A 85 -5.668 10.160 4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -3.690 10.988 3.762 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -3.448 11.150 5.490 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -4.725 9.921 7.045 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -5.673 8.492 6.566 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.895 8.433 6.532 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.425 10.317 4.397 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.085 9.092 5.506 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.330 8.927 3.751 1.00 0.00 H new ATOM 1283 N ARG A 86 -6.859 8.706 2.662 1.00 0.00 N ATOM 1284 CA ARG A 86 -8.238 8.460 2.251 1.00 0.00 C ATOM 1285 C ARG A 86 -8.344 7.127 1.517 1.00 0.00 C ATOM 1286 O ARG A 86 -9.194 6.298 1.840 1.00 0.00 O ATOM 1287 CB ARG A 86 -8.739 9.595 1.357 1.00 0.00 C ATOM 1288 CG ARG A 86 -10.197 9.955 1.590 1.00 0.00 C ATOM 1289 CD ARG A 86 -11.104 9.312 0.552 1.00 0.00 C ATOM 1290 NE ARG A 86 -10.784 9.754 -0.803 1.00 0.00 N ATOM 1291 CZ ARG A 86 -11.615 9.637 -1.836 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -12.815 9.094 -1.674 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -11.245 10.065 -3.036 1.00 0.00 N ATOM 0 H ARG A 86 -6.388 9.445 2.140 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.861 8.418 3.144 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.124 10.479 1.527 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -8.606 9.310 0.313 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -10.497 9.632 2.587 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.315 11.038 1.557 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -11.011 8.228 0.611 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -12.142 9.556 0.777 1.00 0.00 H new ATOM 0 HE ARG A 86 -9.870 10.177 -0.967 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.105 8.763 -0.754 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.447 9.007 -2.470 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.324 10.483 -3.167 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.882 9.976 -3.828 1.00 0.00 H new ATOM 1307 N GLU A 87 -7.464 6.917 0.540 1.00 0.00 N ATOM 1308 CA GLU A 87 -7.454 5.672 -0.218 1.00 0.00 C ATOM 1309 C GLU A 87 -7.173 4.510 0.724 1.00 0.00 C ATOM 1310 O GLU A 87 -7.857 3.484 0.698 1.00 0.00 O ATOM 1311 CB GLU A 87 -6.397 5.724 -1.323 1.00 0.00 C ATOM 1312 CG GLU A 87 -6.677 6.776 -2.383 1.00 0.00 C ATOM 1313 CD GLU A 87 -7.475 6.230 -3.551 1.00 0.00 C ATOM 1314 OE1 GLU A 87 -7.432 5.002 -3.776 1.00 0.00 O ATOM 1315 OE2 GLU A 87 -8.143 7.029 -4.240 1.00 0.00 O ATOM 0 H GLU A 87 -6.752 7.591 0.257 1.00 0.00 H new ATOM 0 HA GLU A 87 -8.429 5.532 -0.686 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -5.424 5.922 -0.874 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -6.334 4.746 -1.801 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -7.222 7.605 -1.932 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.732 7.177 -2.749 1.00 0.00 H new ATOM 1322 N ALA A 88 -6.175 4.701 1.579 1.00 0.00 N ATOM 1323 CA ALA A 88 -5.801 3.700 2.566 1.00 0.00 C ATOM 1324 C ALA A 88 -7.011 3.303 3.384 1.00 0.00 C ATOM 1325 O ALA A 88 -7.303 2.129 3.568 1.00 0.00 O ATOM 1326 CB ALA A 88 -4.742 4.266 3.485 1.00 0.00 C ATOM 0 H ALA A 88 -5.607 5.548 1.607 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.410 2.822 2.051 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.463 3.515 4.224 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.865 4.545 2.901 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.134 5.147 3.993 1.00 0.00 H new ATOM 1332 N PHE A 89 -7.710 4.309 3.872 1.00 0.00 N ATOM 1333 CA PHE A 89 -8.900 4.096 4.678 1.00 0.00 C ATOM 1334 C PHE A 89 -9.865 3.145 3.984 1.00 0.00 C ATOM 1335 O PHE A 89 -10.495 2.302 4.623 1.00 0.00 O ATOM 1336 CB PHE A 89 -9.580 5.434 4.950 1.00 0.00 C ATOM 1337 CG PHE A 89 -9.517 5.819 6.388 1.00 0.00 C ATOM 1338 CD1 PHE A 89 -9.850 4.904 7.366 1.00 0.00 C ATOM 1339 CD2 PHE A 89 -9.107 7.080 6.763 1.00 0.00 C ATOM 1340 CE1 PHE A 89 -9.774 5.243 8.702 1.00 0.00 C ATOM 1341 CE2 PHE A 89 -9.034 7.424 8.093 1.00 0.00 C ATOM 1342 CZ PHE A 89 -9.366 6.506 9.066 1.00 0.00 C ATOM 0 H PHE A 89 -7.473 5.290 3.724 1.00 0.00 H new ATOM 0 HA PHE A 89 -8.604 3.643 5.624 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -9.106 6.209 4.348 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.622 5.380 4.636 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -10.173 3.913 7.083 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.841 7.804 6.007 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -10.034 4.519 9.460 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -8.716 8.417 8.376 1.00 0.00 H new ATOM 0 HZ PHE A 89 -9.306 6.777 10.110 1.00 0.00 H new ATOM 1352 N ARG A 90 -9.964 3.285 2.674 1.00 0.00 N ATOM 1353 CA ARG A 90 -10.840 2.439 1.880 1.00 0.00 C ATOM 1354 C ARG A 90 -10.226 1.056 1.683 1.00 0.00 C ATOM 1355 O ARG A 90 -10.944 0.064 1.561 1.00 0.00 O ATOM 1356 CB ARG A 90 -11.119 3.086 0.522 1.00 0.00 C ATOM 1357 CG ARG A 90 -12.356 3.969 0.512 1.00 0.00 C ATOM 1358 CD ARG A 90 -12.008 5.421 0.794 1.00 0.00 C ATOM 1359 NE ARG A 90 -13.035 6.336 0.302 1.00 0.00 N ATOM 1360 CZ ARG A 90 -14.181 6.574 0.936 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -14.450 5.967 2.086 1.00 0.00 N ATOM 1362 NH2 ARG A 90 -15.060 7.422 0.420 1.00 0.00 N ATOM 0 H ARG A 90 -9.447 3.979 2.135 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.781 2.326 2.418 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -10.255 3.682 0.228 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -11.236 2.303 -0.227 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -12.850 3.894 -0.457 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -13.065 3.612 1.259 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -11.882 5.561 1.867 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.053 5.662 0.326 1.00 0.00 H new ATOM 0 HE ARG A 90 -12.864 6.821 -0.579 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.777 5.315 2.488 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -15.330 6.153 2.567 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -14.858 7.892 -0.463 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -15.938 7.605 0.906 1.00 0.00 H new ATOM 1376 N VAL A 91 -8.895 0.992 1.651 1.00 0.00 N ATOM 1377 CA VAL A 91 -8.206 -0.276 1.465 1.00 0.00 C ATOM 1378 C VAL A 91 -8.225 -1.101 2.752 1.00 0.00 C ATOM 1379 O VAL A 91 -8.361 -2.324 2.713 1.00 0.00 O ATOM 1380 CB VAL A 91 -6.760 -0.055 0.974 1.00 0.00 C ATOM 1381 CG1 VAL A 91 -6.703 1.112 0.003 1.00 0.00 C ATOM 1382 CG2 VAL A 91 -5.820 0.188 2.130 1.00 0.00 C ATOM 0 H VAL A 91 -8.280 1.799 1.751 1.00 0.00 H new ATOM 0 HA VAL A 91 -8.738 -0.836 0.696 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.440 -0.962 0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.676 1.255 -0.334 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -7.341 0.902 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.051 2.017 0.501 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.809 0.340 1.751 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -6.139 1.074 2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.832 -0.675 2.796 1.00 0.00 H new ATOM 1392 N PHE A 92 -8.102 -0.424 3.893 1.00 0.00 N ATOM 1393 CA PHE A 92 -8.123 -1.103 5.186 1.00 0.00 C ATOM 1394 C PHE A 92 -9.538 -1.551 5.530 1.00 0.00 C ATOM 1395 O PHE A 92 -9.809 -2.744 5.655 1.00 0.00 O ATOM 1396 CB PHE A 92 -7.592 -0.181 6.286 1.00 0.00 C ATOM 1397 CG PHE A 92 -6.143 -0.400 6.613 1.00 0.00 C ATOM 1398 CD1 PHE A 92 -5.668 -1.670 6.902 1.00 0.00 C ATOM 1399 CD2 PHE A 92 -5.257 0.664 6.638 1.00 0.00 C ATOM 1400 CE1 PHE A 92 -4.336 -1.873 7.208 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -3.924 0.467 6.944 1.00 0.00 C ATOM 1402 CZ PHE A 92 -3.462 -0.803 7.229 1.00 0.00 C ATOM 0 H PHE A 92 -7.987 0.588 3.948 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.479 -1.980 5.119 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.733 0.855 5.978 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -8.185 -0.329 7.189 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.347 -2.510 6.888 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.612 1.659 6.416 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.978 -2.867 7.431 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.244 1.306 6.960 1.00 0.00 H new ATOM 0 HZ PHE A 92 -2.420 -0.959 7.468 1.00 0.00 H new ATOM 1412 N ASP A 93 -10.437 -0.586 5.680 1.00 0.00 N ATOM 1413 CA ASP A 93 -11.826 -0.879 6.008 1.00 0.00 C ATOM 1414 C ASP A 93 -12.624 -1.198 4.748 1.00 0.00 C ATOM 1415 O ASP A 93 -12.599 -0.443 3.777 1.00 0.00 O ATOM 1416 CB ASP A 93 -12.455 0.304 6.745 1.00 0.00 C ATOM 1417 CG ASP A 93 -13.706 -0.089 7.506 1.00 0.00 C ATOM 1418 OD1 ASP A 93 -13.797 -1.255 7.944 1.00 0.00 O ATOM 1419 OD2 ASP A 93 -14.600 0.769 7.671 1.00 0.00 O ATOM 0 H ASP A 93 -10.228 0.407 5.580 1.00 0.00 H new ATOM 0 HA ASP A 93 -11.847 -1.754 6.658 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.728 0.724 7.439 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.700 1.087 6.027 1.00 0.00 H new ATOM 1424 N LYS A 94 -13.327 -2.326 4.770 1.00 0.00 N ATOM 1425 CA LYS A 94 -14.128 -2.750 3.627 1.00 0.00 C ATOM 1426 C LYS A 94 -15.386 -1.897 3.486 1.00 0.00 C ATOM 1427 O LYS A 94 -15.660 -1.352 2.417 1.00 0.00 O ATOM 1428 CB LYS A 94 -14.513 -4.224 3.768 1.00 0.00 C ATOM 1429 CG LYS A 94 -13.323 -5.145 3.984 1.00 0.00 C ATOM 1430 CD LYS A 94 -12.308 -5.016 2.860 1.00 0.00 C ATOM 1431 CE LYS A 94 -11.412 -6.242 2.776 1.00 0.00 C ATOM 1432 NZ LYS A 94 -10.021 -5.887 2.381 1.00 0.00 N ATOM 0 H LYS A 94 -13.358 -2.963 5.566 1.00 0.00 H new ATOM 0 HA LYS A 94 -13.524 -2.619 2.729 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -15.203 -4.332 4.605 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -15.048 -4.539 2.872 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.846 -4.908 4.935 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -13.667 -6.177 4.048 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.828 -4.879 1.912 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.697 -4.128 3.020 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -11.397 -6.748 3.741 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -11.826 -6.946 2.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.518 -6.744 2.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.046 -5.201 1.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -9.525 -5.468 3.194 1.00 0.00 H new ATOM 1446 N ASP A 95 -16.149 -1.790 4.569 1.00 0.00 N ATOM 1447 CA ASP A 95 -17.380 -1.006 4.558 1.00 0.00 C ATOM 1448 C ASP A 95 -17.093 0.490 4.676 1.00 0.00 C ATOM 1449 O ASP A 95 -17.991 1.314 4.503 1.00 0.00 O ATOM 1450 CB ASP A 95 -18.295 -1.448 5.702 1.00 0.00 C ATOM 1451 CG ASP A 95 -17.642 -1.276 7.059 1.00 0.00 C ATOM 1452 OD1 ASP A 95 -17.789 -0.191 7.659 1.00 0.00 O ATOM 1453 OD2 ASP A 95 -16.975 -2.224 7.524 1.00 0.00 O ATOM 0 H ASP A 95 -15.938 -2.234 5.463 1.00 0.00 H new ATOM 0 HA ASP A 95 -17.877 -1.182 3.604 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -19.219 -0.870 5.670 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -18.568 -2.494 5.563 1.00 0.00 H new ATOM 1458 N GLY A 96 -15.839 0.839 4.966 1.00 0.00 N ATOM 1459 CA GLY A 96 -15.463 2.237 5.097 1.00 0.00 C ATOM 1460 C GLY A 96 -16.458 3.044 5.912 1.00 0.00 C ATOM 1461 O GLY A 96 -17.180 3.880 5.369 1.00 0.00 O ATOM 0 H GLY A 96 -15.077 0.177 5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -14.481 2.301 5.565 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -15.372 2.678 4.104 1.00 0.00 H new ATOM 1465 N ASN A 97 -16.496 2.794 7.217 1.00 0.00 N ATOM 1466 CA ASN A 97 -17.411 3.507 8.102 1.00 0.00 C ATOM 1467 C ASN A 97 -16.737 4.726 8.728 1.00 0.00 C ATOM 1468 O ASN A 97 -17.241 5.293 9.698 1.00 0.00 O ATOM 1469 CB ASN A 97 -17.923 2.572 9.200 1.00 0.00 C ATOM 1470 CG ASN A 97 -16.814 2.089 10.115 1.00 0.00 C ATOM 1471 OD1 ASN A 97 -15.721 1.753 9.661 1.00 0.00 O ATOM 1472 ND2 ASN A 97 -17.092 2.053 11.413 1.00 0.00 N ATOM 0 H ASN A 97 -15.906 2.105 7.684 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.254 3.853 7.504 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -18.678 3.090 9.791 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -18.412 1.712 8.742 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -16.385 1.737 12.077 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -18.012 2.341 11.746 1.00 0.00 H new ATOM 1479 N GLY A 98 -15.597 5.125 8.171 1.00 0.00 N ATOM 1480 CA GLY A 98 -14.881 6.274 8.694 1.00 0.00 C ATOM 1481 C GLY A 98 -14.329 6.032 10.085 1.00 0.00 C ATOM 1482 O GLY A 98 -14.006 6.979 10.803 1.00 0.00 O ATOM 0 H GLY A 98 -15.158 4.674 7.369 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -14.062 6.525 8.020 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.549 7.135 8.717 1.00 0.00 H new ATOM 1486 N TYR A 99 -14.219 4.764 10.470 1.00 0.00 N ATOM 1487 CA TYR A 99 -13.701 4.410 11.787 1.00 0.00 C ATOM 1488 C TYR A 99 -13.284 2.939 11.833 1.00 0.00 C ATOM 1489 O TYR A 99 -14.115 2.045 11.672 1.00 0.00 O ATOM 1490 CB TYR A 99 -14.764 4.671 12.856 1.00 0.00 C ATOM 1491 CG TYR A 99 -14.805 6.101 13.347 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -13.647 6.751 13.755 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -16.005 6.798 13.409 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -13.684 8.054 14.211 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -16.050 8.102 13.864 1.00 0.00 C ATOM 1496 CZ TYR A 99 -14.887 8.725 14.264 1.00 0.00 C ATOM 1497 OH TYR A 99 -14.927 10.024 14.718 1.00 0.00 O ATOM 0 H TYR A 99 -14.481 3.967 9.890 1.00 0.00 H new ATOM 0 HA TYR A 99 -12.825 5.028 11.983 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -15.742 4.408 12.453 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -14.581 4.012 13.704 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -12.702 6.229 13.715 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -16.918 6.313 13.096 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -12.775 8.545 14.525 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -16.991 8.630 13.906 1.00 0.00 H new ATOM 0 HH TYR A 99 -15.850 10.352 14.691 1.00 0.00 H new ATOM 1507 N ILE A 100 -11.996 2.696 12.053 1.00 0.00 N ATOM 1508 CA ILE A 100 -11.471 1.334 12.119 1.00 0.00 C ATOM 1509 C ILE A 100 -11.015 0.980 13.526 1.00 0.00 C ATOM 1510 O ILE A 100 -10.204 1.685 14.126 1.00 0.00 O ATOM 1511 CB ILE A 100 -10.278 1.134 11.168 1.00 0.00 C ATOM 1512 CG1 ILE A 100 -10.501 1.902 9.872 1.00 0.00 C ATOM 1513 CG2 ILE A 100 -10.055 -0.346 10.890 1.00 0.00 C ATOM 1514 CD1 ILE A 100 -9.223 2.194 9.115 1.00 0.00 C ATOM 0 H ILE A 100 -11.295 3.424 12.189 1.00 0.00 H new ATOM 0 HA ILE A 100 -12.291 0.682 11.819 1.00 0.00 H new ATOM 0 HB ILE A 100 -9.381 1.525 11.649 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -11.171 1.330 9.231 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -11.003 2.843 10.098 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -9.207 -0.466 10.216 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -9.850 -0.865 11.826 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -10.948 -0.768 10.429 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -9.458 2.743 8.203 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -8.559 2.793 9.739 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -8.730 1.256 8.857 1.00 0.00 H new ATOM 1526 N SER A 101 -11.527 -0.129 14.034 1.00 0.00 N ATOM 1527 CA SER A 101 -11.161 -0.602 15.359 1.00 0.00 C ATOM 1528 C SER A 101 -10.199 -1.774 15.249 1.00 0.00 C ATOM 1529 O SER A 101 -10.150 -2.457 14.227 1.00 0.00 O ATOM 1530 CB SER A 101 -12.408 -1.017 16.141 1.00 0.00 C ATOM 1531 OG SER A 101 -13.039 0.106 16.731 1.00 0.00 O ATOM 0 H SER A 101 -12.200 -0.721 13.547 1.00 0.00 H new ATOM 0 HA SER A 101 -10.669 0.210 15.894 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.107 -1.522 15.475 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.133 -1.732 16.916 1.00 0.00 H new ATOM 0 HG SER A 101 -12.381 0.618 17.246 1.00 0.00 H new ATOM 1537 N ALA A 102 -9.432 -1.996 16.304 1.00 0.00 N ATOM 1538 CA ALA A 102 -8.461 -3.080 16.335 1.00 0.00 C ATOM 1539 C ALA A 102 -9.077 -4.391 15.855 1.00 0.00 C ATOM 1540 O ALA A 102 -8.452 -5.137 15.103 1.00 0.00 O ATOM 1541 CB ALA A 102 -7.914 -3.230 17.736 1.00 0.00 C ATOM 0 H ALA A 102 -9.463 -1.436 17.156 1.00 0.00 H new ATOM 0 HA ALA A 102 -7.645 -2.834 15.655 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -7.187 -4.042 17.758 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.430 -2.302 18.039 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.730 -3.455 18.423 1.00 0.00 H new ATOM 1547 N ALA A 103 -10.309 -4.661 16.277 1.00 0.00 N ATOM 1548 CA ALA A 103 -11.003 -5.869 15.870 1.00 0.00 C ATOM 1549 C ALA A 103 -11.122 -5.941 14.357 1.00 0.00 C ATOM 1550 O ALA A 103 -10.630 -6.876 13.725 1.00 0.00 O ATOM 1551 CB ALA A 103 -12.374 -5.879 16.497 1.00 0.00 C ATOM 0 H ALA A 103 -10.844 -4.056 16.901 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.435 -6.737 16.204 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -12.904 -6.783 16.198 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -12.278 -5.857 17.583 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -12.932 -5.004 16.165 1.00 0.00 H new ATOM 1557 N GLU A 104 -11.763 -4.932 13.782 1.00 0.00 N ATOM 1558 CA GLU A 104 -11.931 -4.860 12.337 1.00 0.00 C ATOM 1559 C GLU A 104 -10.572 -4.934 11.657 1.00 0.00 C ATOM 1560 O GLU A 104 -10.413 -5.575 10.617 1.00 0.00 O ATOM 1561 CB GLU A 104 -12.644 -3.565 11.942 1.00 0.00 C ATOM 1562 CG GLU A 104 -13.943 -3.328 12.694 1.00 0.00 C ATOM 1563 CD GLU A 104 -14.892 -4.507 12.605 1.00 0.00 C ATOM 1564 OE1 GLU A 104 -14.685 -5.493 13.344 1.00 0.00 O ATOM 1565 OE2 GLU A 104 -15.843 -4.446 11.797 1.00 0.00 O ATOM 0 H GLU A 104 -12.175 -4.152 14.294 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.542 -5.703 12.014 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -11.974 -2.724 12.118 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.853 -3.587 10.872 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -13.720 -3.124 13.741 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -14.433 -2.441 12.294 1.00 0.00 H new ATOM 1572 N LEU A 105 -9.585 -4.284 12.270 1.00 0.00 N ATOM 1573 CA LEU A 105 -8.230 -4.288 11.741 1.00 0.00 C ATOM 1574 C LEU A 105 -7.710 -5.715 11.665 1.00 0.00 C ATOM 1575 O LEU A 105 -7.231 -6.163 10.623 1.00 0.00 O ATOM 1576 CB LEU A 105 -7.306 -3.440 12.611 1.00 0.00 C ATOM 1577 CG LEU A 105 -6.556 -2.346 11.856 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -6.180 -1.218 12.793 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -5.324 -2.916 11.168 1.00 0.00 C ATOM 0 H LEU A 105 -9.701 -3.750 13.131 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.248 -3.857 10.740 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.896 -2.979 13.403 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -6.580 -4.094 13.094 1.00 0.00 H new ATOM 0 HG LEU A 105 -7.215 -1.943 11.087 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.646 -0.447 12.238 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.083 -0.791 13.230 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -5.540 -1.603 13.587 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.804 -2.120 10.635 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.658 -3.349 11.914 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.627 -3.688 10.461 1.00 0.00 H new ATOM 1591 N ARG A 106 -7.834 -6.433 12.778 1.00 0.00 N ATOM 1592 CA ARG A 106 -7.406 -7.822 12.845 1.00 0.00 C ATOM 1593 C ARG A 106 -8.105 -8.613 11.748 1.00 0.00 C ATOM 1594 O ARG A 106 -7.486 -9.408 11.041 1.00 0.00 O ATOM 1595 CB ARG A 106 -7.727 -8.404 14.230 1.00 0.00 C ATOM 1596 CG ARG A 106 -7.817 -9.919 14.273 1.00 0.00 C ATOM 1597 CD ARG A 106 -6.581 -10.549 13.676 1.00 0.00 C ATOM 1598 NE ARG A 106 -6.271 -11.841 14.282 1.00 0.00 N ATOM 1599 CZ ARG A 106 -6.890 -12.976 13.966 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -7.853 -12.983 13.052 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -6.546 -14.108 14.566 1.00 0.00 N ATOM 0 H ARG A 106 -8.229 -6.072 13.647 1.00 0.00 H new ATOM 0 HA ARG A 106 -6.328 -7.885 12.694 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -6.960 -8.078 14.933 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -8.673 -7.987 14.575 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -7.938 -10.251 15.304 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -8.700 -10.251 13.726 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -6.723 -10.678 12.603 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -5.733 -9.876 13.806 1.00 0.00 H new ATOM 0 HE ARG A 106 -5.537 -11.876 14.989 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -8.122 -12.115 12.588 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -8.324 -13.856 12.814 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.807 -14.108 15.269 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -7.020 -14.978 14.324 1.00 0.00 H new ATOM 1615 N HIS A 107 -9.402 -8.365 11.601 1.00 0.00 N ATOM 1616 CA HIS A 107 -10.195 -9.032 10.578 1.00 0.00 C ATOM 1617 C HIS A 107 -9.610 -8.762 9.193 1.00 0.00 C ATOM 1618 O HIS A 107 -9.597 -9.641 8.332 1.00 0.00 O ATOM 1619 CB HIS A 107 -11.648 -8.557 10.635 1.00 0.00 C ATOM 1620 CG HIS A 107 -12.645 -9.652 10.415 1.00 0.00 C ATOM 1621 ND1 HIS A 107 -13.130 -10.445 11.434 1.00 0.00 N ATOM 1622 CD2 HIS A 107 -13.251 -10.085 9.284 1.00 0.00 C ATOM 1623 CE1 HIS A 107 -13.989 -11.318 10.940 1.00 0.00 C ATOM 1624 NE2 HIS A 107 -14.081 -11.120 9.638 1.00 0.00 N ATOM 0 H HIS A 107 -9.925 -7.707 12.178 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.170 -10.105 10.767 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.834 -8.098 11.606 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -11.798 -7.783 9.882 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -13.108 -9.690 8.289 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.525 -12.066 11.505 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -14.673 -11.650 8.998 1.00 0.00 H new ATOM 1633 N VAL A 108 -9.119 -7.541 8.992 1.00 0.00 N ATOM 1634 CA VAL A 108 -8.523 -7.156 7.716 1.00 0.00 C ATOM 1635 C VAL A 108 -7.193 -7.875 7.501 1.00 0.00 C ATOM 1636 O VAL A 108 -6.988 -8.527 6.478 1.00 0.00 O ATOM 1637 CB VAL A 108 -8.301 -5.628 7.635 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -7.423 -5.257 6.446 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -9.634 -4.904 7.552 1.00 0.00 C ATOM 0 H VAL A 108 -9.122 -6.803 9.696 1.00 0.00 H new ATOM 0 HA VAL A 108 -9.221 -7.448 6.932 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.785 -5.317 8.543 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.286 -4.176 6.418 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.452 -5.743 6.545 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.901 -5.586 5.524 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.461 -3.829 7.496 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -10.172 -5.232 6.663 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -10.227 -5.130 8.438 1.00 0.00 H new ATOM 1649 N MET A 109 -6.292 -7.751 8.473 1.00 0.00 N ATOM 1650 CA MET A 109 -4.983 -8.391 8.387 1.00 0.00 C ATOM 1651 C MET A 109 -5.123 -9.864 8.018 1.00 0.00 C ATOM 1652 O MET A 109 -4.529 -10.330 7.047 1.00 0.00 O ATOM 1653 CB MET A 109 -4.235 -8.253 9.714 1.00 0.00 C ATOM 1654 CG MET A 109 -3.961 -6.812 10.109 1.00 0.00 C ATOM 1655 SD MET A 109 -2.356 -6.227 9.531 1.00 0.00 S ATOM 1656 CE MET A 109 -2.781 -5.624 7.899 1.00 0.00 C ATOM 0 H MET A 109 -6.444 -7.214 9.327 1.00 0.00 H new ATOM 0 HA MET A 109 -4.412 -7.891 7.605 1.00 0.00 H new ATOM 0 HB2 MET A 109 -4.817 -8.733 10.501 1.00 0.00 H new ATOM 0 HB3 MET A 109 -3.288 -8.789 9.646 1.00 0.00 H new ATOM 0 HG2 MET A 109 -4.744 -6.173 9.702 1.00 0.00 H new ATOM 0 HG3 MET A 109 -4.007 -6.722 11.194 1.00 0.00 H new ATOM 0 HE1 MET A 109 -2.178 -4.746 7.667 1.00 0.00 H new ATOM 0 HE2 MET A 109 -2.586 -6.403 7.161 1.00 0.00 H new ATOM 0 HE3 MET A 109 -3.837 -5.356 7.874 1.00 0.00 H new ATOM 1666 N THR A 110 -5.923 -10.587 8.794 1.00 0.00 N ATOM 1667 CA THR A 110 -6.151 -12.004 8.538 1.00 0.00 C ATOM 1668 C THR A 110 -6.904 -12.197 7.225 1.00 0.00 C ATOM 1669 O THR A 110 -6.801 -13.244 6.586 1.00 0.00 O ATOM 1670 CB THR A 110 -6.934 -12.635 9.691 1.00 0.00 C ATOM 1671 OG1 THR A 110 -7.046 -14.036 9.513 1.00 0.00 O ATOM 1672 CG2 THR A 110 -8.334 -12.079 9.842 1.00 0.00 C ATOM 0 H THR A 110 -6.423 -10.217 9.603 1.00 0.00 H new ATOM 0 HA THR A 110 -5.183 -12.498 8.460 1.00 0.00 H new ATOM 0 HB THR A 110 -6.367 -12.394 10.590 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.548 -14.422 10.261 1.00 0.00 H new ATOM 0 HG21 THR A 110 -8.832 -12.570 10.678 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.281 -11.007 10.031 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.898 -12.259 8.927 1.00 0.00 H new ATOM 1680 N ASN A 111 -7.659 -11.176 6.826 1.00 0.00 N ATOM 1681 CA ASN A 111 -8.427 -11.227 5.588 1.00 0.00 C ATOM 1682 C ASN A 111 -7.501 -11.226 4.375 1.00 0.00 C ATOM 1683 O ASN A 111 -7.831 -11.786 3.329 1.00 0.00 O ATOM 1684 CB ASN A 111 -9.392 -10.039 5.512 1.00 0.00 C ATOM 1685 CG ASN A 111 -10.817 -10.430 5.852 1.00 0.00 C ATOM 1686 OD1 ASN A 111 -10.974 -11.274 6.865 1.00 0.00 O flip ATOM 1687 ND2 ASN A 111 -11.766 -9.977 5.213 1.00 0.00 N flip ATOM 0 H ASN A 111 -7.754 -10.303 7.344 1.00 0.00 H new ATOM 0 HA ASN A 111 -9.002 -12.153 5.583 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -9.059 -9.259 6.197 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -9.364 -9.615 4.508 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -11.599 -9.331 4.442 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -12.719 -10.248 5.455 1.00 0.00 H new ATOM 1694 N LEU A 112 -6.341 -10.593 4.522 1.00 0.00 N ATOM 1695 CA LEU A 112 -5.368 -10.518 3.438 1.00 0.00 C ATOM 1696 C LEU A 112 -4.294 -11.591 3.592 1.00 0.00 C ATOM 1697 O LEU A 112 -3.720 -12.055 2.607 1.00 0.00 O ATOM 1698 CB LEU A 112 -4.719 -9.133 3.403 1.00 0.00 C ATOM 1699 CG LEU A 112 -5.471 -8.085 2.581 1.00 0.00 C ATOM 1700 CD1 LEU A 112 -5.386 -8.408 1.098 1.00 0.00 C ATOM 1701 CD2 LEU A 112 -6.923 -8.000 3.028 1.00 0.00 C ATOM 0 H LEU A 112 -6.052 -10.125 5.381 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.895 -10.690 2.499 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -4.621 -8.769 4.426 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -3.710 -9.231 3.002 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.002 -7.115 2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -5.927 -7.652 0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -4.341 -8.418 0.787 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.829 -9.387 0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.444 -7.250 2.433 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.403 -8.969 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.964 -7.720 4.081 1.00 0.00 H new ATOM 1713 N GLY A 113 -4.026 -11.982 4.835 1.00 0.00 N ATOM 1714 CA GLY A 113 -3.021 -12.997 5.092 1.00 0.00 C ATOM 1715 C GLY A 113 -2.089 -12.618 6.227 1.00 0.00 C ATOM 1716 O GLY A 113 -0.875 -12.793 6.126 1.00 0.00 O ATOM 0 H GLY A 113 -4.487 -11.614 5.667 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -3.514 -13.939 5.330 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -2.437 -13.163 4.187 1.00 0.00 H new ATOM 1720 N GLU A 114 -2.659 -12.098 7.309 1.00 0.00 N ATOM 1721 CA GLU A 114 -1.872 -11.693 8.468 1.00 0.00 C ATOM 1722 C GLU A 114 -2.679 -11.847 9.753 1.00 0.00 C ATOM 1723 O GLU A 114 -3.675 -11.154 9.959 1.00 0.00 O ATOM 1724 CB GLU A 114 -1.408 -10.243 8.315 1.00 0.00 C ATOM 1725 CG GLU A 114 -0.207 -10.083 7.396 1.00 0.00 C ATOM 1726 CD GLU A 114 -0.599 -10.003 5.934 1.00 0.00 C ATOM 1727 OE1 GLU A 114 -1.595 -9.317 5.622 1.00 0.00 O ATOM 1728 OE2 GLU A 114 0.091 -10.628 5.100 1.00 0.00 O ATOM 0 H GLU A 114 -3.663 -11.947 7.407 1.00 0.00 H new ATOM 0 HA GLU A 114 -0.998 -12.342 8.528 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -2.233 -9.645 7.928 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -1.159 -9.844 9.298 1.00 0.00 H new ATOM 0 HG2 GLU A 114 0.339 -9.181 7.672 1.00 0.00 H new ATOM 0 HG3 GLU A 114 0.472 -10.924 7.541 1.00 0.00 H new ATOM 1735 N LYS A 115 -2.244 -12.761 10.613 1.00 0.00 N ATOM 1736 CA LYS A 115 -2.928 -13.007 11.878 1.00 0.00 C ATOM 1737 C LYS A 115 -2.352 -12.136 12.989 1.00 0.00 C ATOM 1738 O LYS A 115 -1.278 -12.420 13.520 1.00 0.00 O ATOM 1739 CB LYS A 115 -2.818 -14.484 12.262 1.00 0.00 C ATOM 1740 CG LYS A 115 -3.293 -15.433 11.174 1.00 0.00 C ATOM 1741 CD LYS A 115 -3.337 -16.870 11.669 1.00 0.00 C ATOM 1742 CE LYS A 115 -2.084 -17.634 11.272 1.00 0.00 C ATOM 1743 NZ LYS A 115 -2.269 -18.381 9.997 1.00 0.00 N ATOM 0 H LYS A 115 -1.421 -13.344 10.458 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.979 -12.749 11.749 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.780 -14.712 12.503 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.401 -14.660 13.166 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -4.285 -15.133 10.835 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.628 -15.364 10.313 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.442 -16.879 12.754 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.215 -17.370 11.260 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.252 -16.937 11.167 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -1.817 -18.332 12.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.392 -18.888 9.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -3.046 -19.064 10.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.498 -17.713 9.233 1.00 0.00 H new ATOM 1757 N LEU A 116 -3.074 -11.076 13.338 1.00 0.00 N ATOM 1758 CA LEU A 116 -2.635 -10.164 14.388 1.00 0.00 C ATOM 1759 C LEU A 116 -3.265 -10.537 15.727 1.00 0.00 C ATOM 1760 O LEU A 116 -4.241 -11.285 15.777 1.00 0.00 O ATOM 1761 CB LEU A 116 -2.997 -8.723 14.025 1.00 0.00 C ATOM 1762 CG LEU A 116 -1.978 -8.003 13.140 1.00 0.00 C ATOM 1763 CD1 LEU A 116 -0.686 -7.759 13.904 1.00 0.00 C ATOM 1764 CD2 LEU A 116 -1.709 -8.807 11.877 1.00 0.00 C ATOM 0 H LEU A 116 -3.965 -10.827 12.909 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.552 -10.246 14.479 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -3.961 -8.724 13.516 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -3.123 -8.153 14.946 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.393 -7.037 12.851 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.027 -7.246 13.259 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.892 -7.143 14.779 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.266 -8.713 14.222 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -0.982 -8.281 11.259 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -1.315 -9.787 12.146 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.638 -8.931 11.320 1.00 0.00 H new ATOM 1776 N THR A 117 -2.701 -10.013 16.809 1.00 0.00 N ATOM 1777 CA THR A 117 -3.210 -10.294 18.146 1.00 0.00 C ATOM 1778 C THR A 117 -4.112 -9.165 18.633 1.00 0.00 C ATOM 1779 O THR A 117 -4.034 -8.039 18.141 1.00 0.00 O ATOM 1780 CB THR A 117 -2.049 -10.492 19.122 1.00 0.00 C ATOM 1781 OG1 THR A 117 -1.073 -11.358 18.571 1.00 0.00 O ATOM 1782 CG2 THR A 117 -2.475 -11.071 20.454 1.00 0.00 C ATOM 0 H THR A 117 -1.892 -9.392 16.787 1.00 0.00 H new ATOM 0 HA THR A 117 -3.799 -11.210 18.100 1.00 0.00 H new ATOM 0 HB THR A 117 -1.644 -9.495 19.292 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.338 -11.471 19.209 1.00 0.00 H new ATOM 0 HG21 THR A 117 -1.602 -11.185 21.097 1.00 0.00 H new ATOM 0 HG22 THR A 117 -3.191 -10.401 20.930 1.00 0.00 H new ATOM 0 HG23 THR A 117 -2.939 -12.045 20.296 1.00 0.00 H new ATOM 1790 N ASP A 118 -4.966 -9.472 19.605 1.00 0.00 N ATOM 1791 CA ASP A 118 -5.879 -8.480 20.161 1.00 0.00 C ATOM 1792 C ASP A 118 -5.106 -7.307 20.754 1.00 0.00 C ATOM 1793 O ASP A 118 -5.477 -6.147 20.570 1.00 0.00 O ATOM 1794 CB ASP A 118 -6.766 -9.116 21.233 1.00 0.00 C ATOM 1795 CG ASP A 118 -7.797 -8.147 21.780 1.00 0.00 C ATOM 1796 OD1 ASP A 118 -8.899 -8.064 21.200 1.00 0.00 O ATOM 1797 OD2 ASP A 118 -7.501 -7.473 22.789 1.00 0.00 O ATOM 0 H ASP A 118 -5.044 -10.399 20.023 1.00 0.00 H new ATOM 0 HA ASP A 118 -6.510 -8.108 19.354 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.274 -9.984 20.812 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -6.141 -9.477 22.050 1.00 0.00 H new ATOM 1802 N GLU A 119 -4.025 -7.617 21.462 1.00 0.00 N ATOM 1803 CA GLU A 119 -3.195 -6.590 22.078 1.00 0.00 C ATOM 1804 C GLU A 119 -2.441 -5.799 21.014 1.00 0.00 C ATOM 1805 O GLU A 119 -2.232 -4.594 21.153 1.00 0.00 O ATOM 1806 CB GLU A 119 -2.206 -7.222 23.058 1.00 0.00 C ATOM 1807 CG GLU A 119 -2.844 -7.669 24.363 1.00 0.00 C ATOM 1808 CD GLU A 119 -2.291 -8.990 24.860 1.00 0.00 C ATOM 1809 OE1 GLU A 119 -2.399 -9.993 24.124 1.00 0.00 O ATOM 1810 OE2 GLU A 119 -1.751 -9.022 25.986 1.00 0.00 O ATOM 0 H GLU A 119 -3.704 -8.572 21.623 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.846 -5.907 22.624 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.734 -8.081 22.581 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.415 -6.504 23.277 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.684 -6.904 25.122 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.921 -7.760 24.224 1.00 0.00 H new ATOM 1817 N GLU A 120 -2.037 -6.486 19.950 1.00 0.00 N ATOM 1818 CA GLU A 120 -1.309 -5.847 18.860 1.00 0.00 C ATOM 1819 C GLU A 120 -2.189 -4.827 18.147 1.00 0.00 C ATOM 1820 O GLU A 120 -1.823 -3.658 18.018 1.00 0.00 O ATOM 1821 CB GLU A 120 -0.815 -6.898 17.864 1.00 0.00 C ATOM 1822 CG GLU A 120 0.339 -6.420 16.998 1.00 0.00 C ATOM 1823 CD GLU A 120 1.581 -6.101 17.807 1.00 0.00 C ATOM 1824 OE1 GLU A 120 2.345 -7.040 18.115 1.00 0.00 O ATOM 1825 OE2 GLU A 120 1.790 -4.913 18.132 1.00 0.00 O ATOM 0 H GLU A 120 -2.201 -7.484 19.820 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.450 -5.327 19.283 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.503 -7.787 18.412 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.643 -7.194 17.220 1.00 0.00 H new ATOM 0 HG2 GLU A 120 0.577 -7.187 16.261 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.031 -5.532 16.446 1.00 0.00 H new ATOM 1832 N VAL A 121 -3.354 -5.275 17.687 1.00 0.00 N ATOM 1833 CA VAL A 121 -4.286 -4.396 16.989 1.00 0.00 C ATOM 1834 C VAL A 121 -4.794 -3.293 17.914 1.00 0.00 C ATOM 1835 O VAL A 121 -4.928 -2.139 17.503 1.00 0.00 O ATOM 1836 CB VAL A 121 -5.486 -5.177 16.412 1.00 0.00 C ATOM 1837 CG1 VAL A 121 -5.105 -5.860 15.110 1.00 0.00 C ATOM 1838 CG2 VAL A 121 -6.006 -6.201 17.411 1.00 0.00 C ATOM 0 H VAL A 121 -3.674 -6.239 17.785 1.00 0.00 H new ATOM 0 HA VAL A 121 -3.737 -3.947 16.161 1.00 0.00 H new ATOM 0 HB VAL A 121 -6.283 -4.461 16.211 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -5.965 -6.405 14.720 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -4.791 -5.110 14.384 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.286 -6.556 15.290 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -6.851 -6.736 16.977 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -5.213 -6.909 17.652 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -6.327 -5.692 18.320 1.00 0.00 H new ATOM 1848 N ASP A 122 -5.064 -3.649 19.167 1.00 0.00 N ATOM 1849 CA ASP A 122 -5.544 -2.681 20.148 1.00 0.00 C ATOM 1850 C ASP A 122 -4.504 -1.589 20.365 1.00 0.00 C ATOM 1851 O ASP A 122 -4.834 -0.406 20.452 1.00 0.00 O ATOM 1852 CB ASP A 122 -5.858 -3.376 21.474 1.00 0.00 C ATOM 1853 CG ASP A 122 -7.242 -3.995 21.489 1.00 0.00 C ATOM 1854 OD1 ASP A 122 -7.743 -4.355 20.403 1.00 0.00 O ATOM 1855 OD2 ASP A 122 -7.824 -4.120 22.587 1.00 0.00 O ATOM 0 H ASP A 122 -4.959 -4.598 19.526 1.00 0.00 H new ATOM 0 HA ASP A 122 -6.458 -2.227 19.766 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -5.114 -4.151 21.660 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -5.777 -2.655 22.287 1.00 0.00 H new ATOM 1860 N GLU A 123 -3.243 -2.000 20.438 1.00 0.00 N ATOM 1861 CA GLU A 123 -2.141 -1.068 20.630 1.00 0.00 C ATOM 1862 C GLU A 123 -1.895 -0.269 19.357 1.00 0.00 C ATOM 1863 O GLU A 123 -1.457 0.879 19.404 1.00 0.00 O ATOM 1864 CB GLU A 123 -0.870 -1.821 21.028 1.00 0.00 C ATOM 1865 CG GLU A 123 -0.902 -2.360 22.449 1.00 0.00 C ATOM 1866 CD GLU A 123 0.191 -3.376 22.712 1.00 0.00 C ATOM 1867 OE1 GLU A 123 0.146 -4.467 22.105 1.00 0.00 O ATOM 1868 OE2 GLU A 123 1.093 -3.082 23.524 1.00 0.00 O ATOM 0 H GLU A 123 -2.959 -2.977 20.367 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.408 -0.379 21.432 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -0.718 -2.650 20.337 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -0.014 -1.155 20.920 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.799 -1.532 23.150 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.873 -2.819 22.638 1.00 0.00 H new ATOM 1875 N MET A 124 -2.188 -0.888 18.218 1.00 0.00 N ATOM 1876 CA MET A 124 -2.007 -0.241 16.927 1.00 0.00 C ATOM 1877 C MET A 124 -3.040 0.861 16.728 1.00 0.00 C ATOM 1878 O MET A 124 -2.754 1.889 16.116 1.00 0.00 O ATOM 1879 CB MET A 124 -2.115 -1.269 15.798 1.00 0.00 C ATOM 1880 CG MET A 124 -1.901 -0.677 14.415 1.00 0.00 C ATOM 1881 SD MET A 124 -2.083 -1.899 13.102 1.00 0.00 S ATOM 1882 CE MET A 124 -0.731 -3.011 13.483 1.00 0.00 C ATOM 0 H MET A 124 -2.553 -1.839 18.165 1.00 0.00 H new ATOM 0 HA MET A 124 -1.013 0.206 16.905 1.00 0.00 H new ATOM 0 HB2 MET A 124 -1.381 -2.058 15.964 1.00 0.00 H new ATOM 0 HB3 MET A 124 -3.099 -1.736 15.836 1.00 0.00 H new ATOM 0 HG2 MET A 124 -2.615 0.131 14.255 1.00 0.00 H new ATOM 0 HG3 MET A 124 -0.905 -0.238 14.362 1.00 0.00 H new ATOM 0 HE1 MET A 124 -0.506 -3.623 12.610 1.00 0.00 H new ATOM 0 HE2 MET A 124 0.151 -2.431 13.756 1.00 0.00 H new ATOM 0 HE3 MET A 124 -1.014 -3.656 14.315 1.00 0.00 H new ATOM 1892 N ILE A 125 -4.246 0.640 17.245 1.00 0.00 N ATOM 1893 CA ILE A 125 -5.314 1.616 17.119 1.00 0.00 C ATOM 1894 C ILE A 125 -5.179 2.732 18.145 1.00 0.00 C ATOM 1895 O ILE A 125 -5.158 3.910 17.792 1.00 0.00 O ATOM 1896 CB ILE A 125 -6.682 0.956 17.311 1.00 0.00 C ATOM 1897 CG1 ILE A 125 -6.994 -0.006 16.155 1.00 0.00 C ATOM 1898 CG2 ILE A 125 -7.759 2.016 17.496 1.00 0.00 C ATOM 1899 CD1 ILE A 125 -7.692 0.619 14.970 1.00 0.00 C ATOM 0 H ILE A 125 -4.503 -0.206 17.753 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.235 2.035 16.116 1.00 0.00 H new ATOM 0 HB ILE A 125 -6.662 0.354 18.220 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.060 -0.452 15.813 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -7.614 -0.817 16.536 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.726 1.532 17.631 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -7.529 2.619 18.374 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.794 2.657 16.615 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -7.868 -0.141 14.209 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -8.645 1.040 15.290 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -7.067 1.410 14.555 1.00 0.00 H new ATOM 1911 N ARG A 126 -5.103 2.359 19.417 1.00 0.00 N ATOM 1912 CA ARG A 126 -4.988 3.344 20.484 1.00 0.00 C ATOM 1913 C ARG A 126 -3.811 4.268 20.227 1.00 0.00 C ATOM 1914 O ARG A 126 -3.838 5.446 20.585 1.00 0.00 O ATOM 1915 CB ARG A 126 -4.853 2.657 21.843 1.00 0.00 C ATOM 1916 CG ARG A 126 -3.618 1.783 21.971 1.00 0.00 C ATOM 1917 CD ARG A 126 -3.771 0.762 23.089 1.00 0.00 C ATOM 1918 NE ARG A 126 -4.350 1.348 24.297 1.00 0.00 N ATOM 1919 CZ ARG A 126 -5.649 1.324 24.591 1.00 0.00 C ATOM 1920 NH1 ARG A 126 -6.519 0.751 23.767 1.00 0.00 N ATOM 1921 NH2 ARG A 126 -6.082 1.878 25.715 1.00 0.00 N ATOM 0 H ARG A 126 -5.119 1.389 19.733 1.00 0.00 H new ATOM 0 HA ARG A 126 -5.898 3.944 20.499 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -4.830 3.418 22.623 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -5.738 2.046 22.020 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -3.437 1.267 21.028 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -2.747 2.409 22.165 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.403 -0.058 22.746 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -2.796 0.336 23.325 1.00 0.00 H new ATOM 0 HE ARG A 126 -3.719 1.804 24.956 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -6.195 0.324 22.899 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -7.512 0.738 24.002 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -5.421 2.321 26.353 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -7.076 1.861 25.942 1.00 0.00 H new ATOM 1935 N GLU A 127 -2.781 3.727 19.592 1.00 0.00 N ATOM 1936 CA GLU A 127 -1.595 4.505 19.273 1.00 0.00 C ATOM 1937 C GLU A 127 -1.853 5.429 18.085 1.00 0.00 C ATOM 1938 O GLU A 127 -1.157 6.428 17.907 1.00 0.00 O ATOM 1939 CB GLU A 127 -0.409 3.580 18.983 1.00 0.00 C ATOM 1940 CG GLU A 127 -0.434 2.951 17.597 1.00 0.00 C ATOM 1941 CD GLU A 127 0.734 3.390 16.735 1.00 0.00 C ATOM 1942 OE1 GLU A 127 0.803 4.590 16.394 1.00 0.00 O ATOM 1943 OE2 GLU A 127 1.579 2.534 16.399 1.00 0.00 O ATOM 0 H GLU A 127 -2.744 2.754 19.288 1.00 0.00 H new ATOM 0 HA GLU A 127 -1.352 5.122 20.138 1.00 0.00 H new ATOM 0 HB2 GLU A 127 0.515 4.146 19.096 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -0.390 2.786 19.730 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -0.421 1.865 17.695 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.367 3.215 17.099 1.00 0.00 H new ATOM 1950 N ALA A 128 -2.855 5.094 17.269 1.00 0.00 N ATOM 1951 CA ALA A 128 -3.180 5.910 16.107 1.00 0.00 C ATOM 1952 C ALA A 128 -4.428 6.755 16.346 1.00 0.00 C ATOM 1953 O ALA A 128 -4.700 7.693 15.597 1.00 0.00 O ATOM 1954 CB ALA A 128 -3.363 5.029 14.891 1.00 0.00 C ATOM 0 H ALA A 128 -3.447 4.272 17.393 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.349 6.594 15.932 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.606 5.647 14.027 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -2.441 4.480 14.697 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.174 4.323 15.072 1.00 0.00 H new ATOM 1960 N ASP A 129 -5.188 6.424 17.389 1.00 0.00 N ATOM 1961 CA ASP A 129 -6.400 7.171 17.699 1.00 0.00 C ATOM 1962 C ASP A 129 -6.082 8.414 18.518 1.00 0.00 C ATOM 1963 O ASP A 129 -6.053 8.383 19.748 1.00 0.00 O ATOM 1964 CB ASP A 129 -7.419 6.299 18.435 1.00 0.00 C ATOM 1965 CG ASP A 129 -8.773 6.977 18.537 1.00 0.00 C ATOM 1966 OD1 ASP A 129 -8.829 8.217 18.413 1.00 0.00 O ATOM 1967 OD2 ASP A 129 -9.788 6.271 18.717 1.00 0.00 O ATOM 0 H ASP A 129 -4.987 5.652 18.025 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.840 7.483 16.752 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.527 5.348 17.914 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.049 6.074 19.435 1.00 0.00 H new ATOM 1972 N ILE A 130 -5.851 9.506 17.807 1.00 0.00 N ATOM 1973 CA ILE A 130 -5.536 10.791 18.421 1.00 0.00 C ATOM 1974 C ILE A 130 -6.699 11.309 19.252 1.00 0.00 C ATOM 1975 O ILE A 130 -6.507 12.017 20.240 1.00 0.00 O ATOM 1976 CB ILE A 130 -5.207 11.834 17.344 1.00 0.00 C ATOM 1977 CG1 ILE A 130 -6.124 11.641 16.135 1.00 0.00 C ATOM 1978 CG2 ILE A 130 -3.753 11.699 16.938 1.00 0.00 C ATOM 1979 CD1 ILE A 130 -6.540 12.922 15.447 1.00 0.00 C ATOM 0 H ILE A 130 -5.876 9.529 16.788 1.00 0.00 H new ATOM 0 HA ILE A 130 -4.674 10.634 19.069 1.00 0.00 H new ATOM 0 HB ILE A 130 -5.370 12.835 17.743 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -5.618 11.003 15.410 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -7.020 11.110 16.457 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.519 12.439 16.173 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -3.116 11.861 17.807 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.577 10.699 16.541 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -7.188 12.688 14.603 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -7.078 13.556 16.152 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.654 13.447 15.090 1.00 0.00 H new ATOM 1991 N ASP A 131 -7.906 10.960 18.833 1.00 0.00 N ATOM 1992 CA ASP A 131 -9.109 11.394 19.519 1.00 0.00 C ATOM 1993 C ASP A 131 -9.459 10.448 20.677 1.00 0.00 C ATOM 1994 O ASP A 131 -10.324 10.746 21.501 1.00 0.00 O ATOM 1995 CB ASP A 131 -10.242 11.520 18.493 1.00 0.00 C ATOM 1996 CG ASP A 131 -11.116 10.281 18.364 1.00 0.00 C ATOM 1997 OD1 ASP A 131 -10.949 9.334 19.159 1.00 0.00 O ATOM 1998 OD2 ASP A 131 -11.959 10.246 17.445 1.00 0.00 O ATOM 0 H ASP A 131 -8.076 10.374 18.016 1.00 0.00 H new ATOM 0 HA ASP A 131 -8.947 12.371 19.974 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -10.872 12.366 18.768 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -9.809 11.747 17.519 1.00 0.00 H new ATOM 2003 N GLY A 132 -8.752 9.319 20.737 1.00 0.00 N ATOM 2004 CA GLY A 132 -8.954 8.340 21.796 1.00 0.00 C ATOM 2005 C GLY A 132 -10.401 7.932 22.019 1.00 0.00 C ATOM 2006 O GLY A 132 -10.899 8.004 23.143 1.00 0.00 O ATOM 0 H GLY A 132 -8.033 9.063 20.060 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -8.372 7.449 21.563 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -8.558 8.746 22.727 1.00 0.00 H new ATOM 2010 N ASP A 133 -11.074 7.480 20.966 1.00 0.00 N ATOM 2011 CA ASP A 133 -12.462 7.036 21.089 1.00 0.00 C ATOM 2012 C ASP A 133 -12.592 5.531 20.830 1.00 0.00 C ATOM 2013 O ASP A 133 -13.672 4.961 20.981 1.00 0.00 O ATOM 2014 CB ASP A 133 -13.368 7.815 20.132 1.00 0.00 C ATOM 2015 CG ASP A 133 -13.101 7.489 18.678 1.00 0.00 C ATOM 2016 OD1 ASP A 133 -12.557 6.401 18.401 1.00 0.00 O ATOM 2017 OD2 ASP A 133 -13.417 8.329 17.812 1.00 0.00 O ATOM 0 H ASP A 133 -10.687 7.411 20.025 1.00 0.00 H new ATOM 0 HA ASP A 133 -12.780 7.234 22.113 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.410 7.594 20.364 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -13.225 8.884 20.292 1.00 0.00 H new ATOM 2022 N GLY A 134 -11.488 4.892 20.435 1.00 0.00 N ATOM 2023 CA GLY A 134 -11.514 3.464 20.161 1.00 0.00 C ATOM 2024 C GLY A 134 -11.524 3.139 18.673 1.00 0.00 C ATOM 2025 O GLY A 134 -11.662 1.977 18.291 1.00 0.00 O ATOM 0 H GLY A 134 -10.580 5.338 20.301 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -10.645 2.996 20.623 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -12.397 3.027 20.628 1.00 0.00 H new ATOM 2029 N GLN A 135 -11.374 4.161 17.832 1.00 0.00 N ATOM 2030 CA GLN A 135 -11.363 3.970 16.380 1.00 0.00 C ATOM 2031 C GLN A 135 -10.405 4.953 15.718 1.00 0.00 C ATOM 2032 O GLN A 135 -9.686 5.680 16.394 1.00 0.00 O ATOM 2033 CB GLN A 135 -12.765 4.118 15.770 1.00 0.00 C ATOM 2034 CG GLN A 135 -13.808 4.713 16.705 1.00 0.00 C ATOM 2035 CD GLN A 135 -15.219 4.291 16.345 1.00 0.00 C ATOM 2036 OE1 GLN A 135 -16.077 5.266 16.068 1.00 0.00 O flip ATOM 2037 NE2 GLN A 135 -15.535 3.101 16.316 1.00 0.00 N flip ATOM 0 H GLN A 135 -11.258 5.130 18.129 1.00 0.00 H new ATOM 0 HA GLN A 135 -11.022 2.952 16.193 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.695 4.745 14.881 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -13.109 3.137 15.442 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -13.591 4.407 17.728 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.739 5.800 16.676 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -14.843 2.384 16.536 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -16.488 2.832 16.072 1.00 0.00 H new ATOM 2046 N VAL A 136 -10.378 4.957 14.392 1.00 0.00 N ATOM 2047 CA VAL A 136 -9.492 5.849 13.661 1.00 0.00 C ATOM 2048 C VAL A 136 -10.252 6.636 12.595 1.00 0.00 C ATOM 2049 O VAL A 136 -10.901 6.058 11.724 1.00 0.00 O ATOM 2050 CB VAL A 136 -8.340 5.057 13.016 1.00 0.00 C ATOM 2051 CG1 VAL A 136 -7.544 5.919 12.044 1.00 0.00 C ATOM 2052 CG2 VAL A 136 -7.440 4.485 14.099 1.00 0.00 C ATOM 0 H VAL A 136 -10.956 4.356 13.805 1.00 0.00 H new ATOM 0 HA VAL A 136 -9.076 6.560 14.374 1.00 0.00 H new ATOM 0 HB VAL A 136 -8.767 4.236 12.440 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.739 5.327 11.608 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -8.202 6.276 11.252 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.121 6.771 12.576 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.626 3.925 13.638 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -7.028 5.298 14.697 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -8.019 3.821 14.740 1.00 0.00 H new ATOM 2062 N ASN A 137 -10.159 7.961 12.674 1.00 0.00 N ATOM 2063 CA ASN A 137 -10.832 8.834 11.720 1.00 0.00 C ATOM 2064 C ASN A 137 -9.844 9.372 10.683 1.00 0.00 C ATOM 2065 O ASN A 137 -8.742 8.850 10.541 1.00 0.00 O ATOM 2066 CB ASN A 137 -11.512 9.995 12.450 1.00 0.00 C ATOM 2067 CG ASN A 137 -12.939 10.214 11.987 1.00 0.00 C ATOM 2068 OD1 ASN A 137 -13.678 9.260 11.745 1.00 0.00 O ATOM 2069 ND2 ASN A 137 -13.334 11.476 11.861 1.00 0.00 N ATOM 0 H ASN A 137 -9.624 8.452 13.390 1.00 0.00 H new ATOM 0 HA ASN A 137 -11.591 8.249 11.201 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -11.507 9.799 13.522 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -10.937 10.907 12.290 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -14.284 11.685 11.553 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -12.688 12.236 12.073 1.00 0.00 H new ATOM 2076 N TYR A 138 -10.250 10.411 9.955 1.00 0.00 N ATOM 2077 CA TYR A 138 -9.407 11.007 8.919 1.00 0.00 C ATOM 2078 C TYR A 138 -8.125 11.608 9.478 1.00 0.00 C ATOM 2079 O TYR A 138 -7.047 11.044 9.307 1.00 0.00 O ATOM 2080 CB TYR A 138 -10.197 12.063 8.161 1.00 0.00 C ATOM 2081 CG TYR A 138 -9.482 12.601 6.942 1.00 0.00 C ATOM 2082 CD1 TYR A 138 -8.810 11.748 6.075 1.00 0.00 C ATOM 2083 CD2 TYR A 138 -9.480 13.961 6.657 1.00 0.00 C ATOM 2084 CE1 TYR A 138 -8.156 12.235 4.960 1.00 0.00 C ATOM 2085 CE2 TYR A 138 -8.828 14.455 5.543 1.00 0.00 C ATOM 2086 CZ TYR A 138 -8.168 13.588 4.698 1.00 0.00 C ATOM 2087 OH TYR A 138 -7.518 14.076 3.588 1.00 0.00 O ATOM 0 H TYR A 138 -11.160 10.859 10.064 1.00 0.00 H new ATOM 0 HA TYR A 138 -9.109 10.207 8.241 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -11.152 11.637 7.852 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -10.420 12.890 8.835 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -8.799 10.687 6.276 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -9.996 14.643 7.317 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -7.638 11.559 4.297 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.835 15.515 5.335 1.00 0.00 H new ATOM 0 HH TYR A 138 -7.217 14.992 3.762 1.00 0.00 H new ATOM 2097 N GLU A 139 -8.237 12.751 10.144 1.00 0.00 N ATOM 2098 CA GLU A 139 -7.068 13.415 10.710 1.00 0.00 C ATOM 2099 C GLU A 139 -6.240 12.429 11.514 1.00 0.00 C ATOM 2100 O GLU A 139 -5.016 12.385 11.407 1.00 0.00 O ATOM 2101 CB GLU A 139 -7.511 14.574 11.589 1.00 0.00 C ATOM 2102 CG GLU A 139 -6.811 15.886 11.271 1.00 0.00 C ATOM 2103 CD GLU A 139 -6.559 16.726 12.508 1.00 0.00 C ATOM 2104 OE1 GLU A 139 -7.474 16.829 13.352 1.00 0.00 O ATOM 2105 OE2 GLU A 139 -5.447 17.281 12.631 1.00 0.00 O ATOM 0 H GLU A 139 -9.120 13.236 10.305 1.00 0.00 H new ATOM 0 HA GLU A 139 -6.451 13.801 9.899 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.587 14.711 11.479 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -7.327 14.318 12.632 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.861 15.677 10.778 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -7.417 16.456 10.566 1.00 0.00 H new ATOM 2112 N GLU A 140 -6.920 11.630 12.310 1.00 0.00 N ATOM 2113 CA GLU A 140 -6.251 10.628 13.119 1.00 0.00 C ATOM 2114 C GLU A 140 -5.411 9.691 12.248 1.00 0.00 C ATOM 2115 O GLU A 140 -4.340 9.246 12.660 1.00 0.00 O ATOM 2116 CB GLU A 140 -7.264 9.794 13.914 1.00 0.00 C ATOM 2117 CG GLU A 140 -8.549 10.528 14.266 1.00 0.00 C ATOM 2118 CD GLU A 140 -9.320 9.845 15.371 1.00 0.00 C ATOM 2119 OE1 GLU A 140 -8.704 9.071 16.131 1.00 0.00 O ATOM 2120 OE2 GLU A 140 -10.540 10.088 15.477 1.00 0.00 O ATOM 0 H GLU A 140 -7.934 11.653 12.415 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.599 11.159 13.812 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -7.515 8.904 13.337 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -6.791 9.453 14.835 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -8.310 11.547 14.570 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -9.178 10.599 13.379 1.00 0.00 H new ATOM 2127 N PHE A 141 -5.906 9.382 11.047 1.00 0.00 N ATOM 2128 CA PHE A 141 -5.201 8.487 10.141 1.00 0.00 C ATOM 2129 C PHE A 141 -4.075 9.204 9.414 1.00 0.00 C ATOM 2130 O PHE A 141 -2.948 8.714 9.355 1.00 0.00 O ATOM 2131 CB PHE A 141 -6.192 7.880 9.147 1.00 0.00 C ATOM 2132 CG PHE A 141 -5.978 6.413 8.857 1.00 0.00 C ATOM 2133 CD1 PHE A 141 -5.548 5.538 9.847 1.00 0.00 C ATOM 2134 CD2 PHE A 141 -6.211 5.906 7.585 1.00 0.00 C ATOM 2135 CE1 PHE A 141 -5.356 4.201 9.574 1.00 0.00 C ATOM 2136 CE2 PHE A 141 -6.019 4.566 7.310 1.00 0.00 C ATOM 2137 CZ PHE A 141 -5.590 3.713 8.306 1.00 0.00 C ATOM 0 H PHE A 141 -6.790 9.740 10.685 1.00 0.00 H new ATOM 0 HA PHE A 141 -4.747 7.688 10.727 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.202 8.016 9.533 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.131 8.434 8.210 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -5.362 5.911 10.843 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -6.547 6.568 6.801 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -5.022 3.534 10.355 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -6.205 4.186 6.316 1.00 0.00 H new ATOM 0 HZ PHE A 141 -5.438 2.665 8.093 1.00 0.00 H new ATOM 2147 N VAL A 142 -4.385 10.364 8.856 1.00 0.00 N ATOM 2148 CA VAL A 142 -3.405 11.143 8.131 1.00 0.00 C ATOM 2149 C VAL A 142 -2.213 11.472 9.033 1.00 0.00 C ATOM 2150 O VAL A 142 -1.060 11.405 8.609 1.00 0.00 O ATOM 2151 CB VAL A 142 -4.049 12.435 7.584 1.00 0.00 C ATOM 2152 CG1 VAL A 142 -5.411 12.146 6.966 1.00 0.00 C ATOM 2153 CG2 VAL A 142 -4.225 13.438 8.684 1.00 0.00 C ATOM 0 H VAL A 142 -5.313 10.785 8.894 1.00 0.00 H new ATOM 0 HA VAL A 142 -3.043 10.555 7.288 1.00 0.00 H new ATOM 0 HB VAL A 142 -3.383 12.835 6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -5.843 13.073 6.588 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.295 11.438 6.145 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -6.071 11.720 7.722 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.680 14.343 8.282 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -4.870 13.020 9.457 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -3.253 13.681 9.114 1.00 0.00 H new ATOM 2163 N GLN A 143 -2.509 11.816 10.286 1.00 0.00 N ATOM 2164 CA GLN A 143 -1.478 12.144 11.263 1.00 0.00 C ATOM 2165 C GLN A 143 -0.698 10.902 11.696 1.00 0.00 C ATOM 2166 O GLN A 143 0.503 10.973 11.950 1.00 0.00 O ATOM 2167 CB GLN A 143 -2.093 12.853 12.478 1.00 0.00 C ATOM 2168 CG GLN A 143 -2.714 11.918 13.507 1.00 0.00 C ATOM 2169 CD GLN A 143 -1.762 11.587 14.640 1.00 0.00 C ATOM 2170 OE1 GLN A 143 -1.065 12.461 15.156 1.00 0.00 O ATOM 2171 NE2 GLN A 143 -1.728 10.320 15.034 1.00 0.00 N ATOM 0 H GLN A 143 -3.461 11.874 10.647 1.00 0.00 H new ATOM 0 HA GLN A 143 -0.772 12.824 10.785 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -1.320 13.447 12.965 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -2.857 13.548 12.129 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -3.614 12.378 13.915 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -3.023 10.996 13.015 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -2.323 9.628 14.578 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -1.107 10.038 15.792 1.00 0.00 H new ATOM 2180 N MET A 144 -1.386 9.763 11.784 1.00 0.00 N ATOM 2181 CA MET A 144 -0.747 8.517 12.192 1.00 0.00 C ATOM 2182 C MET A 144 -0.021 7.854 11.020 1.00 0.00 C ATOM 2183 O MET A 144 0.476 6.735 11.142 1.00 0.00 O ATOM 2184 CB MET A 144 -1.786 7.560 12.793 1.00 0.00 C ATOM 2185 CG MET A 144 -2.548 6.736 11.765 1.00 0.00 C ATOM 2186 SD MET A 144 -2.015 5.015 11.720 1.00 0.00 S ATOM 2187 CE MET A 144 -2.010 4.706 9.957 1.00 0.00 C ATOM 0 H MET A 144 -2.382 9.680 11.579 1.00 0.00 H new ATOM 0 HA MET A 144 -0.003 8.752 12.953 1.00 0.00 H new ATOM 0 HB2 MET A 144 -1.283 6.883 13.483 1.00 0.00 H new ATOM 0 HB3 MET A 144 -2.500 8.139 13.379 1.00 0.00 H new ATOM 0 HG2 MET A 144 -3.614 6.776 11.991 1.00 0.00 H new ATOM 0 HG3 MET A 144 -2.414 7.180 10.778 1.00 0.00 H new ATOM 0 HE1 MET A 144 -2.690 3.885 9.730 1.00 0.00 H new ATOM 0 HE2 MET A 144 -2.335 5.603 9.429 1.00 0.00 H new ATOM 0 HE3 MET A 144 -1.002 4.442 9.637 1.00 0.00 H new ATOM 2197 N MET A 145 0.033 8.548 9.884 1.00 0.00 N ATOM 2198 CA MET A 145 0.693 8.020 8.699 1.00 0.00 C ATOM 2199 C MET A 145 1.904 8.866 8.316 1.00 0.00 C ATOM 2200 O MET A 145 2.885 8.349 7.781 1.00 0.00 O ATOM 2201 CB MET A 145 -0.295 7.960 7.532 1.00 0.00 C ATOM 2202 CG MET A 145 -0.764 6.551 7.208 1.00 0.00 C ATOM 2203 SD MET A 145 -2.435 6.514 6.530 1.00 0.00 S ATOM 2204 CE MET A 145 -3.029 4.947 7.165 1.00 0.00 C ATOM 0 H MET A 145 -0.373 9.476 9.763 1.00 0.00 H new ATOM 0 HA MET A 145 1.043 7.013 8.928 1.00 0.00 H new ATOM 0 HB2 MET A 145 -1.162 8.578 7.767 1.00 0.00 H new ATOM 0 HB3 MET A 145 0.173 8.391 6.647 1.00 0.00 H new ATOM 0 HG2 MET A 145 -0.076 6.098 6.494 1.00 0.00 H new ATOM 0 HG3 MET A 145 -0.729 5.944 8.112 1.00 0.00 H new ATOM 0 HE1 MET A 145 -3.659 4.467 6.417 1.00 0.00 H new ATOM 0 HE2 MET A 145 -2.181 4.302 7.393 1.00 0.00 H new ATOM 0 HE3 MET A 145 -3.609 5.118 8.072 1.00 0.00 H new ATOM 2214 N THR A 146 1.834 10.168 8.584 1.00 0.00 N ATOM 2215 CA THR A 146 2.937 11.067 8.253 1.00 0.00 C ATOM 2216 C THR A 146 3.142 12.127 9.332 1.00 0.00 C ATOM 2217 O THR A 146 4.264 12.351 9.785 1.00 0.00 O ATOM 2218 CB THR A 146 2.688 11.738 6.901 1.00 0.00 C ATOM 2219 OG1 THR A 146 3.807 12.516 6.514 1.00 0.00 O ATOM 2220 CG2 THR A 146 1.475 12.644 6.893 1.00 0.00 C ATOM 0 H THR A 146 1.033 10.621 9.025 1.00 0.00 H new ATOM 0 HA THR A 146 3.845 10.467 8.195 1.00 0.00 H new ATOM 0 HB THR A 146 2.513 10.920 6.202 1.00 0.00 H new ATOM 0 HG1 THR A 146 4.370 11.998 5.902 1.00 0.00 H new ATOM 0 HG21 THR A 146 1.358 13.087 5.904 1.00 0.00 H new ATOM 0 HG22 THR A 146 0.586 12.064 7.138 1.00 0.00 H new ATOM 0 HG23 THR A 146 1.607 13.435 7.631 1.00 0.00 H new ATOM 2228 N ALA A 147 2.059 12.781 9.738 1.00 0.00 N ATOM 2229 CA ALA A 147 2.137 13.819 10.759 1.00 0.00 C ATOM 2230 C ALA A 147 2.019 13.232 12.161 1.00 0.00 C ATOM 2231 O ALA A 147 0.955 13.280 12.778 1.00 0.00 O ATOM 2232 CB ALA A 147 1.066 14.868 10.530 1.00 0.00 C ATOM 0 H ALA A 147 1.120 12.612 9.377 1.00 0.00 H new ATOM 0 HA ALA A 147 3.115 14.293 10.679 1.00 0.00 H new ATOM 0 HB1 ALA A 147 1.138 15.636 11.301 1.00 0.00 H new ATOM 0 HB2 ALA A 147 1.207 15.324 9.550 1.00 0.00 H new ATOM 0 HB3 ALA A 147 0.083 14.400 10.575 1.00 0.00 H new ATOM 2238 N LYS A 148 3.122 12.680 12.658 1.00 0.00 N ATOM 2239 CA LYS A 148 3.149 12.084 13.990 1.00 0.00 C ATOM 2240 C LYS A 148 2.188 10.903 14.080 1.00 0.00 C ATOM 2241 O LYS A 148 1.003 11.129 14.400 1.00 0.00 O ATOM 2242 CB LYS A 148 2.791 13.130 15.048 1.00 0.00 C ATOM 2243 CG LYS A 148 3.994 13.880 15.594 1.00 0.00 C ATOM 2244 CD LYS A 148 3.644 15.317 15.944 1.00 0.00 C ATOM 2245 CE LYS A 148 3.203 15.445 17.393 1.00 0.00 C ATOM 2246 NZ LYS A 148 3.256 16.856 17.867 1.00 0.00 N ATOM 0 H LYS A 148 4.010 12.633 12.158 1.00 0.00 H new ATOM 0 HA LYS A 148 4.160 11.720 14.176 1.00 0.00 H new ATOM 0 HB2 LYS A 148 2.092 13.846 14.616 1.00 0.00 H new ATOM 0 HB3 LYS A 148 2.275 12.638 15.873 1.00 0.00 H new ATOM 0 HG2 LYS A 148 4.370 13.370 16.481 1.00 0.00 H new ATOM 0 HG3 LYS A 148 4.796 13.869 14.856 1.00 0.00 H new ATOM 0 HD2 LYS A 148 4.509 15.957 15.768 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.848 15.669 15.288 1.00 0.00 H new ATOM 0 HE2 LYS A 148 2.187 15.065 17.498 1.00 0.00 H new ATOM 0 HE3 LYS A 148 3.842 14.826 18.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 2.948 16.901 18.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 4.230 17.211 17.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 2.627 17.442 17.282 1.00 0.00 H new TER 2260 LYS A 148 ATOM 2261 N THR B 60 -3.111 7.315 -8.262 1.00 0.00 N ATOM 2262 CA THR B 60 -3.131 8.113 -9.515 1.00 0.00 C ATOM 2263 C THR B 60 -2.053 9.194 -9.499 1.00 0.00 C ATOM 2264 O THR B 60 -2.308 10.331 -9.102 1.00 0.00 O ATOM 2265 CB THR B 60 -4.514 8.750 -9.665 1.00 0.00 C ATOM 2266 OG1 THR B 60 -5.533 7.804 -9.396 1.00 0.00 O ATOM 2267 CG2 THR B 60 -4.766 9.316 -11.046 1.00 0.00 C ATOM 0 HA THR B 60 -2.925 7.456 -10.360 1.00 0.00 H new ATOM 0 HB THR B 60 -4.535 9.569 -8.946 1.00 0.00 H new ATOM 0 HG1 THR B 60 -5.202 7.140 -8.756 1.00 0.00 H new ATOM 0 HG21 THR B 60 -5.764 9.752 -11.084 1.00 0.00 H new ATOM 0 HG22 THR B 60 -4.025 10.085 -11.265 1.00 0.00 H new ATOM 0 HG23 THR B 60 -4.690 8.519 -11.785 1.00 0.00 H new ATOM 2274 N PRO B 61 -0.828 8.851 -9.933 1.00 0.00 N ATOM 2275 CA PRO B 61 0.291 9.798 -9.966 1.00 0.00 C ATOM 2276 C PRO B 61 0.110 10.870 -11.035 1.00 0.00 C ATOM 2277 O PRO B 61 -0.930 10.940 -11.688 1.00 0.00 O ATOM 2278 CB PRO B 61 1.496 8.914 -10.294 1.00 0.00 C ATOM 2279 CG PRO B 61 0.923 7.747 -11.021 1.00 0.00 C ATOM 2280 CD PRO B 61 -0.438 7.516 -10.424 1.00 0.00 C ATOM 0 HA PRO B 61 0.390 10.345 -9.028 1.00 0.00 H new ATOM 0 HB2 PRO B 61 2.222 9.446 -10.909 1.00 0.00 H new ATOM 0 HB3 PRO B 61 2.015 8.600 -9.388 1.00 0.00 H new ATOM 0 HG2 PRO B 61 0.851 7.950 -12.090 1.00 0.00 H new ATOM 0 HG3 PRO B 61 1.555 6.866 -10.905 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -1.143 7.139 -11.165 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -0.403 6.785 -9.616 1.00 0.00 H new ATOM 2288 N ARG B 62 1.131 11.704 -11.208 1.00 0.00 N ATOM 2289 CA ARG B 62 1.085 12.773 -12.198 1.00 0.00 C ATOM 2290 C ARG B 62 1.767 12.345 -13.493 1.00 0.00 C ATOM 2291 O ARG B 62 1.386 12.779 -14.580 1.00 0.00 O ATOM 2292 CB ARG B 62 1.753 14.035 -11.649 1.00 0.00 C ATOM 2293 CG ARG B 62 0.866 14.833 -10.708 1.00 0.00 C ATOM 2294 CD ARG B 62 1.507 16.158 -10.328 1.00 0.00 C ATOM 2295 NE ARG B 62 1.868 16.949 -11.502 1.00 0.00 N ATOM 2296 CZ ARG B 62 2.734 17.959 -11.478 1.00 0.00 C ATOM 2297 NH1 ARG B 62 3.329 18.305 -10.343 1.00 0.00 N ATOM 2298 NH2 ARG B 62 3.005 18.626 -12.592 1.00 0.00 N ATOM 0 H ARG B 62 2.000 11.660 -10.675 1.00 0.00 H new ATOM 0 HA ARG B 62 0.039 12.989 -12.414 1.00 0.00 H new ATOM 0 HB2 ARG B 62 2.665 13.754 -11.123 1.00 0.00 H new ATOM 0 HB3 ARG B 62 2.049 14.671 -12.483 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -0.098 15.017 -11.183 1.00 0.00 H new ATOM 0 HG3 ARG B 62 0.672 14.250 -9.808 1.00 0.00 H new ATOM 0 HD2 ARG B 62 0.818 16.728 -9.705 1.00 0.00 H new ATOM 0 HD3 ARG B 62 2.398 15.971 -9.729 1.00 0.00 H new ATOM 0 HE ARG B 62 1.430 16.713 -12.393 1.00 0.00 H new ATOM 0 HH11 ARG B 62 3.123 17.796 -9.483 1.00 0.00 H new ATOM 0 HH12 ARG B 62 3.992 19.080 -10.330 1.00 0.00 H new ATOM 0 HH21 ARG B 62 2.550 18.365 -13.466 1.00 0.00 H new ATOM 0 HH22 ARG B 62 3.669 19.400 -12.574 1.00 0.00 H new ATOM 2312 N ARG B 63 2.778 11.491 -13.369 1.00 0.00 N ATOM 2313 CA ARG B 63 3.514 11.004 -14.530 1.00 0.00 C ATOM 2314 C ARG B 63 4.161 9.654 -14.236 1.00 0.00 C ATOM 2315 O ARG B 63 5.289 9.390 -14.654 1.00 0.00 O ATOM 2316 CB ARG B 63 4.583 12.017 -14.944 1.00 0.00 C ATOM 2317 CG ARG B 63 4.068 13.093 -15.886 1.00 0.00 C ATOM 2318 CD ARG B 63 3.503 12.492 -17.162 1.00 0.00 C ATOM 2319 NE ARG B 63 3.696 13.370 -18.314 1.00 0.00 N ATOM 2320 CZ ARG B 63 3.273 13.085 -19.543 1.00 0.00 C ATOM 2321 NH1 ARG B 63 2.633 11.947 -19.785 1.00 0.00 N ATOM 2322 NH2 ARG B 63 3.489 13.940 -20.534 1.00 0.00 N ATOM 0 H ARG B 63 3.106 11.122 -12.476 1.00 0.00 H new ATOM 0 HA ARG B 63 2.808 10.877 -15.350 1.00 0.00 H new ATOM 0 HB2 ARG B 63 4.988 12.492 -14.050 1.00 0.00 H new ATOM 0 HB3 ARG B 63 5.406 11.488 -15.425 1.00 0.00 H new ATOM 0 HG2 ARG B 63 3.296 13.678 -15.385 1.00 0.00 H new ATOM 0 HG3 ARG B 63 4.878 13.779 -16.133 1.00 0.00 H new ATOM 0 HD2 ARG B 63 3.983 11.532 -17.354 1.00 0.00 H new ATOM 0 HD3 ARG B 63 2.439 12.296 -17.030 1.00 0.00 H new ATOM 0 HE ARG B 63 4.184 14.254 -18.167 1.00 0.00 H new ATOM 0 HH11 ARG B 63 2.463 11.286 -19.027 1.00 0.00 H new ATOM 0 HH12 ARG B 63 2.311 11.734 -20.729 1.00 0.00 H new ATOM 0 HH21 ARG B 63 3.979 14.816 -20.354 1.00 0.00 H new ATOM 0 HH22 ARG B 63 3.165 13.721 -21.476 1.00 0.00 H new ATOM 2336 N GLY B 64 3.440 8.802 -13.515 1.00 0.00 N ATOM 2337 CA GLY B 64 3.959 7.489 -13.178 1.00 0.00 C ATOM 2338 C GLY B 64 3.047 6.370 -13.639 1.00 0.00 C ATOM 2339 O GLY B 64 2.546 6.391 -14.763 1.00 0.00 O ATOM 0 H GLY B 64 2.505 8.997 -13.158 1.00 0.00 H new ATOM 0 HA2 GLY B 64 4.942 7.363 -13.632 1.00 0.00 H new ATOM 0 HA3 GLY B 64 4.095 7.421 -12.099 1.00 0.00 H new ATOM 2343 N ARG B 65 2.832 5.388 -12.768 1.00 0.00 N ATOM 2344 CA ARG B 65 1.974 4.254 -13.092 1.00 0.00 C ATOM 2345 C ARG B 65 0.702 4.280 -12.251 1.00 0.00 C ATOM 2346 O ARG B 65 0.759 4.306 -11.022 1.00 0.00 O ATOM 2347 CB ARG B 65 2.720 2.936 -12.867 1.00 0.00 C ATOM 2348 CG ARG B 65 3.643 2.542 -14.010 1.00 0.00 C ATOM 2349 CD ARG B 65 4.883 3.421 -14.061 1.00 0.00 C ATOM 2350 NE ARG B 65 5.887 3.010 -13.082 1.00 0.00 N ATOM 2351 CZ ARG B 65 6.886 3.790 -12.674 1.00 0.00 C ATOM 2352 NH1 ARG B 65 7.016 5.021 -13.154 1.00 0.00 N ATOM 2353 NH2 ARG B 65 7.759 3.337 -11.785 1.00 0.00 N ATOM 0 H ARG B 65 3.240 5.355 -11.834 1.00 0.00 H new ATOM 0 HA ARG B 65 1.698 4.330 -14.144 1.00 0.00 H new ATOM 0 HB2 ARG B 65 3.306 3.014 -11.951 1.00 0.00 H new ATOM 0 HB3 ARG B 65 1.991 2.140 -12.712 1.00 0.00 H new ATOM 0 HG2 ARG B 65 3.940 1.500 -13.895 1.00 0.00 H new ATOM 0 HG3 ARG B 65 3.105 2.617 -14.955 1.00 0.00 H new ATOM 0 HD2 ARG B 65 5.315 3.381 -15.061 1.00 0.00 H new ATOM 0 HD3 ARG B 65 4.600 4.457 -13.877 1.00 0.00 H new ATOM 0 HE ARG B 65 5.819 2.071 -12.688 1.00 0.00 H new ATOM 0 HH11 ARG B 65 6.348 5.374 -13.839 1.00 0.00 H new ATOM 0 HH12 ARG B 65 7.784 5.613 -12.837 1.00 0.00 H new ATOM 0 HH21 ARG B 65 7.665 2.391 -11.414 1.00 0.00 H new ATOM 0 HH22 ARG B 65 8.525 3.934 -11.472 1.00 0.00 H new ATOM 2367 N GLY B 66 -0.446 4.277 -12.921 1.00 0.00 N ATOM 2368 CA GLY B 66 -1.718 4.305 -12.219 1.00 0.00 C ATOM 2369 C GLY B 66 -1.868 3.168 -11.226 1.00 0.00 C ATOM 2370 O GLY B 66 -1.897 3.392 -10.016 1.00 0.00 O ATOM 0 H GLY B 66 -0.519 4.256 -13.938 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -1.817 5.255 -11.694 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -2.529 4.256 -12.945 1.00 0.00 H new ATOM 2374 N GLY B 67 -1.969 1.945 -11.737 1.00 0.00 N ATOM 2375 CA GLY B 67 -2.121 0.788 -10.872 1.00 0.00 C ATOM 2376 C GLY B 67 -0.919 0.570 -9.974 1.00 0.00 C ATOM 2377 O GLY B 67 -1.060 0.390 -8.765 1.00 0.00 O ATOM 0 H GLY B 67 -1.948 1.734 -12.735 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -3.012 0.914 -10.257 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -2.279 -0.100 -11.484 1.00 0.00 H new ATOM 2381 N PHE B 68 0.268 0.587 -10.570 1.00 0.00 N ATOM 2382 CA PHE B 68 1.507 0.393 -9.825 1.00 0.00 C ATOM 2383 C PHE B 68 1.636 1.417 -8.703 1.00 0.00 C ATOM 2384 O PHE B 68 1.601 1.062 -7.529 1.00 0.00 O ATOM 2385 CB PHE B 68 2.702 0.496 -10.774 1.00 0.00 C ATOM 2386 CG PHE B 68 3.572 -0.728 -10.808 1.00 0.00 C ATOM 2387 CD1 PHE B 68 3.049 -1.968 -11.144 1.00 0.00 C ATOM 2388 CD2 PHE B 68 4.922 -0.631 -10.520 1.00 0.00 C ATOM 2389 CE1 PHE B 68 3.860 -3.087 -11.189 1.00 0.00 C ATOM 2390 CE2 PHE B 68 5.735 -1.745 -10.565 1.00 0.00 C ATOM 2391 CZ PHE B 68 5.204 -2.973 -10.899 1.00 0.00 C ATOM 0 H PHE B 68 0.399 0.734 -11.571 1.00 0.00 H new ATOM 0 HA PHE B 68 1.488 -0.600 -9.375 1.00 0.00 H new ATOM 0 HB2 PHE B 68 2.335 0.695 -11.781 1.00 0.00 H new ATOM 0 HB3 PHE B 68 3.310 1.352 -10.482 1.00 0.00 H new ATOM 0 HD1 PHE B 68 1.998 -2.060 -11.373 1.00 0.00 H new ATOM 0 HD2 PHE B 68 5.344 0.328 -10.257 1.00 0.00 H new ATOM 0 HE1 PHE B 68 3.442 -4.048 -11.451 1.00 0.00 H new ATOM 0 HE2 PHE B 68 6.787 -1.655 -10.339 1.00 0.00 H new ATOM 0 HZ PHE B 68 5.840 -3.845 -10.934 1.00 0.00 H new ATOM 2401 N GLN B 69 1.780 2.690 -9.059 1.00 0.00 N ATOM 2402 CA GLN B 69 1.917 3.738 -8.052 1.00 0.00 C ATOM 2403 C GLN B 69 0.793 3.645 -7.029 1.00 0.00 C ATOM 2404 O GLN B 69 1.008 3.862 -5.837 1.00 0.00 O ATOM 2405 CB GLN B 69 1.915 5.123 -8.696 1.00 0.00 C ATOM 2406 CG GLN B 69 2.465 6.210 -7.787 1.00 0.00 C ATOM 2407 CD GLN B 69 1.372 6.964 -7.052 1.00 0.00 C ATOM 2408 OE1 GLN B 69 0.910 8.010 -7.507 1.00 0.00 O ATOM 2409 NE2 GLN B 69 0.953 6.435 -5.907 1.00 0.00 N ATOM 0 H GLN B 69 1.805 3.019 -10.024 1.00 0.00 H new ATOM 0 HA GLN B 69 2.872 3.591 -7.548 1.00 0.00 H new ATOM 0 HB2 GLN B 69 2.506 5.091 -9.611 1.00 0.00 H new ATOM 0 HB3 GLN B 69 0.896 5.381 -8.983 1.00 0.00 H new ATOM 0 HG2 GLN B 69 3.144 5.762 -7.061 1.00 0.00 H new ATOM 0 HG3 GLN B 69 3.050 6.913 -8.380 1.00 0.00 H new ATOM 0 HE21 GLN B 69 1.364 5.566 -5.566 1.00 0.00 H new ATOM 0 HE22 GLN B 69 0.221 6.898 -5.369 1.00 0.00 H new ATOM 2418 N ARG B 70 -0.403 3.292 -7.490 1.00 0.00 N ATOM 2419 CA ARG B 70 -1.534 3.144 -6.586 1.00 0.00 C ATOM 2420 C ARG B 70 -1.168 2.146 -5.496 1.00 0.00 C ATOM 2421 O ARG B 70 -1.311 2.421 -4.306 1.00 0.00 O ATOM 2422 CB ARG B 70 -2.777 2.674 -7.344 1.00 0.00 C ATOM 2423 CG ARG B 70 -3.990 2.464 -6.452 1.00 0.00 C ATOM 2424 CD ARG B 70 -4.343 3.728 -5.685 1.00 0.00 C ATOM 2425 NE ARG B 70 -5.787 3.895 -5.539 1.00 0.00 N ATOM 2426 CZ ARG B 70 -6.582 4.350 -6.505 1.00 0.00 C ATOM 2427 NH1 ARG B 70 -6.078 4.684 -7.687 1.00 0.00 N ATOM 2428 NH2 ARG B 70 -7.885 4.471 -6.289 1.00 0.00 N ATOM 0 H ARG B 70 -0.611 3.106 -8.471 1.00 0.00 H new ATOM 0 HA ARG B 70 -1.764 4.110 -6.136 1.00 0.00 H new ATOM 0 HB2 ARG B 70 -3.023 3.408 -8.112 1.00 0.00 H new ATOM 0 HB3 ARG B 70 -2.548 1.740 -7.857 1.00 0.00 H new ATOM 0 HG2 ARG B 70 -4.841 2.156 -7.060 1.00 0.00 H new ATOM 0 HG3 ARG B 70 -3.791 1.655 -5.750 1.00 0.00 H new ATOM 0 HD2 ARG B 70 -3.880 3.694 -4.699 1.00 0.00 H new ATOM 0 HD3 ARG B 70 -3.929 4.593 -6.202 1.00 0.00 H new ATOM 0 HE ARG B 70 -6.211 3.649 -4.645 1.00 0.00 H new ATOM 0 HH11 ARG B 70 -5.077 4.593 -7.859 1.00 0.00 H new ATOM 0 HH12 ARG B 70 -6.692 5.032 -8.423 1.00 0.00 H new ATOM 0 HH21 ARG B 70 -8.278 4.215 -5.383 1.00 0.00 H new ATOM 0 HH22 ARG B 70 -8.494 4.820 -7.029 1.00 0.00 H new ATOM 2442 N ILE B 71 -0.663 0.992 -5.924 1.00 0.00 N ATOM 2443 CA ILE B 71 -0.239 -0.047 -5.014 1.00 0.00 C ATOM 2444 C ILE B 71 0.905 0.459 -4.133 1.00 0.00 C ATOM 2445 O ILE B 71 0.938 0.206 -2.930 1.00 0.00 O ATOM 2446 CB ILE B 71 0.181 -1.315 -5.806 1.00 0.00 C ATOM 2447 CG1 ILE B 71 -0.360 -2.560 -5.120 1.00 0.00 C ATOM 2448 CG2 ILE B 71 1.694 -1.420 -5.976 1.00 0.00 C ATOM 2449 CD1 ILE B 71 0.080 -2.677 -3.686 1.00 0.00 C ATOM 0 H ILE B 71 -0.540 0.759 -6.909 1.00 0.00 H new ATOM 0 HA ILE B 71 -1.073 -0.315 -4.365 1.00 0.00 H new ATOM 0 HB ILE B 71 -0.248 -1.232 -6.804 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -1.449 -2.547 -5.161 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -0.031 -3.443 -5.669 1.00 0.00 H new ATOM 0 HG21 ILE B 71 1.935 -2.323 -6.536 1.00 0.00 H new ATOM 0 HG22 ILE B 71 2.061 -0.548 -6.518 1.00 0.00 H new ATOM 0 HG23 ILE B 71 2.168 -1.464 -4.995 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -0.338 -3.585 -3.250 1.00 0.00 H new ATOM 0 HD12 ILE B 71 1.168 -2.721 -3.642 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.272 -1.811 -3.126 1.00 0.00 H new ATOM 2461 N VAL B 72 1.834 1.188 -4.750 1.00 0.00 N ATOM 2462 CA VAL B 72 2.980 1.751 -4.050 1.00 0.00 C ATOM 2463 C VAL B 72 2.554 2.513 -2.797 1.00 0.00 C ATOM 2464 O VAL B 72 3.074 2.282 -1.703 1.00 0.00 O ATOM 2465 CB VAL B 72 3.751 2.703 -4.982 1.00 0.00 C ATOM 2466 CG1 VAL B 72 4.906 3.391 -4.265 1.00 0.00 C ATOM 2467 CG2 VAL B 72 4.248 1.937 -6.188 1.00 0.00 C ATOM 0 H VAL B 72 1.811 1.403 -5.747 1.00 0.00 H new ATOM 0 HA VAL B 72 3.621 0.922 -3.749 1.00 0.00 H new ATOM 0 HB VAL B 72 3.068 3.488 -5.307 1.00 0.00 H new ATOM 0 HG11 VAL B 72 5.423 4.053 -4.960 1.00 0.00 H new ATOM 0 HG12 VAL B 72 4.520 3.973 -3.428 1.00 0.00 H new ATOM 0 HG13 VAL B 72 5.603 2.640 -3.894 1.00 0.00 H new ATOM 0 HG21 VAL B 72 4.794 2.611 -6.848 1.00 0.00 H new ATOM 0 HG22 VAL B 72 4.909 1.134 -5.862 1.00 0.00 H new ATOM 0 HG23 VAL B 72 3.399 1.513 -6.725 1.00 0.00 H new ATOM 2477 N ARG B 73 1.617 3.436 -2.971 1.00 0.00 N ATOM 2478 CA ARG B 73 1.130 4.250 -1.866 1.00 0.00 C ATOM 2479 C ARG B 73 0.289 3.426 -0.895 1.00 0.00 C ATOM 2480 O ARG B 73 0.449 3.536 0.321 1.00 0.00 O ATOM 2481 CB ARG B 73 0.325 5.434 -2.405 1.00 0.00 C ATOM 2482 CG ARG B 73 1.137 6.715 -2.525 1.00 0.00 C ATOM 2483 CD ARG B 73 2.421 6.497 -3.314 1.00 0.00 C ATOM 2484 NE ARG B 73 2.692 7.601 -4.233 1.00 0.00 N ATOM 2485 CZ ARG B 73 3.881 7.830 -4.786 1.00 0.00 C ATOM 2486 NH1 ARG B 73 4.910 7.036 -4.517 1.00 0.00 N ATOM 2487 NH2 ARG B 73 4.041 8.855 -5.611 1.00 0.00 N ATOM 0 H ARG B 73 1.178 3.640 -3.869 1.00 0.00 H new ATOM 0 HA ARG B 73 1.992 4.627 -1.315 1.00 0.00 H new ATOM 0 HB2 ARG B 73 -0.076 5.174 -3.385 1.00 0.00 H new ATOM 0 HB3 ARG B 73 -0.527 5.613 -1.749 1.00 0.00 H new ATOM 0 HG2 ARG B 73 0.536 7.482 -3.013 1.00 0.00 H new ATOM 0 HG3 ARG B 73 1.380 7.086 -1.529 1.00 0.00 H new ATOM 0 HD2 ARG B 73 3.257 6.387 -2.623 1.00 0.00 H new ATOM 0 HD3 ARG B 73 2.347 5.566 -3.877 1.00 0.00 H new ATOM 0 HE ARG B 73 1.925 8.233 -4.464 1.00 0.00 H new ATOM 0 HH11 ARG B 73 4.792 6.245 -3.884 1.00 0.00 H new ATOM 0 HH12 ARG B 73 5.819 7.216 -4.944 1.00 0.00 H new ATOM 0 HH21 ARG B 73 3.253 9.468 -5.822 1.00 0.00 H new ATOM 0 HH22 ARG B 73 4.952 9.031 -6.035 1.00 0.00 H new ATOM 2501 N LEU B 74 -0.603 2.596 -1.429 1.00 0.00 N ATOM 2502 CA LEU B 74 -1.454 1.760 -0.588 1.00 0.00 C ATOM 2503 C LEU B 74 -0.608 0.899 0.346 1.00 0.00 C ATOM 2504 O LEU B 74 -0.823 0.886 1.559 1.00 0.00 O ATOM 2505 CB LEU B 74 -2.357 0.870 -1.448 1.00 0.00 C ATOM 2506 CG LEU B 74 -3.474 1.598 -2.205 1.00 0.00 C ATOM 2507 CD1 LEU B 74 -4.506 0.604 -2.713 1.00 0.00 C ATOM 2508 CD2 LEU B 74 -4.133 2.649 -1.322 1.00 0.00 C ATOM 0 H LEU B 74 -0.755 2.485 -2.432 1.00 0.00 H new ATOM 0 HA LEU B 74 -2.082 2.416 0.015 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -1.735 0.343 -2.172 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -2.810 0.114 -0.806 1.00 0.00 H new ATOM 0 HG LEU B 74 -3.030 2.106 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -5.292 1.137 -3.248 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -4.026 -0.106 -3.386 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -4.941 0.068 -1.869 1.00 0.00 H new ATOM 0 HD21 LEU B 74 -4.922 3.152 -1.882 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -4.562 2.168 -0.442 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -3.388 3.380 -1.009 1.00 0.00 H new ATOM 2520 N VAL B 75 0.364 0.191 -0.223 1.00 0.00 N ATOM 2521 CA VAL B 75 1.244 -0.657 0.570 1.00 0.00 C ATOM 2522 C VAL B 75 2.062 0.180 1.540 1.00 0.00 C ATOM 2523 O VAL B 75 2.155 -0.137 2.724 1.00 0.00 O ATOM 2524 CB VAL B 75 2.213 -1.476 -0.309 1.00 0.00 C ATOM 2525 CG1 VAL B 75 3.152 -0.557 -1.077 1.00 0.00 C ATOM 2526 CG2 VAL B 75 3.005 -2.454 0.547 1.00 0.00 C ATOM 0 H VAL B 75 0.560 0.188 -1.224 1.00 0.00 H new ATOM 0 HA VAL B 75 0.600 -1.347 1.115 1.00 0.00 H new ATOM 0 HB VAL B 75 1.626 -2.043 -1.032 1.00 0.00 H new ATOM 0 HG11 VAL B 75 3.826 -1.155 -1.690 1.00 0.00 H new ATOM 0 HG12 VAL B 75 2.570 0.105 -1.718 1.00 0.00 H new ATOM 0 HG13 VAL B 75 3.734 0.039 -0.374 1.00 0.00 H new ATOM 0 HG21 VAL B 75 3.684 -3.025 -0.086 1.00 0.00 H new ATOM 0 HG22 VAL B 75 3.580 -1.903 1.291 1.00 0.00 H new ATOM 0 HG23 VAL B 75 2.319 -3.136 1.050 1.00 0.00 H new ATOM 2536 N GLY B 76 2.661 1.250 1.032 1.00 0.00 N ATOM 2537 CA GLY B 76 3.467 2.098 1.877 1.00 0.00 C ATOM 2538 C GLY B 76 2.682 2.636 3.058 1.00 0.00 C ATOM 2539 O GLY B 76 3.245 2.905 4.119 1.00 0.00 O ATOM 0 H GLY B 76 2.602 1.541 0.056 1.00 0.00 H new ATOM 0 HA2 GLY B 76 4.327 1.535 2.240 1.00 0.00 H new ATOM 0 HA3 GLY B 76 3.855 2.931 1.290 1.00 0.00 H new ATOM 2543 N VAL B 77 1.374 2.789 2.868 1.00 0.00 N ATOM 2544 CA VAL B 77 0.498 3.295 3.917 1.00 0.00 C ATOM 2545 C VAL B 77 0.201 2.221 4.961 1.00 0.00 C ATOM 2546 O VAL B 77 0.404 2.435 6.156 1.00 0.00 O ATOM 2547 CB VAL B 77 -0.833 3.814 3.333 1.00 0.00 C ATOM 2548 CG1 VAL B 77 -1.798 4.213 4.443 1.00 0.00 C ATOM 2549 CG2 VAL B 77 -0.581 4.983 2.392 1.00 0.00 C ATOM 0 H VAL B 77 0.898 2.568 1.993 1.00 0.00 H new ATOM 0 HA VAL B 77 1.025 4.120 4.396 1.00 0.00 H new ATOM 0 HB VAL B 77 -1.293 3.006 2.764 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -2.728 4.575 4.004 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.007 3.348 5.072 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -1.351 5.002 5.048 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -1.530 5.337 1.989 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -0.095 5.791 2.938 1.00 0.00 H new ATOM 0 HG23 VAL B 77 0.062 4.659 1.574 1.00 0.00 H new ATOM 2559 N ILE B 78 -0.297 1.073 4.509 1.00 0.00 N ATOM 2560 CA ILE B 78 -0.634 -0.013 5.422 1.00 0.00 C ATOM 2561 C ILE B 78 0.593 -0.521 6.180 1.00 0.00 C ATOM 2562 O ILE B 78 0.531 -0.736 7.389 1.00 0.00 O ATOM 2563 CB ILE B 78 -1.317 -1.190 4.696 1.00 0.00 C ATOM 2564 CG1 ILE B 78 -0.380 -1.833 3.686 1.00 0.00 C ATOM 2565 CG2 ILE B 78 -2.598 -0.731 4.018 1.00 0.00 C ATOM 2566 CD1 ILE B 78 0.412 -2.965 4.286 1.00 0.00 C ATOM 0 H ILE B 78 -0.475 0.872 3.525 1.00 0.00 H new ATOM 0 HA ILE B 78 -1.339 0.406 6.140 1.00 0.00 H new ATOM 0 HB ILE B 78 -1.570 -1.941 5.444 1.00 0.00 H new ATOM 0 HG12 ILE B 78 -0.959 -2.205 2.841 1.00 0.00 H new ATOM 0 HG13 ILE B 78 0.304 -1.079 3.296 1.00 0.00 H new ATOM 0 HG21 ILE B 78 -3.065 -1.576 3.512 1.00 0.00 H new ATOM 0 HG22 ILE B 78 -3.283 -0.333 4.766 1.00 0.00 H new ATOM 0 HG23 ILE B 78 -2.366 0.046 3.289 1.00 0.00 H new ATOM 0 HD11 ILE B 78 1.067 -3.393 3.527 1.00 0.00 H new ATOM 0 HD12 ILE B 78 1.013 -2.590 5.114 1.00 0.00 H new ATOM 0 HD13 ILE B 78 -0.270 -3.733 4.651 1.00 0.00 H new ATOM 2578 N ARG B 79 1.708 -0.700 5.473 1.00 0.00 N ATOM 2579 CA ARG B 79 2.942 -1.170 6.092 1.00 0.00 C ATOM 2580 C ARG B 79 3.356 -0.219 7.199 1.00 0.00 C ATOM 2581 O ARG B 79 3.889 -0.632 8.229 1.00 0.00 O ATOM 2582 CB ARG B 79 4.069 -1.270 5.057 1.00 0.00 C ATOM 2583 CG ARG B 79 3.762 -2.196 3.892 1.00 0.00 C ATOM 2584 CD ARG B 79 3.793 -3.657 4.309 1.00 0.00 C ATOM 2585 NE ARG B 79 4.985 -3.978 5.091 1.00 0.00 N ATOM 2586 CZ ARG B 79 5.084 -5.038 5.891 1.00 0.00 C ATOM 2587 NH1 ARG B 79 4.068 -5.882 6.016 1.00 0.00 N ATOM 2588 NH2 ARG B 79 6.204 -5.255 6.568 1.00 0.00 N ATOM 0 H ARG B 79 1.780 -0.526 4.471 1.00 0.00 H new ATOM 0 HA ARG B 79 2.761 -2.162 6.507 1.00 0.00 H new ATOM 0 HB2 ARG B 79 4.281 -0.274 4.669 1.00 0.00 H new ATOM 0 HB3 ARG B 79 4.975 -1.617 5.554 1.00 0.00 H new ATOM 0 HG2 ARG B 79 2.780 -1.955 3.485 1.00 0.00 H new ATOM 0 HG3 ARG B 79 4.487 -2.030 3.095 1.00 0.00 H new ATOM 0 HD2 ARG B 79 2.903 -3.886 4.895 1.00 0.00 H new ATOM 0 HD3 ARG B 79 3.761 -4.288 3.421 1.00 0.00 H new ATOM 0 HE ARG B 79 5.788 -3.354 5.020 1.00 0.00 H new ATOM 0 HH11 ARG B 79 3.204 -5.721 5.498 1.00 0.00 H new ATOM 0 HH12 ARG B 79 4.150 -6.692 6.630 1.00 0.00 H new ATOM 0 HH21 ARG B 79 6.989 -4.610 6.476 1.00 0.00 H new ATOM 0 HH22 ARG B 79 6.280 -6.067 7.181 1.00 0.00 H new ATOM 2602 N ASP B 80 3.098 1.062 6.974 1.00 0.00 N ATOM 2603 CA ASP B 80 3.432 2.087 7.947 1.00 0.00 C ATOM 2604 C ASP B 80 2.690 1.834 9.253 1.00 0.00 C ATOM 2605 O ASP B 80 3.225 2.050 10.340 1.00 0.00 O ATOM 2606 CB ASP B 80 3.085 3.473 7.400 1.00 0.00 C ATOM 2607 CG ASP B 80 4.190 4.482 7.639 1.00 0.00 C ATOM 2608 OD1 ASP B 80 5.373 4.080 7.637 1.00 0.00 O ATOM 2609 OD2 ASP B 80 3.874 5.676 7.829 1.00 0.00 O ATOM 0 H ASP B 80 2.658 1.414 6.124 1.00 0.00 H new ATOM 0 HA ASP B 80 4.504 2.048 8.140 1.00 0.00 H new ATOM 0 HB2 ASP B 80 2.889 3.400 6.330 1.00 0.00 H new ATOM 0 HB3 ASP B 80 2.167 3.826 7.869 1.00 0.00 H new ATOM 2614 N TRP B 81 1.455 1.363 9.132 1.00 0.00 N ATOM 2615 CA TRP B 81 0.631 1.061 10.295 1.00 0.00 C ATOM 2616 C TRP B 81 0.732 -0.419 10.662 1.00 0.00 C ATOM 2617 O TRP B 81 0.273 -0.837 11.725 1.00 0.00 O ATOM 2618 CB TRP B 81 -0.826 1.436 10.018 1.00 0.00 C ATOM 2619 CG TRP B 81 -1.619 1.705 11.260 1.00 0.00 C ATOM 2620 CD1 TRP B 81 -1.136 2.084 12.481 1.00 0.00 C ATOM 2621 CD2 TRP B 81 -3.040 1.613 11.402 1.00 0.00 C ATOM 2622 NE1 TRP B 81 -2.173 2.237 13.371 1.00 0.00 N ATOM 2623 CE2 TRP B 81 -3.348 1.948 12.733 1.00 0.00 C ATOM 2624 CE3 TRP B 81 -4.085 1.280 10.534 1.00 0.00 C ATOM 2625 CZ2 TRP B 81 -4.651 1.958 13.212 1.00 0.00 C ATOM 2626 CZ3 TRP B 81 -5.381 1.294 11.020 1.00 0.00 C ATOM 2627 CH2 TRP B 81 -5.646 1.632 12.354 1.00 0.00 C ATOM 0 H TRP B 81 1.001 1.182 8.237 1.00 0.00 H new ATOM 0 HA TRP B 81 0.996 1.649 11.137 1.00 0.00 H new ATOM 0 HB2 TRP B 81 -0.851 2.321 9.382 1.00 0.00 H new ATOM 0 HB3 TRP B 81 -1.301 0.629 9.460 1.00 0.00 H new ATOM 0 HD1 TRP B 81 -0.093 2.240 12.713 1.00 0.00 H new ATOM 0 HE1 TRP B 81 -2.081 2.520 14.347 1.00 0.00 H new ATOM 0 HE3 TRP B 81 -3.885 1.017 9.506 1.00 0.00 H new ATOM 0 HZ2 TRP B 81 -4.864 2.218 14.238 1.00 0.00 H new ATOM 0 HZ3 TRP B 81 -6.199 1.041 10.362 1.00 0.00 H new ATOM 0 HH2 TRP B 81 -6.667 1.632 12.705 1.00 0.00 H new ATOM 2638 N ALA B 82 1.331 -1.208 9.771 1.00 0.00 N ATOM 2639 CA ALA B 82 1.492 -2.629 9.983 1.00 0.00 C ATOM 2640 C ALA B 82 2.614 -2.919 10.971 1.00 0.00 C ATOM 2641 O ALA B 82 2.534 -3.858 11.763 1.00 0.00 O ATOM 2642 CB ALA B 82 1.773 -3.289 8.651 1.00 0.00 C ATOM 0 H ALA B 82 1.714 -0.873 8.887 1.00 0.00 H new ATOM 0 HA ALA B 82 0.574 -3.032 10.411 1.00 0.00 H new ATOM 0 HB1 ALA B 82 1.897 -4.362 8.796 1.00 0.00 H new ATOM 0 HB2 ALA B 82 0.939 -3.108 7.972 1.00 0.00 H new ATOM 0 HB3 ALA B 82 2.685 -2.873 8.224 1.00 0.00 H new ATOM 2648 N ASN B 83 3.666 -2.109 10.912 1.00 0.00 N ATOM 2649 CA ASN B 83 4.813 -2.279 11.792 1.00 0.00 C ATOM 2650 C ASN B 83 5.467 -0.937 12.108 1.00 0.00 C ATOM 2651 O ASN B 83 5.466 -0.489 13.255 1.00 0.00 O ATOM 2652 CB ASN B 83 5.828 -3.214 11.138 1.00 0.00 C ATOM 2653 CG ASN B 83 5.750 -4.627 11.683 1.00 0.00 C ATOM 2654 OD1 ASN B 83 6.506 -5.000 12.581 1.00 0.00 O ATOM 2655 ND2 ASN B 83 4.834 -5.420 11.142 1.00 0.00 N ATOM 0 H ASN B 83 3.746 -1.327 10.262 1.00 0.00 H new ATOM 0 HA ASN B 83 4.467 -2.715 12.729 1.00 0.00 H new ATOM 0 HB2 ASN B 83 5.659 -3.233 10.061 1.00 0.00 H new ATOM 0 HB3 ASN B 83 6.833 -2.822 11.296 1.00 0.00 H new ATOM 0 HD21 ASN B 83 4.735 -6.381 11.468 1.00 0.00 H new ATOM 0 HD22 ASN B 83 4.229 -5.068 10.400 1.00 0.00 H new ATOM 2662 N LYS B 84 6.027 -0.303 11.083 1.00 0.00 N ATOM 2663 CA LYS B 84 6.689 0.987 11.248 1.00 0.00 C ATOM 2664 C LYS B 84 5.675 2.089 11.543 1.00 0.00 C ATOM 2665 O LYS B 84 5.482 3.001 10.739 1.00 0.00 O ATOM 2666 CB LYS B 84 7.491 1.335 9.992 1.00 0.00 C ATOM 2667 CG LYS B 84 8.422 0.224 9.538 1.00 0.00 C ATOM 2668 CD LYS B 84 9.381 -0.187 10.644 1.00 0.00 C ATOM 2669 CE LYS B 84 8.884 -1.420 11.382 1.00 0.00 C ATOM 2670 NZ LYS B 84 9.931 -1.994 12.272 1.00 0.00 N ATOM 0 H LYS B 84 6.036 -0.662 10.128 1.00 0.00 H new ATOM 0 HA LYS B 84 7.369 0.912 12.096 1.00 0.00 H new ATOM 0 HB2 LYS B 84 6.799 1.571 9.183 1.00 0.00 H new ATOM 0 HB3 LYS B 84 8.077 2.234 10.183 1.00 0.00 H new ATOM 0 HG2 LYS B 84 7.834 -0.639 9.225 1.00 0.00 H new ATOM 0 HG3 LYS B 84 8.989 0.556 8.668 1.00 0.00 H new ATOM 0 HD2 LYS B 84 10.364 -0.388 10.219 1.00 0.00 H new ATOM 0 HD3 LYS B 84 9.501 0.636 11.348 1.00 0.00 H new ATOM 0 HE2 LYS B 84 8.007 -1.160 11.974 1.00 0.00 H new ATOM 0 HE3 LYS B 84 8.569 -2.173 10.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 84 9.553 -2.833 12.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 84 10.758 -2.266 11.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 84 10.214 -1.284 12.978 1.00 0.00 H new ATOM 2684 N ASN B 85 5.032 1.999 12.702 1.00 0.00 N ATOM 2685 CA ASN B 85 4.039 2.991 13.105 1.00 0.00 C ATOM 2686 C ASN B 85 4.523 3.780 14.317 1.00 0.00 C ATOM 2687 O ASN B 85 4.780 4.981 14.227 1.00 0.00 O ATOM 2688 CB ASN B 85 2.693 2.323 13.421 1.00 0.00 C ATOM 2689 CG ASN B 85 2.822 0.844 13.736 1.00 0.00 C ATOM 2690 OD1 ASN B 85 2.853 0.019 12.695 1.00 0.00 O flip ATOM 2691 ND2 ASN B 85 2.894 0.448 14.899 1.00 0.00 N flip ATOM 0 H ASN B 85 5.180 1.251 13.379 1.00 0.00 H new ATOM 0 HA ASN B 85 3.900 3.678 12.271 1.00 0.00 H new ATOM 0 HB2 ASN B 85 2.233 2.830 14.269 1.00 0.00 H new ATOM 0 HB3 ASN B 85 2.023 2.450 12.571 1.00 0.00 H new ATOM 0 HD21 ASN B 85 2.866 1.117 15.668 1.00 0.00 H new ATOM 0 HD22 ASN B 85 2.981 -0.549 15.094 1.00 0.00 H new ATOM 2698 N PHE B 86 4.645 3.098 15.451 1.00 0.00 N ATOM 2699 CA PHE B 86 5.099 3.735 16.682 1.00 0.00 C ATOM 2700 C PHE B 86 6.499 3.261 17.056 1.00 0.00 C ATOM 2701 O PHE B 86 6.820 3.110 18.235 1.00 0.00 O ATOM 2702 CB PHE B 86 4.125 3.438 17.824 1.00 0.00 C ATOM 2703 CG PHE B 86 4.441 4.180 19.091 1.00 0.00 C ATOM 2704 CD1 PHE B 86 4.249 5.550 19.173 1.00 0.00 C ATOM 2705 CD2 PHE B 86 4.929 3.508 20.200 1.00 0.00 C ATOM 2706 CE1 PHE B 86 4.539 6.236 20.337 1.00 0.00 C ATOM 2707 CE2 PHE B 86 5.221 4.188 21.367 1.00 0.00 C ATOM 2708 CZ PHE B 86 5.026 5.554 21.436 1.00 0.00 C ATOM 0 H PHE B 86 4.436 2.104 15.543 1.00 0.00 H new ATOM 0 HA PHE B 86 5.133 4.811 16.513 1.00 0.00 H new ATOM 0 HB2 PHE B 86 3.115 3.694 17.505 1.00 0.00 H new ATOM 0 HB3 PHE B 86 4.133 2.367 18.028 1.00 0.00 H new ATOM 0 HD1 PHE B 86 3.868 6.088 18.317 1.00 0.00 H new ATOM 0 HD2 PHE B 86 5.083 2.440 20.152 1.00 0.00 H new ATOM 0 HE1 PHE B 86 4.385 7.304 20.388 1.00 0.00 H new ATOM 0 HE2 PHE B 86 5.601 3.652 22.224 1.00 0.00 H new ATOM 0 HZ PHE B 86 5.254 6.088 22.347 1.00 0.00 H new ATOM 2718 N ARG B 87 7.329 3.028 16.045 1.00 0.00 N ATOM 2719 CA ARG B 87 8.696 2.570 16.267 1.00 0.00 C ATOM 2720 C ARG B 87 9.633 3.751 16.500 1.00 0.00 C ATOM 2721 O ARG B 87 10.706 3.543 17.106 1.00 0.00 O ATOM 2722 CB ARG B 87 9.181 1.746 15.073 1.00 0.00 C ATOM 2723 CG ARG B 87 9.265 2.541 13.780 1.00 0.00 C ATOM 2724 CD ARG B 87 10.675 3.051 13.530 1.00 0.00 C ATOM 2725 NE ARG B 87 10.856 4.418 14.014 1.00 0.00 N ATOM 2726 CZ ARG B 87 10.396 5.495 13.382 1.00 0.00 C ATOM 2727 NH1 ARG B 87 9.727 5.369 12.242 1.00 0.00 N ATOM 2728 NH2 ARG B 87 10.604 6.702 13.891 1.00 0.00 N ATOM 0 H ARG B 87 7.079 3.149 15.063 1.00 0.00 H new ATOM 0 HA ARG B 87 8.703 1.942 17.158 1.00 0.00 H new ATOM 0 HB2 ARG B 87 10.164 1.334 15.301 1.00 0.00 H new ATOM 0 HB3 ARG B 87 8.508 0.901 14.927 1.00 0.00 H new ATOM 0 HG2 ARG B 87 8.950 1.914 12.945 1.00 0.00 H new ATOM 0 HG3 ARG B 87 8.575 3.383 13.824 1.00 0.00 H new ATOM 0 HD2 ARG B 87 11.391 2.394 14.023 1.00 0.00 H new ATOM 0 HD3 ARG B 87 10.890 3.013 12.462 1.00 0.00 H new ATOM 0 HE ARG B 87 11.365 4.555 14.887 1.00 0.00 H new ATOM 0 HH11 ARG B 87 9.563 4.443 11.846 1.00 0.00 H new ATOM 0 HH12 ARG B 87 9.377 6.198 11.762 1.00 0.00 H new ATOM 0 HH21 ARG B 87 11.117 6.805 14.767 1.00 0.00 H new ATOM 0 HH22 ARG B 87 10.251 7.527 13.407 1.00 0.00 H new TER 2742 ARG B 87 HETATM 2743 CA CA A 201 3.015 -14.424 -11.187 1.00 0.00 CA HETATM 2744 CA CA A 202 10.147 -8.559 -17.873 1.00 0.00 CA HETATM 2745 CA CA A 203 -15.898 -0.725 9.283 1.00 0.00 CA HETATM 2746 CA CA A 204 -11.002 7.880 17.073 1.00 0.00 CA