USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1001 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 118 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 50 MET CE :methyl 143:sc= -0.0312 (180deg=-0.161) USER MOD Set 2.2: A 101 HIS : no HE2:sc= -1.55! C(o=-1.6!,f=-2.9!) USER MOD Set 3.1: A 33 SER OG : rot 180:sc= -0.4 USER MOD Set 3.2: A 44 LYS NZ :NH3+ -150:sc= 0.407 (180deg=-0.543) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0594 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 3:sc= 0.591 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.449 K(o=-0.45,f=-5.4!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.315 K(o=-0.32,f=-1.3) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 23 THR OG1 : rot 71:sc= 0.0545 USER MOD Single : A 25 SER OG : rot 82:sc= 1.2 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 170:sc= -0.137 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot 180:sc= 0.0196 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot -79:sc= 1.12 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -119:sc= 0 (180deg=-0.00271) USER MOD Single : A 45 LYS NZ :NH3+ -128:sc= -0.0434 (180deg=-1.07) USER MOD Single : A 48 HIS : no HD1:sc= -0.0309 X(o=-0.031,f=0) USER MOD Single : A 51 ASN : amide:sc= -0.618 K(o=-0.62,f=-0.023) USER MOD Single : A 53 ASN : amide:sc=-0.00791 K(o=-0.0079,f=-1.3) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0483 X(o=-0.048,f=0) USER MOD Single : A 67 GLN : amide:sc= -3.95! C(o=-3.9!,f=-6.3!) USER MOD Single : A 69 GLN : amide:sc= -0.336 X(o=-0.34,f=-0.012) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -154:sc= -0.126 (180deg=-0.574) USER MOD Single : A 75 MET CE :methyl -115:sc= -0.713 (180deg=-2.53!) USER MOD Single : A 76 THR OG1 : rot 160:sc= -0.222 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.13 K(o=-0.13,f=-3.5!) USER MOD Single : A 89 THR OG1 : rot 19:sc= 0.607 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 88:sc= 0.403 USER MOD Single : A 98 HIS : no HD1:sc= -2.67! X(o=-2.7!,f=-3.1) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ -159:sc= -3.08 (180deg=-4.95!) USER MOD Single : A 111 HIS : no HD1:sc= -4.88! C(o=-4.9!,f=-4.2!) USER MOD Single : A 112 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 114 TYR OH : rot -144:sc= 0.0137 USER MOD Single : A 116 LYS NZ :NH3+ -167:sc=-0.00634 (180deg=-0.158) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 125 SER OG : rot -56:sc= 0.0382 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.858 -3.377 -5.740 1.00 0.00 N ATOM 2 CA GLY A 1 27.442 -1.987 -5.788 1.00 0.00 C ATOM 3 C GLY A 1 26.237 -1.712 -4.911 1.00 0.00 C ATOM 4 O GLY A 1 25.489 -2.628 -4.567 1.00 0.00 O ATOM 0 H1 GLY A 1 28.817 -3.439 -5.343 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.200 -3.916 -5.141 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.855 -3.774 -6.701 1.00 0.00 H new ATOM 0 HA2 GLY A 1 28.270 -1.352 -5.472 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.208 -1.716 -6.818 1.00 0.00 H new ATOM 8 N SER A 2 26.049 -0.448 -4.546 1.00 0.00 N ATOM 9 CA SER A 2 24.929 -0.056 -3.698 1.00 0.00 C ATOM 10 C SER A 2 24.224 1.173 -4.264 1.00 0.00 C ATOM 11 O SER A 2 23.033 1.133 -4.571 1.00 0.00 O ATOM 12 CB SER A 2 25.414 0.230 -2.276 1.00 0.00 C ATOM 13 OG SER A 2 24.357 0.710 -1.463 1.00 0.00 O ATOM 0 H SER A 2 26.657 0.322 -4.824 1.00 0.00 H new ATOM 0 HA SER A 2 24.218 -0.882 -3.672 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.828 -0.679 -1.840 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.218 0.965 -2.304 1.00 0.00 H new ATOM 0 HG SER A 2 24.693 0.884 -0.559 1.00 0.00 H new ATOM 19 N SER A 3 24.970 2.265 -4.399 1.00 0.00 N ATOM 20 CA SER A 3 24.417 3.508 -4.924 1.00 0.00 C ATOM 21 C SER A 3 23.960 3.332 -6.369 1.00 0.00 C ATOM 22 O SER A 3 24.749 2.976 -7.243 1.00 0.00 O ATOM 23 CB SER A 3 25.455 4.629 -4.839 1.00 0.00 C ATOM 24 OG SER A 3 26.467 4.462 -5.816 1.00 0.00 O ATOM 0 H SER A 3 25.958 2.314 -4.152 1.00 0.00 H new ATOM 0 HA SER A 3 23.552 3.776 -4.317 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.966 5.593 -4.979 1.00 0.00 H new ATOM 0 HB3 SER A 3 25.903 4.640 -3.845 1.00 0.00 H new ATOM 0 HG SER A 3 26.262 3.679 -6.369 1.00 0.00 H new ATOM 30 N GLY A 4 22.677 3.584 -6.613 1.00 0.00 N ATOM 31 CA GLY A 4 22.136 3.448 -7.952 1.00 0.00 C ATOM 32 C GLY A 4 21.877 2.003 -8.329 1.00 0.00 C ATOM 33 O GLY A 4 21.103 1.311 -7.668 1.00 0.00 O ATOM 0 H GLY A 4 22.003 3.880 -5.907 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.206 4.011 -8.023 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.831 3.888 -8.668 1.00 0.00 H new ATOM 37 N SER A 5 22.526 1.546 -9.395 1.00 0.00 N ATOM 38 CA SER A 5 22.358 0.175 -9.863 1.00 0.00 C ATOM 39 C SER A 5 20.912 -0.086 -10.274 1.00 0.00 C ATOM 40 O SER A 5 20.348 -1.136 -9.969 1.00 0.00 O ATOM 41 CB SER A 5 22.775 -0.813 -8.772 1.00 0.00 C ATOM 42 OG SER A 5 23.179 -2.051 -9.332 1.00 0.00 O ATOM 0 H SER A 5 23.173 2.105 -9.951 1.00 0.00 H new ATOM 0 HA SER A 5 22.997 0.035 -10.735 1.00 0.00 H new ATOM 0 HB2 SER A 5 23.592 -0.391 -8.188 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.943 -0.975 -8.086 1.00 0.00 H new ATOM 0 HG SER A 5 23.442 -2.664 -8.614 1.00 0.00 H new ATOM 48 N SER A 6 20.318 0.879 -10.969 1.00 0.00 N ATOM 49 CA SER A 6 18.937 0.757 -11.420 1.00 0.00 C ATOM 50 C SER A 6 18.870 0.090 -12.791 1.00 0.00 C ATOM 51 O SER A 6 18.777 0.762 -13.817 1.00 0.00 O ATOM 52 CB SER A 6 18.274 2.135 -11.478 1.00 0.00 C ATOM 53 OG SER A 6 16.919 2.032 -11.882 1.00 0.00 O ATOM 0 H SER A 6 20.772 1.754 -11.232 1.00 0.00 H new ATOM 0 HA SER A 6 18.401 0.133 -10.705 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.330 2.610 -10.499 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.817 2.774 -12.174 1.00 0.00 H new ATOM 0 HG SER A 6 16.517 2.925 -11.910 1.00 0.00 H new ATOM 59 N GLY A 7 18.917 -1.239 -12.798 1.00 0.00 N ATOM 60 CA GLY A 7 18.861 -1.977 -14.047 1.00 0.00 C ATOM 61 C GLY A 7 18.617 -3.458 -13.835 1.00 0.00 C ATOM 62 O GLY A 7 18.084 -3.864 -12.802 1.00 0.00 O ATOM 0 H GLY A 7 18.993 -1.818 -11.961 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.068 -1.567 -14.672 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.797 -1.840 -14.589 1.00 0.00 H new ATOM 66 N SER A 8 19.006 -4.266 -14.815 1.00 0.00 N ATOM 67 CA SER A 8 18.822 -5.710 -14.734 1.00 0.00 C ATOM 68 C SER A 8 19.654 -6.301 -13.600 1.00 0.00 C ATOM 69 O SER A 8 20.549 -5.646 -13.064 1.00 0.00 O ATOM 70 CB SER A 8 19.205 -6.370 -16.060 1.00 0.00 C ATOM 71 OG SER A 8 18.427 -5.858 -17.128 1.00 0.00 O ATOM 0 H SER A 8 19.451 -3.945 -15.675 1.00 0.00 H new ATOM 0 HA SER A 8 17.769 -5.906 -14.530 1.00 0.00 H new ATOM 0 HB2 SER A 8 20.263 -6.200 -16.262 1.00 0.00 H new ATOM 0 HB3 SER A 8 19.064 -7.448 -15.987 1.00 0.00 H new ATOM 0 HG SER A 8 18.692 -6.294 -17.964 1.00 0.00 H new ATOM 77 N LEU A 9 19.353 -7.543 -13.239 1.00 0.00 N ATOM 78 CA LEU A 9 20.072 -8.225 -12.168 1.00 0.00 C ATOM 79 C LEU A 9 20.248 -9.706 -12.487 1.00 0.00 C ATOM 80 O LEU A 9 19.424 -10.304 -13.178 1.00 0.00 O ATOM 81 CB LEU A 9 19.327 -8.062 -10.842 1.00 0.00 C ATOM 82 CG LEU A 9 17.832 -8.386 -10.868 1.00 0.00 C ATOM 83 CD1 LEU A 9 17.609 -9.886 -10.756 1.00 0.00 C ATOM 84 CD2 LEU A 9 17.108 -7.652 -9.749 1.00 0.00 C ATOM 0 H LEU A 9 18.616 -8.099 -13.672 1.00 0.00 H new ATOM 0 HA LEU A 9 21.059 -7.771 -12.081 1.00 0.00 H new ATOM 0 HB2 LEU A 9 19.804 -8.701 -10.099 1.00 0.00 H new ATOM 0 HB3 LEU A 9 19.450 -7.033 -10.503 1.00 0.00 H new ATOM 0 HG LEU A 9 17.423 -8.049 -11.821 1.00 0.00 H new ATOM 0 HD11 LEU A 9 16.540 -10.097 -10.776 1.00 0.00 H new ATOM 0 HD12 LEU A 9 18.094 -10.389 -11.592 1.00 0.00 H new ATOM 0 HD13 LEU A 9 18.033 -10.248 -9.819 1.00 0.00 H new ATOM 0 HD21 LEU A 9 16.046 -7.894 -9.783 1.00 0.00 H new ATOM 0 HD22 LEU A 9 17.520 -7.958 -8.787 1.00 0.00 H new ATOM 0 HD23 LEU A 9 17.239 -6.577 -9.874 1.00 0.00 H new ATOM 96 N GLU A 10 21.326 -10.292 -11.976 1.00 0.00 N ATOM 97 CA GLU A 10 21.608 -11.704 -12.206 1.00 0.00 C ATOM 98 C GLU A 10 21.014 -12.566 -11.096 1.00 0.00 C ATOM 99 O GLU A 10 20.389 -13.592 -11.359 1.00 0.00 O ATOM 100 CB GLU A 10 23.118 -11.937 -12.294 1.00 0.00 C ATOM 101 CG GLU A 10 23.678 -11.774 -13.697 1.00 0.00 C ATOM 102 CD GLU A 10 24.935 -12.592 -13.922 1.00 0.00 C ATOM 103 OE1 GLU A 10 24.815 -13.760 -14.348 1.00 0.00 O ATOM 104 OE2 GLU A 10 26.039 -12.064 -13.673 1.00 0.00 O ATOM 0 H GLU A 10 22.018 -9.811 -11.401 1.00 0.00 H new ATOM 0 HA GLU A 10 21.147 -11.991 -13.151 1.00 0.00 H new ATOM 0 HB2 GLU A 10 23.624 -11.240 -11.626 1.00 0.00 H new ATOM 0 HB3 GLU A 10 23.344 -12.942 -11.936 1.00 0.00 H new ATOM 0 HG2 GLU A 10 22.921 -12.071 -14.423 1.00 0.00 H new ATOM 0 HG3 GLU A 10 23.897 -10.721 -13.877 1.00 0.00 H new ATOM 111 N ASN A 11 21.214 -12.140 -9.853 1.00 0.00 N ATOM 112 CA ASN A 11 20.699 -12.872 -8.702 1.00 0.00 C ATOM 113 C ASN A 11 19.840 -11.968 -7.821 1.00 0.00 C ATOM 114 O ASN A 11 19.846 -10.746 -7.976 1.00 0.00 O ATOM 115 CB ASN A 11 21.853 -13.453 -7.883 1.00 0.00 C ATOM 116 CG ASN A 11 22.541 -14.604 -8.590 1.00 0.00 C ATOM 117 OD1 ASN A 11 22.458 -14.736 -9.811 1.00 0.00 O ATOM 118 ND2 ASN A 11 23.226 -15.445 -7.823 1.00 0.00 N ATOM 0 H ASN A 11 21.729 -11.292 -9.617 1.00 0.00 H new ATOM 0 HA ASN A 11 20.077 -13.687 -9.071 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.581 -12.668 -7.679 1.00 0.00 H new ATOM 0 HB3 ASN A 11 21.475 -13.796 -6.920 1.00 0.00 H new ATOM 0 HD21 ASN A 11 23.710 -16.239 -8.242 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.268 -15.297 -6.815 1.00 0.00 H new ATOM 125 N LEU A 12 19.105 -12.577 -6.898 1.00 0.00 N ATOM 126 CA LEU A 12 18.242 -11.828 -5.991 1.00 0.00 C ATOM 127 C LEU A 12 19.065 -10.943 -5.061 1.00 0.00 C ATOM 128 O LEU A 12 20.035 -11.397 -4.454 1.00 0.00 O ATOM 129 CB LEU A 12 17.378 -12.786 -5.169 1.00 0.00 C ATOM 130 CG LEU A 12 16.089 -13.268 -5.837 1.00 0.00 C ATOM 131 CD1 LEU A 12 15.627 -14.579 -5.221 1.00 0.00 C ATOM 132 CD2 LEU A 12 15.001 -12.210 -5.721 1.00 0.00 C ATOM 0 H LEU A 12 19.089 -13.587 -6.758 1.00 0.00 H new ATOM 0 HA LEU A 12 17.595 -11.189 -6.592 1.00 0.00 H new ATOM 0 HB2 LEU A 12 17.980 -13.658 -4.914 1.00 0.00 H new ATOM 0 HB3 LEU A 12 17.116 -12.294 -4.232 1.00 0.00 H new ATOM 0 HG LEU A 12 16.292 -13.438 -6.894 1.00 0.00 H new ATOM 0 HD11 LEU A 12 14.709 -14.907 -5.709 1.00 0.00 H new ATOM 0 HD12 LEU A 12 16.399 -15.336 -5.355 1.00 0.00 H new ATOM 0 HD13 LEU A 12 15.441 -14.435 -4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 12 14.091 -12.570 -6.202 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.800 -12.008 -4.669 1.00 0.00 H new ATOM 0 HD23 LEU A 12 15.331 -11.293 -6.210 1.00 0.00 H new ATOM 144 N ALA A 13 18.671 -9.679 -4.953 1.00 0.00 N ATOM 145 CA ALA A 13 19.370 -8.731 -4.093 1.00 0.00 C ATOM 146 C ALA A 13 18.471 -8.252 -2.959 1.00 0.00 C ATOM 147 O ALA A 13 18.699 -7.191 -2.377 1.00 0.00 O ATOM 148 CB ALA A 13 19.870 -7.548 -4.909 1.00 0.00 C ATOM 0 H ALA A 13 17.871 -9.287 -5.450 1.00 0.00 H new ATOM 0 HA ALA A 13 20.226 -9.241 -3.651 1.00 0.00 H new ATOM 0 HB1 ALA A 13 20.390 -6.848 -4.255 1.00 0.00 H new ATOM 0 HB2 ALA A 13 20.555 -7.901 -5.680 1.00 0.00 H new ATOM 0 HB3 ALA A 13 19.024 -7.046 -5.378 1.00 0.00 H new ATOM 154 N THR A 14 17.446 -9.040 -2.649 1.00 0.00 N ATOM 155 CA THR A 14 16.511 -8.695 -1.586 1.00 0.00 C ATOM 156 C THR A 14 16.193 -7.204 -1.595 1.00 0.00 C ATOM 157 O THR A 14 16.048 -6.584 -0.542 1.00 0.00 O ATOM 158 CB THR A 14 17.067 -9.081 -0.202 1.00 0.00 C ATOM 159 OG1 THR A 14 17.548 -10.429 -0.226 1.00 0.00 O ATOM 160 CG2 THR A 14 15.997 -8.937 0.870 1.00 0.00 C ATOM 0 H THR A 14 17.243 -9.922 -3.120 1.00 0.00 H new ATOM 0 HA THR A 14 15.598 -9.259 -1.773 1.00 0.00 H new ATOM 0 HB THR A 14 17.890 -8.407 0.036 1.00 0.00 H new ATOM 0 HG1 THR A 14 17.901 -10.666 0.657 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.413 -9.215 1.839 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.654 -7.903 0.905 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.156 -9.590 0.635 1.00 0.00 H new ATOM 168 N ALA A 15 16.086 -6.635 -2.791 1.00 0.00 N ATOM 169 CA ALA A 15 15.782 -5.217 -2.937 1.00 0.00 C ATOM 170 C ALA A 15 14.687 -4.787 -1.967 1.00 0.00 C ATOM 171 O ALA A 15 13.985 -5.611 -1.380 1.00 0.00 O ATOM 172 CB ALA A 15 15.371 -4.910 -4.370 1.00 0.00 C ATOM 0 H ALA A 15 16.205 -7.134 -3.673 1.00 0.00 H new ATOM 0 HA ALA A 15 16.683 -4.652 -2.700 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.147 -3.847 -4.465 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.185 -5.171 -5.046 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.486 -5.492 -4.627 1.00 0.00 H new ATOM 178 N PRO A 16 14.535 -3.466 -1.792 1.00 0.00 N ATOM 179 CA PRO A 16 13.527 -2.897 -0.893 1.00 0.00 C ATOM 180 C PRO A 16 12.108 -3.089 -1.417 1.00 0.00 C ATOM 181 O PRO A 16 11.218 -3.522 -0.685 1.00 0.00 O ATOM 182 CB PRO A 16 13.885 -1.409 -0.854 1.00 0.00 C ATOM 183 CG PRO A 16 14.595 -1.157 -2.139 1.00 0.00 C ATOM 184 CD PRO A 16 15.336 -2.425 -2.459 1.00 0.00 C ATOM 0 HA PRO A 16 13.536 -3.378 0.085 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.993 -0.789 -0.767 1.00 0.00 H new ATOM 0 HB3 PRO A 16 14.520 -1.177 0.001 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.890 -0.907 -2.932 1.00 0.00 H new ATOM 0 HG3 PRO A 16 15.282 -0.316 -2.046 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.399 -2.593 -3.534 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.358 -2.400 -2.080 1.00 0.00 H new ATOM 192 N VAL A 17 11.903 -2.766 -2.691 1.00 0.00 N ATOM 193 CA VAL A 17 10.593 -2.905 -3.314 1.00 0.00 C ATOM 194 C VAL A 17 9.967 -4.255 -2.982 1.00 0.00 C ATOM 195 O VAL A 17 8.784 -4.339 -2.656 1.00 0.00 O ATOM 196 CB VAL A 17 10.680 -2.754 -4.844 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.338 -3.976 -5.465 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.297 -2.524 -5.436 1.00 0.00 C ATOM 0 H VAL A 17 12.629 -2.406 -3.311 1.00 0.00 H new ATOM 0 HA VAL A 17 9.966 -2.109 -2.913 1.00 0.00 H new ATOM 0 HB VAL A 17 11.297 -1.885 -5.071 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.391 -3.851 -6.547 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.345 -4.091 -5.064 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.751 -4.864 -5.231 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.377 -2.419 -6.518 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.655 -3.372 -5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.867 -1.615 -5.015 1.00 0.00 H new ATOM 208 N ASN A 18 10.770 -5.311 -3.068 1.00 0.00 N ATOM 209 CA ASN A 18 10.295 -6.658 -2.777 1.00 0.00 C ATOM 210 C ASN A 18 9.670 -6.727 -1.387 1.00 0.00 C ATOM 211 O ASN A 18 8.571 -7.254 -1.216 1.00 0.00 O ATOM 212 CB ASN A 18 11.447 -7.661 -2.880 1.00 0.00 C ATOM 213 CG ASN A 18 12.200 -7.543 -4.191 1.00 0.00 C ATOM 214 OD1 ASN A 18 11.635 -7.148 -5.211 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.483 -7.886 -4.169 1.00 0.00 N ATOM 0 H ASN A 18 11.753 -5.259 -3.337 1.00 0.00 H new ATOM 0 HA ASN A 18 9.532 -6.913 -3.512 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.138 -7.503 -2.052 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.054 -8.673 -2.779 1.00 0.00 H new ATOM 0 HD21 ASN A 18 14.041 -7.827 -5.021 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.910 -8.208 -3.300 1.00 0.00 H new ATOM 222 N GLN A 19 10.377 -6.189 -0.399 1.00 0.00 N ATOM 223 CA GLN A 19 9.891 -6.189 0.976 1.00 0.00 C ATOM 224 C GLN A 19 8.487 -5.598 1.057 1.00 0.00 C ATOM 225 O GLN A 19 7.644 -6.080 1.814 1.00 0.00 O ATOM 226 CB GLN A 19 10.843 -5.398 1.875 1.00 0.00 C ATOM 227 CG GLN A 19 12.243 -5.985 1.946 1.00 0.00 C ATOM 228 CD GLN A 19 13.188 -5.142 2.778 1.00 0.00 C ATOM 229 OE1 GLN A 19 12.855 -4.728 3.889 1.00 0.00 O ATOM 230 NE2 GLN A 19 14.377 -4.883 2.245 1.00 0.00 N ATOM 0 H GLN A 19 11.288 -5.748 -0.525 1.00 0.00 H new ATOM 0 HA GLN A 19 9.851 -7.222 1.321 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.906 -4.373 1.510 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.426 -5.353 2.881 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.191 -6.989 2.368 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.643 -6.084 0.937 1.00 0.00 H new ATOM 0 HE21 GLN A 19 14.612 -5.246 1.321 1.00 0.00 H new ATOM 0 HE22 GLN A 19 15.055 -4.321 2.760 1.00 0.00 H new ATOM 239 N ILE A 20 8.244 -4.554 0.273 1.00 0.00 N ATOM 240 CA ILE A 20 6.942 -3.899 0.256 1.00 0.00 C ATOM 241 C ILE A 20 5.884 -4.794 -0.380 1.00 0.00 C ATOM 242 O ILE A 20 4.835 -5.048 0.211 1.00 0.00 O ATOM 243 CB ILE A 20 6.994 -2.562 -0.508 1.00 0.00 C ATOM 244 CG1 ILE A 20 8.112 -1.677 0.045 1.00 0.00 C ATOM 245 CG2 ILE A 20 5.653 -1.849 -0.419 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.481 -0.528 -0.868 1.00 0.00 C ATOM 0 H ILE A 20 8.931 -4.143 -0.359 1.00 0.00 H new ATOM 0 HA ILE A 20 6.673 -3.705 1.294 1.00 0.00 H new ATOM 0 HB ILE A 20 7.205 -2.768 -1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.804 -1.278 1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.996 -2.290 0.220 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.705 -0.906 -0.963 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.877 -2.478 -0.856 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.414 -1.652 0.626 1.00 0.00 H new ATOM 0 HD11 ILE A 20 9.280 0.057 -0.412 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.820 -0.920 -1.827 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.609 0.108 -1.023 1.00 0.00 H new ATOM 258 N GLN A 21 6.169 -5.271 -1.588 1.00 0.00 N ATOM 259 CA GLN A 21 5.242 -6.140 -2.303 1.00 0.00 C ATOM 260 C GLN A 21 4.618 -7.163 -1.361 1.00 0.00 C ATOM 261 O GLN A 21 3.452 -7.529 -1.512 1.00 0.00 O ATOM 262 CB GLN A 21 5.961 -6.855 -3.448 1.00 0.00 C ATOM 263 CG GLN A 21 6.551 -5.909 -4.482 1.00 0.00 C ATOM 264 CD GLN A 21 6.738 -6.566 -5.835 1.00 0.00 C ATOM 265 OE1 GLN A 21 7.222 -7.695 -5.928 1.00 0.00 O ATOM 266 NE2 GLN A 21 6.355 -5.863 -6.894 1.00 0.00 N ATOM 0 H GLN A 21 7.033 -5.070 -2.091 1.00 0.00 H new ATOM 0 HA GLN A 21 4.446 -5.520 -2.714 1.00 0.00 H new ATOM 0 HB2 GLN A 21 6.759 -7.472 -3.035 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.260 -7.528 -3.942 1.00 0.00 H new ATOM 0 HG2 GLN A 21 5.899 -5.043 -4.590 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.513 -5.541 -4.125 1.00 0.00 H new ATOM 0 HE21 GLN A 21 5.959 -4.931 -6.771 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.457 -6.255 -7.830 1.00 0.00 H new ATOM 275 N GLU A 22 5.401 -7.622 -0.390 1.00 0.00 N ATOM 276 CA GLU A 22 4.924 -8.605 0.576 1.00 0.00 C ATOM 277 C GLU A 22 4.013 -7.952 1.612 1.00 0.00 C ATOM 278 O GLU A 22 2.997 -8.522 2.010 1.00 0.00 O ATOM 279 CB GLU A 22 6.105 -9.282 1.274 1.00 0.00 C ATOM 280 CG GLU A 22 7.099 -9.913 0.313 1.00 0.00 C ATOM 281 CD GLU A 22 7.859 -11.068 0.936 1.00 0.00 C ATOM 282 OE1 GLU A 22 7.276 -12.165 1.060 1.00 0.00 O ATOM 283 OE2 GLU A 22 9.038 -10.875 1.299 1.00 0.00 O ATOM 0 H GLU A 22 6.368 -7.329 -0.251 1.00 0.00 H new ATOM 0 HA GLU A 22 4.350 -9.358 0.036 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.623 -8.546 1.889 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.726 -10.050 1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 22 6.569 -10.266 -0.572 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.807 -9.155 -0.021 1.00 0.00 H new ATOM 290 N THR A 23 4.386 -6.752 2.046 1.00 0.00 N ATOM 291 CA THR A 23 3.605 -6.021 3.036 1.00 0.00 C ATOM 292 C THR A 23 2.217 -5.685 2.503 1.00 0.00 C ATOM 293 O THR A 23 1.225 -5.779 3.227 1.00 0.00 O ATOM 294 CB THR A 23 4.310 -4.718 3.457 1.00 0.00 C ATOM 295 OG1 THR A 23 5.565 -5.018 4.077 1.00 0.00 O ATOM 296 CG2 THR A 23 3.443 -3.919 4.418 1.00 0.00 C ATOM 0 H THR A 23 5.224 -6.266 1.727 1.00 0.00 H new ATOM 0 HA THR A 23 3.509 -6.671 3.906 1.00 0.00 H new ATOM 0 HB THR A 23 4.481 -4.119 2.563 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.196 -5.340 3.400 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.962 -3.003 4.701 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.500 -3.666 3.933 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.245 -4.514 5.310 1.00 0.00 H new ATOM 304 N ILE A 24 2.154 -5.294 1.235 1.00 0.00 N ATOM 305 CA ILE A 24 0.886 -4.946 0.606 1.00 0.00 C ATOM 306 C ILE A 24 0.088 -6.196 0.249 1.00 0.00 C ATOM 307 O ILE A 24 -1.132 -6.142 0.094 1.00 0.00 O ATOM 308 CB ILE A 24 1.101 -4.108 -0.668 1.00 0.00 C ATOM 309 CG1 ILE A 24 1.864 -4.919 -1.717 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.848 -2.824 -0.337 1.00 0.00 C ATOM 311 CD1 ILE A 24 2.048 -4.190 -3.029 1.00 0.00 C ATOM 0 H ILE A 24 2.966 -5.210 0.623 1.00 0.00 H new ATOM 0 HA ILE A 24 0.326 -4.355 1.331 1.00 0.00 H new ATOM 0 HB ILE A 24 0.127 -3.844 -1.080 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.843 -5.184 -1.318 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.331 -5.852 -1.901 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.993 -2.242 -1.247 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.269 -2.240 0.379 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.818 -3.069 0.095 1.00 0.00 H new ATOM 0 HD11 ILE A 24 2.597 -4.825 -3.724 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.072 -3.948 -3.451 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.608 -3.270 -2.859 1.00 0.00 H new ATOM 323 N SER A 25 0.785 -7.321 0.123 1.00 0.00 N ATOM 324 CA SER A 25 0.142 -8.584 -0.216 1.00 0.00 C ATOM 325 C SER A 25 -0.592 -9.162 0.990 1.00 0.00 C ATOM 326 O SER A 25 -1.729 -9.620 0.878 1.00 0.00 O ATOM 327 CB SER A 25 1.178 -9.588 -0.726 1.00 0.00 C ATOM 328 OG SER A 25 1.506 -9.338 -2.082 1.00 0.00 O ATOM 0 H SER A 25 1.795 -7.383 0.251 1.00 0.00 H new ATOM 0 HA SER A 25 -0.586 -8.392 -1.004 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.078 -9.529 -0.114 1.00 0.00 H new ATOM 0 HB3 SER A 25 0.789 -10.601 -0.624 1.00 0.00 H new ATOM 0 HG SER A 25 2.170 -8.619 -2.131 1.00 0.00 H new ATOM 334 N ASP A 26 0.068 -9.138 2.143 1.00 0.00 N ATOM 335 CA ASP A 26 -0.521 -9.658 3.372 1.00 0.00 C ATOM 336 C ASP A 26 -1.631 -8.740 3.873 1.00 0.00 C ATOM 337 O ASP A 26 -2.758 -9.179 4.101 1.00 0.00 O ATOM 338 CB ASP A 26 0.553 -9.817 4.449 1.00 0.00 C ATOM 339 CG ASP A 26 -0.011 -10.338 5.756 1.00 0.00 C ATOM 340 OD1 ASP A 26 -1.068 -9.834 6.189 1.00 0.00 O ATOM 341 OD2 ASP A 26 0.605 -11.251 6.346 1.00 0.00 O ATOM 0 H ASP A 26 1.011 -8.764 2.252 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.953 -10.635 3.155 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.324 -10.500 4.091 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.035 -8.855 4.622 1.00 0.00 H new ATOM 346 N ASN A 27 -1.304 -7.463 4.045 1.00 0.00 N ATOM 347 CA ASN A 27 -2.273 -6.483 4.522 1.00 0.00 C ATOM 348 C ASN A 27 -3.361 -6.243 3.480 1.00 0.00 C ATOM 349 O ASN A 27 -3.134 -6.405 2.281 1.00 0.00 O ATOM 350 CB ASN A 27 -1.573 -5.165 4.858 1.00 0.00 C ATOM 351 CG ASN A 27 -0.946 -5.179 6.239 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.514 -4.654 7.196 1.00 0.00 O ATOM 353 ND2 ASN A 27 0.233 -5.781 6.347 1.00 0.00 N ATOM 0 H ASN A 27 -0.375 -7.083 3.861 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.740 -6.879 5.424 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.802 -4.966 4.114 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.293 -4.349 4.797 1.00 0.00 H new ATOM 0 HD21 ASN A 27 0.704 -5.821 7.251 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.667 -6.203 5.526 1.00 0.00 H new ATOM 360 N CYS A 28 -4.544 -5.855 3.947 1.00 0.00 N ATOM 361 CA CYS A 28 -5.668 -5.592 3.057 1.00 0.00 C ATOM 362 C CYS A 28 -5.530 -4.224 2.395 1.00 0.00 C ATOM 363 O CYS A 28 -5.932 -4.034 1.247 1.00 0.00 O ATOM 364 CB CYS A 28 -6.986 -5.666 3.831 1.00 0.00 C ATOM 365 SG CYS A 28 -7.691 -7.342 3.941 1.00 0.00 S ATOM 0 H CYS A 28 -4.748 -5.716 4.937 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.668 -6.354 2.278 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -6.825 -5.284 4.839 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -7.713 -5.008 3.354 1.00 0.00 H new ATOM 370 N VAL A 29 -4.958 -3.274 3.128 1.00 0.00 N ATOM 371 CA VAL A 29 -4.764 -1.924 2.613 1.00 0.00 C ATOM 372 C VAL A 29 -3.616 -1.222 3.328 1.00 0.00 C ATOM 373 O VAL A 29 -3.609 -1.110 4.554 1.00 0.00 O ATOM 374 CB VAL A 29 -6.042 -1.077 2.763 1.00 0.00 C ATOM 375 CG1 VAL A 29 -5.815 0.331 2.236 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.208 -1.742 2.047 1.00 0.00 C ATOM 0 H VAL A 29 -4.621 -3.415 4.080 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.523 -2.021 1.554 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.288 -1.006 3.823 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.729 0.914 2.350 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.010 0.804 2.798 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.543 0.285 1.181 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.103 -1.130 2.163 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.974 -1.845 0.987 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.384 -2.728 2.477 1.00 0.00 H new ATOM 386 N VAL A 30 -2.644 -0.749 2.554 1.00 0.00 N ATOM 387 CA VAL A 30 -1.490 -0.055 3.113 1.00 0.00 C ATOM 388 C VAL A 30 -1.434 1.392 2.636 1.00 0.00 C ATOM 389 O VAL A 30 -1.546 1.667 1.441 1.00 0.00 O ATOM 390 CB VAL A 30 -0.174 -0.760 2.734 1.00 0.00 C ATOM 391 CG1 VAL A 30 1.018 -0.008 3.305 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.185 -2.203 3.216 1.00 0.00 C ATOM 0 H VAL A 30 -2.633 -0.834 1.538 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.605 -0.073 4.197 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.084 -0.764 1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.939 -0.521 3.027 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.033 1.006 2.907 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.938 0.030 4.391 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.752 -2.686 2.940 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.298 -2.224 4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.017 -2.735 2.754 1.00 0.00 H new ATOM 402 N ILE A 31 -1.260 2.313 3.578 1.00 0.00 N ATOM 403 CA ILE A 31 -1.188 3.732 3.254 1.00 0.00 C ATOM 404 C ILE A 31 0.193 4.298 3.567 1.00 0.00 C ATOM 405 O ILE A 31 0.505 4.600 4.719 1.00 0.00 O ATOM 406 CB ILE A 31 -2.249 4.540 4.025 1.00 0.00 C ATOM 407 CG1 ILE A 31 -3.652 4.188 3.526 1.00 0.00 C ATOM 408 CG2 ILE A 31 -1.988 6.032 3.878 1.00 0.00 C ATOM 409 CD1 ILE A 31 -4.756 4.898 4.277 1.00 0.00 C ATOM 0 H ILE A 31 -1.166 2.102 4.571 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.381 3.822 2.185 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.184 4.281 5.082 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.725 4.437 2.467 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.800 3.111 3.611 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.746 6.590 4.428 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.002 6.270 4.276 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.029 6.306 2.824 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.722 4.601 3.870 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.709 4.630 5.332 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.633 5.976 4.171 1.00 0.00 H new ATOM 421 N PHE A 32 1.016 4.440 2.534 1.00 0.00 N ATOM 422 CA PHE A 32 2.365 4.971 2.698 1.00 0.00 C ATOM 423 C PHE A 32 2.368 6.492 2.582 1.00 0.00 C ATOM 424 O PHE A 32 2.221 7.042 1.490 1.00 0.00 O ATOM 425 CB PHE A 32 3.305 4.366 1.654 1.00 0.00 C ATOM 426 CG PHE A 32 3.669 2.935 1.932 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.400 2.599 3.060 1.00 0.00 C ATOM 428 CD2 PHE A 32 3.279 1.926 1.066 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.737 1.284 3.319 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.612 0.609 1.320 1.00 0.00 C ATOM 431 CZ PHE A 32 4.343 0.288 2.447 1.00 0.00 C ATOM 0 H PHE A 32 0.773 4.195 1.574 1.00 0.00 H new ATOM 0 HA PHE A 32 2.717 4.699 3.693 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.834 4.429 0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 32 4.216 4.962 1.609 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.710 3.374 3.745 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.708 2.172 0.183 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.307 1.036 4.202 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.301 -0.168 0.638 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.606 -0.740 2.646 1.00 0.00 H new ATOM 441 N SER A 33 2.537 7.166 3.715 1.00 0.00 N ATOM 442 CA SER A 33 2.555 8.624 3.741 1.00 0.00 C ATOM 443 C SER A 33 3.924 9.142 4.172 1.00 0.00 C ATOM 444 O SER A 33 4.784 8.375 4.603 1.00 0.00 O ATOM 445 CB SER A 33 1.476 9.152 4.689 1.00 0.00 C ATOM 446 OG SER A 33 0.179 8.885 4.185 1.00 0.00 O ATOM 0 H SER A 33 2.663 6.726 4.627 1.00 0.00 H new ATOM 0 HA SER A 33 2.350 8.984 2.733 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.591 8.690 5.669 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.602 10.226 4.826 1.00 0.00 H new ATOM 0 HG SER A 33 -0.492 9.231 4.810 1.00 0.00 H new ATOM 452 N LYS A 34 4.118 10.451 4.051 1.00 0.00 N ATOM 453 CA LYS A 34 5.381 11.075 4.428 1.00 0.00 C ATOM 454 C LYS A 34 5.140 12.335 5.254 1.00 0.00 C ATOM 455 O LYS A 34 5.944 13.268 5.233 1.00 0.00 O ATOM 456 CB LYS A 34 6.196 11.420 3.179 1.00 0.00 C ATOM 457 CG LYS A 34 5.361 11.993 2.047 1.00 0.00 C ATOM 458 CD LYS A 34 5.948 11.645 0.690 1.00 0.00 C ATOM 459 CE LYS A 34 7.349 12.215 0.526 1.00 0.00 C ATOM 460 NZ LYS A 34 7.325 13.681 0.268 1.00 0.00 N ATOM 0 H LYS A 34 3.417 11.100 3.695 1.00 0.00 H new ATOM 0 HA LYS A 34 5.941 10.364 5.036 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.970 12.138 3.448 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.703 10.522 2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.343 11.608 2.114 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.300 13.076 2.151 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.979 10.562 0.573 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.302 12.033 -0.097 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.930 12.014 1.426 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.852 11.710 -0.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.299 14.031 0.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.792 13.871 -0.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.868 14.166 1.066 1.00 0.00 H new ATOM 474 N THR A 35 4.029 12.355 5.984 1.00 0.00 N ATOM 475 CA THR A 35 3.683 13.500 6.817 1.00 0.00 C ATOM 476 C THR A 35 4.125 14.806 6.169 1.00 0.00 C ATOM 477 O THR A 35 4.727 15.661 6.819 1.00 0.00 O ATOM 478 CB THR A 35 4.322 13.391 8.214 1.00 0.00 C ATOM 479 OG1 THR A 35 5.709 13.054 8.093 1.00 0.00 O ATOM 480 CG2 THR A 35 3.612 12.341 9.055 1.00 0.00 C ATOM 0 H THR A 35 3.354 11.591 6.015 1.00 0.00 H new ATOM 0 HA THR A 35 2.598 13.499 6.920 1.00 0.00 H new ATOM 0 HB THR A 35 4.224 14.357 8.710 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.145 13.144 8.966 1.00 0.00 H new ATOM 0 HG21 THR A 35 4.082 12.283 10.037 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.563 12.615 9.170 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.682 11.372 8.562 1.00 0.00 H new ATOM 488 N SER A 36 3.823 14.955 4.883 1.00 0.00 N ATOM 489 CA SER A 36 4.193 16.158 4.145 1.00 0.00 C ATOM 490 C SER A 36 2.962 16.817 3.529 1.00 0.00 C ATOM 491 O SER A 36 2.808 18.038 3.579 1.00 0.00 O ATOM 492 CB SER A 36 5.205 15.818 3.050 1.00 0.00 C ATOM 493 OG SER A 36 6.032 16.931 2.757 1.00 0.00 O ATOM 0 H SER A 36 3.323 14.258 4.331 1.00 0.00 H new ATOM 0 HA SER A 36 4.647 16.859 4.845 1.00 0.00 H new ATOM 0 HB2 SER A 36 5.821 14.977 3.368 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.679 15.505 2.148 1.00 0.00 H new ATOM 0 HG SER A 36 6.671 16.688 2.055 1.00 0.00 H new ATOM 499 N CYS A 37 2.090 16.001 2.950 1.00 0.00 N ATOM 500 CA CYS A 37 0.872 16.504 2.323 1.00 0.00 C ATOM 501 C CYS A 37 -0.289 16.503 3.312 1.00 0.00 C ATOM 502 O CYS A 37 -0.205 15.902 4.382 1.00 0.00 O ATOM 503 CB CYS A 37 0.516 15.657 1.100 1.00 0.00 C ATOM 504 SG CYS A 37 -0.420 16.546 -0.166 1.00 0.00 S ATOM 0 H CYS A 37 2.203 14.988 2.901 1.00 0.00 H new ATOM 0 HA CYS A 37 1.054 17.531 2.005 1.00 0.00 H new ATOM 0 HB2 CYS A 37 1.435 15.275 0.656 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.064 14.793 1.426 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.672 15.747 -1.161 1.00 0.00 H new ATOM 510 N SER A 38 -1.371 17.183 2.946 1.00 0.00 N ATOM 511 CA SER A 38 -2.547 17.266 3.804 1.00 0.00 C ATOM 512 C SER A 38 -3.492 16.096 3.545 1.00 0.00 C ATOM 513 O SER A 38 -4.296 15.732 4.403 1.00 0.00 O ATOM 514 CB SER A 38 -3.281 18.589 3.573 1.00 0.00 C ATOM 515 OG SER A 38 -2.419 19.693 3.784 1.00 0.00 O ATOM 0 H SER A 38 -1.457 17.684 2.062 1.00 0.00 H new ATOM 0 HA SER A 38 -2.214 17.219 4.841 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.673 18.619 2.556 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.136 18.657 4.246 1.00 0.00 H new ATOM 0 HG SER A 38 -2.911 20.526 3.629 1.00 0.00 H new ATOM 521 N TYR A 39 -3.387 15.511 2.357 1.00 0.00 N ATOM 522 CA TYR A 39 -4.233 14.384 1.983 1.00 0.00 C ATOM 523 C TYR A 39 -3.879 13.143 2.798 1.00 0.00 C ATOM 524 O TYR A 39 -4.660 12.194 2.876 1.00 0.00 O ATOM 525 CB TYR A 39 -4.089 14.085 0.490 1.00 0.00 C ATOM 526 CG TYR A 39 -4.829 15.060 -0.397 1.00 0.00 C ATOM 527 CD1 TYR A 39 -4.519 16.414 -0.383 1.00 0.00 C ATOM 528 CD2 TYR A 39 -5.838 14.627 -1.248 1.00 0.00 C ATOM 529 CE1 TYR A 39 -5.193 17.309 -1.191 1.00 0.00 C ATOM 530 CE2 TYR A 39 -6.517 15.515 -2.060 1.00 0.00 C ATOM 531 CZ TYR A 39 -6.191 16.855 -2.029 1.00 0.00 C ATOM 532 OH TYR A 39 -6.865 17.742 -2.836 1.00 0.00 O ATOM 0 H TYR A 39 -2.725 15.799 1.637 1.00 0.00 H new ATOM 0 HA TYR A 39 -5.268 14.653 2.195 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -3.032 14.097 0.226 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -4.455 13.077 0.293 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -3.738 16.773 0.271 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -6.096 13.579 -1.275 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -4.940 18.359 -1.167 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -7.299 15.162 -2.716 1.00 0.00 H new ATOM 0 HH TYR A 39 -7.535 17.260 -3.364 1.00 0.00 H new ATOM 542 N CYS A 40 -2.697 13.160 3.405 1.00 0.00 N ATOM 543 CA CYS A 40 -2.238 12.037 4.215 1.00 0.00 C ATOM 544 C CYS A 40 -3.210 11.757 5.357 1.00 0.00 C ATOM 545 O CYS A 40 -3.264 10.645 5.883 1.00 0.00 O ATOM 546 CB CYS A 40 -0.843 12.322 4.775 1.00 0.00 C ATOM 547 SG CYS A 40 -0.808 13.594 6.059 1.00 0.00 S ATOM 0 H CYS A 40 -2.040 13.938 3.352 1.00 0.00 H new ATOM 0 HA CYS A 40 -2.192 11.155 3.576 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.431 11.399 5.182 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.191 12.628 3.957 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.864 14.770 5.507 1.00 0.00 H new ATOM 553 N THR A 41 -3.977 12.774 5.738 1.00 0.00 N ATOM 554 CA THR A 41 -4.944 12.639 6.819 1.00 0.00 C ATOM 555 C THR A 41 -6.331 12.311 6.278 1.00 0.00 C ATOM 556 O THR A 41 -7.088 11.564 6.896 1.00 0.00 O ATOM 557 CB THR A 41 -5.026 13.925 7.664 1.00 0.00 C ATOM 558 OG1 THR A 41 -5.490 13.616 8.983 1.00 0.00 O ATOM 559 CG2 THR A 41 -5.958 14.938 7.017 1.00 0.00 C ATOM 0 H THR A 41 -3.947 13.701 5.313 1.00 0.00 H new ATOM 0 HA THR A 41 -4.600 11.820 7.450 1.00 0.00 H new ATOM 0 HB THR A 41 -4.028 14.359 7.723 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.538 14.438 9.514 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.000 15.838 7.631 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.586 15.193 6.025 1.00 0.00 H new ATOM 0 HG23 THR A 41 -6.957 14.510 6.931 1.00 0.00 H new ATOM 567 N MET A 42 -6.657 12.874 5.119 1.00 0.00 N ATOM 568 CA MET A 42 -7.954 12.639 4.494 1.00 0.00 C ATOM 569 C MET A 42 -8.074 11.195 4.019 1.00 0.00 C ATOM 570 O MET A 42 -9.167 10.629 3.993 1.00 0.00 O ATOM 571 CB MET A 42 -8.156 13.594 3.316 1.00 0.00 C ATOM 572 CG MET A 42 -7.592 13.071 2.005 1.00 0.00 C ATOM 573 SD MET A 42 -8.070 14.081 0.590 1.00 0.00 S ATOM 574 CE MET A 42 -9.729 13.476 0.287 1.00 0.00 C ATOM 0 H MET A 42 -6.042 13.496 4.594 1.00 0.00 H new ATOM 0 HA MET A 42 -8.728 12.823 5.239 1.00 0.00 H new ATOM 0 HB2 MET A 42 -9.222 13.785 3.193 1.00 0.00 H new ATOM 0 HB3 MET A 42 -7.686 14.549 3.549 1.00 0.00 H new ATOM 0 HG2 MET A 42 -6.505 13.036 2.070 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.935 12.048 1.849 1.00 0.00 H new ATOM 0 HE1 MET A 42 -9.782 13.046 -0.713 1.00 0.00 H new ATOM 0 HE2 MET A 42 -9.978 12.713 1.024 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.437 14.301 0.365 1.00 0.00 H new ATOM 584 N ALA A 43 -6.945 10.604 3.643 1.00 0.00 N ATOM 585 CA ALA A 43 -6.924 9.225 3.170 1.00 0.00 C ATOM 586 C ALA A 43 -7.311 8.258 4.283 1.00 0.00 C ATOM 587 O ALA A 43 -8.132 7.361 4.084 1.00 0.00 O ATOM 588 CB ALA A 43 -5.550 8.876 2.619 1.00 0.00 C ATOM 0 H ALA A 43 -6.032 11.059 3.657 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.658 9.130 2.370 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.550 7.843 2.270 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.312 9.540 1.788 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.803 8.994 3.404 1.00 0.00 H new ATOM 594 N LYS A 44 -6.716 8.444 5.456 1.00 0.00 N ATOM 595 CA LYS A 44 -6.998 7.588 6.603 1.00 0.00 C ATOM 596 C LYS A 44 -8.450 7.733 7.046 1.00 0.00 C ATOM 597 O LYS A 44 -9.162 6.743 7.210 1.00 0.00 O ATOM 598 CB LYS A 44 -6.062 7.932 7.764 1.00 0.00 C ATOM 599 CG LYS A 44 -4.729 7.207 7.706 1.00 0.00 C ATOM 600 CD LYS A 44 -3.699 7.996 6.916 1.00 0.00 C ATOM 601 CE LYS A 44 -2.912 8.940 7.813 1.00 0.00 C ATOM 602 NZ LYS A 44 -1.591 9.293 7.222 1.00 0.00 N ATOM 0 H LYS A 44 -6.034 9.181 5.638 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.830 6.554 6.303 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.881 9.007 7.768 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.558 7.689 8.704 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.361 7.038 8.718 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.866 6.227 7.249 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.014 7.308 6.420 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.199 8.568 6.134 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.490 9.849 7.980 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.762 8.475 8.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.908 9.478 7.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.251 8.504 6.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -1.691 10.144 6.633 1.00 0.00 H new ATOM 616 N LYS A 45 -8.884 8.975 7.236 1.00 0.00 N ATOM 617 CA LYS A 45 -10.253 9.251 7.657 1.00 0.00 C ATOM 618 C LYS A 45 -11.253 8.505 6.779 1.00 0.00 C ATOM 619 O LYS A 45 -12.189 7.880 7.280 1.00 0.00 O ATOM 620 CB LYS A 45 -10.531 10.755 7.602 1.00 0.00 C ATOM 621 CG LYS A 45 -9.951 11.524 8.776 1.00 0.00 C ATOM 622 CD LYS A 45 -10.349 12.990 8.734 1.00 0.00 C ATOM 623 CE LYS A 45 -11.687 13.224 9.417 1.00 0.00 C ATOM 624 NZ LYS A 45 -12.826 13.095 8.466 1.00 0.00 N ATOM 0 H LYS A 45 -8.307 9.806 7.105 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.369 8.904 8.684 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.121 11.158 6.676 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.609 10.916 7.570 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.296 11.079 9.709 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.864 11.441 8.765 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.581 13.591 9.221 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.405 13.323 7.698 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.810 12.508 10.230 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -11.698 14.218 9.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.429 13.940 8.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.460 13.003 7.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -13.385 12.252 8.706 1.00 0.00 H new ATOM 638 N LEU A 46 -11.049 8.574 5.468 1.00 0.00 N ATOM 639 CA LEU A 46 -11.933 7.904 4.520 1.00 0.00 C ATOM 640 C LEU A 46 -12.166 6.452 4.926 1.00 0.00 C ATOM 641 O LEU A 46 -13.301 6.037 5.159 1.00 0.00 O ATOM 642 CB LEU A 46 -11.340 7.963 3.111 1.00 0.00 C ATOM 643 CG LEU A 46 -11.893 6.951 2.108 1.00 0.00 C ATOM 644 CD1 LEU A 46 -13.222 7.428 1.544 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.892 6.710 0.987 1.00 0.00 C ATOM 0 H LEU A 46 -10.280 9.087 5.037 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.892 8.422 4.526 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -11.501 8.965 2.712 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.262 7.819 3.186 1.00 0.00 H new ATOM 0 HG LEU A 46 -12.061 6.008 2.628 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.599 6.694 0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.939 7.548 2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -13.081 8.384 1.039 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.302 5.987 0.282 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.692 7.648 0.469 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.963 6.322 1.406 1.00 0.00 H new ATOM 657 N PHE A 47 -11.084 5.686 5.011 1.00 0.00 N ATOM 658 CA PHE A 47 -11.170 4.280 5.390 1.00 0.00 C ATOM 659 C PHE A 47 -11.687 4.133 6.818 1.00 0.00 C ATOM 660 O PHE A 47 -12.454 3.218 7.121 1.00 0.00 O ATOM 661 CB PHE A 47 -9.801 3.610 5.259 1.00 0.00 C ATOM 662 CG PHE A 47 -9.376 3.385 3.836 1.00 0.00 C ATOM 663 CD1 PHE A 47 -9.848 2.296 3.122 1.00 0.00 C ATOM 664 CD2 PHE A 47 -8.504 4.264 3.212 1.00 0.00 C ATOM 665 CE1 PHE A 47 -9.460 2.086 1.812 1.00 0.00 C ATOM 666 CE2 PHE A 47 -8.113 4.059 1.903 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.590 2.969 1.202 1.00 0.00 C ATOM 0 H PHE A 47 -10.137 6.015 4.823 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.872 3.790 4.716 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -9.054 4.227 5.759 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.823 2.652 5.779 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.528 1.602 3.595 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -8.127 5.118 3.755 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.836 1.233 1.266 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -7.434 4.751 1.428 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.284 2.807 0.179 1.00 0.00 H new ATOM 677 N HIS A 48 -11.261 5.039 7.692 1.00 0.00 N ATOM 678 CA HIS A 48 -11.680 5.011 9.088 1.00 0.00 C ATOM 679 C HIS A 48 -13.201 4.958 9.198 1.00 0.00 C ATOM 680 O HIS A 48 -13.757 4.055 9.822 1.00 0.00 O ATOM 681 CB HIS A 48 -11.146 6.238 9.828 1.00 0.00 C ATOM 682 CG HIS A 48 -10.978 6.023 11.301 1.00 0.00 C ATOM 683 ND1 HIS A 48 -9.946 6.576 12.029 1.00 0.00 N ATOM 684 CD2 HIS A 48 -11.719 5.311 12.182 1.00 0.00 C ATOM 685 CE1 HIS A 48 -10.058 6.213 13.294 1.00 0.00 C ATOM 686 NE2 HIS A 48 -11.127 5.445 13.414 1.00 0.00 N ATOM 0 H HIS A 48 -10.626 5.802 7.458 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.269 4.112 9.547 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -10.185 6.521 9.399 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -11.826 7.074 9.666 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -12.610 4.743 11.958 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.390 6.496 14.094 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -11.458 5.021 14.280 1.00 0.00 H new ATOM 694 N ASP A 49 -13.868 5.932 8.588 1.00 0.00 N ATOM 695 CA ASP A 49 -15.324 5.997 8.616 1.00 0.00 C ATOM 696 C ASP A 49 -15.936 4.738 8.008 1.00 0.00 C ATOM 697 O ASP A 49 -17.038 4.333 8.375 1.00 0.00 O ATOM 698 CB ASP A 49 -15.816 7.233 7.863 1.00 0.00 C ATOM 699 CG ASP A 49 -17.311 7.441 8.005 1.00 0.00 C ATOM 700 OD1 ASP A 49 -17.814 7.371 9.146 1.00 0.00 O ATOM 701 OD2 ASP A 49 -17.978 7.676 6.976 1.00 0.00 O ATOM 0 H ASP A 49 -13.423 6.688 8.068 1.00 0.00 H new ATOM 0 HA ASP A 49 -15.640 6.067 9.657 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -15.293 8.114 8.235 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -15.564 7.135 6.807 1.00 0.00 H new ATOM 706 N MET A 50 -15.213 4.126 7.077 1.00 0.00 N ATOM 707 CA MET A 50 -15.685 2.914 6.418 1.00 0.00 C ATOM 708 C MET A 50 -15.495 1.697 7.318 1.00 0.00 C ATOM 709 O MET A 50 -15.950 0.600 6.997 1.00 0.00 O ATOM 710 CB MET A 50 -14.944 2.705 5.095 1.00 0.00 C ATOM 711 CG MET A 50 -15.185 3.813 4.083 1.00 0.00 C ATOM 712 SD MET A 50 -13.801 4.027 2.946 1.00 0.00 S ATOM 713 CE MET A 50 -13.652 2.371 2.279 1.00 0.00 C ATOM 0 H MET A 50 -14.298 4.449 6.762 1.00 0.00 H new ATOM 0 HA MET A 50 -16.749 3.032 6.215 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.875 2.632 5.294 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.253 1.754 4.661 1.00 0.00 H new ATOM 0 HG2 MET A 50 -16.087 3.590 3.513 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.365 4.749 4.611 1.00 0.00 H new ATOM 0 HE1 MET A 50 -13.388 2.427 1.223 1.00 0.00 H new ATOM 0 HE2 MET A 50 -12.875 1.830 2.819 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.602 1.848 2.389 1.00 0.00 H new ATOM 723 N ASN A 51 -14.820 1.899 8.445 1.00 0.00 N ATOM 724 CA ASN A 51 -14.570 0.818 9.391 1.00 0.00 C ATOM 725 C ASN A 51 -13.762 -0.300 8.738 1.00 0.00 C ATOM 726 O ASN A 51 -13.856 -1.462 9.134 1.00 0.00 O ATOM 727 CB ASN A 51 -15.892 0.262 9.924 1.00 0.00 C ATOM 728 CG ASN A 51 -16.708 1.312 10.653 1.00 0.00 C ATOM 729 OD1 ASN A 51 -16.647 1.421 11.878 1.00 0.00 O ATOM 730 ND2 ASN A 51 -17.478 2.090 9.902 1.00 0.00 N ATOM 0 H ASN A 51 -14.436 2.802 8.725 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.992 1.223 10.222 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.476 -0.137 9.095 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.688 -0.569 10.599 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -18.050 2.814 10.337 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.497 1.964 8.890 1.00 0.00 H new ATOM 737 N VAL A 52 -12.968 0.060 7.734 1.00 0.00 N ATOM 738 CA VAL A 52 -12.142 -0.912 7.027 1.00 0.00 C ATOM 739 C VAL A 52 -10.716 -0.915 7.565 1.00 0.00 C ATOM 740 O VAL A 52 -9.880 -0.119 7.141 1.00 0.00 O ATOM 741 CB VAL A 52 -12.108 -0.624 5.514 1.00 0.00 C ATOM 742 CG1 VAL A 52 -11.157 -1.579 4.810 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.506 -0.718 4.923 1.00 0.00 C ATOM 0 H VAL A 52 -12.879 1.017 7.392 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.592 -1.891 7.193 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.742 0.392 5.363 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.146 -1.360 3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.153 -1.457 5.216 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -11.490 -2.605 4.967 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.464 -0.512 3.854 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -13.902 -1.721 5.084 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -14.156 0.011 5.408 1.00 0.00 H new ATOM 753 N ASN A 53 -10.445 -1.819 8.501 1.00 0.00 N ATOM 754 CA ASN A 53 -9.118 -1.927 9.098 1.00 0.00 C ATOM 755 C ASN A 53 -8.033 -1.627 8.069 1.00 0.00 C ATOM 756 O ASN A 53 -7.859 -2.368 7.101 1.00 0.00 O ATOM 757 CB ASN A 53 -8.911 -3.326 9.682 1.00 0.00 C ATOM 758 CG ASN A 53 -7.620 -3.438 10.469 1.00 0.00 C ATOM 759 OD1 ASN A 53 -6.991 -2.433 10.798 1.00 0.00 O ATOM 760 ND2 ASN A 53 -7.219 -4.667 10.775 1.00 0.00 N ATOM 0 H ASN A 53 -11.126 -2.487 8.862 1.00 0.00 H new ATOM 0 HA ASN A 53 -9.046 -1.192 9.900 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.751 -3.574 10.330 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.905 -4.057 8.874 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -6.358 -4.806 11.304 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -7.772 -5.472 10.481 1.00 0.00 H new ATOM 767 N TYR A 54 -7.305 -0.537 8.285 1.00 0.00 N ATOM 768 CA TYR A 54 -6.237 -0.138 7.376 1.00 0.00 C ATOM 769 C TYR A 54 -4.887 -0.142 8.086 1.00 0.00 C ATOM 770 O TYR A 54 -4.813 -0.307 9.304 1.00 0.00 O ATOM 771 CB TYR A 54 -6.520 1.251 6.802 1.00 0.00 C ATOM 772 CG TYR A 54 -6.446 2.358 7.830 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.540 2.665 8.629 1.00 0.00 C ATOM 774 CD2 TYR A 54 -5.282 3.097 8.001 1.00 0.00 C ATOM 775 CE1 TYR A 54 -7.477 3.676 9.569 1.00 0.00 C ATOM 776 CE2 TYR A 54 -5.209 4.108 8.939 1.00 0.00 C ATOM 777 CZ TYR A 54 -6.309 4.394 9.720 1.00 0.00 C ATOM 778 OH TYR A 54 -6.241 5.401 10.655 1.00 0.00 O ATOM 0 H TYR A 54 -7.435 0.086 9.082 1.00 0.00 H new ATOM 0 HA TYR A 54 -6.200 -0.860 6.560 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.806 1.458 6.005 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.512 1.253 6.349 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -8.456 2.104 8.514 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.419 2.877 7.390 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -8.337 3.903 10.182 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.296 4.671 9.060 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.349 5.806 10.635 1.00 0.00 H new ATOM 788 N LYS A 55 -3.820 0.043 7.316 1.00 0.00 N ATOM 789 CA LYS A 55 -2.471 0.063 7.868 1.00 0.00 C ATOM 790 C LYS A 55 -1.657 1.208 7.273 1.00 0.00 C ATOM 791 O LYS A 55 -1.232 1.146 6.119 1.00 0.00 O ATOM 792 CB LYS A 55 -1.768 -1.270 7.602 1.00 0.00 C ATOM 793 CG LYS A 55 -0.694 -1.605 8.621 1.00 0.00 C ATOM 794 CD LYS A 55 0.658 -1.045 8.212 1.00 0.00 C ATOM 795 CE LYS A 55 1.394 -1.991 7.277 1.00 0.00 C ATOM 796 NZ LYS A 55 2.228 -2.973 8.024 1.00 0.00 N ATOM 0 H LYS A 55 -3.864 0.181 6.306 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.548 0.216 8.944 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.511 -2.068 7.594 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -1.319 -1.243 6.609 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.976 -1.202 9.594 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.622 -2.687 8.732 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.520 -0.081 7.722 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.263 -0.867 9.101 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.672 -2.524 6.658 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.028 -1.415 6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.713 -3.600 7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.934 -2.466 8.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.620 -3.540 8.649 1.00 0.00 H new ATOM 810 N VAL A 56 -1.441 2.251 8.068 1.00 0.00 N ATOM 811 CA VAL A 56 -0.676 3.408 7.620 1.00 0.00 C ATOM 812 C VAL A 56 0.800 3.261 7.974 1.00 0.00 C ATOM 813 O VAL A 56 1.146 2.871 9.089 1.00 0.00 O ATOM 814 CB VAL A 56 -1.213 4.711 8.241 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.543 4.982 9.579 1.00 0.00 C ATOM 816 CG2 VAL A 56 -1.009 5.879 7.287 1.00 0.00 C ATOM 0 H VAL A 56 -1.785 2.318 9.026 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.784 3.459 6.537 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.283 4.596 8.415 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.936 5.907 10.002 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.746 4.156 10.261 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.533 5.077 9.434 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.394 6.792 7.742 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.054 5.998 7.079 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.541 5.685 6.356 1.00 0.00 H new ATOM 826 N VAL A 57 1.667 3.576 7.017 1.00 0.00 N ATOM 827 CA VAL A 57 3.106 3.480 7.227 1.00 0.00 C ATOM 828 C VAL A 57 3.817 4.741 6.748 1.00 0.00 C ATOM 829 O VAL A 57 4.060 4.911 5.553 1.00 0.00 O ATOM 830 CB VAL A 57 3.700 2.261 6.499 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.177 2.106 6.831 1.00 0.00 C ATOM 832 CG2 VAL A 57 2.930 0.999 6.858 1.00 0.00 C ATOM 0 H VAL A 57 1.397 3.900 6.088 1.00 0.00 H new ATOM 0 HA VAL A 57 3.262 3.364 8.300 1.00 0.00 H new ATOM 0 HB VAL A 57 3.609 2.422 5.425 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.579 1.239 6.307 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.716 3.001 6.519 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.296 1.967 7.906 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.364 0.147 6.334 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.987 0.831 7.934 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.887 1.113 6.564 1.00 0.00 H new ATOM 842 N GLU A 58 4.147 5.622 7.687 1.00 0.00 N ATOM 843 CA GLU A 58 4.830 6.868 7.359 1.00 0.00 C ATOM 844 C GLU A 58 6.316 6.625 7.114 1.00 0.00 C ATOM 845 O GLU A 58 7.052 6.236 8.022 1.00 0.00 O ATOM 846 CB GLU A 58 4.647 7.887 8.485 1.00 0.00 C ATOM 847 CG GLU A 58 3.202 8.305 8.700 1.00 0.00 C ATOM 848 CD GLU A 58 2.778 9.432 7.778 1.00 0.00 C ATOM 849 OE1 GLU A 58 3.613 9.877 6.963 1.00 0.00 O ATOM 850 OE2 GLU A 58 1.612 9.870 7.873 1.00 0.00 O ATOM 0 H GLU A 58 3.953 5.496 8.680 1.00 0.00 H new ATOM 0 HA GLU A 58 4.389 7.265 6.445 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.036 7.465 9.412 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.243 8.772 8.263 1.00 0.00 H new ATOM 0 HG2 GLU A 58 2.551 7.445 8.540 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.068 8.618 9.736 1.00 0.00 H new ATOM 857 N LEU A 59 6.752 6.858 5.881 1.00 0.00 N ATOM 858 CA LEU A 59 8.151 6.665 5.514 1.00 0.00 C ATOM 859 C LEU A 59 9.000 7.849 5.964 1.00 0.00 C ATOM 860 O LEU A 59 10.118 7.676 6.449 1.00 0.00 O ATOM 861 CB LEU A 59 8.281 6.475 4.002 1.00 0.00 C ATOM 862 CG LEU A 59 7.350 5.437 3.374 1.00 0.00 C ATOM 863 CD1 LEU A 59 7.288 5.619 1.865 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.808 4.028 3.724 1.00 0.00 C ATOM 0 H LEU A 59 6.157 7.181 5.118 1.00 0.00 H new ATOM 0 HA LEU A 59 8.513 5.769 6.019 1.00 0.00 H new ATOM 0 HB2 LEU A 59 8.101 7.435 3.518 1.00 0.00 H new ATOM 0 HB3 LEU A 59 9.310 6.193 3.778 1.00 0.00 H new ATOM 0 HG LEU A 59 6.349 5.584 3.779 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.621 4.872 1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.913 6.616 1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 59 8.286 5.500 1.443 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.134 3.303 3.269 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.819 3.870 3.348 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.800 3.901 4.807 1.00 0.00 H new ATOM 876 N ASP A 60 8.461 9.053 5.802 1.00 0.00 N ATOM 877 CA ASP A 60 9.168 10.266 6.194 1.00 0.00 C ATOM 878 C ASP A 60 9.739 10.132 7.602 1.00 0.00 C ATOM 879 O ASP A 60 10.854 10.576 7.877 1.00 0.00 O ATOM 880 CB ASP A 60 8.231 11.473 6.123 1.00 0.00 C ATOM 881 CG ASP A 60 8.981 12.791 6.142 1.00 0.00 C ATOM 882 OD1 ASP A 60 9.699 13.051 7.130 1.00 0.00 O ATOM 883 OD2 ASP A 60 8.850 13.561 5.168 1.00 0.00 O ATOM 0 H ASP A 60 7.537 9.214 5.402 1.00 0.00 H new ATOM 0 HA ASP A 60 9.995 10.416 5.499 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.633 11.412 5.214 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.538 11.441 6.963 1.00 0.00 H new ATOM 888 N LEU A 61 8.967 9.517 8.491 1.00 0.00 N ATOM 889 CA LEU A 61 9.395 9.324 9.873 1.00 0.00 C ATOM 890 C LEU A 61 10.294 8.099 9.998 1.00 0.00 C ATOM 891 O LEU A 61 11.101 8.000 10.924 1.00 0.00 O ATOM 892 CB LEU A 61 8.179 9.174 10.788 1.00 0.00 C ATOM 893 CG LEU A 61 7.260 10.392 10.889 1.00 0.00 C ATOM 894 CD1 LEU A 61 8.054 11.676 10.705 1.00 0.00 C ATOM 895 CD2 LEU A 61 6.141 10.303 9.861 1.00 0.00 C ATOM 0 H LEU A 61 8.042 9.143 8.280 1.00 0.00 H new ATOM 0 HA LEU A 61 9.964 10.202 10.177 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.589 8.327 10.439 1.00 0.00 H new ATOM 0 HB3 LEU A 61 8.531 8.926 11.789 1.00 0.00 H new ATOM 0 HG LEU A 61 6.813 10.404 11.883 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.384 12.532 10.780 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.819 11.745 11.479 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.530 11.672 9.724 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.497 11.178 9.948 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.569 10.265 8.859 1.00 0.00 H new ATOM 0 HD23 LEU A 61 5.554 9.402 10.039 1.00 0.00 H new ATOM 907 N LEU A 62 10.152 7.169 9.061 1.00 0.00 N ATOM 908 CA LEU A 62 10.953 5.950 9.064 1.00 0.00 C ATOM 909 C LEU A 62 12.422 6.263 8.794 1.00 0.00 C ATOM 910 O LEU A 62 12.746 7.275 8.174 1.00 0.00 O ATOM 911 CB LEU A 62 10.428 4.967 8.016 1.00 0.00 C ATOM 912 CG LEU A 62 9.235 4.109 8.439 1.00 0.00 C ATOM 913 CD1 LEU A 62 8.643 3.389 7.237 1.00 0.00 C ATOM 914 CD2 LEU A 62 9.649 3.111 9.510 1.00 0.00 C ATOM 0 H LEU A 62 9.489 7.236 8.289 1.00 0.00 H new ATOM 0 HA LEU A 62 10.873 5.495 10.051 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.147 5.531 7.126 1.00 0.00 H new ATOM 0 HB3 LEU A 62 11.244 4.303 7.729 1.00 0.00 H new ATOM 0 HG LEU A 62 8.471 4.764 8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.795 2.783 7.557 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.309 4.122 6.502 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.400 2.745 6.789 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.787 2.509 9.799 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.431 2.461 9.118 1.00 0.00 H new ATOM 0 HD23 LEU A 62 10.025 3.647 10.381 1.00 0.00 H new ATOM 926 N GLU A 63 13.304 5.385 9.262 1.00 0.00 N ATOM 927 CA GLU A 63 14.738 5.568 9.069 1.00 0.00 C ATOM 928 C GLU A 63 15.137 5.257 7.629 1.00 0.00 C ATOM 929 O GLU A 63 15.989 5.932 7.050 1.00 0.00 O ATOM 930 CB GLU A 63 15.523 4.675 10.032 1.00 0.00 C ATOM 931 CG GLU A 63 15.444 3.196 9.692 1.00 0.00 C ATOM 932 CD GLU A 63 15.662 2.307 10.900 1.00 0.00 C ATOM 933 OE1 GLU A 63 15.345 2.748 12.025 1.00 0.00 O ATOM 934 OE2 GLU A 63 16.149 1.172 10.722 1.00 0.00 O ATOM 0 H GLU A 63 13.051 4.541 9.777 1.00 0.00 H new ATOM 0 HA GLU A 63 14.977 6.611 9.277 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.568 4.984 10.031 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.147 4.827 11.044 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.468 2.979 9.257 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.191 2.961 8.933 1.00 0.00 H new ATOM 941 N TYR A 64 14.517 4.231 7.058 1.00 0.00 N ATOM 942 CA TYR A 64 14.809 3.827 5.688 1.00 0.00 C ATOM 943 C TYR A 64 13.722 4.312 4.734 1.00 0.00 C ATOM 944 O TYR A 64 13.332 3.604 3.807 1.00 0.00 O ATOM 945 CB TYR A 64 14.939 2.306 5.599 1.00 0.00 C ATOM 946 CG TYR A 64 14.015 1.563 6.537 1.00 0.00 C ATOM 947 CD1 TYR A 64 12.659 1.441 6.257 1.00 0.00 C ATOM 948 CD2 TYR A 64 14.497 0.984 7.705 1.00 0.00 C ATOM 949 CE1 TYR A 64 11.811 0.763 7.111 1.00 0.00 C ATOM 950 CE2 TYR A 64 13.656 0.304 8.565 1.00 0.00 C ATOM 951 CZ TYR A 64 12.314 0.197 8.264 1.00 0.00 C ATOM 952 OH TYR A 64 11.474 -0.479 9.119 1.00 0.00 O ATOM 0 H TYR A 64 13.808 3.663 7.523 1.00 0.00 H new ATOM 0 HA TYR A 64 15.755 4.283 5.395 1.00 0.00 H new ATOM 0 HB2 TYR A 64 14.734 1.992 4.576 1.00 0.00 H new ATOM 0 HB3 TYR A 64 15.969 2.024 5.818 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.261 1.884 5.356 1.00 0.00 H new ATOM 0 HD2 TYR A 64 15.547 1.067 7.945 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.760 0.677 6.877 1.00 0.00 H new ATOM 0 HE2 TYR A 64 14.047 -0.141 9.468 1.00 0.00 H new ATOM 0 HH TYR A 64 11.987 -0.817 9.882 1.00 0.00 H new ATOM 962 N GLY A 65 13.237 5.528 4.969 1.00 0.00 N ATOM 963 CA GLY A 65 12.200 6.089 4.123 1.00 0.00 C ATOM 964 C GLY A 65 12.675 6.327 2.703 1.00 0.00 C ATOM 965 O GLY A 65 12.121 5.774 1.755 1.00 0.00 O ATOM 0 H GLY A 65 13.544 6.134 5.730 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.344 5.415 4.108 1.00 0.00 H new ATOM 0 HA3 GLY A 65 11.857 7.031 4.551 1.00 0.00 H new ATOM 969 N ASN A 66 13.705 7.155 2.557 1.00 0.00 N ATOM 970 CA ASN A 66 14.254 7.467 1.242 1.00 0.00 C ATOM 971 C ASN A 66 14.393 6.204 0.397 1.00 0.00 C ATOM 972 O ASN A 66 14.398 6.267 -0.832 1.00 0.00 O ATOM 973 CB ASN A 66 15.615 8.151 1.384 1.00 0.00 C ATOM 974 CG ASN A 66 15.490 9.617 1.752 1.00 0.00 C ATOM 975 OD1 ASN A 66 15.936 10.041 2.818 1.00 0.00 O ATOM 976 ND2 ASN A 66 14.880 10.398 0.868 1.00 0.00 N ATOM 0 H ASN A 66 14.176 7.621 3.332 1.00 0.00 H new ATOM 0 HA ASN A 66 13.564 8.145 0.739 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.199 7.636 2.147 1.00 0.00 H new ATOM 0 HB3 ASN A 66 16.164 8.060 0.447 1.00 0.00 H new ATOM 0 HD21 ASN A 66 14.766 11.393 1.060 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.526 10.003 -0.003 1.00 0.00 H new ATOM 983 N GLN A 67 14.504 5.061 1.065 1.00 0.00 N ATOM 984 CA GLN A 67 14.642 3.784 0.375 1.00 0.00 C ATOM 985 C GLN A 67 13.314 3.346 -0.233 1.00 0.00 C ATOM 986 O GLN A 67 13.133 3.387 -1.450 1.00 0.00 O ATOM 987 CB GLN A 67 15.153 2.712 1.339 1.00 0.00 C ATOM 988 CG GLN A 67 16.554 2.982 1.864 1.00 0.00 C ATOM 989 CD GLN A 67 16.799 4.452 2.141 1.00 0.00 C ATOM 990 OE1 GLN A 67 16.631 4.920 3.268 1.00 0.00 O ATOM 991 NE2 GLN A 67 17.200 5.190 1.112 1.00 0.00 N ATOM 0 H GLN A 67 14.501 4.993 2.083 1.00 0.00 H new ATOM 0 HA GLN A 67 15.364 3.912 -0.431 1.00 0.00 H new ATOM 0 HB2 GLN A 67 14.466 2.637 2.182 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.144 1.746 0.833 1.00 0.00 H new ATOM 0 HG2 GLN A 67 16.711 2.412 2.780 1.00 0.00 H new ATOM 0 HG3 GLN A 67 17.285 2.626 1.138 1.00 0.00 H new ATOM 0 HE21 GLN A 67 17.326 4.761 0.195 1.00 0.00 H new ATOM 0 HE22 GLN A 67 17.382 6.186 1.239 1.00 0.00 H new ATOM 1000 N PHE A 68 12.387 2.928 0.622 1.00 0.00 N ATOM 1001 CA PHE A 68 11.074 2.482 0.169 1.00 0.00 C ATOM 1002 C PHE A 68 10.389 3.563 -0.661 1.00 0.00 C ATOM 1003 O PHE A 68 9.543 3.268 -1.505 1.00 0.00 O ATOM 1004 CB PHE A 68 10.197 2.110 1.366 1.00 0.00 C ATOM 1005 CG PHE A 68 10.594 0.817 2.021 1.00 0.00 C ATOM 1006 CD1 PHE A 68 10.840 -0.314 1.260 1.00 0.00 C ATOM 1007 CD2 PHE A 68 10.721 0.734 3.398 1.00 0.00 C ATOM 1008 CE1 PHE A 68 11.204 -1.504 1.860 1.00 0.00 C ATOM 1009 CE2 PHE A 68 11.085 -0.454 4.004 1.00 0.00 C ATOM 1010 CZ PHE A 68 11.328 -1.574 3.234 1.00 0.00 C ATOM 0 H PHE A 68 12.520 2.889 1.632 1.00 0.00 H new ATOM 0 HA PHE A 68 11.214 1.601 -0.458 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.244 2.911 2.104 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.160 2.039 1.038 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.746 -0.265 0.185 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.533 1.607 4.005 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.391 -2.379 1.255 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.179 -0.506 5.079 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.614 -2.503 3.705 1.00 0.00 H new ATOM 1020 N GLN A 69 10.760 4.815 -0.414 1.00 0.00 N ATOM 1021 CA GLN A 69 10.181 5.940 -1.138 1.00 0.00 C ATOM 1022 C GLN A 69 10.438 5.814 -2.636 1.00 0.00 C ATOM 1023 O GLN A 69 9.561 6.101 -3.452 1.00 0.00 O ATOM 1024 CB GLN A 69 10.756 7.259 -0.618 1.00 0.00 C ATOM 1025 CG GLN A 69 9.994 7.830 0.567 1.00 0.00 C ATOM 1026 CD GLN A 69 10.259 9.308 0.773 1.00 0.00 C ATOM 1027 OE1 GLN A 69 10.842 9.712 1.780 1.00 0.00 O ATOM 1028 NE2 GLN A 69 9.831 10.126 -0.182 1.00 0.00 N ATOM 0 H GLN A 69 11.459 5.076 0.282 1.00 0.00 H new ATOM 0 HA GLN A 69 9.104 5.931 -0.971 1.00 0.00 H new ATOM 0 HB2 GLN A 69 11.796 7.104 -0.330 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.755 7.990 -1.426 1.00 0.00 H new ATOM 0 HG2 GLN A 69 8.926 7.674 0.417 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.272 7.286 1.469 1.00 0.00 H new ATOM 0 HE21 GLN A 69 9.352 9.749 -1.000 1.00 0.00 H new ATOM 0 HE22 GLN A 69 9.981 11.131 -0.097 1.00 0.00 H new ATOM 1037 N ASP A 70 11.644 5.386 -2.990 1.00 0.00 N ATOM 1038 CA ASP A 70 12.017 5.221 -4.390 1.00 0.00 C ATOM 1039 C ASP A 70 11.359 3.980 -4.986 1.00 0.00 C ATOM 1040 O ASP A 70 10.645 4.063 -5.985 1.00 0.00 O ATOM 1041 CB ASP A 70 13.537 5.124 -4.528 1.00 0.00 C ATOM 1042 CG ASP A 70 13.998 5.261 -5.966 1.00 0.00 C ATOM 1043 OD1 ASP A 70 13.288 5.917 -6.757 1.00 0.00 O ATOM 1044 OD2 ASP A 70 15.070 4.714 -6.299 1.00 0.00 O ATOM 0 H ASP A 70 12.381 5.147 -2.327 1.00 0.00 H new ATOM 0 HA ASP A 70 11.666 6.095 -4.939 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.004 5.902 -3.924 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.875 4.167 -4.131 1.00 0.00 H new ATOM 1049 N ALA A 71 11.606 2.831 -4.366 1.00 0.00 N ATOM 1050 CA ALA A 71 11.038 1.573 -4.834 1.00 0.00 C ATOM 1051 C ALA A 71 9.546 1.716 -5.115 1.00 0.00 C ATOM 1052 O ALA A 71 9.009 1.070 -6.017 1.00 0.00 O ATOM 1053 CB ALA A 71 11.281 0.472 -3.812 1.00 0.00 C ATOM 0 H ALA A 71 12.196 2.745 -3.538 1.00 0.00 H new ATOM 0 HA ALA A 71 11.533 1.304 -5.767 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.852 -0.462 -4.174 1.00 0.00 H new ATOM 0 HB2 ALA A 71 12.353 0.345 -3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.813 0.744 -2.866 1.00 0.00 H new ATOM 1059 N LEU A 72 8.881 2.564 -4.339 1.00 0.00 N ATOM 1060 CA LEU A 72 7.449 2.791 -4.505 1.00 0.00 C ATOM 1061 C LEU A 72 7.171 3.626 -5.751 1.00 0.00 C ATOM 1062 O LEU A 72 6.237 3.346 -6.502 1.00 0.00 O ATOM 1063 CB LEU A 72 6.878 3.490 -3.270 1.00 0.00 C ATOM 1064 CG LEU A 72 6.633 2.603 -2.049 1.00 0.00 C ATOM 1065 CD1 LEU A 72 6.239 3.446 -0.847 1.00 0.00 C ATOM 1066 CD2 LEU A 72 5.560 1.566 -2.350 1.00 0.00 C ATOM 0 H LEU A 72 9.310 3.106 -3.589 1.00 0.00 H new ATOM 0 HA LEU A 72 6.963 1.823 -4.624 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.560 4.290 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.935 3.960 -3.547 1.00 0.00 H new ATOM 0 HG LEU A 72 7.560 2.080 -1.812 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.069 2.797 0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.040 4.149 -0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.326 3.997 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.399 0.943 -1.470 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.630 2.070 -2.613 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.882 0.941 -3.183 1.00 0.00 H new ATOM 1078 N TYR A 73 7.989 4.650 -5.965 1.00 0.00 N ATOM 1079 CA TYR A 73 7.832 5.526 -7.120 1.00 0.00 C ATOM 1080 C TYR A 73 7.775 4.718 -8.413 1.00 0.00 C ATOM 1081 O TYR A 73 7.171 5.142 -9.398 1.00 0.00 O ATOM 1082 CB TYR A 73 8.982 6.533 -7.184 1.00 0.00 C ATOM 1083 CG TYR A 73 9.094 7.240 -8.516 1.00 0.00 C ATOM 1084 CD1 TYR A 73 9.696 6.621 -9.604 1.00 0.00 C ATOM 1085 CD2 TYR A 73 8.599 8.527 -8.685 1.00 0.00 C ATOM 1086 CE1 TYR A 73 9.802 7.263 -10.823 1.00 0.00 C ATOM 1087 CE2 TYR A 73 8.698 9.176 -9.900 1.00 0.00 C ATOM 1088 CZ TYR A 73 9.301 8.540 -10.966 1.00 0.00 C ATOM 1089 OH TYR A 73 9.403 9.185 -12.178 1.00 0.00 O ATOM 0 H TYR A 73 8.768 4.894 -5.354 1.00 0.00 H new ATOM 0 HA TYR A 73 6.892 6.066 -7.009 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.847 7.276 -6.398 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.919 6.016 -6.977 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.088 5.621 -9.495 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.129 9.029 -7.852 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.274 6.768 -11.659 1.00 0.00 H new ATOM 0 HE2 TYR A 73 8.306 10.176 -10.015 1.00 0.00 H new ATOM 0 HH TYR A 73 9.000 10.076 -12.110 1.00 0.00 H new ATOM 1099 N LYS A 74 8.408 3.550 -8.401 1.00 0.00 N ATOM 1100 CA LYS A 74 8.430 2.679 -9.570 1.00 0.00 C ATOM 1101 C LYS A 74 7.102 1.946 -9.727 1.00 0.00 C ATOM 1102 O LYS A 74 6.479 1.991 -10.787 1.00 0.00 O ATOM 1103 CB LYS A 74 9.574 1.668 -9.457 1.00 0.00 C ATOM 1104 CG LYS A 74 10.953 2.297 -9.551 1.00 0.00 C ATOM 1105 CD LYS A 74 11.393 2.878 -8.217 1.00 0.00 C ATOM 1106 CE LYS A 74 12.908 2.872 -8.079 1.00 0.00 C ATOM 1107 NZ LYS A 74 13.453 1.488 -8.020 1.00 0.00 N ATOM 0 H LYS A 74 8.913 3.184 -7.594 1.00 0.00 H new ATOM 0 HA LYS A 74 8.588 3.300 -10.452 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.489 1.140 -8.507 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.469 0.923 -10.246 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.674 1.548 -9.878 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.945 3.083 -10.306 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.022 3.899 -8.123 1.00 0.00 H new ATOM 0 HD3 LYS A 74 10.950 2.302 -7.404 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.352 3.402 -8.922 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.193 3.413 -7.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.357 1.493 -7.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 12.778 0.870 -7.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.606 1.134 -8.986 1.00 0.00 H new ATOM 1121 N MET A 75 6.675 1.272 -8.664 1.00 0.00 N ATOM 1122 CA MET A 75 5.419 0.531 -8.684 1.00 0.00 C ATOM 1123 C MET A 75 4.258 1.439 -9.078 1.00 0.00 C ATOM 1124 O MET A 75 3.358 1.031 -9.813 1.00 0.00 O ATOM 1125 CB MET A 75 5.150 -0.096 -7.315 1.00 0.00 C ATOM 1126 CG MET A 75 6.319 -0.904 -6.776 1.00 0.00 C ATOM 1127 SD MET A 75 5.795 -2.249 -5.695 1.00 0.00 S ATOM 1128 CE MET A 75 4.908 -1.341 -4.431 1.00 0.00 C ATOM 0 H MET A 75 7.180 1.224 -7.779 1.00 0.00 H new ATOM 0 HA MET A 75 5.505 -0.261 -9.427 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.907 0.694 -6.604 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.275 -0.742 -7.386 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.887 -1.314 -7.611 1.00 0.00 H new ATOM 0 HG3 MET A 75 6.990 -0.243 -6.228 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.428 -1.442 -3.478 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.857 -0.288 -4.707 1.00 0.00 H new ATOM 0 HE3 MET A 75 3.898 -1.740 -4.337 1.00 0.00 H new ATOM 1138 N THR A 76 4.283 2.673 -8.583 1.00 0.00 N ATOM 1139 CA THR A 76 3.233 3.638 -8.882 1.00 0.00 C ATOM 1140 C THR A 76 3.564 4.440 -10.135 1.00 0.00 C ATOM 1141 O THR A 76 2.736 4.572 -11.036 1.00 0.00 O ATOM 1142 CB THR A 76 3.012 4.609 -7.707 1.00 0.00 C ATOM 1143 OG1 THR A 76 4.035 5.612 -7.702 1.00 0.00 O ATOM 1144 CG2 THR A 76 3.017 3.865 -6.381 1.00 0.00 C ATOM 0 H THR A 76 5.020 3.027 -7.973 1.00 0.00 H new ATOM 0 HA THR A 76 2.319 3.069 -9.050 1.00 0.00 H new ATOM 0 HB THR A 76 2.039 5.083 -7.834 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.730 6.388 -7.187 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.859 4.572 -5.567 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.219 3.123 -6.377 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.977 3.366 -6.247 1.00 0.00 H new ATOM 1152 N GLY A 77 4.781 4.974 -10.187 1.00 0.00 N ATOM 1153 CA GLY A 77 5.199 5.757 -11.335 1.00 0.00 C ATOM 1154 C GLY A 77 5.203 7.246 -11.051 1.00 0.00 C ATOM 1155 O GLY A 77 5.271 8.059 -11.972 1.00 0.00 O ATOM 0 H GLY A 77 5.484 4.878 -9.455 1.00 0.00 H new ATOM 0 HA2 GLY A 77 6.198 5.446 -11.639 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.533 5.552 -12.173 1.00 0.00 H new ATOM 1159 N GLU A 78 5.128 7.603 -9.773 1.00 0.00 N ATOM 1160 CA GLU A 78 5.120 9.005 -9.372 1.00 0.00 C ATOM 1161 C GLU A 78 5.488 9.152 -7.899 1.00 0.00 C ATOM 1162 O GLU A 78 5.498 8.175 -7.150 1.00 0.00 O ATOM 1163 CB GLU A 78 3.744 9.625 -9.629 1.00 0.00 C ATOM 1164 CG GLU A 78 3.795 11.110 -9.945 1.00 0.00 C ATOM 1165 CD GLU A 78 2.458 11.654 -10.409 1.00 0.00 C ATOM 1166 OE1 GLU A 78 1.419 11.062 -10.048 1.00 0.00 O ATOM 1167 OE2 GLU A 78 2.451 12.672 -11.132 1.00 0.00 O ATOM 0 H GLU A 78 5.072 6.942 -8.998 1.00 0.00 H new ATOM 0 HA GLU A 78 5.865 9.531 -9.969 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.268 9.102 -10.458 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.116 9.470 -8.752 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.117 11.656 -9.058 1.00 0.00 H new ATOM 0 HG3 GLU A 78 4.543 11.288 -10.717 1.00 0.00 H new ATOM 1174 N ARG A 79 5.792 10.380 -7.490 1.00 0.00 N ATOM 1175 CA ARG A 79 6.163 10.655 -6.107 1.00 0.00 C ATOM 1176 C ARG A 79 5.076 11.461 -5.402 1.00 0.00 C ATOM 1177 O ARG A 79 5.353 12.486 -4.778 1.00 0.00 O ATOM 1178 CB ARG A 79 7.490 11.413 -6.054 1.00 0.00 C ATOM 1179 CG ARG A 79 7.480 12.715 -6.839 1.00 0.00 C ATOM 1180 CD ARG A 79 8.626 13.624 -6.426 1.00 0.00 C ATOM 1181 NE ARG A 79 8.473 14.975 -6.959 1.00 0.00 N ATOM 1182 CZ ARG A 79 8.601 15.277 -8.246 1.00 0.00 C ATOM 1183 NH1 ARG A 79 8.883 14.327 -9.128 1.00 0.00 N ATOM 1184 NH2 ARG A 79 8.446 16.530 -8.654 1.00 0.00 N ATOM 0 H ARG A 79 5.789 11.200 -8.097 1.00 0.00 H new ATOM 0 HA ARG A 79 6.276 9.701 -5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 79 7.735 11.628 -5.014 1.00 0.00 H new ATOM 0 HB3 ARG A 79 8.281 10.771 -6.442 1.00 0.00 H new ATOM 0 HG2 ARG A 79 7.552 12.499 -7.905 1.00 0.00 H new ATOM 0 HG3 ARG A 79 6.532 13.229 -6.681 1.00 0.00 H new ATOM 0 HD2 ARG A 79 8.680 13.668 -5.338 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.568 13.201 -6.775 1.00 0.00 H new ATOM 0 HE ARG A 79 8.256 15.728 -6.307 1.00 0.00 H new ATOM 0 HH11 ARG A 79 9.002 13.362 -8.818 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.981 14.561 -10.116 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.228 17.263 -7.979 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.545 16.760 -9.643 1.00 0.00 H new ATOM 1198 N THR A 80 3.837 10.991 -5.506 1.00 0.00 N ATOM 1199 CA THR A 80 2.707 11.667 -4.881 1.00 0.00 C ATOM 1200 C THR A 80 2.276 10.953 -3.605 1.00 0.00 C ATOM 1201 O THR A 80 2.522 9.759 -3.437 1.00 0.00 O ATOM 1202 CB THR A 80 1.504 11.755 -5.839 1.00 0.00 C ATOM 1203 OG1 THR A 80 0.706 10.571 -5.732 1.00 0.00 O ATOM 1204 CG2 THR A 80 1.969 11.931 -7.277 1.00 0.00 C ATOM 0 H THR A 80 3.591 10.144 -6.018 1.00 0.00 H new ATOM 0 HA THR A 80 3.039 12.675 -4.635 1.00 0.00 H new ATOM 0 HB THR A 80 0.907 12.622 -5.559 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.058 10.635 -6.343 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.102 11.991 -7.935 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.552 12.848 -7.361 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.586 11.081 -7.566 1.00 0.00 H new ATOM 1212 N VAL A 81 1.630 11.692 -2.709 1.00 0.00 N ATOM 1213 CA VAL A 81 1.162 11.128 -1.448 1.00 0.00 C ATOM 1214 C VAL A 81 -0.136 11.789 -0.999 1.00 0.00 C ATOM 1215 O VAL A 81 -0.470 12.901 -1.408 1.00 0.00 O ATOM 1216 CB VAL A 81 2.217 11.287 -0.337 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.161 10.094 -0.323 1.00 0.00 C ATOM 1218 CG2 VAL A 81 2.989 12.585 -0.516 1.00 0.00 C ATOM 0 H VAL A 81 1.419 12.682 -2.833 1.00 0.00 H new ATOM 0 HA VAL A 81 0.985 10.067 -1.622 1.00 0.00 H new ATOM 0 HB VAL A 81 1.704 11.326 0.624 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.900 10.224 0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.592 9.182 -0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.669 10.020 -1.285 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.730 12.680 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.492 12.579 -1.483 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.299 13.428 -0.471 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.888 11.089 -0.136 1.00 0.00 N ATOM 1229 CA PRO A 82 -0.502 9.764 0.357 1.00 0.00 C ATOM 1230 C PRO A 82 -0.580 8.696 -0.728 1.00 0.00 C ATOM 1231 O PRO A 82 -0.986 8.973 -1.857 1.00 0.00 O ATOM 1232 CB PRO A 82 -1.527 9.483 1.459 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.714 10.303 1.089 1.00 0.00 C ATOM 1234 CD PRO A 82 -2.174 11.538 0.424 1.00 0.00 C ATOM 0 HA PRO A 82 0.532 9.743 0.702 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.777 8.423 1.506 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.142 9.764 2.439 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.373 9.754 0.416 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.301 10.560 1.971 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.846 11.902 -0.353 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.040 12.352 1.136 1.00 0.00 H new ATOM 1242 N ARG A 83 -0.187 7.475 -0.380 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.213 6.366 -1.325 1.00 0.00 C ATOM 1244 C ARG A 83 -1.011 5.192 -0.765 1.00 0.00 C ATOM 1245 O ARG A 83 -0.597 4.551 0.201 1.00 0.00 O ATOM 1246 CB ARG A 83 1.212 5.916 -1.654 1.00 0.00 C ATOM 1247 CG ARG A 83 2.123 7.051 -2.093 1.00 0.00 C ATOM 1248 CD ARG A 83 3.584 6.728 -1.823 1.00 0.00 C ATOM 1249 NE ARG A 83 4.217 6.064 -2.960 1.00 0.00 N ATOM 1250 CZ ARG A 83 4.575 6.694 -4.073 1.00 0.00 C ATOM 1251 NH1 ARG A 83 4.364 7.997 -4.198 1.00 0.00 N ATOM 1252 NH2 ARG A 83 5.145 6.020 -5.064 1.00 0.00 N ATOM 0 H ARG A 83 0.153 7.229 0.550 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.699 6.711 -2.238 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.643 5.434 -0.777 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.174 5.166 -2.444 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.982 7.242 -3.157 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.848 7.965 -1.566 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.122 7.648 -1.595 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.657 6.089 -0.943 1.00 0.00 H new ATOM 0 HE ARG A 83 4.394 5.061 -2.895 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.926 8.518 -3.438 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.640 8.479 -5.054 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.308 5.017 -4.971 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.420 6.505 -5.919 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.157 4.917 -1.378 1.00 0.00 N ATOM 1267 CA ILE A 84 -3.013 3.821 -0.942 1.00 0.00 C ATOM 1268 C ILE A 84 -2.799 2.580 -1.801 1.00 0.00 C ATOM 1269 O ILE A 84 -2.786 2.657 -3.030 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.501 4.214 -0.990 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -4.760 5.426 -0.092 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.373 3.041 -0.571 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.564 6.751 -0.794 1.00 0.00 C ATOM 0 H ILE A 84 -2.514 5.438 -2.179 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.738 3.598 0.089 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.757 4.483 -2.015 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.780 5.374 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.094 5.379 0.770 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.422 3.335 -0.610 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.205 2.203 -1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.118 2.743 0.446 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.765 7.565 -0.097 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.537 6.825 -1.152 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.249 6.820 -1.639 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.632 1.435 -1.147 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.419 0.176 -1.851 1.00 0.00 C ATOM 1287 C PHE A 85 -3.409 -0.885 -1.380 1.00 0.00 C ATOM 1288 O PHE A 85 -3.449 -1.232 -0.199 1.00 0.00 O ATOM 1289 CB PHE A 85 -0.986 -0.316 -1.638 1.00 0.00 C ATOM 1290 CG PHE A 85 0.020 0.365 -2.521 1.00 0.00 C ATOM 1291 CD1 PHE A 85 0.323 -0.146 -3.772 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.664 1.518 -2.099 1.00 0.00 C ATOM 1293 CE1 PHE A 85 1.247 0.478 -4.587 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.589 2.147 -2.910 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.882 1.626 -4.155 1.00 0.00 C ATOM 0 H PHE A 85 -2.640 1.353 -0.130 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.581 0.351 -2.915 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.708 -0.159 -0.596 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -0.949 -1.390 -1.820 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.170 -1.044 -4.115 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.440 1.929 -1.126 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.473 0.069 -5.561 1.00 0.00 H new ATOM 0 HE2 PHE A 85 2.083 3.046 -2.571 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.606 2.115 -4.790 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.206 -1.397 -2.312 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.196 -2.419 -1.993 1.00 0.00 C ATOM 1307 C VAL A 86 -4.785 -3.776 -2.553 1.00 0.00 C ATOM 1308 O VAL A 86 -4.459 -3.899 -3.733 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.585 -2.047 -2.546 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.562 -3.197 -2.353 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.101 -0.781 -1.881 1.00 0.00 C ATOM 0 H VAL A 86 -4.186 -1.121 -3.294 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.250 -2.479 -0.906 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.492 -1.856 -3.615 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.538 -2.916 -2.750 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.196 -4.078 -2.880 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.653 -3.422 -1.290 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.083 -0.533 -2.284 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.179 -0.941 -0.806 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.411 0.040 -2.076 1.00 0.00 H new ATOM 1321 N ASN A 87 -4.803 -4.793 -1.698 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.432 -6.143 -2.107 1.00 0.00 C ATOM 1323 C ASN A 87 -3.178 -6.122 -2.976 1.00 0.00 C ATOM 1324 O ASN A 87 -3.038 -6.919 -3.903 1.00 0.00 O ATOM 1325 CB ASN A 87 -5.583 -6.802 -2.870 1.00 0.00 C ATOM 1326 CG ASN A 87 -6.538 -7.539 -1.952 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -6.873 -7.056 -0.870 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -6.982 -8.715 -2.380 1.00 0.00 N ATOM 0 H ASN A 87 -5.071 -4.708 -0.717 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.221 -6.723 -1.209 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.131 -6.040 -3.424 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.177 -7.499 -3.603 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -7.627 -9.257 -1.805 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -6.678 -9.077 -3.284 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.266 -5.205 -2.668 1.00 0.00 N ATOM 1336 CA GLY A 88 -1.035 -5.097 -3.429 1.00 0.00 C ATOM 1337 C GLY A 88 -1.264 -4.571 -4.832 1.00 0.00 C ATOM 1338 O GLY A 88 -0.753 -5.128 -5.804 1.00 0.00 O ATOM 0 H GLY A 88 -2.358 -4.535 -1.905 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.345 -4.436 -2.905 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.559 -6.076 -3.485 1.00 0.00 H new ATOM 1342 N THR A 89 -2.038 -3.495 -4.940 1.00 0.00 N ATOM 1343 CA THR A 89 -2.337 -2.896 -6.234 1.00 0.00 C ATOM 1344 C THR A 89 -2.688 -1.419 -6.088 1.00 0.00 C ATOM 1345 O THR A 89 -3.577 -1.056 -5.318 1.00 0.00 O ATOM 1346 CB THR A 89 -3.501 -3.622 -6.934 1.00 0.00 C ATOM 1347 OG1 THR A 89 -3.048 -4.871 -7.469 1.00 0.00 O ATOM 1348 CG2 THR A 89 -4.079 -2.766 -8.051 1.00 0.00 C ATOM 0 H THR A 89 -2.469 -3.021 -4.146 1.00 0.00 H new ATOM 0 HA THR A 89 -1.439 -2.995 -6.843 1.00 0.00 H new ATOM 0 HB THR A 89 -4.282 -3.805 -6.196 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.211 -5.130 -7.031 1.00 0.00 H new ATOM 0 HG21 THR A 89 -4.900 -3.299 -8.531 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.449 -1.828 -7.636 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.303 -2.556 -8.787 1.00 0.00 H new ATOM 1356 N PHE A 90 -1.985 -0.572 -6.833 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.223 0.866 -6.786 1.00 0.00 C ATOM 1358 C PHE A 90 -3.546 1.220 -7.458 1.00 0.00 C ATOM 1359 O PHE A 90 -3.668 1.159 -8.682 1.00 0.00 O ATOM 1360 CB PHE A 90 -1.075 1.616 -7.465 1.00 0.00 C ATOM 1361 CG PHE A 90 -1.016 3.073 -7.104 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -0.306 3.497 -5.992 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -1.670 4.019 -7.877 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -0.249 4.837 -5.658 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -1.616 5.360 -7.548 1.00 0.00 C ATOM 1366 CZ PHE A 90 -0.906 5.769 -6.436 1.00 0.00 C ATOM 0 H PHE A 90 -1.246 -0.857 -7.476 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.276 1.167 -5.740 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.131 1.144 -7.193 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.178 1.521 -8.546 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.209 2.772 -5.379 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.228 3.705 -8.746 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.309 5.154 -4.789 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.128 6.088 -8.160 1.00 0.00 H new ATOM 0 HZ PHE A 90 -0.865 6.816 -6.176 1.00 0.00 H new ATOM 1376 N ILE A 91 -4.533 1.590 -6.649 1.00 0.00 N ATOM 1377 CA ILE A 91 -5.847 1.955 -7.165 1.00 0.00 C ATOM 1378 C ILE A 91 -5.985 3.468 -7.297 1.00 0.00 C ATOM 1379 O ILE A 91 -6.878 3.963 -7.984 1.00 0.00 O ATOM 1380 CB ILE A 91 -6.974 1.425 -6.260 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -7.008 2.203 -4.943 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -6.789 -0.062 -5.998 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -5.901 1.820 -3.986 1.00 0.00 C ATOM 0 H ILE A 91 -4.448 1.645 -5.634 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.938 1.497 -8.150 1.00 0.00 H new ATOM 0 HB ILE A 91 -7.927 1.568 -6.770 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.938 3.269 -5.158 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.970 2.038 -4.458 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -7.594 -0.421 -5.357 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -6.809 -0.603 -6.944 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.831 -0.228 -5.505 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.987 2.411 -3.074 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.982 0.761 -3.741 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.935 2.011 -4.452 1.00 0.00 H new ATOM 1395 N GLY A 92 -5.092 4.198 -6.636 1.00 0.00 N ATOM 1396 CA GLY A 92 -5.130 5.648 -6.694 1.00 0.00 C ATOM 1397 C GLY A 92 -4.692 6.292 -5.393 1.00 0.00 C ATOM 1398 O GLY A 92 -4.441 5.603 -4.405 1.00 0.00 O ATOM 0 H GLY A 92 -4.343 3.812 -6.061 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.485 5.993 -7.502 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.143 5.973 -6.934 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.598 7.618 -5.393 1.00 0.00 N ATOM 1403 CA GLY A 93 -4.186 8.332 -4.200 1.00 0.00 C ATOM 1404 C GLY A 93 -5.350 8.651 -3.283 1.00 0.00 C ATOM 1405 O GLY A 93 -6.421 8.058 -3.400 1.00 0.00 O ATOM 0 H GLY A 93 -4.800 8.210 -6.199 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.454 7.734 -3.658 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.690 9.259 -4.488 1.00 0.00 H new ATOM 1409 N ALA A 94 -5.140 9.590 -2.366 1.00 0.00 N ATOM 1410 CA ALA A 94 -6.180 9.987 -1.426 1.00 0.00 C ATOM 1411 C ALA A 94 -7.451 10.406 -2.158 1.00 0.00 C ATOM 1412 O ALA A 94 -8.562 10.169 -1.683 1.00 0.00 O ATOM 1413 CB ALA A 94 -5.685 11.116 -0.535 1.00 0.00 C ATOM 0 H ALA A 94 -4.258 10.090 -2.255 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.418 9.126 -0.802 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.473 11.402 0.162 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.810 10.782 0.023 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.416 11.974 -1.151 1.00 0.00 H new ATOM 1419 N THR A 95 -7.280 11.032 -3.318 1.00 0.00 N ATOM 1420 CA THR A 95 -8.412 11.487 -4.115 1.00 0.00 C ATOM 1421 C THR A 95 -9.082 10.322 -4.835 1.00 0.00 C ATOM 1422 O THR A 95 -10.204 9.938 -4.505 1.00 0.00 O ATOM 1423 CB THR A 95 -7.982 12.538 -5.155 1.00 0.00 C ATOM 1424 OG1 THR A 95 -6.967 13.386 -4.604 1.00 0.00 O ATOM 1425 CG2 THR A 95 -9.169 13.381 -5.597 1.00 0.00 C ATOM 0 H THR A 95 -6.368 11.235 -3.727 1.00 0.00 H new ATOM 0 HA THR A 95 -9.122 11.940 -3.423 1.00 0.00 H new ATOM 0 HB THR A 95 -7.585 12.014 -6.025 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.698 14.051 -5.272 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.840 14.116 -6.332 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.927 12.737 -6.043 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.592 13.895 -4.734 1.00 0.00 H new ATOM 1433 N ASP A 96 -8.386 9.762 -5.818 1.00 0.00 N ATOM 1434 CA ASP A 96 -8.912 8.638 -6.584 1.00 0.00 C ATOM 1435 C ASP A 96 -9.578 7.619 -5.665 1.00 0.00 C ATOM 1436 O ASP A 96 -10.744 7.268 -5.849 1.00 0.00 O ATOM 1437 CB ASP A 96 -7.793 7.968 -7.382 1.00 0.00 C ATOM 1438 CG ASP A 96 -7.467 8.715 -8.660 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -8.403 9.245 -9.294 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -6.274 8.769 -9.027 1.00 0.00 O ATOM 0 H ASP A 96 -7.456 10.068 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.662 9.021 -7.276 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.898 7.904 -6.764 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -8.086 6.947 -7.626 1.00 0.00 H new ATOM 1445 N THR A 97 -8.830 7.145 -4.673 1.00 0.00 N ATOM 1446 CA THR A 97 -9.346 6.165 -3.726 1.00 0.00 C ATOM 1447 C THR A 97 -10.679 6.617 -3.139 1.00 0.00 C ATOM 1448 O THR A 97 -11.602 5.817 -2.980 1.00 0.00 O ATOM 1449 CB THR A 97 -8.351 5.915 -2.578 1.00 0.00 C ATOM 1450 OG1 THR A 97 -7.159 5.307 -3.087 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.967 5.020 -1.513 1.00 0.00 C ATOM 0 H THR A 97 -7.864 7.425 -4.505 1.00 0.00 H new ATOM 0 HA THR A 97 -9.491 5.237 -4.279 1.00 0.00 H new ATOM 0 HB THR A 97 -8.104 6.875 -2.125 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.533 6.004 -3.373 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.245 4.858 -0.712 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.858 5.498 -1.107 1.00 0.00 H new ATOM 0 HG23 THR A 97 -9.239 4.062 -1.956 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.773 7.903 -2.818 1.00 0.00 N ATOM 1460 CA HIS A 98 -11.995 8.462 -2.249 1.00 0.00 C ATOM 1461 C HIS A 98 -13.160 8.327 -3.225 1.00 0.00 C ATOM 1462 O HIS A 98 -14.284 8.020 -2.827 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.787 9.932 -1.885 1.00 0.00 C ATOM 1464 CG HIS A 98 -13.032 10.612 -1.404 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -14.072 9.937 -0.800 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -13.400 11.914 -1.440 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -15.027 10.795 -0.486 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.643 12.001 -0.863 1.00 0.00 N ATOM 0 H HIS A 98 -10.018 8.578 -2.942 1.00 0.00 H new ATOM 0 HA HIS A 98 -12.235 7.902 -1.345 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -11.023 10.001 -1.111 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.406 10.463 -2.757 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.824 12.732 -1.847 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.962 10.551 -0.003 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -15.183 12.859 -0.745 1.00 0.00 H new ATOM 1476 N ARG A 99 -12.884 8.558 -4.504 1.00 0.00 N ATOM 1477 CA ARG A 99 -13.909 8.464 -5.536 1.00 0.00 C ATOM 1478 C ARG A 99 -14.373 7.021 -5.712 1.00 0.00 C ATOM 1479 O ARG A 99 -15.569 6.730 -5.653 1.00 0.00 O ATOM 1480 CB ARG A 99 -13.377 9.005 -6.865 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.407 8.995 -7.983 1.00 0.00 C ATOM 1482 CD ARG A 99 -13.750 8.826 -9.344 1.00 0.00 C ATOM 1483 NE ARG A 99 -14.733 8.770 -10.422 1.00 0.00 N ATOM 1484 CZ ARG A 99 -14.431 8.454 -11.677 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -13.180 8.166 -12.008 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -15.381 8.424 -12.602 1.00 0.00 N ATOM 0 H ARG A 99 -11.959 8.812 -4.850 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.761 9.066 -5.221 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -13.024 10.026 -6.717 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.516 8.411 -7.171 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.117 8.185 -7.818 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -14.975 9.925 -7.965 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.064 9.655 -9.521 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.155 7.913 -9.348 1.00 0.00 H new ATOM 0 HE ARG A 99 -15.705 8.985 -10.200 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.447 8.187 -11.299 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.950 7.924 -12.972 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -16.345 8.644 -12.351 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.148 8.181 -13.565 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.420 6.121 -5.929 1.00 0.00 N ATOM 1501 CA LEU A 100 -13.731 4.708 -6.114 1.00 0.00 C ATOM 1502 C LEU A 100 -14.847 4.267 -5.172 1.00 0.00 C ATOM 1503 O LEU A 100 -15.886 3.774 -5.612 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.482 3.856 -5.877 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.280 4.164 -6.770 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -10.049 3.413 -6.286 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -11.587 3.811 -8.218 1.00 0.00 C ATOM 0 H LEU A 100 -12.426 6.345 -5.981 1.00 0.00 H new ATOM 0 HA LEU A 100 -14.071 4.568 -7.140 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.177 3.976 -4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -12.750 2.808 -6.012 1.00 0.00 H new ATOM 0 HG LEU A 100 -11.074 5.233 -6.713 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.203 3.645 -6.934 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.817 3.715 -5.265 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.243 2.341 -6.312 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.720 4.037 -8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.820 2.749 -8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -12.441 4.394 -8.561 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.626 4.451 -3.874 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.614 4.075 -2.870 1.00 0.00 C ATOM 1521 C HIS A 101 -17.005 4.560 -3.268 1.00 0.00 C ATOM 1522 O HIS A 101 -17.993 3.842 -3.111 1.00 0.00 O ATOM 1523 CB HIS A 101 -15.232 4.651 -1.506 1.00 0.00 C ATOM 1524 CG HIS A 101 -15.994 4.050 -0.366 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -16.247 2.699 -0.259 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.559 4.624 0.722 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -16.936 2.468 0.844 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.138 3.620 1.458 1.00 0.00 N ATOM 0 H HIS A 101 -13.772 4.858 -3.493 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.632 2.987 -2.804 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -14.166 4.496 -1.341 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.399 5.728 -1.516 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -15.949 1.989 -0.927 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.555 5.676 0.966 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -17.276 1.502 1.186 1.00 0.00 H new ATOM 1536 N LYS A 102 -17.075 5.782 -3.784 1.00 0.00 N ATOM 1537 CA LYS A 102 -18.343 6.364 -4.205 1.00 0.00 C ATOM 1538 C LYS A 102 -18.900 5.632 -5.421 1.00 0.00 C ATOM 1539 O LYS A 102 -20.107 5.417 -5.528 1.00 0.00 O ATOM 1540 CB LYS A 102 -18.164 7.849 -4.529 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.579 8.656 -3.383 1.00 0.00 C ATOM 1542 CD LYS A 102 -17.984 10.118 -3.465 1.00 0.00 C ATOM 1543 CE LYS A 102 -18.067 10.751 -2.085 1.00 0.00 C ATOM 1544 NZ LYS A 102 -18.864 12.010 -2.100 1.00 0.00 N ATOM 0 H LYS A 102 -16.267 6.389 -3.921 1.00 0.00 H new ATOM 0 HA LYS A 102 -19.052 6.260 -3.384 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.515 7.947 -5.399 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -19.131 8.271 -4.803 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -17.914 8.238 -2.434 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.492 8.577 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -17.262 10.663 -4.074 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -18.950 10.202 -3.964 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -18.517 10.044 -1.388 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -17.061 10.962 -1.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -18.897 12.411 -1.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -18.421 12.694 -2.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -19.831 11.805 -2.423 1.00 0.00 H new ATOM 1558 N GLU A 103 -18.013 5.249 -6.334 1.00 0.00 N ATOM 1559 CA GLU A 103 -18.418 4.539 -7.542 1.00 0.00 C ATOM 1560 C GLU A 103 -18.468 3.034 -7.298 1.00 0.00 C ATOM 1561 O GLU A 103 -18.680 2.251 -8.222 1.00 0.00 O ATOM 1562 CB GLU A 103 -17.454 4.849 -8.689 1.00 0.00 C ATOM 1563 CG GLU A 103 -17.580 6.265 -9.225 1.00 0.00 C ATOM 1564 CD GLU A 103 -18.698 6.407 -10.240 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -19.800 5.875 -9.988 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -18.471 7.051 -11.286 1.00 0.00 O ATOM 0 H GLU A 103 -17.010 5.418 -6.260 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.417 4.878 -7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.432 4.689 -8.346 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -17.632 4.145 -9.502 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -17.758 6.949 -8.395 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -16.637 6.561 -9.685 1.00 0.00 H new ATOM 1573 N GLY A 104 -18.272 2.637 -6.044 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.298 1.227 -5.700 1.00 0.00 C ATOM 1575 C GLY A 104 -17.174 0.449 -6.356 1.00 0.00 C ATOM 1576 O GLY A 104 -17.285 -0.759 -6.565 1.00 0.00 O ATOM 0 H GLY A 104 -18.096 3.266 -5.261 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.227 1.119 -4.618 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.255 0.800 -6.001 1.00 0.00 H new ATOM 1580 N LYS A 105 -16.089 1.142 -6.683 1.00 0.00 N ATOM 1581 CA LYS A 105 -14.940 0.510 -7.320 1.00 0.00 C ATOM 1582 C LYS A 105 -13.867 0.170 -6.291 1.00 0.00 C ATOM 1583 O LYS A 105 -12.809 -0.360 -6.634 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.357 1.430 -8.395 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.404 2.021 -9.323 1.00 0.00 C ATOM 1586 CD LYS A 105 -14.782 2.534 -10.611 1.00 0.00 C ATOM 1587 CE LYS A 105 -15.726 3.468 -11.352 1.00 0.00 C ATOM 1588 NZ LYS A 105 -15.531 4.889 -10.950 1.00 0.00 N ATOM 0 H LYS A 105 -15.981 2.143 -6.517 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.278 -0.415 -7.786 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -13.813 2.241 -7.911 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.633 0.870 -8.987 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -16.153 1.265 -9.556 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -15.921 2.837 -8.817 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.853 3.058 -10.384 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -14.524 1.691 -11.253 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -15.566 3.369 -12.426 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -16.757 3.173 -11.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -16.385 5.436 -11.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.355 4.939 -9.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.717 5.286 -11.461 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.146 0.475 -5.028 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.205 0.199 -3.949 1.00 0.00 C ATOM 1604 C LEU A 106 -13.681 -0.972 -3.096 1.00 0.00 C ATOM 1605 O LEU A 106 -12.884 -1.807 -2.667 1.00 0.00 O ATOM 1606 CB LEU A 106 -13.024 1.441 -3.074 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.784 1.457 -2.179 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.461 2.877 -1.740 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -11.988 0.557 -0.969 1.00 0.00 C ATOM 0 H LEU A 106 -15.016 0.913 -4.727 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.247 -0.067 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -12.990 2.316 -3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.905 1.547 -2.441 1.00 0.00 H new ATOM 0 HG LEU A 106 -10.940 1.075 -2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.576 2.869 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.271 3.495 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.304 3.286 -1.183 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.096 0.581 -0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.844 0.909 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -12.171 -0.465 -1.302 1.00 0.00 H new ATOM 1621 N LEU A 107 -14.987 -1.030 -2.857 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.571 -2.101 -2.057 1.00 0.00 C ATOM 1623 C LEU A 107 -15.298 -3.463 -2.689 1.00 0.00 C ATOM 1624 O LEU A 107 -14.941 -4.428 -2.013 1.00 0.00 O ATOM 1625 CB LEU A 107 -17.079 -1.889 -1.908 1.00 0.00 C ATOM 1626 CG LEU A 107 -17.717 -2.471 -0.646 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -17.997 -3.955 -0.826 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -16.820 -2.238 0.561 1.00 0.00 C ATOM 0 H LEU A 107 -15.661 -0.348 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.108 -2.078 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -17.279 -0.818 -1.931 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.574 -2.325 -2.776 1.00 0.00 H new ATOM 0 HG LEU A 107 -18.665 -1.962 -0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -18.451 -4.352 0.082 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.678 -4.098 -1.665 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -17.063 -4.480 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -17.290 -2.659 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.857 -2.721 0.397 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -16.670 -1.168 0.702 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.469 -3.544 -4.017 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.243 -4.782 -4.769 1.00 0.00 C ATOM 1642 C PRO A 108 -13.917 -5.445 -4.412 1.00 0.00 C ATOM 1643 O PRO A 108 -13.746 -6.651 -4.590 1.00 0.00 O ATOM 1644 CB PRO A 108 -15.232 -4.314 -6.226 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.054 -3.072 -6.232 1.00 0.00 C ATOM 1646 CD PRO A 108 -15.894 -2.434 -4.886 1.00 0.00 C ATOM 0 HA PRO A 108 -16.002 -5.534 -4.554 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -14.217 -4.118 -6.571 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -15.653 -5.071 -6.888 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -15.725 -2.396 -7.021 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.101 -3.304 -6.427 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.151 -1.636 -4.908 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -16.828 -1.991 -4.540 1.00 0.00 H new ATOM 1654 N LEU A 109 -12.981 -4.649 -3.907 1.00 0.00 N ATOM 1655 CA LEU A 109 -11.669 -5.158 -3.524 1.00 0.00 C ATOM 1656 C LEU A 109 -11.600 -5.410 -2.021 1.00 0.00 C ATOM 1657 O LEU A 109 -11.091 -6.439 -1.576 1.00 0.00 O ATOM 1658 CB LEU A 109 -10.576 -4.172 -3.938 1.00 0.00 C ATOM 1659 CG LEU A 109 -10.819 -3.408 -5.240 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -9.836 -2.256 -5.375 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -10.713 -4.344 -6.435 1.00 0.00 C ATOM 0 H LEU A 109 -13.106 -3.648 -3.753 1.00 0.00 H new ATOM 0 HA LEU A 109 -11.510 -6.105 -4.040 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.445 -3.448 -3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.638 -4.719 -4.031 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.828 -2.996 -5.214 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.025 -1.724 -6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.960 -1.572 -4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.818 -2.645 -5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -10.889 -3.783 -7.353 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.717 -4.785 -6.464 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.458 -5.135 -6.345 1.00 0.00 H new ATOM 1673 N VAL A 110 -12.118 -4.464 -1.243 1.00 0.00 N ATOM 1674 CA VAL A 110 -12.118 -4.585 0.210 1.00 0.00 C ATOM 1675 C VAL A 110 -12.590 -5.967 0.647 1.00 0.00 C ATOM 1676 O VAL A 110 -12.056 -6.547 1.593 1.00 0.00 O ATOM 1677 CB VAL A 110 -13.018 -3.518 0.861 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -13.041 -3.688 2.372 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -12.549 -2.122 0.481 1.00 0.00 C ATOM 0 H VAL A 110 -12.543 -3.606 -1.595 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.090 -4.435 0.540 1.00 0.00 H new ATOM 0 HB VAL A 110 -14.034 -3.649 0.489 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -13.682 -2.925 2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -13.428 -4.676 2.621 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -12.030 -3.585 2.765 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -13.196 -1.381 0.950 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.524 -1.977 0.823 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -12.590 -2.007 -0.602 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.594 -6.491 -0.049 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.138 -7.807 0.266 1.00 0.00 C ATOM 1691 C HIS A 111 -13.195 -8.911 -0.202 1.00 0.00 C ATOM 1692 O HIS A 111 -12.723 -9.717 0.600 1.00 0.00 O ATOM 1693 CB HIS A 111 -15.511 -7.984 -0.384 1.00 0.00 C ATOM 1694 CG HIS A 111 -16.599 -7.211 0.295 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -17.915 -7.245 -0.116 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -16.562 -6.382 1.364 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -18.639 -6.468 0.670 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -17.842 -5.933 1.577 1.00 0.00 N ATOM 0 H HIS A 111 -14.047 -6.024 -0.835 1.00 0.00 H new ATOM 0 HA HIS A 111 -14.245 -7.879 1.348 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -15.453 -7.674 -1.427 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -15.772 -9.042 -0.380 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -15.688 -6.122 1.942 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -19.702 -6.299 0.585 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -18.130 -5.291 2.315 1.00 0.00 H new ATOM 1706 N GLN A 112 -12.925 -8.941 -1.503 1.00 0.00 N ATOM 1707 CA GLN A 112 -12.040 -9.947 -2.076 1.00 0.00 C ATOM 1708 C GLN A 112 -10.920 -10.305 -1.104 1.00 0.00 C ATOM 1709 O GLN A 112 -10.476 -11.452 -1.046 1.00 0.00 O ATOM 1710 CB GLN A 112 -11.446 -9.444 -3.393 1.00 0.00 C ATOM 1711 CG GLN A 112 -12.402 -9.547 -4.570 1.00 0.00 C ATOM 1712 CD GLN A 112 -12.346 -10.900 -5.251 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -13.082 -11.819 -4.892 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -11.469 -11.030 -6.240 1.00 0.00 N ATOM 0 H GLN A 112 -13.307 -8.280 -2.180 1.00 0.00 H new ATOM 0 HA GLN A 112 -12.629 -10.844 -2.270 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -11.143 -8.404 -3.272 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -10.545 -10.014 -3.617 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.419 -9.360 -4.225 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -12.164 -8.769 -5.296 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -10.878 -10.242 -6.505 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -11.386 -11.918 -6.735 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.468 -9.315 -0.341 1.00 0.00 N ATOM 1724 CA CYS A 113 -9.399 -9.524 0.629 1.00 0.00 C ATOM 1725 C CYS A 113 -9.837 -10.498 1.719 1.00 0.00 C ATOM 1726 O CYS A 113 -9.260 -11.575 1.872 1.00 0.00 O ATOM 1727 CB CYS A 113 -8.985 -8.192 1.257 1.00 0.00 C ATOM 1728 SG CYS A 113 -7.423 -8.265 2.192 1.00 0.00 S ATOM 0 H CYS A 113 -10.825 -8.360 -0.376 1.00 0.00 H new ATOM 0 HA CYS A 113 -8.545 -9.952 0.105 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -8.890 -7.445 0.469 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -9.779 -7.854 1.923 1.00 0.00 H new ATOM 1733 N TYR A 114 -10.860 -10.113 2.473 1.00 0.00 N ATOM 1734 CA TYR A 114 -11.374 -10.950 3.550 1.00 0.00 C ATOM 1735 C TYR A 114 -12.618 -11.711 3.102 1.00 0.00 C ATOM 1736 O TYR A 114 -13.419 -12.156 3.925 1.00 0.00 O ATOM 1737 CB TYR A 114 -11.700 -10.097 4.777 1.00 0.00 C ATOM 1738 CG TYR A 114 -13.125 -9.591 4.803 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -13.482 -8.427 4.133 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -14.113 -10.277 5.497 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -14.782 -7.961 4.154 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -15.416 -9.819 5.523 1.00 0.00 C ATOM 1743 CZ TYR A 114 -15.746 -8.661 4.850 1.00 0.00 C ATOM 1744 OH TYR A 114 -17.042 -8.201 4.874 1.00 0.00 O ATOM 0 H TYR A 114 -11.350 -9.226 2.358 1.00 0.00 H new ATOM 0 HA TYR A 114 -10.602 -11.673 3.813 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -11.516 -10.684 5.677 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -11.020 -9.245 4.808 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -12.730 -7.877 3.586 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -13.858 -11.184 6.025 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -15.042 -7.054 3.629 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -16.172 -10.365 6.067 1.00 0.00 H new ATOM 0 HH TYR A 114 -17.435 -8.377 5.754 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.773 -11.858 1.791 1.00 0.00 N ATOM 1755 CA LEU A 115 -13.919 -12.567 1.230 1.00 0.00 C ATOM 1756 C LEU A 115 -13.864 -14.051 1.576 1.00 0.00 C ATOM 1757 O LEU A 115 -12.813 -14.575 1.946 1.00 0.00 O ATOM 1758 CB LEU A 115 -13.962 -12.386 -0.288 1.00 0.00 C ATOM 1759 CG LEU A 115 -15.315 -12.633 -0.955 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -16.403 -11.817 -0.274 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -15.247 -12.301 -2.439 1.00 0.00 C ATOM 0 H LEU A 115 -12.120 -11.496 1.096 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.825 -12.145 1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.644 -11.370 -0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -13.231 -13.059 -0.735 1.00 0.00 H new ATOM 0 HG LEU A 115 -15.562 -13.689 -0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -17.359 -12.006 -0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -16.469 -12.103 0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -16.162 -10.757 -0.347 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -16.219 -12.483 -2.897 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -14.977 -11.253 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -14.496 -12.929 -2.918 1.00 0.00 H new ATOM 1773 N LYS A 116 -15.002 -14.725 1.452 1.00 0.00 N ATOM 1774 CA LYS A 116 -15.084 -16.150 1.747 1.00 0.00 C ATOM 1775 C LYS A 116 -13.820 -16.874 1.295 1.00 0.00 C ATOM 1776 O LYS A 116 -13.119 -16.416 0.392 1.00 0.00 O ATOM 1777 CB LYS A 116 -16.308 -16.764 1.064 1.00 0.00 C ATOM 1778 CG LYS A 116 -16.850 -17.992 1.775 1.00 0.00 C ATOM 1779 CD LYS A 116 -17.548 -17.622 3.073 1.00 0.00 C ATOM 1780 CE LYS A 116 -18.211 -18.832 3.714 1.00 0.00 C ATOM 1781 NZ LYS A 116 -19.372 -19.315 2.916 1.00 0.00 N ATOM 0 H LYS A 116 -15.881 -14.306 1.149 1.00 0.00 H new ATOM 0 HA LYS A 116 -15.181 -16.266 2.826 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -17.095 -16.012 1.004 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -16.046 -17.033 0.041 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -17.549 -18.513 1.121 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -16.033 -18.683 1.984 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -16.825 -17.192 3.766 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -18.298 -16.855 2.878 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -17.481 -19.635 3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -18.543 -18.574 4.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -19.926 -19.988 3.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -19.972 -18.508 2.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -19.029 -19.787 2.055 1.00 0.00 H new ATOM 1795 N LYS A 117 -13.534 -18.007 1.927 1.00 0.00 N ATOM 1796 CA LYS A 117 -12.355 -18.796 1.588 1.00 0.00 C ATOM 1797 C LYS A 117 -11.081 -18.094 2.044 1.00 0.00 C ATOM 1798 O LYS A 117 -10.094 -18.038 1.310 1.00 0.00 O ATOM 1799 CB LYS A 117 -12.300 -19.046 0.079 1.00 0.00 C ATOM 1800 CG LYS A 117 -11.461 -20.252 -0.307 1.00 0.00 C ATOM 1801 CD LYS A 117 -11.130 -20.248 -1.790 1.00 0.00 C ATOM 1802 CE LYS A 117 -10.222 -21.410 -2.162 1.00 0.00 C ATOM 1803 NZ LYS A 117 -10.999 -22.634 -2.505 1.00 0.00 N ATOM 0 H LYS A 117 -14.103 -18.400 2.677 1.00 0.00 H new ATOM 0 HA LYS A 117 -12.427 -19.752 2.106 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -13.314 -19.185 -0.295 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.897 -18.161 -0.413 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.538 -20.255 0.273 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -11.999 -21.166 -0.056 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -12.051 -20.305 -2.370 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.646 -19.308 -2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.598 -21.126 -3.010 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.551 -21.627 -1.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -10.344 -23.403 -2.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -11.575 -22.920 -1.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -11.621 -22.435 -3.314 1.00 0.00 H new ATOM 1817 N SER A 118 -11.107 -17.560 3.261 1.00 0.00 N ATOM 1818 CA SER A 118 -9.954 -16.860 3.815 1.00 0.00 C ATOM 1819 C SER A 118 -9.590 -17.414 5.189 1.00 0.00 C ATOM 1820 O SER A 118 -10.319 -18.227 5.757 1.00 0.00 O ATOM 1821 CB SER A 118 -10.243 -15.361 3.917 1.00 0.00 C ATOM 1822 OG SER A 118 -11.054 -15.073 5.042 1.00 0.00 O ATOM 0 H SER A 118 -11.915 -17.599 3.883 1.00 0.00 H new ATOM 0 HA SER A 118 -9.109 -17.016 3.145 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.305 -14.811 3.991 1.00 0.00 H new ATOM 0 HB3 SER A 118 -10.741 -15.021 3.009 1.00 0.00 H new ATOM 0 HG SER A 118 -11.223 -14.109 5.085 1.00 0.00 H new ATOM 1828 N LYS A 119 -8.455 -16.968 5.717 1.00 0.00 N ATOM 1829 CA LYS A 119 -7.992 -17.417 7.025 1.00 0.00 C ATOM 1830 C LYS A 119 -9.164 -17.606 7.982 1.00 0.00 C ATOM 1831 O LYS A 119 -10.173 -16.908 7.888 1.00 0.00 O ATOM 1832 CB LYS A 119 -6.999 -16.410 7.610 1.00 0.00 C ATOM 1833 CG LYS A 119 -5.557 -16.677 7.215 1.00 0.00 C ATOM 1834 CD LYS A 119 -4.925 -17.740 8.098 1.00 0.00 C ATOM 1835 CE LYS A 119 -3.660 -18.306 7.472 1.00 0.00 C ATOM 1836 NZ LYS A 119 -3.129 -19.464 8.242 1.00 0.00 N ATOM 0 H LYS A 119 -7.839 -16.296 5.259 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.493 -18.378 6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -7.276 -15.408 7.284 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -7.078 -16.425 8.697 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.517 -16.997 6.174 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.982 -15.754 7.287 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.690 -17.312 9.072 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.640 -18.545 8.268 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -3.869 -18.616 6.448 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -2.901 -17.526 7.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -2.267 -19.820 7.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -2.905 -19.163 9.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.844 -20.219 8.270 1.00 0.00 H new ATOM 1850 N ARG A 120 -9.023 -18.554 8.903 1.00 0.00 N ATOM 1851 CA ARG A 120 -10.070 -18.834 9.878 1.00 0.00 C ATOM 1852 C ARG A 120 -10.439 -17.575 10.657 1.00 0.00 C ATOM 1853 O ARG A 120 -9.657 -16.627 10.734 1.00 0.00 O ATOM 1854 CB ARG A 120 -9.617 -19.930 10.844 1.00 0.00 C ATOM 1855 CG ARG A 120 -9.558 -21.312 10.214 1.00 0.00 C ATOM 1856 CD ARG A 120 -8.417 -21.420 9.215 1.00 0.00 C ATOM 1857 NE ARG A 120 -8.820 -20.998 7.876 1.00 0.00 N ATOM 1858 CZ ARG A 120 -9.756 -21.613 7.162 1.00 0.00 C ATOM 1859 NH1 ARG A 120 -10.382 -22.672 7.657 1.00 0.00 N ATOM 1860 NH2 ARG A 120 -10.067 -21.170 5.951 1.00 0.00 N ATOM 0 H ARG A 120 -8.194 -19.141 8.994 1.00 0.00 H new ATOM 0 HA ARG A 120 -10.952 -19.177 9.338 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -8.631 -19.675 11.233 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -10.298 -19.957 11.695 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -9.433 -22.063 10.994 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -10.503 -21.526 9.714 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -7.581 -20.807 9.552 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -8.063 -22.450 9.179 1.00 0.00 H new ATOM 0 HE ARG A 120 -8.357 -20.186 7.467 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -10.145 -23.016 8.588 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -11.101 -23.143 7.107 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -9.587 -20.356 5.567 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -10.786 -21.643 5.404 1.00 0.00 H new ATOM 1874 N LYS A 121 -11.637 -17.571 11.231 1.00 0.00 N ATOM 1875 CA LYS A 121 -12.112 -16.429 12.005 1.00 0.00 C ATOM 1876 C LYS A 121 -13.446 -16.742 12.674 1.00 0.00 C ATOM 1877 O LYS A 121 -14.379 -17.216 12.026 1.00 0.00 O ATOM 1878 CB LYS A 121 -12.256 -15.201 11.103 1.00 0.00 C ATOM 1879 CG LYS A 121 -13.411 -15.300 10.121 1.00 0.00 C ATOM 1880 CD LYS A 121 -13.396 -14.152 9.126 1.00 0.00 C ATOM 1881 CE LYS A 121 -14.366 -14.395 7.980 1.00 0.00 C ATOM 1882 NZ LYS A 121 -13.805 -15.333 6.969 1.00 0.00 N ATOM 0 H LYS A 121 -12.298 -18.346 11.175 1.00 0.00 H new ATOM 0 HA LYS A 121 -11.378 -16.217 12.782 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -12.394 -14.317 11.726 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -11.329 -15.058 10.548 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -13.354 -16.248 9.586 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -14.355 -15.298 10.666 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -13.658 -13.224 9.635 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -12.388 -14.025 8.730 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -15.299 -14.800 8.373 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -14.607 -13.446 7.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -14.496 -15.473 6.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -12.928 -14.935 6.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -13.598 -16.247 7.420 1.00 0.00 H new ATOM 1896 N GLU A 122 -13.530 -16.473 13.973 1.00 0.00 N ATOM 1897 CA GLU A 122 -14.751 -16.726 14.728 1.00 0.00 C ATOM 1898 C GLU A 122 -15.528 -15.432 14.955 1.00 0.00 C ATOM 1899 O GLU A 122 -15.471 -14.842 16.035 1.00 0.00 O ATOM 1900 CB GLU A 122 -14.421 -17.378 16.072 1.00 0.00 C ATOM 1901 CG GLU A 122 -13.529 -16.526 16.959 1.00 0.00 C ATOM 1902 CD GLU A 122 -12.691 -17.355 17.913 1.00 0.00 C ATOM 1903 OE1 GLU A 122 -13.275 -18.155 18.674 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -11.452 -17.204 17.897 1.00 0.00 O ATOM 0 H GLU A 122 -12.767 -16.080 14.524 1.00 0.00 H new ATOM 0 HA GLU A 122 -15.373 -17.406 14.146 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -15.350 -17.590 16.601 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -13.932 -18.335 15.892 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -12.871 -15.923 16.334 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -14.147 -15.834 17.531 1.00 0.00 H new ATOM 1911 N PHE A 123 -16.253 -14.996 13.931 1.00 0.00 N ATOM 1912 CA PHE A 123 -17.040 -13.771 14.017 1.00 0.00 C ATOM 1913 C PHE A 123 -17.922 -13.604 12.784 1.00 0.00 C ATOM 1914 O PHE A 123 -17.906 -14.438 11.879 1.00 0.00 O ATOM 1915 CB PHE A 123 -16.120 -12.558 14.169 1.00 0.00 C ATOM 1916 CG PHE A 123 -16.795 -11.368 14.788 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -17.483 -11.488 15.984 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -16.743 -10.127 14.172 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -18.105 -10.395 16.556 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -17.363 -9.030 14.739 1.00 0.00 C ATOM 1921 CZ PHE A 123 -18.046 -9.164 15.932 1.00 0.00 C ATOM 0 H PHE A 123 -16.312 -15.473 13.031 1.00 0.00 H new ATOM 0 HA PHE A 123 -17.683 -13.842 14.894 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -15.262 -12.837 14.780 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -15.736 -12.278 13.188 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -17.534 -12.448 16.476 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -16.212 -10.016 13.238 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -18.637 -10.503 17.490 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -17.314 -8.068 14.250 1.00 0.00 H new ATOM 0 HZ PHE A 123 -18.533 -8.308 16.376 1.00 0.00 H new ATOM 1931 N GLN A 124 -18.691 -12.520 12.756 1.00 0.00 N ATOM 1932 CA GLN A 124 -19.581 -12.243 11.635 1.00 0.00 C ATOM 1933 C GLN A 124 -18.947 -11.247 10.670 1.00 0.00 C ATOM 1934 O GLN A 124 -18.891 -11.486 9.463 1.00 0.00 O ATOM 1935 CB GLN A 124 -20.919 -11.701 12.140 1.00 0.00 C ATOM 1936 CG GLN A 124 -21.950 -12.784 12.416 1.00 0.00 C ATOM 1937 CD GLN A 124 -23.142 -12.269 13.199 1.00 0.00 C ATOM 1938 OE1 GLN A 124 -23.516 -11.102 13.086 1.00 0.00 O ATOM 1939 NE2 GLN A 124 -23.745 -13.141 13.999 1.00 0.00 N ATOM 0 H GLN A 124 -18.715 -11.819 13.497 1.00 0.00 H new ATOM 0 HA GLN A 124 -19.754 -13.178 11.102 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -20.749 -11.132 13.054 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -21.322 -11.007 11.402 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -22.295 -13.202 11.470 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -21.479 -13.596 12.970 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -23.400 -14.099 14.061 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -24.553 -12.853 14.551 1.00 0.00 H new ATOM 1948 N SER A 125 -18.471 -10.129 11.208 1.00 0.00 N ATOM 1949 CA SER A 125 -17.844 -9.095 10.394 1.00 0.00 C ATOM 1950 C SER A 125 -18.515 -8.999 9.027 1.00 0.00 C ATOM 1951 O SER A 125 -17.848 -8.846 8.005 1.00 0.00 O ATOM 1952 CB SER A 125 -16.352 -9.384 10.223 1.00 0.00 C ATOM 1953 OG SER A 125 -15.647 -8.218 9.835 1.00 0.00 O ATOM 0 H SER A 125 -18.508 -9.916 12.205 1.00 0.00 H new ATOM 0 HA SER A 125 -17.965 -8.141 10.907 1.00 0.00 H new ATOM 0 HB2 SER A 125 -15.943 -9.765 11.159 1.00 0.00 H new ATOM 0 HB3 SER A 125 -16.213 -10.163 9.473 1.00 0.00 H new ATOM 0 HG SER A 125 -16.045 -7.852 9.018 1.00 0.00 H new ATOM 1959 N GLY A 126 -19.842 -9.089 9.018 1.00 0.00 N ATOM 1960 CA GLY A 126 -20.582 -9.011 7.772 1.00 0.00 C ATOM 1961 C GLY A 126 -22.082 -9.062 7.985 1.00 0.00 C ATOM 1962 O GLY A 126 -22.710 -10.115 7.881 1.00 0.00 O ATOM 0 H GLY A 126 -20.417 -9.214 9.851 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -20.323 -8.087 7.256 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -20.282 -9.833 7.123 1.00 0.00 H new ATOM 1966 N PRO A 127 -22.679 -7.901 8.293 1.00 0.00 N ATOM 1967 CA PRO A 127 -24.122 -7.791 8.529 1.00 0.00 C ATOM 1968 C PRO A 127 -24.934 -7.984 7.253 1.00 0.00 C ATOM 1969 O PRO A 127 -24.382 -8.272 6.191 1.00 0.00 O ATOM 1970 CB PRO A 127 -24.288 -6.364 9.058 1.00 0.00 C ATOM 1971 CG PRO A 127 -23.124 -5.618 8.504 1.00 0.00 C ATOM 1972 CD PRO A 127 -21.993 -6.606 8.434 1.00 0.00 C ATOM 0 HA PRO A 127 -24.482 -8.558 9.214 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -25.231 -5.927 8.730 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -24.289 -6.343 10.148 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -23.352 -5.216 7.517 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -22.864 -4.772 9.140 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -21.336 -6.405 7.588 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -21.376 -6.574 9.332 1.00 0.00 H new ATOM 1980 N SER A 128 -26.249 -7.822 7.363 1.00 0.00 N ATOM 1981 CA SER A 128 -27.138 -7.981 6.218 1.00 0.00 C ATOM 1982 C SER A 128 -26.570 -7.280 4.988 1.00 0.00 C ATOM 1983 O SER A 128 -26.270 -6.087 5.024 1.00 0.00 O ATOM 1984 CB SER A 128 -28.526 -7.425 6.542 1.00 0.00 C ATOM 1985 OG SER A 128 -29.412 -7.598 5.450 1.00 0.00 O ATOM 0 H SER A 128 -26.722 -7.581 8.234 1.00 0.00 H new ATOM 0 HA SER A 128 -27.223 -9.046 6.000 1.00 0.00 H new ATOM 0 HB2 SER A 128 -28.926 -7.928 7.422 1.00 0.00 H new ATOM 0 HB3 SER A 128 -28.449 -6.366 6.787 1.00 0.00 H new ATOM 0 HG SER A 128 -30.293 -7.236 5.683 1.00 0.00 H new ATOM 1991 N SER A 129 -26.426 -8.030 3.901 1.00 0.00 N ATOM 1992 CA SER A 129 -25.891 -7.483 2.660 1.00 0.00 C ATOM 1993 C SER A 129 -27.001 -7.276 1.634 1.00 0.00 C ATOM 1994 O SER A 129 -28.160 -7.606 1.882 1.00 0.00 O ATOM 1995 CB SER A 129 -24.819 -8.413 2.087 1.00 0.00 C ATOM 1996 OG SER A 129 -23.797 -8.659 3.037 1.00 0.00 O ATOM 0 H SER A 129 -26.672 -9.019 3.854 1.00 0.00 H new ATOM 0 HA SER A 129 -25.441 -6.516 2.883 1.00 0.00 H new ATOM 0 HB2 SER A 129 -25.275 -9.356 1.786 1.00 0.00 H new ATOM 0 HB3 SER A 129 -24.387 -7.967 1.191 1.00 0.00 H new ATOM 0 HG SER A 129 -23.125 -9.257 2.647 1.00 0.00 H new ATOM 2002 N GLY A 130 -26.637 -6.726 0.479 1.00 0.00 N ATOM 2003 CA GLY A 130 -27.612 -6.484 -0.567 1.00 0.00 C ATOM 2004 C GLY A 130 -27.094 -6.859 -1.941 1.00 0.00 C ATOM 2005 O GLY A 130 -25.894 -6.778 -2.203 1.00 0.00 O ATOM 0 H GLY A 130 -25.684 -6.444 0.250 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -28.516 -7.054 -0.355 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -27.891 -5.430 -0.563 1.00 0.00 H new TER 2009 GLY A 130