USER MOD reduce.3.24.130724 H: found=0, std=0, add=1134, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1129 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 49 THR OG1 : rot -159:sc= 0.351 USER MOD Set 1.2: A 52 LYS NZ :NH3+ 144:sc= 0.684 (180deg=-0.0019) USER MOD Set 2.1: A 17 SER OG : rot 92:sc= 1.11 USER MOD Set 2.2: A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 80:sc= 0.0397 USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-2.5!) USER MOD Single : A 13 LYS NZ :NH3+ -172:sc= 1.18 (180deg=1.13) USER MOD Single : A 15 THR OG1 : rot -1:sc= 0.571 USER MOD Single : A 16 SER OG : rot -77:sc= 0.148 USER MOD Single : A 21 GLN : amide:sc=-0.00825 K(o=-0.0083,f=-3!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 170:sc= 1.46 (180deg=1.17) USER MOD Single : A 30 LYS NZ :NH3+ -114:sc= 1.26 (180deg=0.503) USER MOD Single : A 31 SER OG : rot -160:sc= 0.00154 USER MOD Single : A 37 LYS NZ :NH3+ -163:sc= -0.0812 (180deg=-0.56) USER MOD Single : A 42 THR OG1 : rot -69:sc= 0.764 USER MOD Single : A 44 GLN : amide:sc= -0.84 X(o=-0.84,f=-0.55) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -160:sc= 0.344 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc=-0.00245 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -98:sc= 1.09 USER MOD Single : A 77 HIS : no HD1:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 79 THR OG1 : rot 165:sc= 1.17 USER MOD Single : A 81 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.097) USER MOD Single : A 85 HIS : no HE2:sc= -0.469 X(o=-0.47,f=-0.83) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot -177:sc= 1.23 USER MOD Single : A 95 SER OG : rot -170:sc= -0.0628 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc=-0.00688 USER MOD Single : A 109 LYS NZ :NH3+ -172:sc= -0.0116 (180deg=-0.15) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 2:sc= 0.497 USER MOD Single : A 115 CYS SG : rot 180:sc= -0.293 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0.252 K(o=0.25,f=-4!) USER MOD Single : A 120 TYR OH : rot 180:sc= -0.985 USER MOD Single : A 121 ASN : amide:sc= 1.97 K(o=2,f=-6.6!) USER MOD Single : A 127 ASN : amide:sc= -0.379 K(o=-0.38,f=-3.1!) USER MOD Single : A 132 THR OG1 : rot -100:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -0.164 K(o=-0.16,f=-2.8!) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 140 ASN :FLIP amide:sc= -0.7 F(o=-1.4,f=-0.7) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc=-0.00879 K(o=-0.0088,f=-0.73) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.520 9.701 -9.475 1.00 64.32 N ATOM 2 CA GLY A 1 26.212 9.448 -10.888 1.00 1.21 C ATOM 3 C GLY A 1 25.309 8.236 -11.005 1.00 53.22 C ATOM 4 O GLY A 1 24.111 8.389 -11.236 1.00 72.05 O ATOM 0 H1 GLY A 1 27.139 10.533 -9.398 1.00 64.32 H new ATOM 0 H2 GLY A 1 25.638 9.877 -8.953 1.00 64.32 H new ATOM 0 H3 GLY A 1 27.001 8.872 -9.071 1.00 64.32 H new ATOM 0 HA2 GLY A 1 25.725 10.320 -11.326 1.00 1.21 H new ATOM 0 HA3 GLY A 1 27.133 9.283 -11.447 1.00 1.21 H new ATOM 8 N ALA A 2 25.880 7.043 -10.836 1.00 3.52 N ATOM 9 CA ALA A 2 25.193 5.774 -10.679 1.00 60.02 C ATOM 10 C ALA A 2 25.405 5.320 -9.234 1.00 53.13 C ATOM 11 O ALA A 2 26.205 4.425 -8.963 1.00 44.31 O ATOM 12 CB ALA A 2 25.730 4.775 -11.711 1.00 4.51 C ATOM 0 H ALA A 2 26.894 6.938 -10.804 1.00 3.52 H new ATOM 0 HA ALA A 2 24.122 5.857 -10.861 1.00 60.02 H new ATOM 0 HB1 ALA A 2 25.216 3.821 -11.596 1.00 4.51 H new ATOM 0 HB2 ALA A 2 25.557 5.161 -12.716 1.00 4.51 H new ATOM 0 HB3 ALA A 2 26.799 4.632 -11.557 1.00 4.51 H new ATOM 18 N GLU A 3 24.722 5.989 -8.311 1.00 54.55 N ATOM 19 CA GLU A 3 24.622 5.622 -6.910 1.00 52.42 C ATOM 20 C GLU A 3 23.171 5.865 -6.543 1.00 51.51 C ATOM 21 O GLU A 3 22.697 6.999 -6.647 1.00 61.14 O ATOM 22 CB GLU A 3 25.556 6.475 -6.041 1.00 0.12 C ATOM 23 CG GLU A 3 25.195 6.335 -4.551 1.00 60.21 C ATOM 24 CD GLU A 3 26.190 7.073 -3.675 1.00 21.33 C ATOM 25 OE1 GLU A 3 26.128 8.326 -3.609 1.00 71.14 O ATOM 26 OE2 GLU A 3 27.101 6.409 -3.136 1.00 3.42 O ATOM 0 H GLU A 3 24.202 6.838 -8.532 1.00 54.55 H new ATOM 0 HA GLU A 3 24.920 4.587 -6.743 1.00 52.42 H new ATOM 0 HB2 GLU A 3 26.590 6.168 -6.200 1.00 0.12 H new ATOM 0 HB3 GLU A 3 25.485 7.521 -6.340 1.00 0.12 H new ATOM 0 HG2 GLU A 3 24.193 6.727 -4.378 1.00 60.21 H new ATOM 0 HG3 GLU A 3 25.176 5.280 -4.276 1.00 60.21 H new ATOM 33 N GLU A 4 22.453 4.820 -6.161 1.00 55.12 N ATOM 34 CA GLU A 4 21.035 4.925 -5.883 1.00 60.42 C ATOM 35 C GLU A 4 20.780 4.508 -4.446 1.00 4.44 C ATOM 36 O GLU A 4 21.707 4.244 -3.669 1.00 21.14 O ATOM 37 CB GLU A 4 20.192 4.158 -6.900 1.00 32.01 C ATOM 38 CG GLU A 4 20.807 4.074 -8.292 1.00 1.23 C ATOM 39 CD GLU A 4 21.721 2.854 -8.482 1.00 1.44 C ATOM 40 OE1 GLU A 4 22.124 2.217 -7.475 1.00 65.45 O ATOM 41 OE2 GLU A 4 22.025 2.530 -9.651 1.00 2.33 O ATOM 0 H GLU A 4 22.836 3.883 -6.037 1.00 55.12 H new ATOM 0 HA GLU A 4 20.719 5.962 -5.992 1.00 60.42 H new ATOM 0 HB2 GLU A 4 20.026 3.147 -6.528 1.00 32.01 H new ATOM 0 HB3 GLU A 4 19.214 4.634 -6.976 1.00 32.01 H new ATOM 0 HG2 GLU A 4 20.008 4.039 -9.033 1.00 1.23 H new ATOM 0 HG3 GLU A 4 21.380 4.981 -8.484 1.00 1.23 H new ATOM 48 N GLU A 5 19.515 4.504 -4.057 1.00 42.32 N ATOM 49 CA GLU A 5 19.122 4.116 -2.725 1.00 71.14 C ATOM 50 C GLU A 5 19.031 2.594 -2.691 1.00 23.22 C ATOM 51 O GLU A 5 18.535 1.961 -3.627 1.00 12.31 O ATOM 52 CB GLU A 5 17.823 4.842 -2.394 1.00 52.44 C ATOM 53 CG GLU A 5 17.466 4.776 -0.906 1.00 41.25 C ATOM 54 CD GLU A 5 18.377 5.626 -0.001 1.00 61.33 C ATOM 55 OE1 GLU A 5 19.242 6.393 -0.494 1.00 11.51 O ATOM 56 OE2 GLU A 5 18.180 5.606 1.236 1.00 33.00 O ATOM 0 H GLU A 5 18.737 4.771 -4.660 1.00 42.32 H new ATOM 0 HA GLU A 5 19.840 4.400 -1.956 1.00 71.14 H new ATOM 0 HB2 GLU A 5 17.909 5.886 -2.696 1.00 52.44 H new ATOM 0 HB3 GLU A 5 17.011 4.407 -2.977 1.00 52.44 H new ATOM 0 HG2 GLU A 5 16.435 5.105 -0.776 1.00 41.25 H new ATOM 0 HG3 GLU A 5 17.513 3.738 -0.578 1.00 41.25 H new ATOM 63 N ASP A 6 19.570 2.009 -1.631 1.00 13.44 N ATOM 64 CA ASP A 6 19.537 0.582 -1.380 1.00 64.31 C ATOM 65 C ASP A 6 18.140 0.222 -0.894 1.00 12.21 C ATOM 66 O ASP A 6 17.549 0.952 -0.096 1.00 12.42 O ATOM 67 CB ASP A 6 20.581 0.204 -0.330 1.00 12.10 C ATOM 68 CG ASP A 6 20.412 -1.260 0.045 1.00 62.41 C ATOM 69 OD1 ASP A 6 20.785 -2.123 -0.784 1.00 3.30 O ATOM 70 OD2 ASP A 6 19.859 -1.527 1.128 1.00 32.23 O ATOM 0 H ASP A 6 20.056 2.533 -0.903 1.00 13.44 H new ATOM 0 HA ASP A 6 19.769 0.033 -2.293 1.00 64.31 H new ATOM 0 HB2 ASP A 6 21.584 0.378 -0.719 1.00 12.10 H new ATOM 0 HB3 ASP A 6 20.469 0.833 0.553 1.00 12.10 H new ATOM 75 N PHE A 7 17.592 -0.882 -1.395 1.00 61.13 N ATOM 76 CA PHE A 7 16.202 -1.255 -1.165 1.00 4.34 C ATOM 77 C PHE A 7 15.920 -1.513 0.324 1.00 65.05 C ATOM 78 O PHE A 7 14.932 -1.031 0.874 1.00 31.33 O ATOM 79 CB PHE A 7 15.871 -2.462 -2.052 1.00 45.41 C ATOM 80 CG PHE A 7 16.494 -3.786 -1.645 1.00 4.20 C ATOM 81 CD1 PHE A 7 15.829 -4.629 -0.732 1.00 33.31 C ATOM 82 CD2 PHE A 7 17.741 -4.176 -2.169 1.00 41.42 C ATOM 83 CE1 PHE A 7 16.419 -5.838 -0.323 1.00 45.34 C ATOM 84 CE2 PHE A 7 18.324 -5.388 -1.765 1.00 61.02 C ATOM 85 CZ PHE A 7 17.672 -6.216 -0.838 1.00 33.41 C ATOM 0 H PHE A 7 18.104 -1.546 -1.975 1.00 61.13 H new ATOM 0 HA PHE A 7 15.546 -0.429 -1.440 1.00 4.34 H new ATOM 0 HB2 PHE A 7 14.788 -2.585 -2.072 1.00 45.41 H new ATOM 0 HB3 PHE A 7 16.185 -2.235 -3.071 1.00 45.41 H new ATOM 0 HD1 PHE A 7 14.862 -4.345 -0.345 1.00 33.31 H new ATOM 0 HD2 PHE A 7 18.249 -3.543 -2.882 1.00 41.42 H new ATOM 0 HE1 PHE A 7 15.911 -6.475 0.385 1.00 45.34 H new ATOM 0 HE2 PHE A 7 19.280 -5.685 -2.170 1.00 61.02 H new ATOM 0 HZ PHE A 7 18.131 -7.141 -0.521 1.00 33.41 H new ATOM 95 N LYS A 8 16.825 -2.228 0.995 1.00 53.11 N ATOM 96 CA LYS A 8 16.802 -2.506 2.425 1.00 23.44 C ATOM 97 C LYS A 8 16.907 -1.205 3.202 1.00 21.21 C ATOM 98 O LYS A 8 16.029 -0.926 4.012 1.00 50.55 O ATOM 99 CB LYS A 8 17.908 -3.513 2.717 1.00 34.03 C ATOM 100 CG LYS A 8 18.483 -3.512 4.142 1.00 72.44 C ATOM 101 CD LYS A 8 19.744 -4.370 4.137 1.00 21.14 C ATOM 102 CE LYS A 8 20.877 -3.641 3.391 1.00 23.31 C ATOM 103 NZ LYS A 8 22.061 -4.491 3.187 1.00 24.03 N ATOM 0 H LYS A 8 17.631 -2.647 0.530 1.00 53.11 H new ATOM 0 HA LYS A 8 15.862 -2.954 2.748 1.00 23.44 H new ATOM 0 HB2 LYS A 8 17.524 -4.511 2.506 1.00 34.03 H new ATOM 0 HB3 LYS A 8 18.726 -3.332 2.020 1.00 34.03 H new ATOM 0 HG2 LYS A 8 18.714 -2.495 4.460 1.00 72.44 H new ATOM 0 HG3 LYS A 8 17.754 -3.909 4.848 1.00 72.44 H new ATOM 0 HD2 LYS A 8 20.051 -4.585 5.161 1.00 21.14 H new ATOM 0 HD3 LYS A 8 19.540 -5.328 3.658 1.00 21.14 H new ATOM 0 HE2 LYS A 8 20.509 -3.300 2.424 1.00 23.31 H new ATOM 0 HE3 LYS A 8 21.165 -2.753 3.954 1.00 23.31 H new ATOM 0 HZ1 LYS A 8 22.792 -3.952 2.681 1.00 24.03 H new ATOM 0 HZ2 LYS A 8 22.432 -4.797 4.109 1.00 24.03 H new ATOM 0 HZ3 LYS A 8 21.796 -5.326 2.626 1.00 24.03 H new ATOM 117 N THR A 9 17.957 -0.422 2.979 1.00 1.20 N ATOM 118 CA THR A 9 18.173 0.825 3.704 1.00 2.34 C ATOM 119 C THR A 9 16.969 1.761 3.550 1.00 52.11 C ATOM 120 O THR A 9 16.535 2.371 4.529 1.00 0.50 O ATOM 121 CB THR A 9 19.493 1.450 3.234 1.00 21.20 C ATOM 122 OG1 THR A 9 20.534 0.534 3.517 1.00 24.12 O ATOM 123 CG2 THR A 9 19.806 2.782 3.920 1.00 22.23 C ATOM 0 H THR A 9 18.681 -0.633 2.292 1.00 1.20 H new ATOM 0 HA THR A 9 18.260 0.632 4.773 1.00 2.34 H new ATOM 0 HB THR A 9 19.404 1.656 2.167 1.00 21.20 H new ATOM 0 HG1 THR A 9 20.553 -0.163 2.828 1.00 24.12 H new ATOM 0 HG21 THR A 9 20.752 3.172 3.544 1.00 22.23 H new ATOM 0 HG22 THR A 9 19.010 3.496 3.709 1.00 22.23 H new ATOM 0 HG23 THR A 9 19.879 2.628 4.997 1.00 22.23 H new ATOM 131 N PHE A 10 16.392 1.851 2.347 1.00 10.42 N ATOM 132 CA PHE A 10 15.135 2.539 2.112 1.00 15.14 C ATOM 133 C PHE A 10 14.044 1.981 3.026 1.00 20.40 C ATOM 134 O PHE A 10 13.457 2.756 3.782 1.00 63.44 O ATOM 135 CB PHE A 10 14.747 2.458 0.630 1.00 55.41 C ATOM 136 CG PHE A 10 13.287 2.759 0.383 1.00 75.32 C ATOM 137 CD1 PHE A 10 12.813 4.083 0.448 1.00 31.32 C ATOM 138 CD2 PHE A 10 12.389 1.695 0.178 1.00 34.24 C ATOM 139 CE1 PHE A 10 11.440 4.339 0.304 1.00 53.21 C ATOM 140 CE2 PHE A 10 11.016 1.951 0.065 1.00 54.54 C ATOM 141 CZ PHE A 10 10.545 3.271 0.127 1.00 4.51 C ATOM 0 H PHE A 10 16.796 1.441 1.505 1.00 10.42 H new ATOM 0 HA PHE A 10 15.255 3.595 2.356 1.00 15.14 H new ATOM 0 HB2 PHE A 10 15.358 3.159 0.062 1.00 55.41 H new ATOM 0 HB3 PHE A 10 14.975 1.460 0.255 1.00 55.41 H new ATOM 0 HD1 PHE A 10 13.503 4.899 0.608 1.00 31.32 H new ATOM 0 HD2 PHE A 10 12.758 0.682 0.108 1.00 34.24 H new ATOM 0 HE1 PHE A 10 11.073 5.354 0.329 1.00 53.21 H new ATOM 0 HE2 PHE A 10 10.322 1.134 -0.069 1.00 54.54 H new ATOM 0 HZ PHE A 10 9.487 3.467 0.038 1.00 4.51 H new ATOM 151 N LEU A 11 13.791 0.671 2.967 1.00 32.43 N ATOM 152 CA LEU A 11 12.735 -0.007 3.703 1.00 34.44 C ATOM 153 C LEU A 11 12.815 0.282 5.196 1.00 25.02 C ATOM 154 O LEU A 11 11.808 0.678 5.779 1.00 72.02 O ATOM 155 CB LEU A 11 12.791 -1.520 3.427 1.00 25.00 C ATOM 156 CG LEU A 11 11.771 -1.976 2.373 1.00 24.00 C ATOM 157 CD1 LEU A 11 12.072 -3.424 1.984 1.00 72.45 C ATOM 158 CD2 LEU A 11 10.335 -1.870 2.904 1.00 5.50 C ATOM 0 H LEU A 11 14.337 0.037 2.384 1.00 32.43 H new ATOM 0 HA LEU A 11 11.776 0.378 3.356 1.00 34.44 H new ATOM 0 HB2 LEU A 11 13.794 -1.786 3.093 1.00 25.00 H new ATOM 0 HB3 LEU A 11 12.611 -2.060 4.356 1.00 25.00 H new ATOM 0 HG LEU A 11 11.855 -1.326 1.502 1.00 24.00 H new ATOM 0 HD11 LEU A 11 11.353 -3.757 1.236 1.00 72.45 H new ATOM 0 HD12 LEU A 11 13.079 -3.488 1.573 1.00 72.45 H new ATOM 0 HD13 LEU A 11 11.999 -4.060 2.866 1.00 72.45 H new ATOM 0 HD21 LEU A 11 9.637 -2.200 2.134 1.00 5.50 H new ATOM 0 HD22 LEU A 11 10.226 -2.500 3.787 1.00 5.50 H new ATOM 0 HD23 LEU A 11 10.120 -0.835 3.168 1.00 5.50 H new ATOM 170 N GLN A 12 14.008 0.175 5.795 1.00 50.45 N ATOM 171 CA GLN A 12 14.233 0.493 7.203 1.00 2.20 C ATOM 172 C GLN A 12 13.604 1.843 7.549 1.00 74.34 C ATOM 173 O GLN A 12 12.689 1.902 8.373 1.00 55.23 O ATOM 174 CB GLN A 12 15.733 0.510 7.542 1.00 51.34 C ATOM 175 CG GLN A 12 16.439 -0.841 7.398 1.00 51.53 C ATOM 176 CD GLN A 12 17.880 -0.728 7.874 1.00 21.03 C ATOM 177 OE1 GLN A 12 18.747 -0.197 7.182 1.00 74.42 O ATOM 178 NE2 GLN A 12 18.169 -1.199 9.072 1.00 63.03 N ATOM 0 H GLN A 12 14.848 -0.138 5.308 1.00 50.45 H new ATOM 0 HA GLN A 12 13.760 -0.287 7.799 1.00 2.20 H new ATOM 0 HB2 GLN A 12 16.229 1.234 6.896 1.00 51.34 H new ATOM 0 HB3 GLN A 12 15.856 0.861 8.567 1.00 51.34 H new ATOM 0 HG2 GLN A 12 15.914 -1.599 7.979 1.00 51.53 H new ATOM 0 HG3 GLN A 12 16.415 -1.164 6.357 1.00 51.53 H new ATOM 0 HE21 GLN A 12 17.441 -1.637 9.637 1.00 63.03 H new ATOM 0 HE22 GLN A 12 19.120 -1.125 9.433 1.00 63.03 H new ATOM 187 N LYS A 13 14.062 2.899 6.867 1.00 42.41 N ATOM 188 CA LYS A 13 13.622 4.275 7.073 1.00 64.11 C ATOM 189 C LYS A 13 12.117 4.380 6.848 1.00 12.11 C ATOM 190 O LYS A 13 11.406 4.995 7.642 1.00 52.44 O ATOM 191 CB LYS A 13 14.348 5.199 6.090 1.00 21.04 C ATOM 192 CG LYS A 13 15.873 5.288 6.275 1.00 53.51 C ATOM 193 CD LYS A 13 16.497 5.677 4.931 1.00 42.53 C ATOM 194 CE LYS A 13 17.978 6.036 5.041 1.00 14.54 C ATOM 195 NZ LYS A 13 18.470 6.647 3.786 1.00 63.13 N ATOM 0 H LYS A 13 14.769 2.813 6.137 1.00 42.41 H new ATOM 0 HA LYS A 13 13.854 4.573 8.095 1.00 64.11 H new ATOM 0 HB2 LYS A 13 14.141 4.858 5.076 1.00 21.04 H new ATOM 0 HB3 LYS A 13 13.928 6.201 6.181 1.00 21.04 H new ATOM 0 HG2 LYS A 13 16.121 6.027 7.037 1.00 53.51 H new ATOM 0 HG3 LYS A 13 16.271 4.332 6.616 1.00 53.51 H new ATOM 0 HD2 LYS A 13 16.380 4.850 4.230 1.00 42.53 H new ATOM 0 HD3 LYS A 13 15.953 6.526 4.516 1.00 42.53 H new ATOM 0 HE2 LYS A 13 18.128 6.728 5.870 1.00 14.54 H new ATOM 0 HE3 LYS A 13 18.557 5.140 5.265 1.00 14.54 H new ATOM 0 HZ1 LYS A 13 19.503 6.757 3.835 1.00 63.13 H new ATOM 0 HZ2 LYS A 13 18.225 6.034 2.982 1.00 63.13 H new ATOM 0 HZ3 LYS A 13 18.028 7.580 3.657 1.00 63.13 H new ATOM 209 N PHE A 14 11.643 3.799 5.743 1.00 33.24 N ATOM 210 CA PHE A 14 10.260 3.838 5.295 1.00 44.15 C ATOM 211 C PHE A 14 9.319 3.317 6.378 1.00 53.24 C ATOM 212 O PHE A 14 8.254 3.901 6.571 1.00 53.12 O ATOM 213 CB PHE A 14 10.143 3.040 3.988 1.00 20.11 C ATOM 214 CG PHE A 14 8.800 3.135 3.293 1.00 43.11 C ATOM 215 CD1 PHE A 14 8.428 4.324 2.637 1.00 74.41 C ATOM 216 CD2 PHE A 14 7.931 2.027 3.278 1.00 41.14 C ATOM 217 CE1 PHE A 14 7.205 4.391 1.947 1.00 64.35 C ATOM 218 CE2 PHE A 14 6.701 2.103 2.601 1.00 4.32 C ATOM 219 CZ PHE A 14 6.339 3.283 1.930 1.00 54.12 C ATOM 0 H PHE A 14 12.243 3.267 5.113 1.00 33.24 H new ATOM 0 HA PHE A 14 9.960 4.868 5.102 1.00 44.15 H new ATOM 0 HB2 PHE A 14 10.915 3.384 3.300 1.00 20.11 H new ATOM 0 HB3 PHE A 14 10.351 1.991 4.201 1.00 20.11 H new ATOM 0 HD1 PHE A 14 9.081 5.183 2.664 1.00 74.41 H new ATOM 0 HD2 PHE A 14 8.210 1.117 3.788 1.00 41.14 H new ATOM 0 HE1 PHE A 14 6.929 5.297 1.428 1.00 64.35 H new ATOM 0 HE2 PHE A 14 6.034 1.254 2.597 1.00 4.32 H new ATOM 0 HZ PHE A 14 5.398 3.339 1.403 1.00 54.12 H new ATOM 229 N THR A 15 9.714 2.267 7.100 1.00 3.11 N ATOM 230 CA THR A 15 8.894 1.625 8.120 1.00 34.11 C ATOM 231 C THR A 15 8.944 2.329 9.492 1.00 44.34 C ATOM 232 O THR A 15 8.239 1.904 10.411 1.00 14.10 O ATOM 233 CB THR A 15 9.250 0.124 8.182 1.00 2.14 C ATOM 234 OG1 THR A 15 10.631 -0.109 8.434 1.00 73.25 O ATOM 235 CG2 THR A 15 8.908 -0.608 6.876 1.00 14.10 C ATOM 0 H THR A 15 10.630 1.834 6.987 1.00 3.11 H new ATOM 0 HA THR A 15 7.848 1.721 7.829 1.00 34.11 H new ATOM 0 HB THR A 15 8.651 -0.260 9.008 1.00 2.14 H new ATOM 0 HG1 THR A 15 11.099 0.749 8.510 1.00 73.25 H new ATOM 0 HG21 THR A 15 9.176 -1.660 6.968 1.00 14.10 H new ATOM 0 HG22 THR A 15 7.839 -0.522 6.680 1.00 14.10 H new ATOM 0 HG23 THR A 15 9.465 -0.162 6.052 1.00 14.10 H new ATOM 243 N SER A 16 9.739 3.395 9.667 1.00 64.14 N ATOM 244 CA SER A 16 9.925 4.062 10.959 1.00 55.24 C ATOM 245 C SER A 16 9.758 5.581 10.893 1.00 31.11 C ATOM 246 O SER A 16 10.312 6.293 11.734 1.00 73.13 O ATOM 247 CB SER A 16 11.272 3.641 11.559 1.00 4.43 C ATOM 248 OG SER A 16 12.389 3.975 10.748 1.00 74.01 O ATOM 0 H SER A 16 10.274 3.819 8.909 1.00 64.14 H new ATOM 0 HA SER A 16 9.125 3.734 11.623 1.00 55.24 H new ATOM 0 HB2 SER A 16 11.388 4.113 12.534 1.00 4.43 H new ATOM 0 HB3 SER A 16 11.265 2.564 11.725 1.00 4.43 H new ATOM 0 HG SER A 16 12.461 3.334 10.010 1.00 74.01 H new ATOM 254 N SER A 17 9.078 6.107 9.877 1.00 54.34 N ATOM 255 CA SER A 17 8.890 7.534 9.718 1.00 43.21 C ATOM 256 C SER A 17 7.751 7.771 8.732 1.00 0.20 C ATOM 257 O SER A 17 7.936 7.654 7.518 1.00 71.45 O ATOM 258 CB SER A 17 10.205 8.169 9.250 1.00 3.12 C ATOM 259 OG SER A 17 10.082 9.574 9.147 1.00 4.34 O ATOM 0 H SER A 17 8.643 5.548 9.143 1.00 54.34 H new ATOM 0 HA SER A 17 8.620 8.002 10.665 1.00 43.21 H new ATOM 0 HB2 SER A 17 11.002 7.921 9.951 1.00 3.12 H new ATOM 0 HB3 SER A 17 10.490 7.754 8.283 1.00 3.12 H new ATOM 0 HG SER A 17 10.351 9.989 9.993 1.00 4.34 H new ATOM 265 N ALA A 18 6.579 8.129 9.255 1.00 71.25 N ATOM 266 CA ALA A 18 5.412 8.502 8.474 1.00 4.12 C ATOM 267 C ALA A 18 5.703 9.722 7.598 1.00 73.43 C ATOM 268 O ALA A 18 5.207 9.793 6.468 1.00 73.04 O ATOM 269 CB ALA A 18 4.254 8.807 9.423 1.00 41.21 C ATOM 0 H ALA A 18 6.416 8.167 10.261 1.00 71.25 H new ATOM 0 HA ALA A 18 5.148 7.673 7.818 1.00 4.12 H new ATOM 0 HB1 ALA A 18 3.374 9.088 8.845 1.00 41.21 H new ATOM 0 HB2 ALA A 18 4.029 7.922 10.019 1.00 41.21 H new ATOM 0 HB3 ALA A 18 4.532 9.629 10.083 1.00 41.21 H new ATOM 275 N SER A 19 6.508 10.671 8.093 1.00 74.21 N ATOM 276 CA SER A 19 6.833 11.867 7.331 1.00 24.01 C ATOM 277 C SER A 19 7.700 11.503 6.129 1.00 43.53 C ATOM 278 O SER A 19 7.406 11.919 5.006 1.00 71.45 O ATOM 279 CB SER A 19 7.465 12.925 8.242 1.00 63.12 C ATOM 280 OG SER A 19 8.718 12.543 8.785 1.00 11.10 O ATOM 0 H SER A 19 6.941 10.627 9.015 1.00 74.21 H new ATOM 0 HA SER A 19 5.921 12.313 6.933 1.00 24.01 H new ATOM 0 HB2 SER A 19 7.592 13.848 7.676 1.00 63.12 H new ATOM 0 HB3 SER A 19 6.778 13.144 9.059 1.00 63.12 H new ATOM 0 HG SER A 19 9.062 13.264 9.353 1.00 11.10 H new ATOM 286 N PHE A 20 8.726 10.672 6.339 1.00 40.52 N ATOM 287 CA PHE A 20 9.561 10.174 5.260 1.00 33.24 C ATOM 288 C PHE A 20 8.742 9.339 4.276 1.00 22.23 C ATOM 289 O PHE A 20 8.884 9.549 3.075 1.00 63.45 O ATOM 290 CB PHE A 20 10.722 9.362 5.823 1.00 20.42 C ATOM 291 CG PHE A 20 11.579 8.745 4.745 1.00 24.04 C ATOM 292 CD1 PHE A 20 12.266 9.568 3.835 1.00 71.24 C ATOM 293 CD2 PHE A 20 11.639 7.346 4.618 1.00 2.13 C ATOM 294 CE1 PHE A 20 13.002 8.985 2.793 1.00 73.21 C ATOM 295 CE2 PHE A 20 12.361 6.762 3.565 1.00 13.11 C ATOM 296 CZ PHE A 20 13.034 7.588 2.650 1.00 32.21 C ATOM 0 H PHE A 20 8.994 10.331 7.262 1.00 40.52 H new ATOM 0 HA PHE A 20 9.966 11.028 4.717 1.00 33.24 H new ATOM 0 HB2 PHE A 20 11.340 10.006 6.449 1.00 20.42 H new ATOM 0 HB3 PHE A 20 10.330 8.574 6.466 1.00 20.42 H new ATOM 0 HD1 PHE A 20 12.227 10.642 3.938 1.00 71.24 H new ATOM 0 HD2 PHE A 20 11.128 6.718 5.333 1.00 2.13 H new ATOM 0 HE1 PHE A 20 13.545 9.611 2.100 1.00 73.21 H new ATOM 0 HE2 PHE A 20 12.399 5.688 3.460 1.00 13.11 H new ATOM 0 HZ PHE A 20 13.580 7.146 1.830 1.00 32.21 H new ATOM 306 N GLN A 21 7.877 8.441 4.771 1.00 11.40 N ATOM 307 CA GLN A 21 6.915 7.676 3.985 1.00 64.21 C ATOM 308 C GLN A 21 6.204 8.624 3.008 1.00 61.02 C ATOM 309 O GLN A 21 6.357 8.437 1.802 1.00 63.44 O ATOM 310 CB GLN A 21 6.007 6.843 4.913 1.00 33.43 C ATOM 311 CG GLN A 21 5.007 5.935 4.166 1.00 54.12 C ATOM 312 CD GLN A 21 4.671 4.619 4.865 1.00 44.51 C ATOM 313 OE1 GLN A 21 3.513 4.229 4.929 1.00 75.35 O ATOM 314 NE2 GLN A 21 5.660 3.885 5.337 1.00 33.24 N ATOM 0 H GLN A 21 7.832 8.224 5.767 1.00 11.40 H new ATOM 0 HA GLN A 21 7.402 6.929 3.359 1.00 64.21 H new ATOM 0 HB2 GLN A 21 6.633 6.224 5.556 1.00 33.43 H new ATOM 0 HB3 GLN A 21 5.452 7.519 5.563 1.00 33.43 H new ATOM 0 HG2 GLN A 21 4.082 6.491 4.011 1.00 54.12 H new ATOM 0 HG3 GLN A 21 5.413 5.710 3.180 1.00 54.12 H new ATOM 0 HE21 GLN A 21 6.620 4.224 5.276 1.00 33.24 H new ATOM 0 HE22 GLN A 21 5.465 2.979 5.763 1.00 33.24 H new ATOM 323 N TYR A 22 5.556 9.698 3.483 1.00 61.01 N ATOM 324 CA TYR A 22 4.877 10.689 2.639 1.00 44.55 C ATOM 325 C TYR A 22 5.844 11.391 1.674 1.00 0.52 C ATOM 326 O TYR A 22 5.548 11.513 0.481 1.00 34.32 O ATOM 327 CB TYR A 22 4.139 11.736 3.495 1.00 33.12 C ATOM 328 CG TYR A 22 2.785 11.319 4.047 1.00 40.14 C ATOM 329 CD1 TYR A 22 1.772 10.852 3.184 1.00 15.30 C ATOM 330 CD2 TYR A 22 2.531 11.392 5.430 1.00 51.31 C ATOM 331 CE1 TYR A 22 0.506 10.505 3.690 1.00 20.12 C ATOM 332 CE2 TYR A 22 1.283 11.005 5.949 1.00 32.44 C ATOM 333 CZ TYR A 22 0.250 10.589 5.078 1.00 13.23 C ATOM 334 OH TYR A 22 -0.982 10.263 5.554 1.00 73.24 O ATOM 0 H TYR A 22 5.489 9.904 4.480 1.00 61.01 H new ATOM 0 HA TYR A 22 4.148 10.140 2.042 1.00 44.55 H new ATOM 0 HB2 TYR A 22 4.781 12.008 4.333 1.00 33.12 H new ATOM 0 HB3 TYR A 22 4.002 12.635 2.894 1.00 33.12 H new ATOM 0 HD1 TYR A 22 1.970 10.760 2.126 1.00 15.30 H new ATOM 0 HD2 TYR A 22 3.301 11.748 6.098 1.00 51.31 H new ATOM 0 HE1 TYR A 22 -0.271 10.174 3.017 1.00 20.12 H new ATOM 0 HE2 TYR A 22 1.113 11.026 7.015 1.00 32.44 H new ATOM 0 HH TYR A 22 -0.996 10.372 6.528 1.00 73.24 H new ATOM 344 N SER A 23 7.022 11.815 2.147 1.00 53.31 N ATOM 345 CA SER A 23 8.102 12.359 1.317 1.00 51.14 C ATOM 346 C SER A 23 8.733 11.324 0.364 1.00 13.13 C ATOM 347 O SER A 23 9.762 11.600 -0.263 1.00 14.41 O ATOM 348 CB SER A 23 9.150 13.055 2.201 1.00 61.32 C ATOM 349 OG SER A 23 8.819 14.429 2.350 1.00 51.25 O ATOM 0 H SER A 23 7.255 11.789 3.140 1.00 53.31 H new ATOM 0 HA SER A 23 7.655 13.103 0.657 1.00 51.14 H new ATOM 0 HB2 SER A 23 9.192 12.574 3.178 1.00 61.32 H new ATOM 0 HB3 SER A 23 10.139 12.956 1.754 1.00 61.32 H new ATOM 0 HG SER A 23 9.489 14.867 2.915 1.00 51.25 H new ATOM 355 N ARG A 24 8.136 10.141 0.207 1.00 12.11 N ATOM 356 CA ARG A 24 8.500 9.176 -0.812 1.00 31.24 C ATOM 357 C ARG A 24 7.249 8.685 -1.545 1.00 31.31 C ATOM 358 O ARG A 24 7.189 7.514 -1.910 1.00 62.41 O ATOM 359 CB ARG A 24 9.335 8.044 -0.178 1.00 54.13 C ATOM 360 CG ARG A 24 10.707 8.482 0.351 1.00 54.33 C ATOM 361 CD ARG A 24 11.707 8.736 -0.787 1.00 40.51 C ATOM 362 NE ARG A 24 12.439 10.006 -0.652 1.00 72.24 N ATOM 363 CZ ARG A 24 13.768 10.161 -0.624 1.00 24.13 C ATOM 364 NH1 ARG A 24 14.597 9.124 -0.536 1.00 53.55 N ATOM 365 NH2 ARG A 24 14.286 11.377 -0.689 1.00 35.03 N ATOM 0 H ARG A 24 7.369 9.828 0.802 1.00 12.11 H new ATOM 0 HA ARG A 24 9.130 9.641 -1.571 1.00 31.24 H new ATOM 0 HB2 ARG A 24 8.766 7.607 0.643 1.00 54.13 H new ATOM 0 HB3 ARG A 24 9.480 7.258 -0.919 1.00 54.13 H new ATOM 0 HG2 ARG A 24 10.594 9.390 0.944 1.00 54.33 H new ATOM 0 HG3 ARG A 24 11.102 7.714 1.016 1.00 54.33 H new ATOM 0 HD2 ARG A 24 12.423 7.915 -0.821 1.00 40.51 H new ATOM 0 HD3 ARG A 24 11.173 8.733 -1.737 1.00 40.51 H new ATOM 0 HE ARG A 24 11.877 10.853 -0.572 1.00 72.24 H new ATOM 0 HH11 ARG A 24 14.224 8.176 -0.488 1.00 53.55 H new ATOM 0 HH12 ARG A 24 15.605 9.277 -0.517 1.00 53.55 H new ATOM 0 HH21 ARG A 24 13.673 12.189 -0.760 1.00 35.03 H new ATOM 0 HH22 ARG A 24 15.298 11.502 -0.668 1.00 35.03 H new ATOM 379 N ILE A 25 6.240 9.530 -1.776 1.00 2.50 N ATOM 380 CA ILE A 25 5.061 9.171 -2.571 1.00 31.13 C ATOM 381 C ILE A 25 4.866 10.231 -3.651 1.00 34.04 C ATOM 382 O ILE A 25 4.645 11.407 -3.347 1.00 44.11 O ATOM 383 CB ILE A 25 3.785 8.958 -1.718 1.00 43.52 C ATOM 384 CG1 ILE A 25 4.068 8.156 -0.436 1.00 34.10 C ATOM 385 CG2 ILE A 25 2.712 8.289 -2.592 1.00 4.40 C ATOM 386 CD1 ILE A 25 2.860 7.916 0.468 1.00 73.21 C ATOM 0 H ILE A 25 6.217 10.484 -1.416 1.00 2.50 H new ATOM 0 HA ILE A 25 5.239 8.201 -3.036 1.00 31.13 H new ATOM 0 HB ILE A 25 3.419 9.927 -1.380 1.00 43.52 H new ATOM 0 HG12 ILE A 25 4.487 7.190 -0.717 1.00 34.10 H new ATOM 0 HG13 ILE A 25 4.832 8.680 0.139 1.00 34.10 H new ATOM 0 HG21 ILE A 25 1.808 8.133 -2.003 1.00 4.40 H new ATOM 0 HG22 ILE A 25 2.484 8.930 -3.443 1.00 4.40 H new ATOM 0 HG23 ILE A 25 3.082 7.328 -2.950 1.00 4.40 H new ATOM 0 HD11 ILE A 25 3.168 7.342 1.342 1.00 73.21 H new ATOM 0 HD12 ILE A 25 2.449 8.874 0.788 1.00 73.21 H new ATOM 0 HD13 ILE A 25 2.100 7.361 -0.081 1.00 73.21 H new ATOM 398 N LYS A 26 4.986 9.831 -4.916 1.00 11.34 N ATOM 399 CA LYS A 26 4.453 10.564 -6.048 1.00 61.04 C ATOM 400 C LYS A 26 2.939 10.444 -5.967 1.00 40.54 C ATOM 401 O LYS A 26 2.430 9.328 -5.865 1.00 35.14 O ATOM 402 CB LYS A 26 4.981 9.945 -7.352 1.00 42.24 C ATOM 403 CG LYS A 26 6.089 10.766 -8.001 1.00 71.02 C ATOM 404 CD LYS A 26 7.369 10.808 -7.160 1.00 22.33 C ATOM 405 CE LYS A 26 8.302 11.745 -7.912 1.00 51.11 C ATOM 406 NZ LYS A 26 9.482 12.153 -7.139 1.00 55.51 N ATOM 0 H LYS A 26 5.467 8.971 -5.181 1.00 11.34 H new ATOM 0 HA LYS A 26 4.755 11.611 -6.033 1.00 61.04 H new ATOM 0 HB2 LYS A 26 5.354 8.942 -7.145 1.00 42.24 H new ATOM 0 HB3 LYS A 26 4.156 9.839 -8.056 1.00 42.24 H new ATOM 0 HG2 LYS A 26 6.318 10.348 -8.981 1.00 71.02 H new ATOM 0 HG3 LYS A 26 5.733 11.783 -8.163 1.00 71.02 H new ATOM 0 HD2 LYS A 26 7.168 11.175 -6.153 1.00 22.33 H new ATOM 0 HD3 LYS A 26 7.806 9.815 -7.056 1.00 22.33 H new ATOM 0 HE2 LYS A 26 8.631 11.256 -8.829 1.00 51.11 H new ATOM 0 HE3 LYS A 26 7.747 12.635 -8.207 1.00 51.11 H new ATOM 0 HZ1 LYS A 26 10.152 12.647 -7.763 1.00 55.51 H new ATOM 0 HZ2 LYS A 26 9.190 12.790 -6.370 1.00 55.51 H new ATOM 0 HZ3 LYS A 26 9.941 11.311 -6.736 1.00 55.51 H new ATOM 420 N PHE A 27 2.236 11.573 -5.987 1.00 22.44 N ATOM 421 CA PHE A 27 0.777 11.604 -5.920 1.00 52.11 C ATOM 422 C PHE A 27 0.233 12.452 -7.075 1.00 72.23 C ATOM 423 O PHE A 27 0.853 13.464 -7.413 1.00 1.34 O ATOM 424 CB PHE A 27 0.295 12.108 -4.547 1.00 63.35 C ATOM 425 CG PHE A 27 0.901 13.420 -4.069 1.00 35.30 C ATOM 426 CD1 PHE A 27 0.432 14.655 -4.561 1.00 33.41 C ATOM 427 CD2 PHE A 27 1.957 13.404 -3.138 1.00 43.12 C ATOM 428 CE1 PHE A 27 1.033 15.857 -4.148 1.00 51.32 C ATOM 429 CE2 PHE A 27 2.550 14.607 -2.716 1.00 11.32 C ATOM 430 CZ PHE A 27 2.093 15.834 -3.225 1.00 51.25 C ATOM 0 H PHE A 27 2.664 12.497 -6.050 1.00 22.44 H new ATOM 0 HA PHE A 27 0.387 10.592 -6.029 1.00 52.11 H new ATOM 0 HB2 PHE A 27 -0.788 12.223 -4.584 1.00 63.35 H new ATOM 0 HB3 PHE A 27 0.509 11.340 -3.804 1.00 63.35 H new ATOM 0 HD1 PHE A 27 -0.393 14.678 -5.258 1.00 33.41 H new ATOM 0 HD2 PHE A 27 2.313 12.463 -2.746 1.00 43.12 H new ATOM 0 HE1 PHE A 27 0.680 16.799 -4.540 1.00 51.32 H new ATOM 0 HE2 PHE A 27 3.358 14.588 -2.000 1.00 11.32 H new ATOM 0 HZ PHE A 27 2.555 16.757 -2.908 1.00 51.25 H new ATOM 440 N PRO A 28 -0.948 12.147 -7.646 1.00 53.22 N ATOM 441 CA PRO A 28 -1.802 10.992 -7.362 1.00 13.42 C ATOM 442 C PRO A 28 -1.133 9.671 -7.764 1.00 62.24 C ATOM 443 O PRO A 28 -0.031 9.670 -8.326 1.00 41.45 O ATOM 444 CB PRO A 28 -3.105 11.237 -8.132 1.00 62.55 C ATOM 445 CG PRO A 28 -2.718 12.200 -9.250 1.00 31.33 C ATOM 446 CD PRO A 28 -1.491 12.933 -8.739 1.00 61.22 C ATOM 0 HA PRO A 28 -1.991 10.894 -6.293 1.00 13.42 H new ATOM 0 HB2 PRO A 28 -3.509 10.307 -8.532 1.00 62.55 H new ATOM 0 HB3 PRO A 28 -3.872 11.666 -7.487 1.00 62.55 H new ATOM 0 HG2 PRO A 28 -2.500 11.664 -10.173 1.00 31.33 H new ATOM 0 HG3 PRO A 28 -3.529 12.895 -9.469 1.00 31.33 H new ATOM 0 HD2 PRO A 28 -0.753 13.049 -9.533 1.00 61.22 H new ATOM 0 HD3 PRO A 28 -1.754 13.935 -8.399 1.00 61.22 H new ATOM 454 N LEU A 29 -1.759 8.548 -7.402 1.00 51.21 N ATOM 455 CA LEU A 29 -1.197 7.224 -7.635 1.00 13.22 C ATOM 456 C LEU A 29 -1.504 6.769 -9.067 1.00 75.44 C ATOM 457 O LEU A 29 -1.664 7.603 -9.963 1.00 44.41 O ATOM 458 CB LEU A 29 -1.705 6.252 -6.562 1.00 3.03 C ATOM 459 CG LEU A 29 -1.315 6.631 -5.123 1.00 53.25 C ATOM 460 CD1 LEU A 29 -2.064 5.684 -4.194 1.00 21.54 C ATOM 461 CD2 LEU A 29 0.193 6.494 -4.892 1.00 22.30 C ATOM 0 H LEU A 29 -2.668 8.536 -6.940 1.00 51.21 H new ATOM 0 HA LEU A 29 -0.111 7.249 -7.547 1.00 13.22 H new ATOM 0 HB2 LEU A 29 -2.791 6.194 -6.627 1.00 3.03 H new ATOM 0 HB3 LEU A 29 -1.319 5.256 -6.780 1.00 3.03 H new ATOM 0 HG LEU A 29 -1.575 7.672 -4.933 1.00 53.25 H new ATOM 0 HD11 LEU A 29 -1.816 5.918 -3.159 1.00 21.54 H new ATOM 0 HD12 LEU A 29 -3.137 5.800 -4.345 1.00 21.54 H new ATOM 0 HD13 LEU A 29 -1.775 4.656 -4.413 1.00 21.54 H new ATOM 0 HD21 LEU A 29 0.430 6.770 -3.865 1.00 22.30 H new ATOM 0 HD22 LEU A 29 0.496 5.462 -5.070 1.00 22.30 H new ATOM 0 HD23 LEU A 29 0.727 7.152 -5.577 1.00 22.30 H new ATOM 473 N LYS A 30 -1.550 5.454 -9.301 1.00 15.03 N ATOM 474 CA LYS A 30 -1.823 4.865 -10.612 1.00 71.55 C ATOM 475 C LYS A 30 -3.070 3.954 -10.634 1.00 60.14 C ATOM 476 O LYS A 30 -3.604 3.717 -11.717 1.00 32.32 O ATOM 477 CB LYS A 30 -0.552 4.153 -11.078 1.00 61.13 C ATOM 478 CG LYS A 30 0.627 5.106 -11.365 1.00 41.35 C ATOM 479 CD LYS A 30 1.844 4.325 -11.869 1.00 40.55 C ATOM 480 CE LYS A 30 2.937 5.315 -12.288 1.00 14.13 C ATOM 481 NZ LYS A 30 4.057 4.653 -12.975 1.00 61.22 N ATOM 0 H LYS A 30 -1.396 4.758 -8.571 1.00 15.03 H new ATOM 0 HA LYS A 30 -2.079 5.659 -11.314 1.00 71.55 H new ATOM 0 HB2 LYS A 30 -0.249 3.435 -10.316 1.00 61.13 H new ATOM 0 HB3 LYS A 30 -0.776 3.585 -11.981 1.00 61.13 H new ATOM 0 HG2 LYS A 30 0.330 5.846 -12.108 1.00 41.35 H new ATOM 0 HG3 LYS A 30 0.889 5.652 -10.459 1.00 41.35 H new ATOM 0 HD2 LYS A 30 2.216 3.663 -11.087 1.00 40.55 H new ATOM 0 HD3 LYS A 30 1.563 3.695 -12.713 1.00 40.55 H new ATOM 0 HE2 LYS A 30 2.507 6.071 -12.945 1.00 14.13 H new ATOM 0 HE3 LYS A 30 3.311 5.835 -11.406 1.00 14.13 H new ATOM 0 HZ1 LYS A 30 4.915 4.728 -12.392 1.00 61.22 H new ATOM 0 HZ2 LYS A 30 3.827 3.650 -13.126 1.00 61.22 H new ATOM 0 HZ3 LYS A 30 4.221 5.113 -13.893 1.00 61.22 H new ATOM 495 N SER A 31 -3.540 3.491 -9.478 1.00 22.24 N ATOM 496 CA SER A 31 -4.582 2.514 -9.160 1.00 22.51 C ATOM 497 C SER A 31 -5.964 3.170 -9.054 1.00 62.55 C ATOM 498 O SER A 31 -6.285 3.685 -7.977 1.00 0.30 O ATOM 499 CB SER A 31 -4.189 1.771 -7.870 1.00 21.31 C ATOM 500 OG SER A 31 -5.111 0.803 -7.409 1.00 43.05 O ATOM 0 H SER A 31 -3.136 3.848 -8.612 1.00 22.24 H new ATOM 0 HA SER A 31 -4.660 1.792 -9.973 1.00 22.51 H new ATOM 0 HB2 SER A 31 -3.229 1.281 -8.034 1.00 21.31 H new ATOM 0 HB3 SER A 31 -4.040 2.508 -7.081 1.00 21.31 H new ATOM 0 HG SER A 31 -4.953 0.628 -6.458 1.00 43.05 H new ATOM 506 N PRO A 32 -6.759 3.311 -10.136 1.00 33.31 N ATOM 507 CA PRO A 32 -8.149 3.710 -9.969 1.00 33.41 C ATOM 508 C PRO A 32 -8.833 2.840 -8.925 1.00 21.23 C ATOM 509 O PRO A 32 -8.742 1.609 -8.933 1.00 24.52 O ATOM 510 CB PRO A 32 -8.810 3.584 -11.338 1.00 24.41 C ATOM 511 CG PRO A 32 -7.946 2.553 -12.060 1.00 45.42 C ATOM 512 CD PRO A 32 -6.553 2.820 -11.489 1.00 65.15 C ATOM 0 HA PRO A 32 -8.228 4.736 -9.609 1.00 33.41 H new ATOM 0 HB2 PRO A 32 -9.845 3.252 -11.255 1.00 24.41 H new ATOM 0 HB3 PRO A 32 -8.823 4.537 -11.866 1.00 24.41 H new ATOM 0 HG2 PRO A 32 -8.278 1.535 -11.858 1.00 45.42 H new ATOM 0 HG3 PRO A 32 -7.973 2.688 -13.141 1.00 45.42 H new ATOM 0 HD2 PRO A 32 -5.952 1.911 -11.486 1.00 65.15 H new ATOM 0 HD3 PRO A 32 -6.018 3.553 -12.093 1.00 65.15 H new ATOM 520 N ILE A 33 -9.563 3.506 -8.038 1.00 45.11 N ATOM 521 CA ILE A 33 -10.334 2.848 -7.002 1.00 22.32 C ATOM 522 C ILE A 33 -11.671 2.605 -7.672 1.00 54.05 C ATOM 523 O ILE A 33 -12.538 3.482 -7.712 1.00 1.14 O ATOM 524 CB ILE A 33 -10.366 3.690 -5.712 1.00 23.42 C ATOM 525 CG1 ILE A 33 -8.924 3.803 -5.159 1.00 34.40 C ATOM 526 CG2 ILE A 33 -11.283 3.045 -4.656 1.00 24.50 C ATOM 527 CD1 ILE A 33 -8.779 4.869 -4.078 1.00 43.15 C ATOM 0 H ILE A 33 -9.634 4.523 -8.021 1.00 45.11 H new ATOM 0 HA ILE A 33 -9.918 1.906 -6.644 1.00 22.32 H new ATOM 0 HB ILE A 33 -10.762 4.680 -5.940 1.00 23.42 H new ATOM 0 HG12 ILE A 33 -8.621 2.838 -4.752 1.00 34.40 H new ATOM 0 HG13 ILE A 33 -8.244 4.031 -5.979 1.00 34.40 H new ATOM 0 HG21 ILE A 33 -11.288 3.659 -3.755 1.00 24.50 H new ATOM 0 HG22 ILE A 33 -12.296 2.971 -5.051 1.00 24.50 H new ATOM 0 HG23 ILE A 33 -10.914 2.048 -4.414 1.00 24.50 H new ATOM 0 HD11 ILE A 33 -7.746 4.898 -3.732 1.00 43.15 H new ATOM 0 HD12 ILE A 33 -9.052 5.842 -4.487 1.00 43.15 H new ATOM 0 HD13 ILE A 33 -9.435 4.630 -3.241 1.00 43.15 H new ATOM 539 N ALA A 34 -11.774 1.463 -8.341 1.00 61.11 N ATOM 540 CA ALA A 34 -13.004 1.050 -8.974 1.00 22.42 C ATOM 541 C ALA A 34 -13.837 0.314 -7.928 1.00 64.15 C ATOM 542 O ALA A 34 -13.294 -0.528 -7.204 1.00 73.15 O ATOM 543 CB ALA A 34 -12.695 0.200 -10.205 1.00 32.31 C ATOM 0 H ALA A 34 -11.004 0.804 -8.455 1.00 61.11 H new ATOM 0 HA ALA A 34 -13.580 1.902 -9.334 1.00 22.42 H new ATOM 0 HB1 ALA A 34 -13.628 -0.108 -10.678 1.00 32.31 H new ATOM 0 HB2 ALA A 34 -12.106 0.784 -10.912 1.00 32.31 H new ATOM 0 HB3 ALA A 34 -12.131 -0.683 -9.905 1.00 32.31 H new ATOM 549 N LEU A 35 -15.128 0.634 -7.820 1.00 21.24 N ATOM 550 CA LEU A 35 -16.072 -0.046 -6.922 1.00 42.23 C ATOM 551 C LEU A 35 -17.395 -0.193 -7.675 1.00 11.41 C ATOM 552 O LEU A 35 -17.452 0.092 -8.873 1.00 45.32 O ATOM 553 CB LEU A 35 -16.262 0.721 -5.595 1.00 45.24 C ATOM 554 CG LEU A 35 -14.975 1.000 -4.797 1.00 72.53 C ATOM 555 CD1 LEU A 35 -15.297 2.066 -3.754 1.00 25.30 C ATOM 556 CD2 LEU A 35 -14.443 -0.291 -4.172 1.00 30.43 C ATOM 0 H LEU A 35 -15.557 1.385 -8.361 1.00 21.24 H new ATOM 0 HA LEU A 35 -15.680 -1.025 -6.645 1.00 42.23 H new ATOM 0 HB2 LEU A 35 -16.747 1.673 -5.813 1.00 45.24 H new ATOM 0 HB3 LEU A 35 -16.944 0.153 -4.962 1.00 45.24 H new ATOM 0 HG LEU A 35 -14.183 1.370 -5.448 1.00 72.53 H new ATOM 0 HD11 LEU A 35 -14.403 2.286 -3.171 1.00 25.30 H new ATOM 0 HD12 LEU A 35 -15.637 2.973 -4.254 1.00 25.30 H new ATOM 0 HD13 LEU A 35 -16.082 1.701 -3.091 1.00 25.30 H new ATOM 0 HD21 LEU A 35 -13.533 -0.076 -3.612 1.00 30.43 H new ATOM 0 HD22 LEU A 35 -15.194 -0.706 -3.500 1.00 30.43 H new ATOM 0 HD23 LEU A 35 -14.222 -1.012 -4.959 1.00 30.43 H new ATOM 568 N LEU A 36 -18.447 -0.632 -6.985 1.00 3.02 N ATOM 569 CA LEU A 36 -19.733 -0.970 -7.579 1.00 1.14 C ATOM 570 C LEU A 36 -20.819 -0.025 -7.077 1.00 74.42 C ATOM 571 O LEU A 36 -20.880 0.240 -5.872 1.00 14.22 O ATOM 572 CB LEU A 36 -20.095 -2.412 -7.209 1.00 33.13 C ATOM 573 CG LEU A 36 -19.202 -3.508 -7.818 1.00 74.14 C ATOM 574 CD1 LEU A 36 -19.828 -4.869 -7.497 1.00 32.34 C ATOM 575 CD2 LEU A 36 -19.003 -3.347 -9.332 1.00 1.42 C ATOM 0 H LEU A 36 -18.425 -0.764 -5.974 1.00 3.02 H new ATOM 0 HA LEU A 36 -19.660 -0.871 -8.662 1.00 1.14 H new ATOM 0 HB2 LEU A 36 -20.064 -2.507 -6.124 1.00 33.13 H new ATOM 0 HB3 LEU A 36 -21.124 -2.598 -7.516 1.00 33.13 H new ATOM 0 HG LEU A 36 -18.208 -3.425 -7.378 1.00 74.14 H new ATOM 0 HD11 LEU A 36 -19.211 -5.662 -7.920 1.00 32.34 H new ATOM 0 HD12 LEU A 36 -19.891 -4.995 -6.416 1.00 32.34 H new ATOM 0 HD13 LEU A 36 -20.828 -4.920 -7.927 1.00 32.34 H new ATOM 0 HD21 LEU A 36 -18.365 -4.149 -9.702 1.00 1.42 H new ATOM 0 HD22 LEU A 36 -19.970 -3.392 -9.833 1.00 1.42 H new ATOM 0 HD23 LEU A 36 -18.533 -2.385 -9.537 1.00 1.42 H new ATOM 587 N LYS A 37 -21.656 0.487 -7.984 1.00 74.12 N ATOM 588 CA LYS A 37 -22.802 1.344 -7.684 1.00 24.11 C ATOM 589 C LYS A 37 -23.979 0.564 -7.099 1.00 2.42 C ATOM 590 O LYS A 37 -23.868 -0.594 -6.704 1.00 1.11 O ATOM 591 CB LYS A 37 -23.221 2.102 -8.947 1.00 52.45 C ATOM 592 CG LYS A 37 -22.086 2.915 -9.564 1.00 5.31 C ATOM 593 CD LYS A 37 -22.552 3.636 -10.827 1.00 1.21 C ATOM 594 CE LYS A 37 -23.093 5.051 -10.610 1.00 33.20 C ATOM 595 NZ LYS A 37 -24.391 5.080 -9.910 1.00 63.22 N ATOM 0 H LYS A 37 -21.549 0.308 -8.982 1.00 74.12 H new ATOM 0 HA LYS A 37 -22.494 2.056 -6.918 1.00 24.11 H new ATOM 0 HB2 LYS A 37 -23.592 1.390 -9.684 1.00 52.45 H new ATOM 0 HB3 LYS A 37 -24.048 2.770 -8.705 1.00 52.45 H new ATOM 0 HG2 LYS A 37 -21.720 3.643 -8.840 1.00 5.31 H new ATOM 0 HG3 LYS A 37 -21.251 2.257 -9.804 1.00 5.31 H new ATOM 0 HD2 LYS A 37 -21.717 3.687 -11.525 1.00 1.21 H new ATOM 0 HD3 LYS A 37 -23.329 3.037 -11.302 1.00 1.21 H new ATOM 0 HE2 LYS A 37 -22.366 5.626 -10.036 1.00 33.20 H new ATOM 0 HE3 LYS A 37 -23.198 5.544 -11.576 1.00 33.20 H new ATOM 0 HZ1 LYS A 37 -24.837 6.010 -10.045 1.00 63.22 H new ATOM 0 HZ2 LYS A 37 -25.010 4.339 -10.296 1.00 63.22 H new ATOM 0 HZ3 LYS A 37 -24.242 4.911 -8.895 1.00 63.22 H new ATOM 609 N ASP A 38 -25.107 1.255 -6.990 1.00 4.22 N ATOM 610 CA ASP A 38 -26.384 0.847 -6.432 1.00 74.55 C ATOM 611 C ASP A 38 -27.263 0.062 -7.417 1.00 25.52 C ATOM 612 O ASP A 38 -28.455 -0.088 -7.149 1.00 14.33 O ATOM 613 CB ASP A 38 -27.115 2.098 -5.899 1.00 4.02 C ATOM 614 CG ASP A 38 -27.584 3.089 -6.975 1.00 61.55 C ATOM 615 OD1 ASP A 38 -26.906 3.220 -8.024 1.00 64.41 O ATOM 616 OD2 ASP A 38 -28.580 3.809 -6.719 1.00 24.50 O ATOM 0 H ASP A 38 -25.150 2.217 -7.327 1.00 4.22 H new ATOM 0 HA ASP A 38 -26.185 0.152 -5.617 1.00 74.55 H new ATOM 0 HB2 ASP A 38 -27.982 1.775 -5.323 1.00 4.02 H new ATOM 0 HB3 ASP A 38 -26.452 2.621 -5.210 1.00 4.02 H new ATOM 621 N ASP A 39 -26.721 -0.495 -8.509 1.00 61.41 N ATOM 622 CA ASP A 39 -27.389 -1.546 -9.281 1.00 61.13 C ATOM 623 C ASP A 39 -26.399 -2.683 -9.512 1.00 61.33 C ATOM 624 O ASP A 39 -25.909 -2.893 -10.626 1.00 62.15 O ATOM 625 CB ASP A 39 -28.031 -1.041 -10.575 1.00 12.44 C ATOM 626 CG ASP A 39 -28.689 -2.205 -11.329 1.00 13.11 C ATOM 627 OD1 ASP A 39 -29.331 -3.042 -10.652 1.00 65.13 O ATOM 628 OD2 ASP A 39 -28.527 -2.309 -12.569 1.00 4.11 O ATOM 0 H ASP A 39 -25.809 -0.229 -8.879 1.00 61.41 H new ATOM 0 HA ASP A 39 -28.234 -1.918 -8.701 1.00 61.13 H new ATOM 0 HB2 ASP A 39 -28.776 -0.279 -10.347 1.00 12.44 H new ATOM 0 HB3 ASP A 39 -27.276 -0.571 -11.205 1.00 12.44 H new ATOM 633 N GLY A 40 -26.057 -3.373 -8.421 1.00 71.14 N ATOM 634 CA GLY A 40 -25.109 -4.476 -8.383 1.00 4.13 C ATOM 635 C GLY A 40 -23.816 -4.128 -9.104 1.00 2.33 C ATOM 636 O GLY A 40 -23.060 -3.289 -8.631 1.00 53.01 O ATOM 0 H GLY A 40 -26.453 -3.165 -7.504 1.00 71.14 H new ATOM 0 HA2 GLY A 40 -24.890 -4.733 -7.347 1.00 4.13 H new ATOM 0 HA3 GLY A 40 -25.557 -5.357 -8.842 1.00 4.13 H new ATOM 640 N GLU A 41 -23.555 -4.743 -10.252 1.00 42.43 N ATOM 641 CA GLU A 41 -22.275 -4.671 -10.949 1.00 73.22 C ATOM 642 C GLU A 41 -22.159 -3.496 -11.922 1.00 43.04 C ATOM 643 O GLU A 41 -21.503 -3.567 -12.963 1.00 33.22 O ATOM 644 CB GLU A 41 -21.956 -6.011 -11.584 1.00 34.14 C ATOM 645 CG GLU A 41 -22.880 -6.444 -12.726 1.00 41.45 C ATOM 646 CD GLU A 41 -22.244 -7.567 -13.542 1.00 53.32 C ATOM 647 OE1 GLU A 41 -21.309 -7.285 -14.327 1.00 12.21 O ATOM 648 OE2 GLU A 41 -22.711 -8.727 -13.444 1.00 10.12 O ATOM 0 H GLU A 41 -24.244 -5.319 -10.736 1.00 42.43 H new ATOM 0 HA GLU A 41 -21.510 -4.458 -10.202 1.00 73.22 H new ATOM 0 HB2 GLU A 41 -20.934 -5.979 -11.961 1.00 34.14 H new ATOM 0 HB3 GLU A 41 -21.986 -6.776 -10.808 1.00 34.14 H new ATOM 0 HG2 GLU A 41 -23.835 -6.779 -12.320 1.00 41.45 H new ATOM 0 HG3 GLU A 41 -23.090 -5.592 -13.373 1.00 41.45 H new ATOM 655 N THR A 42 -22.840 -2.413 -11.602 1.00 51.44 N ATOM 656 CA THR A 42 -22.657 -1.132 -12.274 1.00 12.11 C ATOM 657 C THR A 42 -21.316 -0.534 -11.849 1.00 43.03 C ATOM 658 O THR A 42 -21.028 -0.417 -10.655 1.00 24.33 O ATOM 659 CB THR A 42 -23.828 -0.171 -12.012 1.00 23.14 C ATOM 660 OG1 THR A 42 -24.601 -0.507 -10.873 1.00 53.01 O ATOM 661 CG2 THR A 42 -24.733 -0.138 -13.235 1.00 53.25 C ATOM 0 H THR A 42 -23.543 -2.393 -10.863 1.00 51.44 H new ATOM 0 HA THR A 42 -22.645 -1.295 -13.352 1.00 12.11 H new ATOM 0 HB THR A 42 -23.388 0.806 -11.814 1.00 23.14 H new ATOM 0 HG1 THR A 42 -25.097 -1.334 -11.047 1.00 53.01 H new ATOM 0 HG21 THR A 42 -25.565 0.542 -13.054 1.00 53.25 H new ATOM 0 HG22 THR A 42 -24.165 0.206 -14.099 1.00 53.25 H new ATOM 0 HG23 THR A 42 -25.119 -1.139 -13.429 1.00 53.25 H new ATOM 669 N GLU A 43 -20.475 -0.192 -12.825 1.00 24.33 N ATOM 670 CA GLU A 43 -19.097 0.205 -12.567 1.00 54.43 C ATOM 671 C GLU A 43 -19.013 1.590 -11.923 1.00 22.22 C ATOM 672 O GLU A 43 -19.817 2.478 -12.210 1.00 53.03 O ATOM 673 CB GLU A 43 -18.313 0.190 -13.887 1.00 4.23 C ATOM 674 CG GLU A 43 -18.632 1.383 -14.809 1.00 11.10 C ATOM 675 CD GLU A 43 -18.208 1.114 -16.237 1.00 70.41 C ATOM 676 OE1 GLU A 43 -16.983 0.986 -16.480 1.00 74.32 O ATOM 677 OE2 GLU A 43 -19.078 1.095 -17.131 1.00 34.31 O ATOM 0 H GLU A 43 -20.732 -0.183 -13.812 1.00 24.33 H new ATOM 0 HA GLU A 43 -18.663 -0.506 -11.864 1.00 54.43 H new ATOM 0 HB2 GLU A 43 -17.246 0.188 -13.666 1.00 4.23 H new ATOM 0 HB3 GLU A 43 -18.530 -0.737 -14.418 1.00 4.23 H new ATOM 0 HG2 GLU A 43 -19.702 1.590 -14.780 1.00 11.10 H new ATOM 0 HG3 GLU A 43 -18.124 2.274 -14.440 1.00 11.10 H new ATOM 684 N GLN A 44 -17.957 1.841 -11.154 1.00 70.44 N ATOM 685 CA GLN A 44 -17.603 3.168 -10.688 1.00 11.40 C ATOM 686 C GLN A 44 -16.083 3.291 -10.683 1.00 50.43 C ATOM 687 O GLN A 44 -15.412 2.291 -10.447 1.00 42.43 O ATOM 688 CB GLN A 44 -18.164 3.355 -9.270 1.00 61.53 C ATOM 689 CG GLN A 44 -18.186 4.841 -8.892 1.00 41.12 C ATOM 690 CD GLN A 44 -17.793 5.166 -7.456 1.00 51.11 C ATOM 691 OE1 GLN A 44 -18.329 6.089 -6.866 1.00 54.32 O ATOM 692 NE2 GLN A 44 -16.810 4.498 -6.873 1.00 73.51 N ATOM 0 H GLN A 44 -17.317 1.114 -10.835 1.00 70.44 H new ATOM 0 HA GLN A 44 -18.020 3.936 -11.340 1.00 11.40 H new ATOM 0 HB2 GLN A 44 -19.172 2.945 -9.215 1.00 61.53 H new ATOM 0 HB3 GLN A 44 -17.555 2.801 -8.556 1.00 61.53 H new ATOM 0 HG2 GLN A 44 -17.514 5.377 -9.563 1.00 41.12 H new ATOM 0 HG3 GLN A 44 -19.190 5.227 -9.070 1.00 41.12 H new ATOM 0 HE21 GLN A 44 -16.358 3.725 -7.362 1.00 73.51 H new ATOM 0 HE22 GLN A 44 -16.504 4.756 -5.935 1.00 73.51 H new ATOM 701 N THR A 45 -15.535 4.502 -10.825 1.00 71.31 N ATOM 702 CA THR A 45 -14.141 4.809 -10.522 1.00 24.34 C ATOM 703 C THR A 45 -14.032 6.091 -9.698 1.00 21.23 C ATOM 704 O THR A 45 -14.861 7.004 -9.813 1.00 61.24 O ATOM 705 CB THR A 45 -13.292 4.874 -11.809 1.00 61.52 C ATOM 706 OG1 THR A 45 -13.832 5.774 -12.760 1.00 63.24 O ATOM 707 CG2 THR A 45 -13.120 3.510 -12.474 1.00 34.14 C ATOM 0 H THR A 45 -16.061 5.309 -11.160 1.00 71.31 H new ATOM 0 HA THR A 45 -13.738 3.998 -9.915 1.00 24.34 H new ATOM 0 HB THR A 45 -12.315 5.232 -11.483 1.00 61.52 H new ATOM 0 HG1 THR A 45 -13.264 5.786 -13.558 1.00 63.24 H new ATOM 0 HG21 THR A 45 -12.514 3.618 -13.374 1.00 34.14 H new ATOM 0 HG22 THR A 45 -12.625 2.828 -11.783 1.00 34.14 H new ATOM 0 HG23 THR A 45 -14.098 3.109 -12.741 1.00 34.14 H new ATOM 715 N PHE A 46 -12.999 6.141 -8.854 1.00 43.44 N ATOM 716 CA PHE A 46 -12.709 7.193 -7.887 1.00 51.11 C ATOM 717 C PHE A 46 -11.256 7.664 -8.054 1.00 43.35 C ATOM 718 O PHE A 46 -10.447 6.947 -8.658 1.00 60.23 O ATOM 719 CB PHE A 46 -12.970 6.662 -6.457 1.00 71.34 C ATOM 720 CG PHE A 46 -14.103 7.352 -5.727 1.00 74.32 C ATOM 721 CD1 PHE A 46 -15.346 7.517 -6.363 1.00 14.42 C ATOM 722 CD2 PHE A 46 -13.923 7.824 -4.412 1.00 75.13 C ATOM 723 CE1 PHE A 46 -16.386 8.200 -5.707 1.00 64.31 C ATOM 724 CE2 PHE A 46 -14.970 8.497 -3.757 1.00 74.25 C ATOM 725 CZ PHE A 46 -16.201 8.687 -4.404 1.00 34.40 C ATOM 0 H PHE A 46 -12.300 5.398 -8.829 1.00 43.44 H new ATOM 0 HA PHE A 46 -13.362 8.049 -8.059 1.00 51.11 H new ATOM 0 HB2 PHE A 46 -13.187 5.595 -6.513 1.00 71.34 H new ATOM 0 HB3 PHE A 46 -12.058 6.771 -5.871 1.00 71.34 H new ATOM 0 HD1 PHE A 46 -15.502 7.119 -7.355 1.00 14.42 H new ATOM 0 HD2 PHE A 46 -12.981 7.669 -3.907 1.00 75.13 H new ATOM 0 HE1 PHE A 46 -17.331 8.350 -6.208 1.00 64.31 H new ATOM 0 HE2 PHE A 46 -14.826 8.869 -2.753 1.00 74.25 H new ATOM 0 HZ PHE A 46 -17.003 9.206 -3.901 1.00 34.40 H new ATOM 735 N PRO A 47 -10.911 8.864 -7.555 1.00 75.35 N ATOM 736 CA PRO A 47 -9.559 9.404 -7.599 1.00 4.01 C ATOM 737 C PRO A 47 -8.686 8.782 -6.507 1.00 74.23 C ATOM 738 O PRO A 47 -9.175 8.415 -5.437 1.00 44.05 O ATOM 739 CB PRO A 47 -9.720 10.908 -7.374 1.00 14.31 C ATOM 740 CG PRO A 47 -10.974 11.002 -6.509 1.00 24.31 C ATOM 741 CD PRO A 47 -11.826 9.826 -6.964 1.00 54.04 C ATOM 0 HA PRO A 47 -9.067 9.185 -8.546 1.00 4.01 H new ATOM 0 HB2 PRO A 47 -8.852 11.335 -6.871 1.00 14.31 H new ATOM 0 HB3 PRO A 47 -9.839 11.445 -8.315 1.00 14.31 H new ATOM 0 HG2 PRO A 47 -10.733 10.933 -5.448 1.00 24.31 H new ATOM 0 HG3 PRO A 47 -11.491 11.950 -6.657 1.00 24.31 H new ATOM 0 HD2 PRO A 47 -12.363 9.386 -6.123 1.00 54.04 H new ATOM 0 HD3 PRO A 47 -12.575 10.146 -7.688 1.00 54.04 H new ATOM 749 N PHE A 48 -7.383 8.717 -6.756 1.00 75.13 N ATOM 750 CA PHE A 48 -6.395 7.993 -5.968 1.00 41.23 C ATOM 751 C PHE A 48 -5.295 8.936 -5.488 1.00 1.40 C ATOM 752 O PHE A 48 -4.358 9.249 -6.224 1.00 43.05 O ATOM 753 CB PHE A 48 -5.787 6.868 -6.820 1.00 75.22 C ATOM 754 CG PHE A 48 -5.839 7.050 -8.331 1.00 73.44 C ATOM 755 CD1 PHE A 48 -7.028 6.760 -9.018 1.00 64.35 C ATOM 756 CD2 PHE A 48 -4.737 7.525 -9.056 1.00 43.05 C ATOM 757 CE1 PHE A 48 -7.089 6.873 -10.419 1.00 13.34 C ATOM 758 CE2 PHE A 48 -4.790 7.639 -10.457 1.00 15.13 C ATOM 759 CZ PHE A 48 -5.962 7.287 -11.139 1.00 52.45 C ATOM 0 H PHE A 48 -6.966 9.194 -7.556 1.00 75.13 H new ATOM 0 HA PHE A 48 -6.885 7.565 -5.094 1.00 41.23 H new ATOM 0 HB2 PHE A 48 -4.744 6.746 -6.528 1.00 75.22 H new ATOM 0 HB3 PHE A 48 -6.299 5.938 -6.571 1.00 75.22 H new ATOM 0 HD1 PHE A 48 -7.903 6.448 -8.467 1.00 64.35 H new ATOM 0 HD2 PHE A 48 -3.836 7.807 -8.532 1.00 43.05 H new ATOM 0 HE1 PHE A 48 -8.006 6.640 -10.940 1.00 13.34 H new ATOM 0 HE2 PHE A 48 -3.931 7.996 -11.005 1.00 15.13 H new ATOM 0 HZ PHE A 48 -5.996 7.335 -12.217 1.00 52.45 H new ATOM 769 N THR A 49 -5.419 9.419 -4.261 1.00 14.22 N ATOM 770 CA THR A 49 -4.872 10.703 -3.854 1.00 44.32 C ATOM 771 C THR A 49 -4.258 10.593 -2.450 1.00 24.22 C ATOM 772 O THR A 49 -4.578 9.670 -1.697 1.00 15.23 O ATOM 773 CB THR A 49 -6.031 11.720 -3.980 1.00 32.40 C ATOM 774 OG1 THR A 49 -7.294 11.129 -3.678 1.00 62.15 O ATOM 775 CG2 THR A 49 -6.128 12.221 -5.420 1.00 14.00 C ATOM 0 H THR A 49 -5.907 8.926 -3.513 1.00 14.22 H new ATOM 0 HA THR A 49 -4.047 11.041 -4.482 1.00 44.32 H new ATOM 0 HB THR A 49 -5.815 12.525 -3.277 1.00 32.40 H new ATOM 0 HG1 THR A 49 -8.010 11.667 -4.075 1.00 62.15 H new ATOM 0 HG21 THR A 49 -6.946 12.937 -5.502 1.00 14.00 H new ATOM 0 HG22 THR A 49 -5.193 12.705 -5.701 1.00 14.00 H new ATOM 0 HG23 THR A 49 -6.315 11.379 -6.086 1.00 14.00 H new ATOM 783 N ARG A 50 -3.342 11.494 -2.064 1.00 55.44 N ATOM 784 CA ARG A 50 -2.623 11.373 -0.781 1.00 32.14 C ATOM 785 C ARG A 50 -3.564 11.478 0.422 1.00 75.42 C ATOM 786 O ARG A 50 -3.298 10.902 1.470 1.00 31.50 O ATOM 787 CB ARG A 50 -1.479 12.396 -0.707 1.00 33.13 C ATOM 788 CG ARG A 50 -0.535 12.110 0.476 1.00 61.31 C ATOM 789 CD ARG A 50 0.659 13.066 0.521 1.00 42.15 C ATOM 790 NE ARG A 50 0.297 14.387 1.049 1.00 51.41 N ATOM 791 CZ ARG A 50 1.149 15.385 1.304 1.00 52.14 C ATOM 792 NH1 ARG A 50 2.447 15.230 1.075 1.00 44.41 N ATOM 793 NH2 ARG A 50 0.707 16.542 1.777 1.00 75.13 N ATOM 0 H ARG A 50 -3.081 12.311 -2.616 1.00 55.44 H new ATOM 0 HA ARG A 50 -2.186 10.375 -0.738 1.00 32.14 H new ATOM 0 HB2 ARG A 50 -0.912 12.376 -1.638 1.00 33.13 H new ATOM 0 HB3 ARG A 50 -1.894 13.399 -0.608 1.00 33.13 H new ATOM 0 HG2 ARG A 50 -1.094 12.188 1.409 1.00 61.31 H new ATOM 0 HG3 ARG A 50 -0.172 11.085 0.407 1.00 61.31 H new ATOM 0 HD2 ARG A 50 1.445 12.633 1.140 1.00 42.15 H new ATOM 0 HD3 ARG A 50 1.069 13.179 -0.483 1.00 42.15 H new ATOM 0 HE ARG A 50 -0.691 14.558 1.238 1.00 51.41 H new ATOM 0 HH11 ARG A 50 2.797 14.347 0.703 1.00 44.41 H new ATOM 0 HH12 ARG A 50 3.094 15.994 1.271 1.00 44.41 H new ATOM 0 HH21 ARG A 50 -0.290 16.675 1.949 1.00 75.13 H new ATOM 0 HH22 ARG A 50 1.363 17.299 1.969 1.00 75.13 H new ATOM 807 N GLU A 51 -4.705 12.133 0.238 1.00 55.12 N ATOM 808 CA GLU A 51 -5.813 12.236 1.185 1.00 23.51 C ATOM 809 C GLU A 51 -6.387 10.874 1.636 1.00 44.24 C ATOM 810 O GLU A 51 -7.182 10.832 2.570 1.00 72.24 O ATOM 811 CB GLU A 51 -6.906 13.083 0.505 1.00 40.32 C ATOM 812 CG GLU A 51 -7.590 12.278 -0.615 1.00 72.22 C ATOM 813 CD GLU A 51 -8.253 13.105 -1.710 1.00 44.04 C ATOM 814 OE1 GLU A 51 -7.732 14.172 -2.106 1.00 60.44 O ATOM 815 OE2 GLU A 51 -9.185 12.549 -2.338 1.00 43.04 O ATOM 0 H GLU A 51 -4.894 12.637 -0.628 1.00 55.12 H new ATOM 0 HA GLU A 51 -5.443 12.698 2.100 1.00 23.51 H new ATOM 0 HB2 GLU A 51 -7.646 13.393 1.243 1.00 40.32 H new ATOM 0 HB3 GLU A 51 -6.467 13.991 0.093 1.00 40.32 H new ATOM 0 HG2 GLU A 51 -6.847 11.627 -1.076 1.00 72.22 H new ATOM 0 HG3 GLU A 51 -8.344 11.632 -0.165 1.00 72.22 H new ATOM 822 N LYS A 52 -6.036 9.772 0.963 1.00 32.24 N ATOM 823 CA LYS A 52 -6.556 8.422 1.170 1.00 0.13 C ATOM 824 C LYS A 52 -5.371 7.442 1.117 1.00 52.01 C ATOM 825 O LYS A 52 -5.436 6.399 0.467 1.00 41.01 O ATOM 826 CB LYS A 52 -7.693 8.143 0.166 1.00 71.11 C ATOM 827 CG LYS A 52 -7.282 8.293 -1.303 1.00 60.41 C ATOM 828 CD LYS A 52 -8.226 7.581 -2.263 1.00 74.22 C ATOM 829 CE LYS A 52 -9.618 8.169 -2.515 1.00 55.32 C ATOM 830 NZ LYS A 52 -9.656 9.638 -2.731 1.00 23.40 N ATOM 0 H LYS A 52 -5.341 9.804 0.217 1.00 32.24 H new ATOM 0 HA LYS A 52 -7.017 8.296 2.150 1.00 0.13 H new ATOM 0 HB2 LYS A 52 -8.065 7.131 0.327 1.00 71.11 H new ATOM 0 HB3 LYS A 52 -8.520 8.823 0.372 1.00 71.11 H new ATOM 0 HG2 LYS A 52 -7.245 9.352 -1.558 1.00 60.41 H new ATOM 0 HG3 LYS A 52 -6.274 7.899 -1.434 1.00 60.41 H new ATOM 0 HD2 LYS A 52 -7.721 7.508 -3.226 1.00 74.22 H new ATOM 0 HD3 LYS A 52 -8.361 6.563 -1.896 1.00 74.22 H new ATOM 0 HE2 LYS A 52 -10.049 7.679 -3.388 1.00 55.32 H new ATOM 0 HE3 LYS A 52 -10.256 7.926 -1.665 1.00 55.32 H new ATOM 0 HZ1 LYS A 52 -10.384 9.866 -3.438 1.00 23.40 H new ATOM 0 HZ2 LYS A 52 -9.882 10.115 -1.835 1.00 23.40 H new ATOM 0 HZ3 LYS A 52 -8.729 9.963 -3.072 1.00 23.40 H new ATOM 844 N TRP A 53 -4.234 7.842 1.701 1.00 34.44 N ATOM 845 CA TRP A 53 -3.098 6.955 1.945 1.00 34.54 C ATOM 846 C TRP A 53 -3.459 5.949 3.053 1.00 4.42 C ATOM 847 O TRP A 53 -4.480 6.134 3.711 1.00 75.41 O ATOM 848 CB TRP A 53 -1.871 7.799 2.344 1.00 20.13 C ATOM 849 CG TRP A 53 -0.600 7.029 2.567 1.00 4.40 C ATOM 850 CD1 TRP A 53 0.090 6.957 3.731 1.00 32.31 C ATOM 851 CD2 TRP A 53 0.089 6.129 1.645 1.00 33.21 C ATOM 852 NE1 TRP A 53 1.150 6.084 3.585 1.00 54.33 N ATOM 853 CE2 TRP A 53 1.194 5.537 2.325 1.00 32.12 C ATOM 854 CE3 TRP A 53 -0.138 5.714 0.315 1.00 41.12 C ATOM 855 CZ2 TRP A 53 2.033 4.589 1.722 1.00 61.34 C ATOM 856 CZ3 TRP A 53 0.719 4.796 -0.318 1.00 20.43 C ATOM 857 CH2 TRP A 53 1.807 4.242 0.380 1.00 0.12 C ATOM 0 H TRP A 53 -4.079 8.799 2.019 1.00 34.44 H new ATOM 0 HA TRP A 53 -2.857 6.397 1.040 1.00 34.54 H new ATOM 0 HB2 TRP A 53 -1.694 8.541 1.565 1.00 20.13 H new ATOM 0 HB3 TRP A 53 -2.109 8.345 3.257 1.00 20.13 H new ATOM 0 HD1 TRP A 53 -0.152 7.499 4.634 1.00 32.31 H new ATOM 0 HE1 TRP A 53 1.820 5.871 4.324 1.00 54.33 H new ATOM 0 HE3 TRP A 53 -0.985 6.109 -0.226 1.00 41.12 H new ATOM 0 HZ2 TRP A 53 2.838 4.134 2.279 1.00 61.34 H new ATOM 0 HZ3 TRP A 53 0.541 4.515 -1.345 1.00 20.43 H new ATOM 0 HH2 TRP A 53 2.470 3.549 -0.117 1.00 0.12 H new ATOM 868 N ALA A 54 -2.607 4.961 3.333 1.00 43.01 N ATOM 869 CA ALA A 54 -2.644 4.125 4.529 1.00 35.13 C ATOM 870 C ALA A 54 -1.194 3.862 4.946 1.00 1.32 C ATOM 871 O ALA A 54 -0.414 3.378 4.121 1.00 73.05 O ATOM 872 CB ALA A 54 -3.418 2.830 4.235 1.00 11.12 C ATOM 0 H ALA A 54 -1.842 4.713 2.705 1.00 43.01 H new ATOM 0 HA ALA A 54 -3.165 4.616 5.351 1.00 35.13 H new ATOM 0 HB1 ALA A 54 -3.443 2.210 5.131 1.00 11.12 H new ATOM 0 HB2 ALA A 54 -4.437 3.075 3.935 1.00 11.12 H new ATOM 0 HB3 ALA A 54 -2.924 2.286 3.430 1.00 11.12 H new ATOM 878 N LEU A 55 -0.815 4.256 6.167 1.00 62.41 N ATOM 879 CA LEU A 55 0.525 4.055 6.732 1.00 71.05 C ATOM 880 C LEU A 55 0.765 2.565 6.985 1.00 14.31 C ATOM 881 O LEU A 55 -0.197 1.809 7.136 1.00 22.02 O ATOM 882 CB LEU A 55 0.680 4.873 8.034 1.00 41.54 C ATOM 883 CG LEU A 55 0.838 6.385 7.766 1.00 1.22 C ATOM 884 CD1 LEU A 55 0.626 7.265 8.999 1.00 44.42 C ATOM 885 CD2 LEU A 55 2.219 6.711 7.197 1.00 53.22 C ATOM 0 H LEU A 55 -1.448 4.736 6.807 1.00 62.41 H new ATOM 0 HA LEU A 55 1.273 4.406 6.021 1.00 71.05 H new ATOM 0 HB2 LEU A 55 -0.191 4.709 8.669 1.00 41.54 H new ATOM 0 HB3 LEU A 55 1.548 4.512 8.585 1.00 41.54 H new ATOM 0 HG LEU A 55 0.052 6.611 7.045 1.00 1.22 H new ATOM 0 HD11 LEU A 55 0.755 8.312 8.725 1.00 44.42 H new ATOM 0 HD12 LEU A 55 -0.381 7.112 9.386 1.00 44.42 H new ATOM 0 HD13 LEU A 55 1.353 6.998 9.766 1.00 44.42 H new ATOM 0 HD21 LEU A 55 2.296 7.784 7.020 1.00 53.22 H new ATOM 0 HD22 LEU A 55 2.987 6.404 7.907 1.00 53.22 H new ATOM 0 HD23 LEU A 55 2.360 6.177 6.257 1.00 53.22 H new ATOM 897 N LEU A 56 2.040 2.148 6.998 1.00 55.24 N ATOM 898 CA LEU A 56 2.429 0.732 7.041 1.00 63.34 C ATOM 899 C LEU A 56 3.618 0.529 7.993 1.00 34.44 C ATOM 900 O LEU A 56 4.509 1.384 8.038 1.00 75.13 O ATOM 901 CB LEU A 56 2.828 0.277 5.621 1.00 70.05 C ATOM 902 CG LEU A 56 1.831 0.558 4.476 1.00 52.52 C ATOM 903 CD1 LEU A 56 2.527 0.298 3.137 1.00 72.02 C ATOM 904 CD2 LEU A 56 0.550 -0.282 4.540 1.00 5.22 C ATOM 0 H LEU A 56 2.834 2.788 6.979 1.00 55.24 H new ATOM 0 HA LEU A 56 1.587 0.143 7.403 1.00 63.34 H new ATOM 0 HB2 LEU A 56 3.774 0.755 5.368 1.00 70.05 H new ATOM 0 HB3 LEU A 56 3.012 -0.797 5.651 1.00 70.05 H new ATOM 0 HG LEU A 56 1.525 1.599 4.581 1.00 52.52 H new ATOM 0 HD11 LEU A 56 1.831 0.494 2.321 1.00 72.02 H new ATOM 0 HD12 LEU A 56 3.391 0.956 3.042 1.00 72.02 H new ATOM 0 HD13 LEU A 56 2.855 -0.741 3.093 1.00 72.02 H new ATOM 0 HD21 LEU A 56 -0.096 -0.024 3.701 1.00 5.22 H new ATOM 0 HD22 LEU A 56 0.806 -1.340 4.489 1.00 5.22 H new ATOM 0 HD23 LEU A 56 0.028 -0.079 5.475 1.00 5.22 H new ATOM 916 N ASP A 57 3.716 -0.620 8.673 1.00 33.04 N ATOM 917 CA ASP A 57 4.731 -0.905 9.702 1.00 71.21 C ATOM 918 C ASP A 57 5.921 -1.702 9.144 1.00 71.01 C ATOM 919 O ASP A 57 5.908 -2.181 8.009 1.00 21.40 O ATOM 920 CB ASP A 57 4.132 -1.745 10.846 1.00 43.55 C ATOM 921 CG ASP A 57 3.206 -0.985 11.788 1.00 70.35 C ATOM 922 OD1 ASP A 57 2.015 -0.830 11.447 1.00 64.45 O ATOM 923 OD2 ASP A 57 3.640 -0.643 12.911 1.00 54.11 O ATOM 0 H ASP A 57 3.076 -1.399 8.521 1.00 33.04 H new ATOM 0 HA ASP A 57 5.070 0.068 10.058 1.00 71.21 H new ATOM 0 HB2 ASP A 57 3.580 -2.579 10.413 1.00 43.55 H new ATOM 0 HB3 ASP A 57 4.948 -2.171 11.429 1.00 43.55 H new ATOM 928 N GLU A 58 6.938 -1.935 9.982 1.00 34.30 N ATOM 929 CA GLU A 58 8.059 -2.825 9.722 1.00 65.04 C ATOM 930 C GLU A 58 7.605 -4.273 9.500 1.00 5.14 C ATOM 931 O GLU A 58 8.186 -4.986 8.683 1.00 22.32 O ATOM 932 CB GLU A 58 9.051 -2.706 10.895 1.00 64.15 C ATOM 933 CG GLU A 58 10.427 -3.204 10.461 1.00 22.14 C ATOM 934 CD GLU A 58 11.497 -3.153 11.557 1.00 63.15 C ATOM 935 OE1 GLU A 58 11.467 -3.976 12.505 1.00 73.34 O ATOM 936 OE2 GLU A 58 12.486 -2.399 11.391 1.00 4.53 O ATOM 0 H GLU A 58 6.998 -1.486 10.896 1.00 34.30 H new ATOM 0 HA GLU A 58 8.551 -2.528 8.796 1.00 65.04 H new ATOM 0 HB2 GLU A 58 9.117 -1.669 11.224 1.00 64.15 H new ATOM 0 HB3 GLU A 58 8.695 -3.288 11.745 1.00 64.15 H new ATOM 0 HG2 GLU A 58 10.333 -4.232 10.110 1.00 22.14 H new ATOM 0 HG3 GLU A 58 10.765 -2.607 9.614 1.00 22.14 H new ATOM 943 N GLU A 59 6.573 -4.719 10.216 1.00 1.44 N ATOM 944 CA GLU A 59 5.974 -6.040 10.038 1.00 63.04 C ATOM 945 C GLU A 59 5.090 -6.118 8.799 1.00 14.22 C ATOM 946 O GLU A 59 4.898 -7.208 8.261 1.00 54.15 O ATOM 947 CB GLU A 59 5.184 -6.436 11.300 1.00 72.33 C ATOM 948 CG GLU A 59 3.984 -5.520 11.630 1.00 64.23 C ATOM 949 CD GLU A 59 3.230 -5.983 12.879 1.00 24.33 C ATOM 950 OE1 GLU A 59 3.895 -6.201 13.914 1.00 41.44 O ATOM 951 OE2 GLU A 59 1.994 -6.172 12.836 1.00 74.44 O ATOM 0 H GLU A 59 6.124 -4.165 10.945 1.00 1.44 H new ATOM 0 HA GLU A 59 6.787 -6.749 9.886 1.00 63.04 H new ATOM 0 HB2 GLU A 59 4.821 -7.457 11.178 1.00 72.33 H new ATOM 0 HB3 GLU A 59 5.865 -6.439 12.151 1.00 72.33 H new ATOM 0 HG2 GLU A 59 4.338 -4.500 11.779 1.00 64.23 H new ATOM 0 HG3 GLU A 59 3.300 -5.500 10.781 1.00 64.23 H new ATOM 958 N THR A 60 4.564 -4.988 8.329 1.00 31.32 N ATOM 959 CA THR A 60 3.761 -4.960 7.125 1.00 63.44 C ATOM 960 C THR A 60 4.658 -5.253 5.921 1.00 45.43 C ATOM 961 O THR A 60 4.298 -6.059 5.062 1.00 62.04 O ATOM 962 CB THR A 60 3.052 -3.602 7.013 1.00 63.22 C ATOM 963 OG1 THR A 60 2.319 -3.295 8.187 1.00 74.45 O ATOM 964 CG2 THR A 60 2.109 -3.583 5.820 1.00 53.55 C ATOM 0 H THR A 60 4.685 -4.078 8.773 1.00 31.32 H new ATOM 0 HA THR A 60 2.987 -5.727 7.157 1.00 63.44 H new ATOM 0 HB THR A 60 3.829 -2.849 6.879 1.00 63.22 H new ATOM 0 HG1 THR A 60 1.644 -2.615 7.983 1.00 74.45 H new ATOM 0 HG21 THR A 60 1.618 -2.612 5.760 1.00 53.55 H new ATOM 0 HG22 THR A 60 2.675 -3.760 4.906 1.00 53.55 H new ATOM 0 HG23 THR A 60 1.357 -4.363 5.938 1.00 53.55 H new ATOM 972 N LEU A 61 5.856 -4.656 5.865 1.00 41.32 N ATOM 973 CA LEU A 61 6.778 -4.822 4.753 1.00 2.54 C ATOM 974 C LEU A 61 7.736 -5.944 5.125 1.00 21.10 C ATOM 975 O LEU A 61 8.962 -5.755 5.178 1.00 5.31 O ATOM 976 CB LEU A 61 7.487 -3.503 4.372 1.00 63.35 C ATOM 977 CG LEU A 61 6.650 -2.411 3.667 1.00 64.02 C ATOM 978 CD1 LEU A 61 5.992 -2.877 2.363 1.00 33.01 C ATOM 979 CD2 LEU A 61 5.575 -1.793 4.561 1.00 22.12 C ATOM 0 H LEU A 61 6.207 -4.042 6.599 1.00 41.32 H new ATOM 0 HA LEU A 61 6.238 -5.096 3.847 1.00 2.54 H new ATOM 0 HB2 LEU A 61 7.902 -3.071 5.283 1.00 63.35 H new ATOM 0 HB3 LEU A 61 8.328 -3.750 3.724 1.00 63.35 H new ATOM 0 HG LEU A 61 7.392 -1.650 3.428 1.00 64.02 H new ATOM 0 HD11 LEU A 61 5.423 -2.055 1.929 1.00 33.01 H new ATOM 0 HD12 LEU A 61 6.762 -3.196 1.661 1.00 33.01 H new ATOM 0 HD13 LEU A 61 5.323 -3.712 2.571 1.00 33.01 H new ATOM 0 HD21 LEU A 61 5.027 -1.035 4.001 1.00 22.12 H new ATOM 0 HD22 LEU A 61 4.885 -2.570 4.891 1.00 22.12 H new ATOM 0 HD23 LEU A 61 6.045 -1.333 5.430 1.00 22.12 H new ATOM 991 N LYS A 62 7.174 -7.130 5.370 1.00 24.12 N ATOM 992 CA LYS A 62 7.928 -8.358 5.519 1.00 11.54 C ATOM 993 C LYS A 62 7.459 -9.407 4.532 1.00 44.32 C ATOM 994 O LYS A 62 6.293 -9.416 4.149 1.00 31.32 O ATOM 995 CB LYS A 62 7.807 -8.910 6.943 1.00 22.43 C ATOM 996 CG LYS A 62 9.196 -9.053 7.560 1.00 43.42 C ATOM 997 CD LYS A 62 9.224 -9.944 8.806 1.00 74.23 C ATOM 998 CE LYS A 62 10.611 -9.868 9.458 1.00 24.14 C ATOM 999 NZ LYS A 62 10.877 -11.006 10.362 1.00 72.31 N ATOM 0 H LYS A 62 6.167 -7.257 5.470 1.00 24.12 H new ATOM 0 HA LYS A 62 8.973 -8.122 5.318 1.00 11.54 H new ATOM 0 HB2 LYS A 62 7.196 -8.243 7.551 1.00 22.43 H new ATOM 0 HB3 LYS A 62 7.305 -9.877 6.927 1.00 22.43 H new ATOM 0 HG2 LYS A 62 9.875 -9.465 6.814 1.00 43.42 H new ATOM 0 HG3 LYS A 62 9.572 -8.064 7.822 1.00 43.42 H new ATOM 0 HD2 LYS A 62 8.460 -9.622 9.513 1.00 74.23 H new ATOM 0 HD3 LYS A 62 8.994 -10.974 8.535 1.00 74.23 H new ATOM 0 HE2 LYS A 62 11.373 -9.841 8.679 1.00 24.14 H new ATOM 0 HE3 LYS A 62 10.695 -8.937 10.018 1.00 24.14 H new ATOM 0 HZ1 LYS A 62 11.826 -10.906 10.776 1.00 72.31 H new ATOM 0 HZ2 LYS A 62 10.167 -11.019 11.122 1.00 72.31 H new ATOM 0 HZ3 LYS A 62 10.825 -11.895 9.825 1.00 72.31 H new ATOM 1013 N GLU A 63 8.357 -10.341 4.238 1.00 13.10 N ATOM 1014 CA GLU A 63 8.103 -11.462 3.354 1.00 25.00 C ATOM 1015 C GLU A 63 8.179 -12.763 4.124 1.00 4.30 C ATOM 1016 O GLU A 63 9.094 -12.978 4.925 1.00 53.15 O ATOM 1017 CB GLU A 63 9.115 -11.508 2.205 1.00 12.34 C ATOM 1018 CG GLU A 63 9.250 -10.206 1.421 1.00 33.20 C ATOM 1019 CD GLU A 63 8.004 -9.758 0.673 1.00 44.21 C ATOM 1020 OE1 GLU A 63 6.875 -10.062 1.097 1.00 41.53 O ATOM 1021 OE2 GLU A 63 8.162 -9.179 -0.415 1.00 34.01 O ATOM 0 H GLU A 63 9.303 -10.335 4.619 1.00 13.10 H new ATOM 0 HA GLU A 63 7.104 -11.331 2.939 1.00 25.00 H new ATOM 0 HB2 GLU A 63 10.091 -11.775 2.609 1.00 12.34 H new ATOM 0 HB3 GLU A 63 8.827 -12.302 1.517 1.00 12.34 H new ATOM 0 HG2 GLU A 63 9.541 -9.415 2.112 1.00 33.20 H new ATOM 0 HG3 GLU A 63 10.063 -10.317 0.703 1.00 33.20 H new ATOM 1028 N GLY A 64 7.265 -13.665 3.793 1.00 5.31 N ATOM 1029 CA GLY A 64 7.187 -15.009 4.324 1.00 10.12 C ATOM 1030 C GLY A 64 5.802 -15.563 4.032 1.00 3.54 C ATOM 1031 O GLY A 64 4.933 -14.856 3.514 1.00 52.54 O ATOM 0 H GLY A 64 6.528 -13.466 3.117 1.00 5.31 H new ATOM 0 HA2 GLY A 64 7.951 -15.640 3.870 1.00 10.12 H new ATOM 0 HA3 GLY A 64 7.374 -15.004 5.398 1.00 10.12 H new ATOM 1035 N ARG A 65 5.572 -16.818 4.399 1.00 25.23 N ATOM 1036 CA ARG A 65 4.234 -17.362 4.577 1.00 64.12 C ATOM 1037 C ARG A 65 3.950 -17.439 6.071 1.00 72.14 C ATOM 1038 O ARG A 65 4.839 -17.790 6.855 1.00 31.30 O ATOM 1039 CB ARG A 65 4.030 -18.688 3.826 1.00 23.23 C ATOM 1040 CG ARG A 65 5.079 -19.752 4.157 1.00 10.33 C ATOM 1041 CD ARG A 65 4.820 -21.072 3.421 1.00 61.24 C ATOM 1042 NE ARG A 65 4.303 -22.103 4.330 1.00 73.23 N ATOM 1043 CZ ARG A 65 4.432 -23.425 4.172 1.00 4.42 C ATOM 1044 NH1 ARG A 65 4.868 -23.937 3.023 1.00 23.32 N ATOM 1045 NH2 ARG A 65 4.136 -24.215 5.195 1.00 14.32 N ATOM 0 H ARG A 65 6.316 -17.491 4.583 1.00 25.23 H new ATOM 0 HA ARG A 65 3.497 -16.700 4.122 1.00 64.12 H new ATOM 0 HB2 ARG A 65 3.041 -19.080 4.062 1.00 23.23 H new ATOM 0 HB3 ARG A 65 4.048 -18.494 2.754 1.00 23.23 H new ATOM 0 HG2 ARG A 65 6.068 -19.379 3.892 1.00 10.33 H new ATOM 0 HG3 ARG A 65 5.084 -19.933 5.232 1.00 10.33 H new ATOM 0 HD2 ARG A 65 4.106 -20.906 2.614 1.00 61.24 H new ATOM 0 HD3 ARG A 65 5.745 -21.421 2.962 1.00 61.24 H new ATOM 0 HE ARG A 65 3.800 -21.782 5.157 1.00 73.23 H new ATOM 0 HH11 ARG A 65 5.109 -23.319 2.248 1.00 23.32 H new ATOM 0 HH12 ARG A 65 4.961 -24.947 2.918 1.00 23.32 H new ATOM 0 HH21 ARG A 65 3.818 -23.811 6.076 1.00 14.32 H new ATOM 0 HH22 ARG A 65 4.226 -25.227 5.101 1.00 14.32 H new ATOM 1059 N THR A 66 2.741 -17.074 6.475 1.00 31.42 N ATOM 1060 CA THR A 66 2.340 -17.096 7.874 1.00 52.11 C ATOM 1061 C THR A 66 1.788 -18.498 8.198 1.00 71.33 C ATOM 1062 O THR A 66 1.858 -19.415 7.368 1.00 64.23 O ATOM 1063 CB THR A 66 1.393 -15.906 8.153 1.00 43.15 C ATOM 1064 OG1 THR A 66 1.477 -15.557 9.517 1.00 53.33 O ATOM 1065 CG2 THR A 66 -0.068 -16.168 7.789 1.00 31.22 C ATOM 0 H THR A 66 2.010 -16.754 5.840 1.00 31.42 H new ATOM 0 HA THR A 66 3.175 -16.946 8.559 1.00 52.11 H new ATOM 0 HB THR A 66 1.726 -15.092 7.509 1.00 43.15 H new ATOM 0 HG1 THR A 66 0.880 -14.802 9.699 1.00 53.33 H new ATOM 0 HG21 THR A 66 -0.664 -15.284 8.016 1.00 31.22 H new ATOM 0 HG22 THR A 66 -0.143 -16.393 6.725 1.00 31.22 H new ATOM 0 HG23 THR A 66 -0.441 -17.014 8.366 1.00 31.22 H new ATOM 1073 N THR A 67 1.251 -18.679 9.397 1.00 23.23 N ATOM 1074 CA THR A 67 0.453 -19.814 9.820 1.00 54.52 C ATOM 1075 C THR A 67 -0.796 -19.215 10.494 1.00 2.44 C ATOM 1076 O THR A 67 -0.753 -18.068 10.957 1.00 61.32 O ATOM 1077 CB THR A 67 1.325 -20.681 10.748 1.00 30.12 C ATOM 1078 OG1 THR A 67 2.505 -21.103 10.084 1.00 63.02 O ATOM 1079 CG2 THR A 67 0.598 -21.930 11.237 1.00 53.12 C ATOM 0 H THR A 67 1.370 -17.994 10.143 1.00 23.23 H new ATOM 0 HA THR A 67 0.124 -20.470 9.014 1.00 54.52 H new ATOM 0 HB THR A 67 1.565 -20.050 11.604 1.00 30.12 H new ATOM 0 HG1 THR A 67 3.044 -21.651 10.692 1.00 63.02 H new ATOM 0 HG21 THR A 67 1.258 -22.504 11.887 1.00 53.12 H new ATOM 0 HG22 THR A 67 -0.294 -21.638 11.792 1.00 53.12 H new ATOM 0 HG23 THR A 67 0.309 -22.541 10.382 1.00 53.12 H new ATOM 1087 N GLU A 68 -1.909 -19.952 10.545 1.00 41.23 N ATOM 1088 CA GLU A 68 -3.161 -19.475 11.124 1.00 23.42 C ATOM 1089 C GLU A 68 -3.813 -20.552 11.974 1.00 30.24 C ATOM 1090 O GLU A 68 -3.441 -21.727 11.918 1.00 51.24 O ATOM 1091 CB GLU A 68 -4.122 -18.981 10.036 1.00 50.31 C ATOM 1092 CG GLU A 68 -3.555 -17.722 9.368 1.00 21.50 C ATOM 1093 CD GLU A 68 -4.602 -16.933 8.591 1.00 61.51 C ATOM 1094 OE1 GLU A 68 -5.533 -17.543 8.040 1.00 32.23 O ATOM 1095 OE2 GLU A 68 -4.468 -15.684 8.549 1.00 14.23 O ATOM 0 H GLU A 68 -1.963 -20.904 10.182 1.00 41.23 H new ATOM 0 HA GLU A 68 -2.926 -18.630 11.771 1.00 23.42 H new ATOM 0 HB2 GLU A 68 -4.273 -19.762 9.291 1.00 50.31 H new ATOM 0 HB3 GLU A 68 -5.097 -18.764 10.472 1.00 50.31 H new ATOM 0 HG2 GLU A 68 -3.117 -17.079 10.131 1.00 21.50 H new ATOM 0 HG3 GLU A 68 -2.749 -18.008 8.692 1.00 21.50 H new ATOM 1102 N GLU A 69 -4.771 -20.134 12.795 1.00 21.10 N ATOM 1103 CA GLU A 69 -5.334 -20.970 13.851 1.00 33.14 C ATOM 1104 C GLU A 69 -6.397 -21.943 13.355 1.00 54.41 C ATOM 1105 O GLU A 69 -6.549 -23.053 13.863 1.00 71.12 O ATOM 1106 CB GLU A 69 -5.872 -20.051 14.954 1.00 64.25 C ATOM 1107 CG GLU A 69 -7.096 -19.229 14.502 1.00 43.02 C ATOM 1108 CD GLU A 69 -7.346 -17.979 15.342 1.00 53.23 C ATOM 1109 OE1 GLU A 69 -6.607 -17.685 16.307 1.00 54.44 O ATOM 1110 OE2 GLU A 69 -8.295 -17.230 15.014 1.00 24.42 O ATOM 0 H GLU A 69 -5.181 -19.201 12.747 1.00 21.10 H new ATOM 0 HA GLU A 69 -4.542 -21.608 14.245 1.00 33.14 H new ATOM 0 HB2 GLU A 69 -6.144 -20.653 15.821 1.00 64.25 H new ATOM 0 HB3 GLU A 69 -5.081 -19.372 15.273 1.00 64.25 H new ATOM 0 HG2 GLU A 69 -6.959 -18.934 13.462 1.00 43.02 H new ATOM 0 HG3 GLU A 69 -7.982 -19.863 14.540 1.00 43.02 H new ATOM 1117 N GLU A 70 -7.026 -21.562 12.259 1.00 42.32 N ATOM 1118 CA GLU A 70 -8.164 -22.214 11.644 1.00 71.24 C ATOM 1119 C GLU A 70 -7.827 -22.782 10.263 1.00 73.55 C ATOM 1120 O GLU A 70 -8.682 -23.398 9.627 1.00 2.42 O ATOM 1121 CB GLU A 70 -9.400 -21.298 11.665 1.00 42.21 C ATOM 1122 CG GLU A 70 -9.270 -20.008 10.840 1.00 43.32 C ATOM 1123 CD GLU A 70 -10.583 -19.219 10.884 1.00 63.34 C ATOM 1124 OE1 GLU A 70 -10.830 -18.490 11.871 1.00 23.12 O ATOM 1125 OE2 GLU A 70 -11.450 -19.389 9.996 1.00 51.24 O ATOM 0 H GLU A 70 -6.735 -20.733 11.741 1.00 42.32 H new ATOM 0 HA GLU A 70 -8.426 -23.086 12.244 1.00 71.24 H new ATOM 0 HB2 GLU A 70 -10.257 -21.862 11.296 1.00 42.21 H new ATOM 0 HB3 GLU A 70 -9.616 -21.029 12.699 1.00 42.21 H new ATOM 0 HG2 GLU A 70 -8.457 -19.397 11.232 1.00 43.32 H new ATOM 0 HG3 GLU A 70 -9.017 -20.251 9.808 1.00 43.32 H new ATOM 1132 N GLY A 71 -6.573 -22.634 9.828 1.00 63.15 N ATOM 1133 CA GLY A 71 -6.076 -23.199 8.590 1.00 42.03 C ATOM 1134 C GLY A 71 -6.152 -22.183 7.463 1.00 74.23 C ATOM 1135 O GLY A 71 -7.068 -22.212 6.650 1.00 50.23 O ATOM 0 H GLY A 71 -5.868 -22.106 10.343 1.00 63.15 H new ATOM 0 HA2 GLY A 71 -5.044 -23.525 8.722 1.00 42.03 H new ATOM 0 HA3 GLY A 71 -6.659 -24.082 8.329 1.00 42.03 H new ATOM 1139 N GLY A 72 -5.152 -21.316 7.388 1.00 22.40 N ATOM 1140 CA GLY A 72 -4.946 -20.383 6.306 1.00 1.14 C ATOM 1141 C GLY A 72 -3.451 -20.130 6.192 1.00 45.43 C ATOM 1142 O GLY A 72 -2.668 -20.455 7.097 1.00 3.52 O ATOM 0 H GLY A 72 -4.437 -21.246 8.112 1.00 22.40 H new ATOM 0 HA2 GLY A 72 -5.338 -20.787 5.373 1.00 1.14 H new ATOM 0 HA3 GLY A 72 -5.478 -19.451 6.498 1.00 1.14 H new ATOM 1146 N THR A 73 -3.035 -19.593 5.049 1.00 34.13 N ATOM 1147 CA THR A 73 -1.650 -19.395 4.700 1.00 34.02 C ATOM 1148 C THR A 73 -1.553 -18.112 3.873 1.00 34.01 C ATOM 1149 O THR A 73 -1.724 -18.158 2.658 1.00 21.24 O ATOM 1150 CB THR A 73 -1.150 -20.627 3.921 1.00 65.34 C ATOM 1151 OG1 THR A 73 -1.498 -21.853 4.541 1.00 3.52 O ATOM 1152 CG2 THR A 73 0.369 -20.555 3.839 1.00 50.55 C ATOM 0 H THR A 73 -3.680 -19.277 4.324 1.00 34.13 H new ATOM 0 HA THR A 73 -1.021 -19.287 5.584 1.00 34.02 H new ATOM 0 HB THR A 73 -1.622 -20.607 2.939 1.00 65.34 H new ATOM 0 HG1 THR A 73 -1.158 -22.599 4.004 1.00 3.52 H new ATOM 0 HG21 THR A 73 0.745 -21.419 3.291 1.00 50.55 H new ATOM 0 HG22 THR A 73 0.663 -19.641 3.322 1.00 50.55 H new ATOM 0 HG23 THR A 73 0.788 -20.553 4.845 1.00 50.55 H new ATOM 1160 N TYR A 74 -1.293 -16.968 4.511 1.00 64.44 N ATOM 1161 CA TYR A 74 -0.944 -15.732 3.807 1.00 24.12 C ATOM 1162 C TYR A 74 0.494 -15.844 3.320 1.00 45.12 C ATOM 1163 O TYR A 74 1.373 -16.078 4.152 1.00 24.41 O ATOM 1164 CB TYR A 74 -1.037 -14.517 4.747 1.00 44.23 C ATOM 1165 CG TYR A 74 -1.008 -13.139 4.095 1.00 32.03 C ATOM 1166 CD1 TYR A 74 -1.621 -12.904 2.850 1.00 61.33 C ATOM 1167 CD2 TYR A 74 -0.475 -12.047 4.805 1.00 61.43 C ATOM 1168 CE1 TYR A 74 -1.830 -11.597 2.387 1.00 44.31 C ATOM 1169 CE2 TYR A 74 -0.656 -10.734 4.339 1.00 43.35 C ATOM 1170 CZ TYR A 74 -1.387 -10.500 3.153 1.00 12.52 C ATOM 1171 OH TYR A 74 -1.712 -9.240 2.751 1.00 54.34 O ATOM 0 H TYR A 74 -1.318 -16.873 5.526 1.00 64.44 H new ATOM 0 HA TYR A 74 -1.638 -15.594 2.978 1.00 24.12 H new ATOM 0 HB2 TYR A 74 -1.960 -14.602 5.321 1.00 44.23 H new ATOM 0 HB3 TYR A 74 -0.213 -14.574 5.458 1.00 44.23 H new ATOM 0 HD1 TYR A 74 -1.934 -13.741 2.244 1.00 61.33 H new ATOM 0 HD2 TYR A 74 0.078 -12.220 5.716 1.00 61.43 H new ATOM 0 HE1 TYR A 74 -2.330 -11.431 1.444 1.00 44.31 H new ATOM 0 HE2 TYR A 74 -0.236 -9.904 4.887 1.00 43.35 H new ATOM 0 HH TYR A 74 -1.337 -8.589 3.380 1.00 54.34 H new ATOM 1181 N ILE A 75 0.768 -15.674 2.029 1.00 70.33 N ATOM 1182 CA ILE A 75 2.106 -15.561 1.463 1.00 73.44 C ATOM 1183 C ILE A 75 2.354 -14.081 1.163 1.00 13.24 C ATOM 1184 O ILE A 75 1.413 -13.343 0.880 1.00 30.04 O ATOM 1185 CB ILE A 75 2.201 -16.449 0.196 1.00 30.34 C ATOM 1186 CG1 ILE A 75 1.875 -17.922 0.535 1.00 2.11 C ATOM 1187 CG2 ILE A 75 3.606 -16.400 -0.425 1.00 4.20 C ATOM 1188 CD1 ILE A 75 0.424 -18.309 0.260 1.00 44.43 C ATOM 0 H ILE A 75 0.035 -15.609 1.323 1.00 70.33 H new ATOM 0 HA ILE A 75 2.874 -15.911 2.153 1.00 73.44 H new ATOM 0 HB ILE A 75 1.477 -16.057 -0.518 1.00 30.34 H new ATOM 0 HG12 ILE A 75 2.531 -18.572 -0.044 1.00 2.11 H new ATOM 0 HG13 ILE A 75 2.096 -18.101 1.587 1.00 2.11 H new ATOM 0 HG21 ILE A 75 3.635 -17.034 -1.311 1.00 4.20 H new ATOM 0 HG22 ILE A 75 3.844 -15.374 -0.706 1.00 4.20 H new ATOM 0 HG23 ILE A 75 4.337 -16.757 0.300 1.00 4.20 H new ATOM 0 HD11 ILE A 75 0.271 -19.356 0.522 1.00 44.43 H new ATOM 0 HD12 ILE A 75 -0.239 -17.684 0.859 1.00 44.43 H new ATOM 0 HD13 ILE A 75 0.203 -18.163 -0.797 1.00 44.43 H new ATOM 1200 N SER A 76 3.614 -13.649 1.211 1.00 21.43 N ATOM 1201 CA SER A 76 4.077 -12.372 0.694 1.00 44.45 C ATOM 1202 C SER A 76 5.490 -12.591 0.140 1.00 14.23 C ATOM 1203 O SER A 76 6.288 -13.302 0.774 1.00 4.22 O ATOM 1204 CB SER A 76 4.000 -11.318 1.810 1.00 5.13 C ATOM 1205 OG SER A 76 4.363 -10.028 1.373 1.00 65.03 O ATOM 0 H SER A 76 4.363 -14.202 1.627 1.00 21.43 H new ATOM 0 HA SER A 76 3.455 -11.994 -0.117 1.00 44.45 H new ATOM 0 HB2 SER A 76 2.985 -11.289 2.206 1.00 5.13 H new ATOM 0 HB3 SER A 76 4.654 -11.616 2.630 1.00 5.13 H new ATOM 0 HG SER A 76 5.298 -9.854 1.609 1.00 65.03 H new ATOM 1211 N HIS A 77 5.791 -12.054 -1.048 1.00 73.34 N ATOM 1212 CA HIS A 77 7.141 -11.975 -1.601 1.00 52.35 C ATOM 1213 C HIS A 77 7.231 -10.962 -2.741 1.00 72.25 C ATOM 1214 O HIS A 77 6.286 -10.761 -3.503 1.00 31.23 O ATOM 1215 CB HIS A 77 7.631 -13.326 -2.148 1.00 64.14 C ATOM 1216 CG HIS A 77 6.849 -13.988 -3.271 1.00 30.00 C ATOM 1217 ND1 HIS A 77 7.385 -14.939 -4.115 1.00 43.11 N ATOM 1218 CD2 HIS A 77 5.531 -13.818 -3.635 1.00 41.12 C ATOM 1219 CE1 HIS A 77 6.415 -15.360 -4.940 1.00 2.44 C ATOM 1220 NE2 HIS A 77 5.266 -14.727 -4.668 1.00 61.23 N ATOM 0 H HIS A 77 5.083 -11.654 -1.664 1.00 73.34 H new ATOM 0 HA HIS A 77 7.771 -11.664 -0.767 1.00 52.35 H new ATOM 0 HB2 HIS A 77 8.655 -13.190 -2.495 1.00 64.14 H new ATOM 0 HB3 HIS A 77 7.667 -14.026 -1.314 1.00 64.14 H new ATOM 0 HD2 HIS A 77 4.833 -13.115 -3.205 1.00 41.12 H new ATOM 0 HE1 HIS A 77 6.542 -16.103 -5.713 1.00 2.44 H new ATOM 0 HE2 HIS A 77 4.368 -14.878 -5.127 1.00 61.23 H new ATOM 1228 N PHE A 78 8.445 -10.451 -2.933 1.00 4.10 N ATOM 1229 CA PHE A 78 8.865 -9.698 -4.090 1.00 72.04 C ATOM 1230 C PHE A 78 8.753 -10.629 -5.276 1.00 64.34 C ATOM 1231 O PHE A 78 9.451 -11.645 -5.328 1.00 33.22 O ATOM 1232 CB PHE A 78 10.332 -9.275 -3.950 1.00 62.31 C ATOM 1233 CG PHE A 78 10.580 -8.204 -2.921 1.00 52.55 C ATOM 1234 CD1 PHE A 78 10.855 -8.545 -1.585 1.00 73.43 C ATOM 1235 CD2 PHE A 78 10.535 -6.858 -3.312 1.00 43.24 C ATOM 1236 CE1 PHE A 78 11.064 -7.542 -0.626 1.00 52.25 C ATOM 1237 CE2 PHE A 78 10.799 -5.860 -2.361 1.00 44.11 C ATOM 1238 CZ PHE A 78 11.041 -6.196 -1.018 1.00 53.54 C ATOM 0 H PHE A 78 9.191 -10.562 -2.247 1.00 4.10 H new ATOM 0 HA PHE A 78 8.251 -8.804 -4.203 1.00 72.04 H new ATOM 0 HB2 PHE A 78 10.926 -10.152 -3.693 1.00 62.31 H new ATOM 0 HB3 PHE A 78 10.688 -8.921 -4.917 1.00 62.31 H new ATOM 0 HD1 PHE A 78 10.906 -9.584 -1.295 1.00 73.43 H new ATOM 0 HD2 PHE A 78 10.300 -6.593 -4.332 1.00 43.24 H new ATOM 0 HE1 PHE A 78 11.241 -7.805 0.406 1.00 52.25 H new ATOM 0 HE2 PHE A 78 10.816 -4.824 -2.664 1.00 44.11 H new ATOM 0 HZ PHE A 78 11.209 -5.418 -0.288 1.00 53.54 H new ATOM 1248 N THR A 79 7.922 -10.283 -6.239 1.00 53.45 N ATOM 1249 CA THR A 79 7.821 -10.979 -7.508 1.00 54.42 C ATOM 1250 C THR A 79 8.676 -10.284 -8.578 1.00 2.53 C ATOM 1251 O THR A 79 8.740 -10.753 -9.714 1.00 74.02 O ATOM 1252 CB THR A 79 6.326 -11.037 -7.861 1.00 30.20 C ATOM 1253 OG1 THR A 79 5.749 -9.764 -7.652 1.00 21.00 O ATOM 1254 CG2 THR A 79 5.610 -12.052 -6.959 1.00 2.30 C ATOM 0 H THR A 79 7.283 -9.492 -6.160 1.00 53.45 H new ATOM 0 HA THR A 79 8.214 -11.994 -7.449 1.00 54.42 H new ATOM 0 HB THR A 79 6.220 -11.337 -8.904 1.00 30.20 H new ATOM 0 HG1 THR A 79 4.877 -9.723 -8.097 1.00 21.00 H new ATOM 0 HG21 THR A 79 4.552 -12.085 -7.217 1.00 2.30 H new ATOM 0 HG22 THR A 79 6.050 -13.039 -7.102 1.00 2.30 H new ATOM 0 HG23 THR A 79 5.720 -11.753 -5.916 1.00 2.30 H new ATOM 1262 N VAL A 80 9.341 -9.167 -8.256 1.00 30.04 N ATOM 1263 CA VAL A 80 9.840 -8.217 -9.257 1.00 12.11 C ATOM 1264 C VAL A 80 11.289 -7.875 -8.934 1.00 2.24 C ATOM 1265 O VAL A 80 11.605 -7.590 -7.777 1.00 5.32 O ATOM 1266 CB VAL A 80 8.926 -6.966 -9.296 1.00 45.33 C ATOM 1267 CG1 VAL A 80 9.216 -6.048 -10.493 1.00 25.34 C ATOM 1268 CG2 VAL A 80 7.448 -7.366 -9.317 1.00 4.34 C ATOM 0 H VAL A 80 9.548 -8.897 -7.294 1.00 30.04 H new ATOM 0 HA VAL A 80 9.816 -8.658 -10.254 1.00 12.11 H new ATOM 0 HB VAL A 80 9.147 -6.408 -8.386 1.00 45.33 H new ATOM 0 HG11 VAL A 80 8.544 -5.190 -10.465 1.00 25.34 H new ATOM 0 HG12 VAL A 80 10.248 -5.702 -10.444 1.00 25.34 H new ATOM 0 HG13 VAL A 80 9.061 -6.600 -11.420 1.00 25.34 H new ATOM 0 HG21 VAL A 80 6.829 -6.469 -9.344 1.00 4.34 H new ATOM 0 HG22 VAL A 80 7.248 -7.972 -10.200 1.00 4.34 H new ATOM 0 HG23 VAL A 80 7.214 -7.941 -8.421 1.00 4.34 H new ATOM 1278 N ASN A 81 12.161 -7.892 -9.948 1.00 4.11 N ATOM 1279 CA ASN A 81 13.553 -7.489 -9.814 1.00 2.51 C ATOM 1280 C ASN A 81 14.031 -6.758 -11.071 1.00 1.50 C ATOM 1281 O ASN A 81 14.907 -7.231 -11.793 1.00 44.34 O ATOM 1282 CB ASN A 81 14.459 -8.669 -9.442 1.00 14.42 C ATOM 1283 CG ASN A 81 15.916 -8.254 -9.232 1.00 33.04 C ATOM 1284 OD1 ASN A 81 16.821 -9.045 -9.483 1.00 45.45 O ATOM 1285 ND2 ASN A 81 16.212 -7.057 -8.742 1.00 72.35 N ATOM 0 H ASN A 81 11.912 -8.190 -10.891 1.00 4.11 H new ATOM 0 HA ASN A 81 13.619 -6.785 -8.984 1.00 2.51 H new ATOM 0 HB2 ASN A 81 14.084 -9.136 -8.531 1.00 14.42 H new ATOM 0 HB3 ASN A 81 14.410 -9.421 -10.229 1.00 14.42 H new ATOM 0 HD21 ASN A 81 17.185 -6.800 -8.577 1.00 72.35 H new ATOM 0 HD22 ASN A 81 15.466 -6.394 -8.531 1.00 72.35 H new ATOM 1292 N GLU A 82 13.446 -5.593 -11.334 1.00 22.31 N ATOM 1293 CA GLU A 82 13.940 -4.599 -12.297 1.00 30.44 C ATOM 1294 C GLU A 82 15.035 -3.764 -11.618 1.00 1.40 C ATOM 1295 O GLU A 82 15.138 -3.773 -10.393 1.00 13.31 O ATOM 1296 CB GLU A 82 12.745 -3.723 -12.700 1.00 11.10 C ATOM 1297 CG GLU A 82 12.051 -4.140 -14.004 1.00 30.34 C ATOM 1298 CD GLU A 82 12.825 -3.722 -15.261 1.00 45.45 C ATOM 1299 OE1 GLU A 82 13.751 -4.466 -15.663 1.00 25.31 O ATOM 1300 OE2 GLU A 82 12.481 -2.676 -15.861 1.00 73.02 O ATOM 0 H GLU A 82 12.586 -5.300 -10.870 1.00 22.31 H new ATOM 0 HA GLU A 82 14.367 -5.065 -13.185 1.00 30.44 H new ATOM 0 HB2 GLU A 82 12.012 -3.740 -11.893 1.00 11.10 H new ATOM 0 HB3 GLU A 82 13.085 -2.692 -12.800 1.00 11.10 H new ATOM 0 HG2 GLU A 82 11.921 -5.222 -14.009 1.00 30.34 H new ATOM 0 HG3 GLU A 82 11.055 -3.699 -14.035 1.00 30.34 H new ATOM 1307 N PRO A 83 15.846 -2.994 -12.352 1.00 73.14 N ATOM 1308 CA PRO A 83 16.904 -2.194 -11.750 1.00 72.02 C ATOM 1309 C PRO A 83 16.333 -1.047 -10.909 1.00 11.11 C ATOM 1310 O PRO A 83 17.021 -0.550 -10.024 1.00 45.41 O ATOM 1311 CB PRO A 83 17.740 -1.693 -12.928 1.00 53.51 C ATOM 1312 CG PRO A 83 16.747 -1.660 -14.086 1.00 51.34 C ATOM 1313 CD PRO A 83 15.763 -2.771 -13.778 1.00 61.34 C ATOM 0 HA PRO A 83 17.510 -2.772 -11.053 1.00 72.02 H new ATOM 0 HB2 PRO A 83 18.159 -0.706 -12.731 1.00 53.51 H new ATOM 0 HB3 PRO A 83 18.577 -2.359 -13.137 1.00 53.51 H new ATOM 0 HG2 PRO A 83 16.246 -0.694 -14.151 1.00 51.34 H new ATOM 0 HG3 PRO A 83 17.246 -1.826 -15.041 1.00 51.34 H new ATOM 0 HD2 PRO A 83 14.752 -2.488 -14.070 1.00 61.34 H new ATOM 0 HD3 PRO A 83 16.013 -3.677 -14.330 1.00 61.34 H new ATOM 1321 N ALA A 84 15.083 -0.642 -11.166 1.00 45.34 N ATOM 1322 CA ALA A 84 14.427 0.474 -10.513 1.00 63.24 C ATOM 1323 C ALA A 84 12.951 0.173 -10.207 1.00 64.41 C ATOM 1324 O ALA A 84 12.170 1.103 -10.002 1.00 61.45 O ATOM 1325 CB ALA A 84 14.609 1.706 -11.411 1.00 4.33 C ATOM 0 H ALA A 84 14.491 -1.103 -11.857 1.00 45.34 H new ATOM 0 HA ALA A 84 14.880 0.664 -9.540 1.00 63.24 H new ATOM 0 HB1 ALA A 84 14.126 2.567 -10.949 1.00 4.33 H new ATOM 0 HB2 ALA A 84 15.672 1.910 -11.537 1.00 4.33 H new ATOM 0 HB3 ALA A 84 14.158 1.516 -12.385 1.00 4.33 H new ATOM 1331 N HIS A 85 12.541 -1.102 -10.178 1.00 12.10 N ATOM 1332 CA HIS A 85 11.172 -1.496 -9.851 1.00 32.21 C ATOM 1333 C HIS A 85 11.207 -2.691 -8.897 1.00 51.52 C ATOM 1334 O HIS A 85 12.013 -3.612 -9.086 1.00 54.34 O ATOM 1335 CB HIS A 85 10.364 -1.796 -11.138 1.00 70.45 C ATOM 1336 CG HIS A 85 8.984 -1.199 -11.192 1.00 3.50 C ATOM 1337 ND1 HIS A 85 7.857 -1.773 -11.743 1.00 14.40 N ATOM 1338 CD2 HIS A 85 8.621 0.024 -10.706 1.00 61.01 C ATOM 1339 CE1 HIS A 85 6.829 -0.934 -11.540 1.00 73.34 C ATOM 1340 NE2 HIS A 85 7.247 0.160 -10.891 1.00 33.30 N ATOM 0 H HIS A 85 13.156 -1.890 -10.382 1.00 12.10 H new ATOM 0 HA HIS A 85 10.662 -0.674 -9.349 1.00 32.21 H new ATOM 0 HB2 HIS A 85 10.931 -1.433 -11.995 1.00 70.45 H new ATOM 0 HB3 HIS A 85 10.278 -2.877 -11.248 1.00 70.45 H new ATOM 0 HD1 HIS A 85 7.813 -2.674 -12.219 1.00 14.40 H new ATOM 0 HD2 HIS A 85 9.280 0.754 -10.259 1.00 61.01 H new ATOM 0 HE1 HIS A 85 5.812 -1.115 -11.855 1.00 73.34 H new ATOM 1348 N LYS A 86 10.341 -2.678 -7.880 1.00 71.33 N ATOM 1349 CA LYS A 86 10.097 -3.800 -6.973 1.00 65.11 C ATOM 1350 C LYS A 86 8.654 -3.692 -6.498 1.00 23.31 C ATOM 1351 O LYS A 86 8.365 -2.842 -5.654 1.00 62.02 O ATOM 1352 CB LYS A 86 11.009 -3.778 -5.729 1.00 24.01 C ATOM 1353 CG LYS A 86 12.446 -4.242 -5.975 1.00 25.44 C ATOM 1354 CD LYS A 86 13.161 -4.621 -4.664 1.00 43.22 C ATOM 1355 CE LYS A 86 14.660 -4.292 -4.648 1.00 71.45 C ATOM 1356 NZ LYS A 86 15.437 -5.057 -5.642 1.00 43.45 N ATOM 0 H LYS A 86 9.773 -1.860 -7.659 1.00 71.33 H new ATOM 0 HA LYS A 86 10.303 -4.724 -7.514 1.00 65.11 H new ATOM 0 HB2 LYS A 86 11.033 -2.763 -5.332 1.00 24.01 H new ATOM 0 HB3 LYS A 86 10.565 -4.410 -4.960 1.00 24.01 H new ATOM 0 HG2 LYS A 86 12.440 -5.101 -6.646 1.00 25.44 H new ATOM 0 HG3 LYS A 86 13.002 -3.450 -6.476 1.00 25.44 H new ATOM 0 HD2 LYS A 86 12.678 -4.102 -3.836 1.00 43.22 H new ATOM 0 HD3 LYS A 86 13.033 -5.689 -4.489 1.00 43.22 H new ATOM 0 HE2 LYS A 86 14.793 -3.226 -4.835 1.00 71.45 H new ATOM 0 HE3 LYS A 86 15.058 -4.493 -3.653 1.00 71.45 H new ATOM 0 HZ1 LYS A 86 16.440 -4.789 -5.580 1.00 43.45 H new ATOM 0 HZ2 LYS A 86 15.338 -6.075 -5.451 1.00 43.45 H new ATOM 0 HZ3 LYS A 86 15.081 -4.848 -6.597 1.00 43.45 H new ATOM 1370 N GLU A 87 7.747 -4.528 -6.997 1.00 73.44 N ATOM 1371 CA GLU A 87 6.438 -4.652 -6.364 1.00 45.24 C ATOM 1372 C GLU A 87 6.576 -5.497 -5.093 1.00 43.53 C ATOM 1373 O GLU A 87 7.635 -6.070 -4.815 1.00 33.00 O ATOM 1374 CB GLU A 87 5.370 -5.211 -7.319 1.00 51.14 C ATOM 1375 CG GLU A 87 5.267 -4.350 -8.588 1.00 2.23 C ATOM 1376 CD GLU A 87 4.011 -4.619 -9.422 1.00 70.41 C ATOM 1377 OE1 GLU A 87 2.897 -4.694 -8.849 1.00 65.31 O ATOM 1378 OE2 GLU A 87 4.149 -4.710 -10.660 1.00 12.54 O ATOM 0 H GLU A 87 7.889 -5.117 -7.818 1.00 73.44 H new ATOM 0 HA GLU A 87 6.087 -3.656 -6.094 1.00 45.24 H new ATOM 0 HB2 GLU A 87 5.619 -6.237 -7.590 1.00 51.14 H new ATOM 0 HB3 GLU A 87 4.404 -5.240 -6.815 1.00 51.14 H new ATOM 0 HG2 GLU A 87 5.283 -3.298 -8.303 1.00 2.23 H new ATOM 0 HG3 GLU A 87 6.147 -4.527 -9.207 1.00 2.23 H new ATOM 1385 N PHE A 88 5.511 -5.535 -4.307 1.00 31.02 N ATOM 1386 CA PHE A 88 5.329 -6.273 -3.073 1.00 43.21 C ATOM 1387 C PHE A 88 3.911 -6.823 -3.190 1.00 74.34 C ATOM 1388 O PHE A 88 2.970 -6.051 -3.410 1.00 24.31 O ATOM 1389 CB PHE A 88 5.491 -5.301 -1.898 1.00 25.44 C ATOM 1390 CG PHE A 88 5.458 -5.887 -0.502 1.00 70.41 C ATOM 1391 CD1 PHE A 88 6.642 -6.383 0.079 1.00 63.04 C ATOM 1392 CD2 PHE A 88 4.260 -5.889 0.239 1.00 32.02 C ATOM 1393 CE1 PHE A 88 6.634 -6.861 1.401 1.00 2.54 C ATOM 1394 CE2 PHE A 88 4.250 -6.399 1.549 1.00 73.11 C ATOM 1395 CZ PHE A 88 5.431 -6.890 2.120 1.00 64.45 C ATOM 0 H PHE A 88 4.676 -4.999 -4.542 1.00 31.02 H new ATOM 0 HA PHE A 88 6.046 -7.077 -2.907 1.00 43.21 H new ATOM 0 HB2 PHE A 88 6.439 -4.777 -2.022 1.00 25.44 H new ATOM 0 HB3 PHE A 88 4.702 -4.552 -1.968 1.00 25.44 H new ATOM 0 HD1 PHE A 88 7.558 -6.396 -0.493 1.00 63.04 H new ATOM 0 HD2 PHE A 88 3.352 -5.500 -0.198 1.00 32.02 H new ATOM 0 HE1 PHE A 88 7.549 -7.204 1.860 1.00 2.54 H new ATOM 0 HE2 PHE A 88 3.331 -6.412 2.116 1.00 73.11 H new ATOM 0 HZ PHE A 88 5.415 -7.294 3.122 1.00 64.45 H new ATOM 1405 N GLU A 89 3.768 -8.141 -3.143 1.00 63.42 N ATOM 1406 CA GLU A 89 2.554 -8.884 -3.423 1.00 73.24 C ATOM 1407 C GLU A 89 2.316 -9.832 -2.264 1.00 10.54 C ATOM 1408 O GLU A 89 3.128 -10.729 -2.010 1.00 44.32 O ATOM 1409 CB GLU A 89 2.735 -9.742 -4.676 1.00 64.41 C ATOM 1410 CG GLU A 89 2.345 -9.059 -5.989 1.00 1.30 C ATOM 1411 CD GLU A 89 2.333 -10.094 -7.120 1.00 30.00 C ATOM 1412 OE1 GLU A 89 1.451 -10.990 -7.119 1.00 24.02 O ATOM 1413 OE2 GLU A 89 3.223 -10.064 -7.996 1.00 4.52 O ATOM 0 H GLU A 89 4.545 -8.753 -2.893 1.00 63.42 H new ATOM 0 HA GLU A 89 1.728 -8.187 -3.566 1.00 73.24 H new ATOM 0 HB2 GLU A 89 3.779 -10.050 -4.740 1.00 64.41 H new ATOM 0 HB3 GLU A 89 2.141 -10.650 -4.566 1.00 64.41 H new ATOM 0 HG2 GLU A 89 1.362 -8.598 -5.893 1.00 1.30 H new ATOM 0 HG3 GLU A 89 3.051 -8.261 -6.220 1.00 1.30 H new ATOM 1420 N ALA A 90 1.162 -9.695 -1.620 1.00 72.34 N ATOM 1421 CA ALA A 90 0.760 -10.544 -0.508 1.00 61.44 C ATOM 1422 C ALA A 90 -0.666 -11.055 -0.708 1.00 41.52 C ATOM 1423 O ALA A 90 -1.596 -10.262 -0.895 1.00 21.42 O ATOM 1424 CB ALA A 90 0.934 -9.796 0.814 1.00 5.20 C ATOM 0 H ALA A 90 0.472 -8.983 -1.859 1.00 72.34 H new ATOM 0 HA ALA A 90 1.406 -11.421 -0.472 1.00 61.44 H new ATOM 0 HB1 ALA A 90 0.630 -10.440 1.639 1.00 5.20 H new ATOM 0 HB2 ALA A 90 1.980 -9.516 0.938 1.00 5.20 H new ATOM 0 HB3 ALA A 90 0.316 -8.898 0.808 1.00 5.20 H new ATOM 1430 N GLY A 91 -0.846 -12.378 -0.663 1.00 42.23 N ATOM 1431 CA GLY A 91 -2.122 -13.052 -0.864 1.00 5.02 C ATOM 1432 C GLY A 91 -2.102 -14.478 -0.348 1.00 22.44 C ATOM 1433 O GLY A 91 -1.031 -15.068 -0.179 1.00 54.13 O ATOM 0 H GLY A 91 -0.080 -13.026 -0.479 1.00 42.23 H new ATOM 0 HA2 GLY A 91 -2.910 -12.495 -0.357 1.00 5.02 H new ATOM 0 HA3 GLY A 91 -2.367 -13.055 -1.926 1.00 5.02 H new ATOM 1437 N TYR A 92 -3.279 -15.040 -0.074 1.00 2.41 N ATOM 1438 CA TYR A 92 -3.389 -16.359 0.527 1.00 33.53 C ATOM 1439 C TYR A 92 -3.205 -17.454 -0.525 1.00 51.11 C ATOM 1440 O TYR A 92 -3.343 -17.213 -1.729 1.00 73.53 O ATOM 1441 CB TYR A 92 -4.722 -16.468 1.278 1.00 10.22 C ATOM 1442 CG TYR A 92 -4.712 -15.820 2.649 1.00 61.52 C ATOM 1443 CD1 TYR A 92 -4.471 -14.441 2.785 1.00 62.52 C ATOM 1444 CD2 TYR A 92 -4.965 -16.596 3.793 1.00 11.23 C ATOM 1445 CE1 TYR A 92 -4.386 -13.854 4.055 1.00 65.32 C ATOM 1446 CE2 TYR A 92 -4.938 -16.000 5.064 1.00 13.14 C ATOM 1447 CZ TYR A 92 -4.634 -14.628 5.207 1.00 2.43 C ATOM 1448 OH TYR A 92 -4.552 -14.040 6.431 1.00 42.44 O ATOM 0 H TYR A 92 -4.176 -14.593 -0.263 1.00 2.41 H new ATOM 0 HA TYR A 92 -2.589 -16.502 1.254 1.00 33.53 H new ATOM 0 HB2 TYR A 92 -5.505 -16.008 0.676 1.00 10.22 H new ATOM 0 HB3 TYR A 92 -4.981 -17.521 1.387 1.00 10.22 H new ATOM 0 HD1 TYR A 92 -4.350 -13.829 1.903 1.00 62.52 H new ATOM 0 HD2 TYR A 92 -5.180 -17.650 3.695 1.00 11.23 H new ATOM 0 HE1 TYR A 92 -4.131 -12.809 4.151 1.00 65.32 H new ATOM 0 HE2 TYR A 92 -5.151 -16.595 5.939 1.00 13.14 H new ATOM 0 HH TYR A 92 -4.703 -14.712 7.128 1.00 42.44 H new ATOM 1458 N ASP A 93 -2.855 -18.663 -0.083 1.00 32.43 N ATOM 1459 CA ASP A 93 -2.714 -19.809 -0.980 1.00 24.30 C ATOM 1460 C ASP A 93 -4.079 -20.157 -1.565 1.00 61.14 C ATOM 1461 O ASP A 93 -5.092 -20.019 -0.876 1.00 74.12 O ATOM 1462 CB ASP A 93 -2.144 -21.034 -0.257 1.00 70.24 C ATOM 1463 CG ASP A 93 -1.896 -22.171 -1.251 1.00 43.02 C ATOM 1464 OD1 ASP A 93 -1.308 -21.903 -2.326 1.00 74.23 O ATOM 1465 OD2 ASP A 93 -2.272 -23.320 -0.938 1.00 45.04 O ATOM 0 H ASP A 93 -2.663 -18.873 0.896 1.00 32.43 H new ATOM 0 HA ASP A 93 -2.016 -19.534 -1.771 1.00 24.30 H new ATOM 0 HB2 ASP A 93 -1.212 -20.769 0.242 1.00 70.24 H new ATOM 0 HB3 ASP A 93 -2.838 -21.363 0.517 1.00 70.24 H new ATOM 1470 N GLU A 94 -4.118 -20.580 -2.832 1.00 11.23 N ATOM 1471 CA GLU A 94 -5.326 -20.912 -3.603 1.00 54.14 C ATOM 1472 C GLU A 94 -6.251 -19.706 -3.849 1.00 24.13 C ATOM 1473 O GLU A 94 -7.219 -19.794 -4.608 1.00 71.52 O ATOM 1474 CB GLU A 94 -6.073 -22.051 -2.899 1.00 53.42 C ATOM 1475 CG GLU A 94 -6.875 -22.950 -3.843 1.00 70.32 C ATOM 1476 CD GLU A 94 -7.631 -23.982 -3.014 1.00 4.00 C ATOM 1477 OE1 GLU A 94 -6.998 -24.971 -2.574 1.00 4.32 O ATOM 1478 OE2 GLU A 94 -8.822 -23.758 -2.711 1.00 4.12 O ATOM 0 H GLU A 94 -3.266 -20.708 -3.378 1.00 11.23 H new ATOM 0 HA GLU A 94 -5.005 -21.232 -4.594 1.00 54.14 H new ATOM 0 HB2 GLU A 94 -5.352 -22.663 -2.357 1.00 53.42 H new ATOM 0 HB3 GLU A 94 -6.750 -21.624 -2.159 1.00 53.42 H new ATOM 0 HG2 GLU A 94 -7.573 -22.353 -4.430 1.00 70.32 H new ATOM 0 HG3 GLU A 94 -6.209 -23.447 -4.548 1.00 70.32 H new ATOM 1485 N SER A 95 -5.927 -18.557 -3.265 1.00 42.04 N ATOM 1486 CA SER A 95 -6.661 -17.305 -3.304 1.00 52.31 C ATOM 1487 C SER A 95 -5.803 -16.221 -3.967 1.00 32.54 C ATOM 1488 O SER A 95 -4.764 -16.507 -4.574 1.00 12.43 O ATOM 1489 CB SER A 95 -7.162 -16.937 -1.894 1.00 65.21 C ATOM 1490 OG SER A 95 -6.570 -17.693 -0.853 1.00 31.23 O ATOM 0 H SER A 95 -5.076 -18.475 -2.709 1.00 42.04 H new ATOM 0 HA SER A 95 -7.555 -17.406 -3.919 1.00 52.31 H new ATOM 0 HB2 SER A 95 -6.968 -15.879 -1.716 1.00 65.21 H new ATOM 0 HB3 SER A 95 -8.243 -17.073 -1.857 1.00 65.21 H new ATOM 0 HG SER A 95 -7.044 -17.520 -0.013 1.00 31.23 H new ATOM 1496 N GLU A 96 -6.289 -14.989 -3.949 1.00 14.24 N ATOM 1497 CA GLU A 96 -5.757 -13.845 -4.661 1.00 1.40 C ATOM 1498 C GLU A 96 -5.128 -12.859 -3.666 1.00 12.22 C ATOM 1499 O GLU A 96 -5.340 -12.989 -2.454 1.00 11.22 O ATOM 1500 CB GLU A 96 -6.841 -13.265 -5.579 1.00 62.35 C ATOM 1501 CG GLU A 96 -8.132 -12.914 -4.855 1.00 71.15 C ATOM 1502 CD GLU A 96 -9.297 -12.644 -5.812 1.00 70.53 C ATOM 1503 OE1 GLU A 96 -9.647 -13.541 -6.618 1.00 22.10 O ATOM 1504 OE2 GLU A 96 -9.910 -11.556 -5.739 1.00 33.42 O ATOM 0 H GLU A 96 -7.116 -14.751 -3.402 1.00 14.24 H new ATOM 0 HA GLU A 96 -4.941 -14.128 -5.326 1.00 1.40 H new ATOM 0 HB2 GLU A 96 -6.452 -12.370 -6.065 1.00 62.35 H new ATOM 0 HB3 GLU A 96 -7.061 -13.985 -6.367 1.00 62.35 H new ATOM 0 HG2 GLU A 96 -8.401 -13.731 -4.185 1.00 71.15 H new ATOM 0 HG3 GLU A 96 -7.967 -12.033 -4.234 1.00 71.15 H new ATOM 1511 N PRO A 97 -4.292 -11.912 -4.125 1.00 74.12 N ATOM 1512 CA PRO A 97 -3.679 -10.959 -3.222 1.00 53.32 C ATOM 1513 C PRO A 97 -4.662 -9.887 -2.751 1.00 24.20 C ATOM 1514 O PRO A 97 -5.690 -9.606 -3.380 1.00 23.42 O ATOM 1515 CB PRO A 97 -2.439 -10.441 -3.953 1.00 32.41 C ATOM 1516 CG PRO A 97 -2.848 -10.529 -5.420 1.00 3.10 C ATOM 1517 CD PRO A 97 -3.694 -11.802 -5.450 1.00 74.15 C ATOM 0 HA PRO A 97 -3.375 -11.413 -2.279 1.00 53.32 H new ATOM 0 HB2 PRO A 97 -2.196 -9.419 -3.662 1.00 32.41 H new ATOM 0 HB3 PRO A 97 -1.561 -11.051 -3.741 1.00 32.41 H new ATOM 0 HG2 PRO A 97 -3.418 -9.655 -5.736 1.00 3.10 H new ATOM 0 HG3 PRO A 97 -1.983 -10.601 -6.079 1.00 3.10 H new ATOM 0 HD2 PRO A 97 -4.461 -11.744 -6.222 1.00 74.15 H new ATOM 0 HD3 PRO A 97 -3.080 -12.674 -5.676 1.00 74.15 H new ATOM 1525 N SER A 98 -4.323 -9.300 -1.604 1.00 32.30 N ATOM 1526 CA SER A 98 -5.110 -8.265 -0.945 1.00 21.24 C ATOM 1527 C SER A 98 -4.311 -6.972 -0.770 1.00 10.24 C ATOM 1528 O SER A 98 -4.904 -5.893 -0.691 1.00 44.42 O ATOM 1529 CB SER A 98 -5.626 -8.792 0.405 1.00 31.23 C ATOM 1530 OG SER A 98 -7.042 -8.803 0.457 1.00 61.21 O ATOM 0 H SER A 98 -3.471 -9.539 -1.096 1.00 32.30 H new ATOM 0 HA SER A 98 -5.963 -8.021 -1.579 1.00 21.24 H new ATOM 0 HB2 SER A 98 -5.248 -9.801 0.570 1.00 31.23 H new ATOM 0 HB3 SER A 98 -5.237 -8.170 1.211 1.00 31.23 H new ATOM 0 HG SER A 98 -7.335 -9.145 1.327 1.00 61.21 H new ATOM 1536 N LEU A 99 -2.979 -7.061 -0.753 1.00 50.02 N ATOM 1537 CA LEU A 99 -2.068 -5.933 -0.652 1.00 41.45 C ATOM 1538 C LEU A 99 -1.184 -5.963 -1.893 1.00 13.04 C ATOM 1539 O LEU A 99 -0.700 -7.032 -2.289 1.00 44.21 O ATOM 1540 CB LEU A 99 -1.249 -6.065 0.642 1.00 71.02 C ATOM 1541 CG LEU A 99 -0.139 -5.010 0.792 1.00 45.32 C ATOM 1542 CD1 LEU A 99 -0.709 -3.598 0.951 1.00 62.02 C ATOM 1543 CD2 LEU A 99 0.732 -5.332 2.006 1.00 10.31 C ATOM 0 H LEU A 99 -2.494 -7.956 -0.812 1.00 50.02 H new ATOM 0 HA LEU A 99 -2.594 -4.979 -0.607 1.00 41.45 H new ATOM 0 HB2 LEU A 99 -1.923 -5.992 1.495 1.00 71.02 H new ATOM 0 HB3 LEU A 99 -0.799 -7.057 0.675 1.00 71.02 H new ATOM 0 HG LEU A 99 0.458 -5.040 -0.120 1.00 45.32 H new ATOM 0 HD11 LEU A 99 0.109 -2.885 1.054 1.00 62.02 H new ATOM 0 HD12 LEU A 99 -1.303 -3.345 0.073 1.00 62.02 H new ATOM 0 HD13 LEU A 99 -1.339 -3.558 1.840 1.00 62.02 H new ATOM 0 HD21 LEU A 99 1.514 -4.579 2.103 1.00 10.31 H new ATOM 0 HD22 LEU A 99 0.116 -5.333 2.905 1.00 10.31 H new ATOM 0 HD23 LEU A 99 1.187 -6.314 1.877 1.00 10.31 H new ATOM 1555 N ARG A 100 -0.985 -4.807 -2.527 1.00 5.14 N ATOM 1556 CA ARG A 100 -0.095 -4.663 -3.667 1.00 45.42 C ATOM 1557 C ARG A 100 0.565 -3.293 -3.569 1.00 63.11 C ATOM 1558 O ARG A 100 -0.118 -2.267 -3.623 1.00 3.20 O ATOM 1559 CB ARG A 100 -0.876 -4.843 -4.978 1.00 71.21 C ATOM 1560 CG ARG A 100 -0.075 -5.681 -5.980 1.00 31.30 C ATOM 1561 CD ARG A 100 -0.773 -5.672 -7.339 1.00 41.02 C ATOM 1562 NE ARG A 100 -1.902 -6.608 -7.473 1.00 3.24 N ATOM 1563 CZ ARG A 100 -1.789 -7.860 -7.943 1.00 34.40 C ATOM 1564 NH1 ARG A 100 -0.593 -8.411 -8.124 1.00 11.02 N ATOM 1565 NH2 ARG A 100 -2.878 -8.562 -8.236 1.00 74.35 N ATOM 0 H ARG A 100 -1.445 -3.938 -2.256 1.00 5.14 H new ATOM 0 HA ARG A 100 0.678 -5.431 -3.662 1.00 45.42 H new ATOM 0 HB2 ARG A 100 -1.831 -5.327 -4.774 1.00 71.21 H new ATOM 0 HB3 ARG A 100 -1.099 -3.867 -5.410 1.00 71.21 H new ATOM 0 HG2 ARG A 100 0.934 -5.281 -6.077 1.00 31.30 H new ATOM 0 HG3 ARG A 100 0.021 -6.704 -5.617 1.00 31.30 H new ATOM 0 HD2 ARG A 100 -1.134 -4.663 -7.537 1.00 41.02 H new ATOM 0 HD3 ARG A 100 -0.037 -5.904 -8.109 1.00 41.02 H new ATOM 0 HE ARG A 100 -2.827 -6.285 -7.191 1.00 3.24 H new ATOM 0 HH11 ARG A 100 0.251 -7.881 -7.905 1.00 11.02 H new ATOM 0 HH12 ARG A 100 -0.519 -9.363 -8.482 1.00 11.02 H new ATOM 0 HH21 ARG A 100 -3.802 -8.150 -8.104 1.00 74.35 H new ATOM 0 HH22 ARG A 100 -2.791 -9.513 -8.593 1.00 74.35 H new ATOM 1579 N VAL A 101 1.882 -3.259 -3.387 1.00 54.12 N ATOM 1580 CA VAL A 101 2.635 -2.019 -3.221 1.00 24.03 C ATOM 1581 C VAL A 101 3.681 -2.010 -4.325 1.00 1.21 C ATOM 1582 O VAL A 101 4.561 -2.867 -4.358 1.00 51.21 O ATOM 1583 CB VAL A 101 3.234 -1.920 -1.801 1.00 5.54 C ATOM 1584 CG1 VAL A 101 3.900 -0.567 -1.523 1.00 33.12 C ATOM 1585 CG2 VAL A 101 2.173 -2.154 -0.718 1.00 50.15 C ATOM 0 H VAL A 101 2.461 -4.098 -3.350 1.00 54.12 H new ATOM 0 HA VAL A 101 2.001 -1.137 -3.311 1.00 24.03 H new ATOM 0 HB VAL A 101 3.992 -2.702 -1.763 1.00 5.54 H new ATOM 0 HG11 VAL A 101 4.301 -0.560 -0.510 1.00 33.12 H new ATOM 0 HG12 VAL A 101 4.710 -0.407 -2.235 1.00 33.12 H new ATOM 0 HG13 VAL A 101 3.163 0.229 -1.627 1.00 33.12 H new ATOM 0 HG21 VAL A 101 2.635 -2.076 0.266 1.00 50.15 H new ATOM 0 HG22 VAL A 101 1.387 -1.405 -0.811 1.00 50.15 H new ATOM 0 HG23 VAL A 101 1.743 -3.148 -0.839 1.00 50.15 H new ATOM 1595 N VAL A 102 3.570 -1.082 -5.272 1.00 70.25 N ATOM 1596 CA VAL A 102 4.599 -0.888 -6.288 1.00 2.30 C ATOM 1597 C VAL A 102 5.702 -0.061 -5.609 1.00 51.11 C ATOM 1598 O VAL A 102 5.397 0.686 -4.670 1.00 2.20 O ATOM 1599 CB VAL A 102 3.899 -0.199 -7.483 1.00 54.25 C ATOM 1600 CG1 VAL A 102 4.804 0.416 -8.558 1.00 31.11 C ATOM 1601 CG2 VAL A 102 2.945 -1.174 -8.188 1.00 65.44 C ATOM 0 H VAL A 102 2.774 -0.450 -5.356 1.00 70.25 H new ATOM 0 HA VAL A 102 5.067 -1.792 -6.677 1.00 2.30 H new ATOM 0 HB VAL A 102 3.382 0.635 -7.008 1.00 54.25 H new ATOM 0 HG11 VAL A 102 4.189 0.866 -9.337 1.00 31.11 H new ATOM 0 HG12 VAL A 102 5.436 1.181 -8.107 1.00 31.11 H new ATOM 0 HG13 VAL A 102 5.431 -0.362 -8.994 1.00 31.11 H new ATOM 0 HG21 VAL A 102 2.463 -0.670 -9.025 1.00 65.44 H new ATOM 0 HG22 VAL A 102 3.508 -2.032 -8.556 1.00 65.44 H new ATOM 0 HG23 VAL A 102 2.186 -1.514 -7.483 1.00 65.44 H new ATOM 1611 N PHE A 103 6.932 -0.061 -6.123 1.00 10.34 N ATOM 1612 CA PHE A 103 7.913 0.978 -5.807 1.00 71.35 C ATOM 1613 C PHE A 103 8.775 1.258 -7.035 1.00 32.30 C ATOM 1614 O PHE A 103 9.234 0.334 -7.705 1.00 44.54 O ATOM 1615 CB PHE A 103 8.821 0.575 -4.640 1.00 14.54 C ATOM 1616 CG PHE A 103 8.167 0.447 -3.277 1.00 2.11 C ATOM 1617 CD1 PHE A 103 7.636 -0.790 -2.875 1.00 13.23 C ATOM 1618 CD2 PHE A 103 8.196 1.519 -2.364 1.00 14.54 C ATOM 1619 CE1 PHE A 103 7.197 -0.983 -1.556 1.00 70.13 C ATOM 1620 CE2 PHE A 103 7.721 1.335 -1.051 1.00 61.33 C ATOM 1621 CZ PHE A 103 7.247 0.079 -0.639 1.00 33.30 C ATOM 0 H PHE A 103 7.275 -0.775 -6.765 1.00 10.34 H new ATOM 0 HA PHE A 103 7.362 1.872 -5.514 1.00 71.35 H new ATOM 0 HB2 PHE A 103 9.285 -0.380 -4.885 1.00 14.54 H new ATOM 0 HB3 PHE A 103 9.623 1.309 -4.564 1.00 14.54 H new ATOM 0 HD1 PHE A 103 7.565 -1.599 -3.587 1.00 13.23 H new ATOM 0 HD2 PHE A 103 8.582 2.480 -2.670 1.00 14.54 H new ATOM 0 HE1 PHE A 103 6.821 -1.947 -1.247 1.00 70.13 H new ATOM 0 HE2 PHE A 103 7.721 2.163 -0.358 1.00 61.33 H new ATOM 0 HZ PHE A 103 6.922 -0.070 0.380 1.00 33.30 H new ATOM 1631 N GLU A 104 9.050 2.534 -7.290 1.00 2.41 N ATOM 1632 CA GLU A 104 9.855 3.040 -8.393 1.00 61.44 C ATOM 1633 C GLU A 104 11.053 3.777 -7.823 1.00 73.14 C ATOM 1634 O GLU A 104 10.887 4.752 -7.094 1.00 22.14 O ATOM 1635 CB GLU A 104 9.046 4.031 -9.235 1.00 63.03 C ATOM 1636 CG GLU A 104 8.138 3.350 -10.254 1.00 42.43 C ATOM 1637 CD GLU A 104 7.255 4.349 -11.006 1.00 13.53 C ATOM 1638 OE1 GLU A 104 7.523 5.575 -10.994 1.00 61.21 O ATOM 1639 OE2 GLU A 104 6.264 3.908 -11.628 1.00 10.10 O ATOM 0 H GLU A 104 8.696 3.284 -6.697 1.00 2.41 H new ATOM 0 HA GLU A 104 10.166 2.201 -9.016 1.00 61.44 H new ATOM 0 HB2 GLU A 104 8.440 4.650 -8.574 1.00 63.03 H new ATOM 0 HB3 GLU A 104 9.731 4.699 -9.757 1.00 63.03 H new ATOM 0 HG2 GLU A 104 8.748 2.798 -10.969 1.00 42.43 H new ATOM 0 HG3 GLU A 104 7.506 2.622 -9.745 1.00 42.43 H new ATOM 1646 N LEU A 105 12.259 3.344 -8.166 1.00 13.51 N ATOM 1647 CA LEU A 105 13.454 4.150 -7.983 1.00 60.04 C ATOM 1648 C LEU A 105 13.477 5.205 -9.093 1.00 35.02 C ATOM 1649 O LEU A 105 13.351 4.879 -10.273 1.00 40.31 O ATOM 1650 CB LEU A 105 14.673 3.230 -8.039 1.00 12.43 C ATOM 1651 CG LEU A 105 16.014 3.942 -7.836 1.00 61.23 C ATOM 1652 CD1 LEU A 105 16.347 4.128 -6.356 1.00 32.02 C ATOM 1653 CD2 LEU A 105 17.098 3.121 -8.530 1.00 65.14 C ATOM 0 H LEU A 105 12.434 2.427 -8.577 1.00 13.51 H new ATOM 0 HA LEU A 105 13.465 4.658 -7.019 1.00 60.04 H new ATOM 0 HB2 LEU A 105 14.566 2.459 -7.276 1.00 12.43 H new ATOM 0 HB3 LEU A 105 14.687 2.724 -9.004 1.00 12.43 H new ATOM 0 HG LEU A 105 15.954 4.941 -8.268 1.00 61.23 H new ATOM 0 HD11 LEU A 105 17.306 4.637 -6.260 1.00 32.02 H new ATOM 0 HD12 LEU A 105 15.570 4.726 -5.881 1.00 32.02 H new ATOM 0 HD13 LEU A 105 16.403 3.154 -5.870 1.00 32.02 H new ATOM 0 HD21 LEU A 105 18.064 3.609 -8.399 1.00 65.14 H new ATOM 0 HD22 LEU A 105 17.134 2.123 -8.094 1.00 65.14 H new ATOM 0 HD23 LEU A 105 16.871 3.044 -9.593 1.00 65.14 H new ATOM 1665 N THR A 106 13.632 6.481 -8.762 1.00 74.41 N ATOM 1666 CA THR A 106 13.790 7.572 -9.718 1.00 14.23 C ATOM 1667 C THR A 106 14.685 8.623 -9.059 1.00 64.34 C ATOM 1668 O THR A 106 14.578 8.837 -7.856 1.00 62.31 O ATOM 1669 CB THR A 106 12.396 8.135 -10.055 1.00 21.10 C ATOM 1670 OG1 THR A 106 11.553 7.110 -10.549 1.00 63.24 O ATOM 1671 CG2 THR A 106 12.452 9.247 -11.103 1.00 55.44 C ATOM 0 H THR A 106 13.652 6.795 -7.792 1.00 74.41 H new ATOM 0 HA THR A 106 14.250 7.244 -10.650 1.00 14.23 H new ATOM 0 HB THR A 106 12.002 8.547 -9.126 1.00 21.10 H new ATOM 0 HG1 THR A 106 10.671 7.483 -10.757 1.00 63.24 H new ATOM 0 HG21 THR A 106 11.444 9.609 -11.304 1.00 55.44 H new ATOM 0 HG22 THR A 106 13.064 10.068 -10.730 1.00 55.44 H new ATOM 0 HG23 THR A 106 12.888 8.858 -12.023 1.00 55.44 H new ATOM 1679 N ASP A 107 15.569 9.281 -9.817 1.00 41.11 N ATOM 1680 CA ASP A 107 16.437 10.357 -9.306 1.00 73.02 C ATOM 1681 C ASP A 107 17.364 9.876 -8.167 1.00 52.41 C ATOM 1682 O ASP A 107 17.830 10.667 -7.343 1.00 4.30 O ATOM 1683 CB ASP A 107 15.578 11.586 -8.935 1.00 0.24 C ATOM 1684 CG ASP A 107 16.311 12.907 -9.162 1.00 60.12 C ATOM 1685 OD1 ASP A 107 16.519 13.253 -10.347 1.00 23.14 O ATOM 1686 OD2 ASP A 107 16.584 13.627 -8.174 1.00 4.11 O ATOM 0 H ASP A 107 15.706 9.084 -10.808 1.00 41.11 H new ATOM 0 HA ASP A 107 17.121 10.665 -10.097 1.00 73.02 H new ATOM 0 HB2 ASP A 107 14.663 11.577 -9.527 1.00 0.24 H new ATOM 0 HB3 ASP A 107 15.282 11.515 -7.888 1.00 0.24 H new ATOM 1691 N GLY A 108 17.607 8.557 -8.101 1.00 14.43 N ATOM 1692 CA GLY A 108 18.371 7.895 -7.051 1.00 62.11 C ATOM 1693 C GLY A 108 17.577 7.661 -5.760 1.00 74.11 C ATOM 1694 O GLY A 108 18.186 7.431 -4.713 1.00 15.13 O ATOM 0 H GLY A 108 17.261 7.906 -8.806 1.00 14.43 H new ATOM 0 HA2 GLY A 108 18.729 6.936 -7.425 1.00 62.11 H new ATOM 0 HA3 GLY A 108 19.251 8.496 -6.821 1.00 62.11 H new ATOM 1698 N LYS A 109 16.240 7.747 -5.790 1.00 23.02 N ATOM 1699 CA LYS A 109 15.352 7.716 -4.623 1.00 75.32 C ATOM 1700 C LYS A 109 14.210 6.737 -4.891 1.00 2.54 C ATOM 1701 O LYS A 109 13.596 6.808 -5.949 1.00 20.14 O ATOM 1702 CB LYS A 109 14.802 9.138 -4.397 1.00 34.10 C ATOM 1703 CG LYS A 109 15.947 10.118 -4.112 1.00 20.31 C ATOM 1704 CD LYS A 109 15.551 11.593 -4.111 1.00 21.42 C ATOM 1705 CE LYS A 109 16.821 12.451 -4.143 1.00 23.21 C ATOM 1706 NZ LYS A 109 17.792 12.124 -3.068 1.00 72.15 N ATOM 0 H LYS A 109 15.727 7.844 -6.666 1.00 23.02 H new ATOM 0 HA LYS A 109 15.890 7.389 -3.733 1.00 75.32 H new ATOM 0 HB2 LYS A 109 14.247 9.464 -5.277 1.00 34.10 H new ATOM 0 HB3 LYS A 109 14.102 9.135 -3.562 1.00 34.10 H new ATOM 0 HG2 LYS A 109 16.381 9.874 -3.143 1.00 20.31 H new ATOM 0 HG3 LYS A 109 16.728 9.968 -4.858 1.00 20.31 H new ATOM 0 HD2 LYS A 109 14.925 11.815 -4.975 1.00 21.42 H new ATOM 0 HD3 LYS A 109 14.963 11.824 -3.223 1.00 21.42 H new ATOM 0 HE2 LYS A 109 17.308 12.327 -5.110 1.00 23.21 H new ATOM 0 HE3 LYS A 109 16.541 13.501 -4.060 1.00 23.21 H new ATOM 0 HZ1 LYS A 109 18.558 12.827 -3.067 1.00 72.15 H new ATOM 0 HZ2 LYS A 109 17.308 12.137 -2.147 1.00 72.15 H new ATOM 0 HZ3 LYS A 109 18.190 11.178 -3.236 1.00 72.15 H new ATOM 1720 N TRP A 110 13.942 5.796 -3.983 1.00 4.53 N ATOM 1721 CA TRP A 110 12.764 4.935 -4.088 1.00 2.43 C ATOM 1722 C TRP A 110 11.529 5.761 -3.716 1.00 41.12 C ATOM 1723 O TRP A 110 11.553 6.478 -2.714 1.00 13.14 O ATOM 1724 CB TRP A 110 12.924 3.687 -3.204 1.00 75.43 C ATOM 1725 CG TRP A 110 13.885 2.655 -3.731 1.00 45.55 C ATOM 1726 CD1 TRP A 110 15.169 2.480 -3.341 1.00 23.41 C ATOM 1727 CD2 TRP A 110 13.655 1.636 -4.756 1.00 51.31 C ATOM 1728 NE1 TRP A 110 15.766 1.505 -4.109 1.00 42.31 N ATOM 1729 CE2 TRP A 110 14.873 0.926 -4.982 1.00 63.02 C ATOM 1730 CE3 TRP A 110 12.542 1.252 -5.535 1.00 43.15 C ATOM 1731 CZ2 TRP A 110 14.985 -0.091 -5.945 1.00 45.23 C ATOM 1732 CZ3 TRP A 110 12.635 0.218 -6.488 1.00 45.44 C ATOM 1733 CH2 TRP A 110 13.855 -0.451 -6.697 1.00 63.04 C ATOM 0 H TRP A 110 14.525 5.612 -3.167 1.00 4.53 H new ATOM 0 HA TRP A 110 12.646 4.572 -5.109 1.00 2.43 H new ATOM 0 HB2 TRP A 110 13.257 4.001 -2.215 1.00 75.43 H new ATOM 0 HB3 TRP A 110 11.947 3.221 -3.078 1.00 75.43 H new ATOM 0 HD1 TRP A 110 15.654 3.025 -2.545 1.00 23.41 H new ATOM 0 HE1 TRP A 110 16.750 1.244 -4.039 1.00 42.31 H new ATOM 0 HE3 TRP A 110 11.600 1.761 -5.398 1.00 43.15 H new ATOM 0 HZ2 TRP A 110 15.929 -0.590 -6.105 1.00 45.23 H new ATOM 0 HZ3 TRP A 110 11.764 -0.063 -7.062 1.00 45.44 H new ATOM 0 HH2 TRP A 110 13.922 -1.238 -7.433 1.00 63.04 H new ATOM 1744 N TYR A 111 10.469 5.660 -4.516 1.00 54.41 N ATOM 1745 CA TYR A 111 9.174 6.304 -4.358 1.00 40.52 C ATOM 1746 C TYR A 111 8.077 5.248 -4.472 1.00 21.43 C ATOM 1747 O TYR A 111 8.233 4.245 -5.170 1.00 40.21 O ATOM 1748 CB TYR A 111 8.965 7.375 -5.449 1.00 13.14 C ATOM 1749 CG TYR A 111 9.930 8.551 -5.454 1.00 54.32 C ATOM 1750 CD1 TYR A 111 10.151 9.288 -4.280 1.00 4.24 C ATOM 1751 CD2 TYR A 111 10.551 8.963 -6.647 1.00 21.40 C ATOM 1752 CE1 TYR A 111 10.998 10.412 -4.272 1.00 74.01 C ATOM 1753 CE2 TYR A 111 11.440 10.051 -6.644 1.00 14.21 C ATOM 1754 CZ TYR A 111 11.662 10.789 -5.459 1.00 40.52 C ATOM 1755 OH TYR A 111 12.387 11.939 -5.523 1.00 1.32 O ATOM 0 H TYR A 111 10.500 5.080 -5.355 1.00 54.41 H new ATOM 0 HA TYR A 111 9.134 6.787 -3.382 1.00 40.52 H new ATOM 0 HB2 TYR A 111 9.023 6.885 -6.421 1.00 13.14 H new ATOM 0 HB3 TYR A 111 7.953 7.767 -5.350 1.00 13.14 H new ATOM 0 HD1 TYR A 111 9.662 8.987 -3.365 1.00 4.24 H new ATOM 0 HD2 TYR A 111 10.344 8.441 -7.569 1.00 21.40 H new ATOM 0 HE1 TYR A 111 11.139 10.981 -3.365 1.00 74.01 H new ATOM 0 HE2 TYR A 111 11.957 10.325 -7.552 1.00 14.21 H new ATOM 0 HH TYR A 111 12.773 12.033 -6.419 1.00 1.32 H new ATOM 1765 N VAL A 112 6.932 5.501 -3.842 1.00 41.34 N ATOM 1766 CA VAL A 112 5.661 4.927 -4.238 1.00 74.12 C ATOM 1767 C VAL A 112 5.089 5.855 -5.309 1.00 55.21 C ATOM 1768 O VAL A 112 5.236 7.073 -5.220 1.00 33.12 O ATOM 1769 CB VAL A 112 4.727 4.810 -3.011 1.00 40.32 C ATOM 1770 CG1 VAL A 112 3.265 4.517 -3.377 1.00 72.42 C ATOM 1771 CG2 VAL A 112 5.193 3.659 -2.104 1.00 13.24 C ATOM 0 H VAL A 112 6.867 6.119 -3.033 1.00 41.34 H new ATOM 0 HA VAL A 112 5.771 3.918 -4.636 1.00 74.12 H new ATOM 0 HB VAL A 112 4.778 5.779 -2.515 1.00 40.32 H new ATOM 0 HG11 VAL A 112 2.669 4.448 -2.467 1.00 72.42 H new ATOM 0 HG12 VAL A 112 2.879 5.321 -4.004 1.00 72.42 H new ATOM 0 HG13 VAL A 112 3.208 3.574 -3.920 1.00 72.42 H new ATOM 0 HG21 VAL A 112 4.530 3.583 -1.242 1.00 13.24 H new ATOM 0 HG22 VAL A 112 5.170 2.723 -2.663 1.00 13.24 H new ATOM 0 HG23 VAL A 112 6.210 3.853 -1.763 1.00 13.24 H new ATOM 1781 N THR A 113 4.370 5.291 -6.267 1.00 71.11 N ATOM 1782 CA THR A 113 3.349 5.945 -7.063 1.00 55.51 C ATOM 1783 C THR A 113 2.174 4.984 -7.259 1.00 1.22 C ATOM 1784 O THR A 113 1.246 5.363 -7.970 1.00 52.32 O ATOM 1785 CB THR A 113 3.908 6.539 -8.375 1.00 72.13 C ATOM 1786 OG1 THR A 113 2.931 6.858 -9.345 1.00 54.25 O ATOM 1787 CG2 THR A 113 5.025 5.710 -8.987 1.00 55.15 C ATOM 0 H THR A 113 4.492 4.311 -6.522 1.00 71.11 H new ATOM 0 HA THR A 113 2.975 6.816 -6.525 1.00 55.51 H new ATOM 0 HB THR A 113 4.337 7.488 -8.052 1.00 72.13 H new ATOM 0 HG1 THR A 113 2.039 6.669 -8.985 1.00 54.25 H new ATOM 0 HG21 THR A 113 5.370 6.186 -9.905 1.00 55.15 H new ATOM 0 HG22 THR A 113 5.853 5.639 -8.282 1.00 55.15 H new ATOM 0 HG23 THR A 113 4.654 4.710 -9.213 1.00 55.15 H new ATOM 1795 N ASP A 114 2.140 3.781 -6.660 1.00 75.32 N ATOM 1796 CA ASP A 114 0.909 3.014 -6.725 1.00 63.21 C ATOM 1797 C ASP A 114 0.655 2.130 -5.520 1.00 42.35 C ATOM 1798 O ASP A 114 1.611 1.630 -4.924 1.00 34.34 O ATOM 1799 CB ASP A 114 0.824 2.183 -8.001 1.00 54.55 C ATOM 1800 CG ASP A 114 -0.645 1.913 -8.283 1.00 54.25 C ATOM 1801 OD1 ASP A 114 -1.467 2.790 -7.928 1.00 24.40 O ATOM 1802 OD2 ASP A 114 -0.957 0.831 -8.819 1.00 64.33 O ATOM 0 H ASP A 114 2.912 3.346 -6.154 1.00 75.32 H new ATOM 0 HA ASP A 114 0.123 3.769 -6.729 1.00 63.21 H new ATOM 0 HB2 ASP A 114 1.281 2.716 -8.835 1.00 54.55 H new ATOM 0 HB3 ASP A 114 1.369 1.246 -7.884 1.00 54.55 H new ATOM 1807 N CYS A 115 -0.623 1.951 -5.175 1.00 41.44 N ATOM 1808 CA CYS A 115 -1.122 1.197 -4.035 1.00 50.14 C ATOM 1809 C CYS A 115 -2.465 0.571 -4.410 1.00 71.21 C ATOM 1810 O CYS A 115 -3.405 1.293 -4.770 1.00 43.23 O ATOM 1811 CB CYS A 115 -1.324 2.153 -2.843 1.00 65.25 C ATOM 1812 SG CYS A 115 -2.133 1.337 -1.440 1.00 22.30 S ATOM 0 H CYS A 115 -1.381 2.357 -5.724 1.00 41.44 H new ATOM 0 HA CYS A 115 -0.410 0.418 -3.762 1.00 50.14 H new ATOM 0 HB2 CYS A 115 -0.358 2.544 -2.526 1.00 65.25 H new ATOM 0 HB3 CYS A 115 -1.924 3.005 -3.161 1.00 65.25 H new ATOM 0 HG CYS A 115 -2.275 2.187 -0.467 1.00 22.30 H new ATOM 1818 N TYR A 116 -2.583 -0.737 -4.208 1.00 24.44 N ATOM 1819 CA TYR A 116 -3.841 -1.418 -3.950 1.00 4.23 C ATOM 1820 C TYR A 116 -3.744 -1.953 -2.525 1.00 31.10 C ATOM 1821 O TYR A 116 -2.732 -2.549 -2.146 1.00 65.24 O ATOM 1822 CB TYR A 116 -4.041 -2.532 -4.973 1.00 1.00 C ATOM 1823 CG TYR A 116 -5.254 -3.409 -4.736 1.00 51.22 C ATOM 1824 CD1 TYR A 116 -6.512 -3.048 -5.253 1.00 22.34 C ATOM 1825 CD2 TYR A 116 -5.108 -4.619 -4.036 1.00 13.00 C ATOM 1826 CE1 TYR A 116 -7.611 -3.912 -5.107 1.00 30.54 C ATOM 1827 CE2 TYR A 116 -6.197 -5.498 -3.900 1.00 32.20 C ATOM 1828 CZ TYR A 116 -7.453 -5.152 -4.448 1.00 73.11 C ATOM 1829 OH TYR A 116 -8.504 -6.018 -4.398 1.00 53.23 O ATOM 0 H TYR A 116 -1.782 -1.368 -4.220 1.00 24.44 H new ATOM 0 HA TYR A 116 -4.703 -0.757 -4.043 1.00 4.23 H new ATOM 0 HB2 TYR A 116 -4.123 -2.085 -5.964 1.00 1.00 H new ATOM 0 HB3 TYR A 116 -3.152 -3.162 -4.980 1.00 1.00 H new ATOM 0 HD1 TYR A 116 -6.633 -2.104 -5.764 1.00 22.34 H new ATOM 0 HD2 TYR A 116 -4.154 -4.875 -3.600 1.00 13.00 H new ATOM 0 HE1 TYR A 116 -8.577 -3.628 -5.499 1.00 30.54 H new ATOM 0 HE2 TYR A 116 -6.074 -6.435 -3.378 1.00 32.20 H new ATOM 0 HH TYR A 116 -8.239 -6.827 -3.912 1.00 53.23 H new ATOM 1839 N ASN A 117 -4.762 -1.686 -1.712 1.00 64.34 N ATOM 1840 CA ASN A 117 -4.822 -2.127 -0.324 1.00 65.13 C ATOM 1841 C ASN A 117 -6.267 -2.429 0.040 1.00 2.12 C ATOM 1842 O ASN A 117 -7.189 -1.886 -0.583 1.00 51.11 O ATOM 1843 CB ASN A 117 -4.252 -1.038 0.599 1.00 23.31 C ATOM 1844 CG ASN A 117 -3.924 -1.563 1.994 1.00 74.51 C ATOM 1845 OD1 ASN A 117 -3.953 -2.760 2.243 1.00 52.45 O ATOM 1846 ND2 ASN A 117 -3.565 -0.679 2.908 1.00 50.34 N ATOM 0 H ASN A 117 -5.579 -1.150 -2.004 1.00 64.34 H new ATOM 0 HA ASN A 117 -4.224 -3.030 -0.199 1.00 65.13 H new ATOM 0 HB2 ASN A 117 -3.350 -0.622 0.150 1.00 23.31 H new ATOM 0 HB3 ASN A 117 -4.972 -0.224 0.681 1.00 23.31 H new ATOM 0 HD21 ASN A 117 -3.305 -0.990 3.844 1.00 50.34 H new ATOM 0 HD22 ASN A 117 -3.548 0.315 2.678 1.00 50.34 H new ATOM 1853 N ASP A 118 -6.473 -3.257 1.058 1.00 41.12 N ATOM 1854 CA ASP A 118 -7.790 -3.708 1.463 1.00 33.14 C ATOM 1855 C ASP A 118 -8.688 -2.562 1.951 1.00 71.21 C ATOM 1856 O ASP A 118 -9.887 -2.587 1.669 1.00 4.00 O ATOM 1857 CB ASP A 118 -7.702 -4.884 2.439 1.00 62.53 C ATOM 1858 CG ASP A 118 -6.989 -4.610 3.757 1.00 74.15 C ATOM 1859 OD1 ASP A 118 -7.117 -3.507 4.321 1.00 21.20 O ATOM 1860 OD2 ASP A 118 -6.316 -5.549 4.247 1.00 12.24 O ATOM 0 H ASP A 118 -5.718 -3.636 1.629 1.00 41.12 H new ATOM 0 HA ASP A 118 -8.292 -4.089 0.573 1.00 33.14 H new ATOM 0 HB2 ASP A 118 -8.714 -5.222 2.661 1.00 62.53 H new ATOM 0 HB3 ASP A 118 -7.193 -5.708 1.938 1.00 62.53 H new ATOM 1865 N TRP A 119 -8.115 -1.481 2.498 1.00 71.14 N ATOM 1866 CA TRP A 119 -8.821 -0.236 2.818 1.00 34.14 C ATOM 1867 C TRP A 119 -9.685 0.293 1.658 1.00 4.14 C ATOM 1868 O TRP A 119 -10.677 0.978 1.914 1.00 42.14 O ATOM 1869 CB TRP A 119 -7.815 0.849 3.250 1.00 33.32 C ATOM 1870 CG TRP A 119 -7.431 0.899 4.703 1.00 51.34 C ATOM 1871 CD1 TRP A 119 -6.181 0.785 5.209 1.00 3.22 C ATOM 1872 CD2 TRP A 119 -8.292 1.161 5.853 1.00 1.03 C ATOM 1873 NE1 TRP A 119 -6.206 1.010 6.576 1.00 14.20 N ATOM 1874 CE2 TRP A 119 -7.486 1.229 7.024 1.00 3.32 C ATOM 1875 CE3 TRP A 119 -9.679 1.330 6.034 1.00 11.34 C ATOM 1876 CZ2 TRP A 119 -8.027 1.462 8.296 1.00 42.14 C ATOM 1877 CZ3 TRP A 119 -10.236 1.562 7.308 1.00 75.43 C ATOM 1878 CH2 TRP A 119 -9.406 1.647 8.439 1.00 52.41 C ATOM 0 H TRP A 119 -7.124 -1.449 2.735 1.00 71.14 H new ATOM 0 HA TRP A 119 -9.500 -0.471 3.637 1.00 34.14 H new ATOM 0 HB2 TRP A 119 -6.905 0.716 2.666 1.00 33.32 H new ATOM 0 HB3 TRP A 119 -8.229 1.820 2.978 1.00 33.32 H new ATOM 0 HD1 TRP A 119 -5.297 0.553 4.634 1.00 3.22 H new ATOM 0 HE1 TRP A 119 -5.379 1.013 7.174 1.00 14.20 H new ATOM 0 HE3 TRP A 119 -10.332 1.281 5.175 1.00 11.34 H new ATOM 0 HZ2 TRP A 119 -7.382 1.498 9.162 1.00 42.14 H new ATOM 0 HZ3 TRP A 119 -11.305 1.675 7.415 1.00 75.43 H new ATOM 0 HH2 TRP A 119 -9.830 1.854 9.411 1.00 52.41 H new ATOM 1889 N TYR A 120 -9.349 -0.021 0.396 1.00 65.34 N ATOM 1890 CA TYR A 120 -10.190 0.325 -0.754 1.00 2.23 C ATOM 1891 C TYR A 120 -10.467 -0.879 -1.663 1.00 5.24 C ATOM 1892 O TYR A 120 -10.361 -0.798 -2.895 1.00 52.11 O ATOM 1893 CB TYR A 120 -9.684 1.563 -1.515 1.00 1.32 C ATOM 1894 CG TYR A 120 -9.180 2.678 -0.615 1.00 35.22 C ATOM 1895 CD1 TYR A 120 -10.093 3.453 0.126 1.00 40.04 C ATOM 1896 CD2 TYR A 120 -7.795 2.862 -0.437 1.00 0.31 C ATOM 1897 CE1 TYR A 120 -9.631 4.414 1.045 1.00 60.32 C ATOM 1898 CE2 TYR A 120 -7.324 3.796 0.502 1.00 54.04 C ATOM 1899 CZ TYR A 120 -8.245 4.553 1.257 1.00 55.22 C ATOM 1900 OH TYR A 120 -7.805 5.404 2.214 1.00 33.41 O ATOM 0 H TYR A 120 -8.493 -0.518 0.149 1.00 65.34 H new ATOM 0 HA TYR A 120 -11.159 0.615 -0.348 1.00 2.23 H new ATOM 0 HB2 TYR A 120 -8.880 1.261 -2.186 1.00 1.32 H new ATOM 0 HB3 TYR A 120 -10.491 1.949 -2.137 1.00 1.32 H new ATOM 0 HD1 TYR A 120 -11.154 3.309 -0.012 1.00 40.04 H new ATOM 0 HD2 TYR A 120 -7.094 2.285 -1.022 1.00 0.31 H new ATOM 0 HE1 TYR A 120 -10.331 5.038 1.581 1.00 60.32 H new ATOM 0 HE2 TYR A 120 -6.262 3.934 0.645 1.00 54.04 H new ATOM 0 HH TYR A 120 -6.825 5.389 2.240 1.00 33.41 H new ATOM 1910 N ASN A 121 -10.775 -2.026 -1.058 1.00 34.21 N ATOM 1911 CA ASN A 121 -11.194 -3.246 -1.752 1.00 41.03 C ATOM 1912 C ASN A 121 -12.662 -3.172 -2.225 1.00 43.34 C ATOM 1913 O ASN A 121 -13.321 -2.150 -2.038 1.00 1.14 O ATOM 1914 CB ASN A 121 -10.947 -4.463 -0.850 1.00 14.41 C ATOM 1915 CG ASN A 121 -12.094 -4.762 0.103 1.00 74.33 C ATOM 1916 OD1 ASN A 121 -12.882 -5.653 -0.178 1.00 30.22 O ATOM 1917 ND2 ASN A 121 -12.219 -4.070 1.217 1.00 65.54 N ATOM 0 H ASN A 121 -10.739 -2.136 -0.045 1.00 34.21 H new ATOM 0 HA ASN A 121 -10.592 -3.351 -2.655 1.00 41.03 H new ATOM 0 HB2 ASN A 121 -10.769 -5.338 -1.476 1.00 14.41 H new ATOM 0 HB3 ASN A 121 -10.039 -4.296 -0.270 1.00 14.41 H new ATOM 0 HD21 ASN A 121 -12.983 -4.274 1.861 1.00 65.54 H new ATOM 0 HD22 ASN A 121 -11.552 -3.330 1.435 1.00 65.54 H new ATOM 1924 N PHE A 122 -13.152 -4.239 -2.873 1.00 14.04 N ATOM 1925 CA PHE A 122 -14.488 -4.416 -3.446 1.00 73.33 C ATOM 1926 C PHE A 122 -15.633 -4.386 -2.425 1.00 30.52 C ATOM 1927 O PHE A 122 -16.721 -3.892 -2.729 1.00 71.12 O ATOM 1928 CB PHE A 122 -14.474 -5.796 -4.138 1.00 12.43 C ATOM 1929 CG PHE A 122 -15.179 -5.864 -5.467 1.00 2.30 C ATOM 1930 CD1 PHE A 122 -14.634 -5.158 -6.549 1.00 14.41 C ATOM 1931 CD2 PHE A 122 -16.268 -6.729 -5.666 1.00 43.42 C ATOM 1932 CE1 PHE A 122 -15.184 -5.311 -7.834 1.00 14.23 C ATOM 1933 CE2 PHE A 122 -16.827 -6.870 -6.948 1.00 11.00 C ATOM 1934 CZ PHE A 122 -16.287 -6.158 -8.031 1.00 24.22 C ATOM 0 H PHE A 122 -12.574 -5.066 -3.020 1.00 14.04 H new ATOM 0 HA PHE A 122 -14.682 -3.582 -4.120 1.00 73.33 H new ATOM 0 HB2 PHE A 122 -13.437 -6.100 -4.281 1.00 12.43 H new ATOM 0 HB3 PHE A 122 -14.930 -6.524 -3.467 1.00 12.43 H new ATOM 0 HD1 PHE A 122 -13.793 -4.498 -6.396 1.00 14.41 H new ATOM 0 HD2 PHE A 122 -16.675 -7.285 -4.835 1.00 43.42 H new ATOM 0 HE1 PHE A 122 -14.758 -4.777 -8.670 1.00 14.23 H new ATOM 0 HE2 PHE A 122 -17.672 -7.526 -7.100 1.00 11.00 H new ATOM 0 HZ PHE A 122 -16.720 -6.262 -9.015 1.00 24.22 H new ATOM 1944 N ASP A 123 -15.400 -4.895 -1.213 1.00 72.15 N ATOM 1945 CA ASP A 123 -16.338 -5.033 -0.091 1.00 45.23 C ATOM 1946 C ASP A 123 -16.480 -3.665 0.597 1.00 3.43 C ATOM 1947 O ASP A 123 -16.367 -3.520 1.817 1.00 12.04 O ATOM 1948 CB ASP A 123 -15.832 -6.157 0.840 1.00 24.34 C ATOM 1949 CG ASP A 123 -16.840 -6.694 1.871 1.00 71.43 C ATOM 1950 OD1 ASP A 123 -17.279 -5.977 2.799 1.00 63.53 O ATOM 1951 OD2 ASP A 123 -17.129 -7.912 1.834 1.00 30.13 O ATOM 0 H ASP A 123 -14.476 -5.251 -0.969 1.00 72.15 H new ATOM 0 HA ASP A 123 -17.336 -5.325 -0.418 1.00 45.23 H new ATOM 0 HB2 ASP A 123 -15.499 -6.990 0.221 1.00 24.34 H new ATOM 0 HB3 ASP A 123 -14.957 -5.789 1.376 1.00 24.34 H new ATOM 1956 N LEU A 124 -16.625 -2.614 -0.213 1.00 3.02 N ATOM 1957 CA LEU A 124 -16.629 -1.219 0.196 1.00 31.53 C ATOM 1958 C LEU A 124 -17.704 -0.471 -0.603 1.00 71.54 C ATOM 1959 O LEU A 124 -17.433 -0.077 -1.742 1.00 63.55 O ATOM 1960 CB LEU A 124 -15.222 -0.611 0.048 1.00 41.31 C ATOM 1961 CG LEU A 124 -14.865 0.442 1.115 1.00 61.54 C ATOM 1962 CD1 LEU A 124 -15.954 1.518 1.253 1.00 12.20 C ATOM 1963 CD2 LEU A 124 -14.591 -0.256 2.453 1.00 61.42 C ATOM 0 H LEU A 124 -16.748 -2.724 -1.219 1.00 3.02 H new ATOM 0 HA LEU A 124 -16.883 -1.128 1.252 1.00 31.53 H new ATOM 0 HB2 LEU A 124 -14.487 -1.415 0.089 1.00 41.31 H new ATOM 0 HB3 LEU A 124 -15.140 -0.153 -0.938 1.00 41.31 H new ATOM 0 HG LEU A 124 -13.962 0.962 0.795 1.00 61.54 H new ATOM 0 HD11 LEU A 124 -15.659 2.238 2.016 1.00 12.20 H new ATOM 0 HD12 LEU A 124 -16.082 2.031 0.300 1.00 12.20 H new ATOM 0 HD13 LEU A 124 -16.895 1.049 1.541 1.00 12.20 H new ATOM 0 HD21 LEU A 124 -14.339 0.489 3.207 1.00 61.42 H new ATOM 0 HD22 LEU A 124 -15.480 -0.803 2.767 1.00 61.42 H new ATOM 0 HD23 LEU A 124 -13.759 -0.951 2.337 1.00 61.42 H new ATOM 1975 N PRO A 125 -18.971 -0.431 -0.159 1.00 4.10 N ATOM 1976 CA PRO A 125 -20.005 0.288 -0.886 1.00 61.54 C ATOM 1977 C PRO A 125 -19.705 1.791 -0.896 1.00 74.23 C ATOM 1978 O PRO A 125 -19.154 2.345 0.056 1.00 14.41 O ATOM 1979 CB PRO A 125 -21.310 -0.039 -0.167 1.00 1.24 C ATOM 1980 CG PRO A 125 -20.857 -0.256 1.277 1.00 1.42 C ATOM 1981 CD PRO A 125 -19.480 -0.901 1.120 1.00 51.21 C ATOM 0 HA PRO A 125 -20.061 -0.007 -1.934 1.00 61.54 H new ATOM 0 HB2 PRO A 125 -22.030 0.775 -0.247 1.00 1.24 H new ATOM 0 HB3 PRO A 125 -21.787 -0.928 -0.579 1.00 1.24 H new ATOM 0 HG2 PRO A 125 -20.801 0.684 1.827 1.00 1.42 H new ATOM 0 HG3 PRO A 125 -21.545 -0.903 1.821 1.00 1.42 H new ATOM 0 HD2 PRO A 125 -18.817 -0.613 1.936 1.00 51.21 H new ATOM 0 HD3 PRO A 125 -19.552 -1.988 1.137 1.00 51.21 H new ATOM 1989 N ILE A 126 -20.092 2.464 -1.981 1.00 24.11 N ATOM 1990 CA ILE A 126 -19.735 3.864 -2.206 1.00 24.31 C ATOM 1991 C ILE A 126 -20.399 4.764 -1.157 1.00 60.14 C ATOM 1992 O ILE A 126 -19.815 5.775 -0.766 1.00 31.12 O ATOM 1993 CB ILE A 126 -20.109 4.281 -3.645 1.00 43.45 C ATOM 1994 CG1 ILE A 126 -19.302 3.478 -4.695 1.00 42.11 C ATOM 1995 CG2 ILE A 126 -19.861 5.781 -3.919 1.00 31.40 C ATOM 1996 CD1 ILE A 126 -20.086 3.348 -6.001 1.00 42.22 C ATOM 0 H ILE A 126 -20.659 2.056 -2.724 1.00 24.11 H new ATOM 0 HA ILE A 126 -18.657 3.982 -2.096 1.00 24.31 H new ATOM 0 HB ILE A 126 -21.175 4.071 -3.733 1.00 43.45 H new ATOM 0 HG12 ILE A 126 -18.350 3.974 -4.885 1.00 42.11 H new ATOM 0 HG13 ILE A 126 -19.073 2.487 -4.303 1.00 42.11 H new ATOM 0 HG21 ILE A 126 -20.142 6.015 -4.946 1.00 31.40 H new ATOM 0 HG22 ILE A 126 -20.460 6.380 -3.233 1.00 31.40 H new ATOM 0 HG23 ILE A 126 -18.805 6.008 -3.771 1.00 31.40 H new ATOM 0 HD11 ILE A 126 -19.499 2.780 -6.723 1.00 42.22 H new ATOM 0 HD12 ILE A 126 -21.026 2.831 -5.811 1.00 42.22 H new ATOM 0 HD13 ILE A 126 -20.293 4.340 -6.402 1.00 42.22 H new ATOM 2008 N ASN A 127 -21.600 4.423 -0.681 1.00 55.35 N ATOM 2009 CA ASN A 127 -22.321 5.299 0.244 1.00 74.45 C ATOM 2010 C ASN A 127 -21.587 5.432 1.584 1.00 14.02 C ATOM 2011 O ASN A 127 -21.726 6.470 2.235 1.00 42.14 O ATOM 2012 CB ASN A 127 -23.764 4.814 0.457 1.00 53.43 C ATOM 2013 CG ASN A 127 -23.809 3.519 1.248 1.00 4.21 C ATOM 2014 OD1 ASN A 127 -23.252 2.524 0.811 1.00 32.44 O ATOM 2015 ND2 ASN A 127 -24.425 3.486 2.411 1.00 0.32 N ATOM 0 H ASN A 127 -22.087 3.559 -0.917 1.00 55.35 H new ATOM 0 HA ASN A 127 -22.360 6.289 -0.211 1.00 74.45 H new ATOM 0 HB2 ASN A 127 -24.332 5.582 0.982 1.00 53.43 H new ATOM 0 HB3 ASN A 127 -24.245 4.667 -0.510 1.00 53.43 H new ATOM 0 HD21 ASN A 127 -24.440 2.624 2.956 1.00 0.32 H new ATOM 0 HD22 ASN A 127 -24.887 4.323 2.767 1.00 0.32 H new ATOM 2022 N GLU A 128 -20.793 4.431 1.973 1.00 24.50 N ATOM 2023 CA GLU A 128 -20.049 4.381 3.232 1.00 33.44 C ATOM 2024 C GLU A 128 -18.563 4.725 3.050 1.00 60.14 C ATOM 2025 O GLU A 128 -17.787 4.689 4.009 1.00 34.53 O ATOM 2026 CB GLU A 128 -20.170 2.971 3.832 1.00 24.53 C ATOM 2027 CG GLU A 128 -21.580 2.498 4.212 1.00 4.10 C ATOM 2028 CD GLU A 128 -22.335 3.381 5.216 1.00 33.32 C ATOM 2029 OE1 GLU A 128 -21.790 4.367 5.761 1.00 55.12 O ATOM 2030 OE2 GLU A 128 -23.524 3.076 5.480 1.00 72.12 O ATOM 0 H GLU A 128 -20.646 3.602 1.397 1.00 24.50 H new ATOM 0 HA GLU A 128 -20.480 5.128 3.899 1.00 33.44 H new ATOM 0 HB2 GLU A 128 -19.755 2.261 3.117 1.00 24.53 H new ATOM 0 HB3 GLU A 128 -19.545 2.927 4.724 1.00 24.53 H new ATOM 0 HG2 GLU A 128 -22.175 2.425 3.302 1.00 4.10 H new ATOM 0 HG3 GLU A 128 -21.506 1.492 4.626 1.00 4.10 H new ATOM 2037 N LEU A 129 -18.151 5.054 1.822 1.00 0.42 N ATOM 2038 CA LEU A 129 -16.758 5.217 1.418 1.00 32.44 C ATOM 2039 C LEU A 129 -16.059 6.259 2.264 1.00 20.11 C ATOM 2040 O LEU A 129 -14.927 6.076 2.707 1.00 61.25 O ATOM 2041 CB LEU A 129 -16.742 5.582 -0.068 1.00 11.33 C ATOM 2042 CG LEU A 129 -15.361 5.414 -0.706 1.00 40.42 C ATOM 2043 CD1 LEU A 129 -15.569 5.204 -2.212 1.00 34.33 C ATOM 2044 CD2 LEU A 129 -14.404 6.576 -0.532 1.00 12.14 C ATOM 0 H LEU A 129 -18.805 5.219 1.057 1.00 0.42 H new ATOM 0 HA LEU A 129 -16.209 4.288 1.572 1.00 32.44 H new ATOM 0 HB2 LEU A 129 -17.461 4.957 -0.598 1.00 11.33 H new ATOM 0 HB3 LEU A 129 -17.069 6.615 -0.187 1.00 11.33 H new ATOM 0 HG LEU A 129 -14.898 4.571 -0.194 1.00 40.42 H new ATOM 0 HD11 LEU A 129 -14.602 5.080 -2.699 1.00 34.33 H new ATOM 0 HD12 LEU A 129 -16.174 4.312 -2.375 1.00 34.33 H new ATOM 0 HD13 LEU A 129 -16.079 6.070 -2.633 1.00 34.33 H new ATOM 0 HD21 LEU A 129 -13.459 6.346 -1.024 1.00 12.14 H new ATOM 0 HD22 LEU A 129 -14.836 7.473 -0.977 1.00 12.14 H new ATOM 0 HD23 LEU A 129 -14.228 6.746 0.530 1.00 12.14 H new ATOM 2056 N GLU A 130 -16.726 7.385 2.438 1.00 44.14 N ATOM 2057 CA GLU A 130 -16.150 8.562 3.043 1.00 12.41 C ATOM 2058 C GLU A 130 -15.819 8.323 4.522 1.00 64.32 C ATOM 2059 O GLU A 130 -14.848 8.891 5.024 1.00 0.34 O ATOM 2060 CB GLU A 130 -17.129 9.717 2.832 1.00 64.44 C ATOM 2061 CG GLU A 130 -17.426 9.966 1.340 1.00 0.22 C ATOM 2062 CD GLU A 130 -18.207 11.255 1.080 1.00 53.04 C ATOM 2063 OE1 GLU A 130 -18.117 12.191 1.915 1.00 21.30 O ATOM 2064 OE2 GLU A 130 -18.794 11.356 -0.020 1.00 44.35 O ATOM 0 H GLU A 130 -17.699 7.505 2.157 1.00 44.14 H new ATOM 0 HA GLU A 130 -15.199 8.811 2.573 1.00 12.41 H new ATOM 0 HB2 GLU A 130 -18.061 9.501 3.355 1.00 64.44 H new ATOM 0 HB3 GLU A 130 -16.718 10.624 3.275 1.00 64.44 H new ATOM 0 HG2 GLU A 130 -16.485 10.004 0.792 1.00 0.22 H new ATOM 0 HG3 GLU A 130 -17.991 9.122 0.944 1.00 0.22 H new ATOM 2071 N GLU A 131 -16.572 7.466 5.215 1.00 13.33 N ATOM 2072 CA GLU A 131 -16.258 7.028 6.573 1.00 72.24 C ATOM 2073 C GLU A 131 -14.983 6.170 6.568 1.00 11.03 C ATOM 2074 O GLU A 131 -14.188 6.247 7.504 1.00 72.15 O ATOM 2075 CB GLU A 131 -17.474 6.262 7.127 1.00 15.03 C ATOM 2076 CG GLU A 131 -17.339 5.736 8.572 1.00 74.52 C ATOM 2077 CD GLU A 131 -17.575 4.226 8.659 1.00 31.52 C ATOM 2078 OE1 GLU A 131 -18.657 3.759 8.238 1.00 64.32 O ATOM 2079 OE2 GLU A 131 -16.643 3.473 9.031 1.00 64.41 O ATOM 0 H GLU A 131 -17.427 7.053 4.843 1.00 13.33 H new ATOM 0 HA GLU A 131 -16.060 7.882 7.221 1.00 72.24 H new ATOM 0 HB2 GLU A 131 -18.344 6.917 7.079 1.00 15.03 H new ATOM 0 HB3 GLU A 131 -17.676 5.416 6.470 1.00 15.03 H new ATOM 0 HG2 GLU A 131 -16.344 5.969 8.951 1.00 74.52 H new ATOM 0 HG3 GLU A 131 -18.054 6.252 9.213 1.00 74.52 H new ATOM 2086 N THR A 132 -14.738 5.389 5.512 1.00 42.45 N ATOM 2087 CA THR A 132 -13.539 4.571 5.390 1.00 42.05 C ATOM 2088 C THR A 132 -12.323 5.456 5.129 1.00 2.03 C ATOM 2089 O THR A 132 -11.291 5.255 5.771 1.00 71.43 O ATOM 2090 CB THR A 132 -13.724 3.540 4.275 1.00 75.14 C ATOM 2091 OG1 THR A 132 -14.884 2.772 4.503 1.00 23.34 O ATOM 2092 CG2 THR A 132 -12.523 2.608 4.117 1.00 21.24 C ATOM 0 H THR A 132 -15.372 5.310 4.717 1.00 42.45 H new ATOM 0 HA THR A 132 -13.370 4.036 6.324 1.00 42.05 H new ATOM 0 HB THR A 132 -13.823 4.106 3.349 1.00 75.14 H new ATOM 0 HG1 THR A 132 -14.633 1.909 4.894 1.00 23.34 H new ATOM 0 HG21 THR A 132 -12.715 1.900 3.311 1.00 21.24 H new ATOM 0 HG22 THR A 132 -11.636 3.195 3.880 1.00 21.24 H new ATOM 0 HG23 THR A 132 -12.360 2.063 5.047 1.00 21.24 H new ATOM 2100 N ILE A 133 -12.409 6.445 4.224 1.00 60.52 N ATOM 2101 CA ILE A 133 -11.325 7.420 4.107 1.00 43.35 C ATOM 2102 C ILE A 133 -11.003 8.053 5.473 1.00 22.24 C ATOM 2103 O ILE A 133 -9.824 8.214 5.786 1.00 44.25 O ATOM 2104 CB ILE A 133 -11.594 8.472 3.009 1.00 61.34 C ATOM 2105 CG1 ILE A 133 -11.758 7.778 1.641 1.00 40.35 C ATOM 2106 CG2 ILE A 133 -10.393 9.428 2.924 1.00 15.44 C ATOM 2107 CD1 ILE A 133 -12.171 8.734 0.513 1.00 75.32 C ATOM 0 H ILE A 133 -13.192 6.585 3.585 1.00 60.52 H new ATOM 0 HA ILE A 133 -10.434 6.883 3.784 1.00 43.35 H new ATOM 0 HB ILE A 133 -12.504 9.018 3.257 1.00 61.34 H new ATOM 0 HG12 ILE A 133 -10.818 7.297 1.372 1.00 40.35 H new ATOM 0 HG13 ILE A 133 -12.506 6.990 1.730 1.00 40.35 H new ATOM 0 HG21 ILE A 133 -10.576 10.174 2.150 1.00 15.44 H new ATOM 0 HG22 ILE A 133 -10.256 9.926 3.884 1.00 15.44 H new ATOM 0 HG23 ILE A 133 -9.494 8.862 2.678 1.00 15.44 H new ATOM 0 HD11 ILE A 133 -12.267 8.177 -0.419 1.00 75.32 H new ATOM 0 HD12 ILE A 133 -13.127 9.197 0.760 1.00 75.32 H new ATOM 0 HD13 ILE A 133 -11.413 9.508 0.396 1.00 75.32 H new ATOM 2119 N GLN A 134 -11.988 8.383 6.312 1.00 0.14 N ATOM 2120 CA GLN A 134 -11.665 8.904 7.636 1.00 3.42 C ATOM 2121 C GLN A 134 -11.090 7.825 8.557 1.00 23.53 C ATOM 2122 O GLN A 134 -10.218 8.139 9.370 1.00 11.41 O ATOM 2123 CB GLN A 134 -12.895 9.581 8.250 1.00 4.12 C ATOM 2124 CG GLN A 134 -13.319 10.833 7.467 1.00 14.20 C ATOM 2125 CD GLN A 134 -12.468 12.072 7.761 1.00 24.52 C ATOM 2126 OE1 GLN A 134 -11.242 12.056 7.677 1.00 12.33 O ATOM 2127 NE2 GLN A 134 -13.089 13.188 8.104 1.00 32.14 N ATOM 0 H GLN A 134 -12.984 8.302 6.106 1.00 0.14 H new ATOM 0 HA GLN A 134 -10.882 9.653 7.521 1.00 3.42 H new ATOM 0 HB2 GLN A 134 -13.723 8.873 8.275 1.00 4.12 H new ATOM 0 HB3 GLN A 134 -12.679 9.856 9.282 1.00 4.12 H new ATOM 0 HG2 GLN A 134 -13.269 10.616 6.400 1.00 14.20 H new ATOM 0 HG3 GLN A 134 -14.360 11.057 7.698 1.00 14.20 H new ATOM 0 HE21 GLN A 134 -14.106 13.204 8.175 1.00 32.14 H new ATOM 0 HE22 GLN A 134 -12.551 14.032 8.298 1.00 32.14 H new ATOM 2136 N ALA A 135 -11.526 6.568 8.428 1.00 42.24 N ATOM 2137 CA ALA A 135 -11.100 5.480 9.297 1.00 4.44 C ATOM 2138 C ALA A 135 -9.627 5.155 9.142 1.00 33.44 C ATOM 2139 O ALA A 135 -8.950 4.916 10.140 1.00 12.24 O ATOM 2140 CB ALA A 135 -11.892 4.210 9.038 1.00 14.01 C ATOM 0 H ALA A 135 -12.190 6.280 7.709 1.00 42.24 H new ATOM 0 HA ALA A 135 -11.284 5.834 10.311 1.00 4.44 H new ATOM 0 HB1 ALA A 135 -11.544 3.422 9.706 1.00 14.01 H new ATOM 0 HB2 ALA A 135 -12.950 4.398 9.218 1.00 14.01 H new ATOM 0 HB3 ALA A 135 -11.750 3.897 8.003 1.00 14.01 H new ATOM 2146 N VAL A 136 -9.112 5.180 7.915 1.00 60.53 N ATOM 2147 CA VAL A 136 -7.679 5.013 7.739 1.00 44.31 C ATOM 2148 C VAL A 136 -6.972 6.117 8.520 1.00 14.00 C ATOM 2149 O VAL A 136 -6.011 5.857 9.239 1.00 73.44 O ATOM 2150 CB VAL A 136 -7.315 4.954 6.256 1.00 31.20 C ATOM 2151 CG1 VAL A 136 -7.802 6.100 5.385 1.00 4.21 C ATOM 2152 CG2 VAL A 136 -5.812 4.791 6.076 1.00 34.42 C ATOM 0 H VAL A 136 -9.647 5.310 7.057 1.00 60.53 H new ATOM 0 HA VAL A 136 -7.340 4.059 8.142 1.00 44.31 H new ATOM 0 HB VAL A 136 -7.861 4.080 5.900 1.00 31.20 H new ATOM 0 HG11 VAL A 136 -7.478 5.939 4.357 1.00 4.21 H new ATOM 0 HG12 VAL A 136 -8.890 6.146 5.420 1.00 4.21 H new ATOM 0 HG13 VAL A 136 -7.387 7.038 5.753 1.00 4.21 H new ATOM 0 HG21 VAL A 136 -5.575 4.751 5.013 1.00 34.42 H new ATOM 0 HG22 VAL A 136 -5.297 5.637 6.531 1.00 34.42 H new ATOM 0 HG23 VAL A 136 -5.486 3.868 6.555 1.00 34.42 H new ATOM 2162 N GLN A 137 -7.466 7.353 8.435 1.00 3.44 N ATOM 2163 CA GLN A 137 -6.761 8.460 9.042 1.00 1.21 C ATOM 2164 C GLN A 137 -6.763 8.328 10.579 1.00 44.14 C ATOM 2165 O GLN A 137 -5.845 8.833 11.217 1.00 55.14 O ATOM 2166 CB GLN A 137 -7.353 9.804 8.579 1.00 40.22 C ATOM 2167 CG GLN A 137 -7.469 9.969 7.050 1.00 51.32 C ATOM 2168 CD GLN A 137 -6.647 11.134 6.477 1.00 35.20 C ATOM 2169 OE1 GLN A 137 -6.580 12.242 7.003 1.00 52.41 O ATOM 2170 NE2 GLN A 137 -6.006 10.926 5.344 1.00 3.33 N ATOM 0 H GLN A 137 -8.334 7.600 7.960 1.00 3.44 H new ATOM 0 HA GLN A 137 -5.722 8.434 8.714 1.00 1.21 H new ATOM 0 HB2 GLN A 137 -8.344 9.919 9.019 1.00 40.22 H new ATOM 0 HB3 GLN A 137 -6.735 10.611 8.971 1.00 40.22 H new ATOM 0 HG2 GLN A 137 -7.149 9.044 6.571 1.00 51.32 H new ATOM 0 HG3 GLN A 137 -8.517 10.117 6.790 1.00 51.32 H new ATOM 0 HE21 GLN A 137 -6.051 10.012 4.893 1.00 3.33 H new ATOM 0 HE22 GLN A 137 -5.465 11.679 4.918 1.00 3.33 H new ATOM 2179 N GLU A 138 -7.745 7.634 11.173 1.00 74.45 N ATOM 2180 CA GLU A 138 -7.814 7.369 12.608 1.00 71.51 C ATOM 2181 C GLU A 138 -6.561 6.601 13.029 1.00 2.43 C ATOM 2182 O GLU A 138 -5.736 7.122 13.786 1.00 31.21 O ATOM 2183 CB GLU A 138 -9.076 6.567 12.977 1.00 73.24 C ATOM 2184 CG GLU A 138 -10.401 7.331 12.835 1.00 40.42 C ATOM 2185 CD GLU A 138 -11.603 6.472 13.235 1.00 72.44 C ATOM 2186 OE1 GLU A 138 -11.904 6.393 14.447 1.00 20.53 O ATOM 2187 OE2 GLU A 138 -12.260 5.846 12.371 1.00 15.44 O ATOM 0 H GLU A 138 -8.527 7.235 10.654 1.00 74.45 H new ATOM 0 HA GLU A 138 -7.868 8.321 13.136 1.00 71.51 H new ATOM 0 HB2 GLU A 138 -9.119 5.678 12.348 1.00 73.24 H new ATOM 0 HB3 GLU A 138 -8.981 6.225 14.007 1.00 73.24 H new ATOM 0 HG2 GLU A 138 -10.372 8.226 13.456 1.00 40.42 H new ATOM 0 HG3 GLU A 138 -10.520 7.663 11.804 1.00 40.42 H new ATOM 2194 N GLU A 139 -6.401 5.374 12.517 1.00 42.43 N ATOM 2195 CA GLU A 139 -5.210 4.584 12.828 1.00 62.11 C ATOM 2196 C GLU A 139 -3.916 5.280 12.384 1.00 21.03 C ATOM 2197 O GLU A 139 -2.884 5.134 13.039 1.00 52.31 O ATOM 2198 CB GLU A 139 -5.233 3.119 12.415 1.00 43.22 C ATOM 2199 CG GLU A 139 -5.657 2.964 10.979 1.00 24.20 C ATOM 2200 CD GLU A 139 -5.022 1.741 10.282 1.00 72.32 C ATOM 2201 OE1 GLU A 139 -4.630 0.769 10.973 1.00 42.14 O ATOM 2202 OE2 GLU A 139 -4.846 1.804 9.040 1.00 51.04 O ATOM 0 H GLU A 139 -7.069 4.916 11.897 1.00 42.43 H new ATOM 0 HA GLU A 139 -5.229 4.540 13.917 1.00 62.11 H new ATOM 0 HB2 GLU A 139 -4.243 2.684 12.553 1.00 43.22 H new ATOM 0 HB3 GLU A 139 -5.917 2.567 13.060 1.00 43.22 H new ATOM 0 HG2 GLU A 139 -6.742 2.875 10.936 1.00 24.20 H new ATOM 0 HG3 GLU A 139 -5.389 3.866 10.429 1.00 24.20 H new ATOM 2209 N ASN A 140 -3.960 6.071 11.303 1.00 43.23 N ATOM 2210 CA ASN A 140 -2.766 6.754 10.797 1.00 32.21 C ATOM 2211 C ASN A 140 -2.252 7.731 11.836 1.00 41.52 C ATOM 2212 O ASN A 140 -1.060 7.717 12.109 1.00 4.21 O ATOM 2213 CB ASN A 140 -2.977 7.504 9.470 1.00 13.40 C ATOM 2214 CG ASN A 140 -2.929 6.603 8.245 1.00 2.43 C ATOM 2215 OD1 ASN A 140 -3.499 5.426 8.332 1.00 73.23 O flip ATOM 2216 ND2 ASN A 140 -2.403 6.968 7.197 1.00 14.10 N flip ATOM 0 H ASN A 140 -4.808 6.252 10.765 1.00 43.23 H new ATOM 0 HA ASN A 140 -2.040 5.965 10.598 1.00 32.21 H new ATOM 0 HB2 ASN A 140 -3.941 8.012 9.499 1.00 13.40 H new ATOM 0 HB3 ASN A 140 -2.213 8.275 9.373 1.00 13.40 H new ATOM 0 HD21 ASN A 140 -1.962 7.886 7.140 1.00 14.10 H new ATOM 0 HD22 ASN A 140 -2.407 6.353 6.383 1.00 14.10 H new ATOM 2223 N LYS A 141 -3.113 8.567 12.425 1.00 52.35 N ATOM 2224 CA LYS A 141 -2.708 9.517 13.466 1.00 20.30 C ATOM 2225 C LYS A 141 -1.989 8.807 14.595 1.00 43.21 C ATOM 2226 O LYS A 141 -0.958 9.289 15.067 1.00 52.52 O ATOM 2227 CB LYS A 141 -3.936 10.189 14.064 1.00 13.42 C ATOM 2228 CG LYS A 141 -4.590 11.173 13.097 1.00 13.02 C ATOM 2229 CD LYS A 141 -6.016 11.427 13.576 1.00 2.34 C ATOM 2230 CE LYS A 141 -5.962 12.267 14.859 1.00 34.11 C ATOM 2231 NZ LYS A 141 -6.865 13.429 14.817 1.00 0.44 N ATOM 0 H LYS A 141 -4.106 8.604 12.195 1.00 52.35 H new ATOM 0 HA LYS A 141 -2.048 10.249 13.001 1.00 20.30 H new ATOM 0 HB2 LYS A 141 -4.662 9.427 14.348 1.00 13.42 H new ATOM 0 HB3 LYS A 141 -3.652 10.714 14.976 1.00 13.42 H new ATOM 0 HG2 LYS A 141 -4.027 12.106 13.064 1.00 13.02 H new ATOM 0 HG3 LYS A 141 -4.594 10.767 12.085 1.00 13.02 H new ATOM 0 HD2 LYS A 141 -6.586 11.948 12.807 1.00 2.34 H new ATOM 0 HD3 LYS A 141 -6.525 10.482 13.764 1.00 2.34 H new ATOM 0 HE2 LYS A 141 -6.224 11.639 15.711 1.00 34.11 H new ATOM 0 HE3 LYS A 141 -4.941 12.612 15.020 1.00 34.11 H new ATOM 0 HZ1 LYS A 141 -6.788 13.961 15.708 1.00 0.44 H new ATOM 0 HZ2 LYS A 141 -6.601 14.045 14.022 1.00 0.44 H new ATOM 0 HZ3 LYS A 141 -7.845 13.103 14.692 1.00 0.44 H new ATOM 2245 N ALA A 142 -2.571 7.692 15.041 1.00 55.23 N ATOM 2246 CA ALA A 142 -1.980 6.880 16.093 1.00 54.13 C ATOM 2247 C ALA A 142 -0.563 6.449 15.700 1.00 1.11 C ATOM 2248 O ALA A 142 0.349 6.603 16.509 1.00 32.11 O ATOM 2249 CB ALA A 142 -2.869 5.678 16.425 1.00 73.03 C ATOM 0 H ALA A 142 -3.457 7.334 14.684 1.00 55.23 H new ATOM 0 HA ALA A 142 -1.906 7.483 16.998 1.00 54.13 H new ATOM 0 HB1 ALA A 142 -2.403 5.088 17.214 1.00 73.03 H new ATOM 0 HB2 ALA A 142 -3.845 6.029 16.762 1.00 73.03 H new ATOM 0 HB3 ALA A 142 -2.993 5.060 15.536 1.00 73.03 H new ATOM 2255 N PHE A 143 -0.385 5.948 14.474 1.00 23.43 N ATOM 2256 CA PHE A 143 0.890 5.519 13.913 1.00 33.10 C ATOM 2257 C PHE A 143 1.888 6.680 13.838 1.00 31.14 C ATOM 2258 O PHE A 143 2.975 6.587 14.402 1.00 1.50 O ATOM 2259 CB PHE A 143 0.622 4.889 12.536 1.00 33.24 C ATOM 2260 CG PHE A 143 1.848 4.376 11.808 1.00 11.54 C ATOM 2261 CD1 PHE A 143 2.693 5.277 11.129 1.00 4.51 C ATOM 2262 CD2 PHE A 143 2.131 3.000 11.782 1.00 51.25 C ATOM 2263 CE1 PHE A 143 3.818 4.809 10.426 1.00 15.33 C ATOM 2264 CE2 PHE A 143 3.259 2.538 11.086 1.00 60.21 C ATOM 2265 CZ PHE A 143 4.104 3.434 10.413 1.00 55.33 C ATOM 0 H PHE A 143 -1.160 5.827 13.822 1.00 23.43 H new ATOM 0 HA PHE A 143 1.351 4.774 14.562 1.00 33.10 H new ATOM 0 HB2 PHE A 143 -0.077 4.062 12.663 1.00 33.24 H new ATOM 0 HB3 PHE A 143 0.129 5.629 11.906 1.00 33.24 H new ATOM 0 HD1 PHE A 143 2.475 6.335 11.149 1.00 4.51 H new ATOM 0 HD2 PHE A 143 1.485 2.302 12.294 1.00 51.25 H new ATOM 0 HE1 PHE A 143 4.457 5.502 9.900 1.00 15.33 H new ATOM 0 HE2 PHE A 143 3.479 1.481 11.068 1.00 60.21 H new ATOM 0 HZ PHE A 143 4.972 3.067 9.886 1.00 55.33 H new ATOM 2275 N GLU A 144 1.570 7.772 13.133 1.00 32.14 N ATOM 2276 CA GLU A 144 2.532 8.843 12.853 1.00 51.43 C ATOM 2277 C GLU A 144 2.956 9.588 14.123 1.00 60.04 C ATOM 2278 O GLU A 144 4.038 10.181 14.153 1.00 63.12 O ATOM 2279 CB GLU A 144 2.017 9.828 11.786 1.00 40.23 C ATOM 2280 CG GLU A 144 0.650 10.435 12.106 1.00 41.15 C ATOM 2281 CD GLU A 144 0.461 11.840 11.545 1.00 52.12 C ATOM 2282 OE1 GLU A 144 0.926 12.836 12.145 1.00 33.40 O ATOM 2283 OE2 GLU A 144 -0.142 11.997 10.456 1.00 14.13 O ATOM 0 H GLU A 144 0.642 7.937 12.742 1.00 32.14 H new ATOM 0 HA GLU A 144 3.417 8.353 12.447 1.00 51.43 H new ATOM 0 HB2 GLU A 144 2.742 10.633 11.670 1.00 40.23 H new ATOM 0 HB3 GLU A 144 1.958 9.311 10.828 1.00 40.23 H new ATOM 0 HG2 GLU A 144 -0.129 9.785 11.707 1.00 41.15 H new ATOM 0 HG3 GLU A 144 0.518 10.464 13.188 1.00 41.15 H new ATOM 2290 N GLU A 145 2.155 9.531 15.189 1.00 11.40 N ATOM 2291 CA GLU A 145 2.547 10.024 16.501 1.00 42.35 C ATOM 2292 C GLU A 145 3.802 9.293 16.988 1.00 4.10 C ATOM 2293 O GLU A 145 4.696 9.900 17.575 1.00 71.13 O ATOM 2294 CB GLU A 145 1.384 9.842 17.478 1.00 42.21 C ATOM 2295 CG GLU A 145 1.771 10.284 18.892 1.00 34.10 C ATOM 2296 CD GLU A 145 0.573 10.255 19.839 1.00 71.44 C ATOM 2297 OE1 GLU A 145 -0.237 11.206 19.849 1.00 54.52 O ATOM 2298 OE2 GLU A 145 0.427 9.255 20.578 1.00 22.41 O ATOM 0 H GLU A 145 1.214 9.139 15.161 1.00 11.40 H new ATOM 0 HA GLU A 145 2.786 11.086 16.438 1.00 42.35 H new ATOM 0 HB2 GLU A 145 0.525 10.420 17.136 1.00 42.21 H new ATOM 0 HB3 GLU A 145 1.079 8.796 17.492 1.00 42.21 H new ATOM 0 HG2 GLU A 145 2.555 9.631 19.276 1.00 34.10 H new ATOM 0 HG3 GLU A 145 2.184 11.292 18.858 1.00 34.10 H new ATOM 2305 N LEU A 146 3.895 7.997 16.710 1.00 14.34 N ATOM 2306 CA LEU A 146 4.974 7.119 17.158 1.00 43.25 C ATOM 2307 C LEU A 146 6.043 6.885 16.087 1.00 51.45 C ATOM 2308 O LEU A 146 7.137 6.438 16.420 1.00 53.13 O ATOM 2309 CB LEU A 146 4.390 5.772 17.638 1.00 12.22 C ATOM 2310 CG LEU A 146 3.717 5.746 19.027 1.00 44.13 C ATOM 2311 CD1 LEU A 146 4.336 6.711 20.041 1.00 33.21 C ATOM 2312 CD2 LEU A 146 2.222 6.049 18.959 1.00 11.30 C ATOM 0 H LEU A 146 3.197 7.510 16.147 1.00 14.34 H new ATOM 0 HA LEU A 146 5.472 7.624 17.986 1.00 43.25 H new ATOM 0 HB2 LEU A 146 3.657 5.441 16.902 1.00 12.22 H new ATOM 0 HB3 LEU A 146 5.195 5.037 17.640 1.00 12.22 H new ATOM 0 HG LEU A 146 3.885 4.724 19.367 1.00 44.13 H new ATOM 0 HD11 LEU A 146 3.806 6.631 20.990 1.00 33.21 H new ATOM 0 HD12 LEU A 146 5.386 6.459 20.189 1.00 33.21 H new ATOM 0 HD13 LEU A 146 4.258 7.732 19.667 1.00 33.21 H new ATOM 0 HD21 LEU A 146 1.798 6.018 19.963 1.00 11.30 H new ATOM 0 HD22 LEU A 146 2.071 7.040 18.532 1.00 11.30 H new ATOM 0 HD23 LEU A 146 1.728 5.305 18.334 1.00 11.30 H new ATOM 2324 N HIS A 147 5.781 7.214 14.826 1.00 24.13 N ATOM 2325 CA HIS A 147 6.660 6.961 13.686 1.00 31.43 C ATOM 2326 C HIS A 147 6.998 8.319 13.051 1.00 62.13 C ATOM 2327 O HIS A 147 6.423 8.664 12.019 1.00 74.25 O ATOM 2328 CB HIS A 147 6.002 5.961 12.713 1.00 33.10 C ATOM 2329 CG HIS A 147 5.970 4.527 13.205 1.00 60.34 C ATOM 2330 ND1 HIS A 147 6.561 3.436 12.593 1.00 3.41 N ATOM 2331 CD2 HIS A 147 5.315 4.062 14.316 1.00 71.22 C ATOM 2332 CE1 HIS A 147 6.293 2.354 13.345 1.00 42.32 C ATOM 2333 NE2 HIS A 147 5.571 2.691 14.424 1.00 54.43 N ATOM 0 H HIS A 147 4.916 7.683 14.558 1.00 24.13 H new ATOM 0 HA HIS A 147 7.594 6.489 13.991 1.00 31.43 H new ATOM 0 HB2 HIS A 147 4.981 6.286 12.515 1.00 33.10 H new ATOM 0 HB3 HIS A 147 6.536 5.993 11.764 1.00 33.10 H new ATOM 0 HD2 HIS A 147 4.709 4.650 14.989 1.00 71.22 H new ATOM 0 HE1 HIS A 147 6.615 1.350 13.112 1.00 42.32 H new ATOM 0 HE2 HIS A 147 5.268 2.070 15.175 1.00 54.43 H new ATOM 2341 N PRO A 148 7.894 9.117 13.663 1.00 35.12 N ATOM 2342 CA PRO A 148 8.191 10.487 13.254 1.00 1.44 C ATOM 2343 C PRO A 148 8.860 10.554 11.889 1.00 42.13 C ATOM 2344 O PRO A 148 10.006 10.078 11.748 1.00 34.20 O ATOM 2345 CB PRO A 148 9.088 11.075 14.355 1.00 40.13 C ATOM 2346 CG PRO A 148 9.637 9.861 15.100 1.00 74.43 C ATOM 2347 CD PRO A 148 8.566 8.804 14.914 1.00 51.23 C ATOM 0 HA PRO A 148 7.271 11.061 13.143 1.00 1.44 H new ATOM 0 HB2 PRO A 148 9.892 11.676 13.931 1.00 40.13 H new ATOM 0 HB3 PRO A 148 8.522 11.725 15.022 1.00 40.13 H new ATOM 0 HG2 PRO A 148 10.593 9.538 14.688 1.00 74.43 H new ATOM 0 HG3 PRO A 148 9.803 10.081 16.155 1.00 74.43 H new ATOM 0 HD2 PRO A 148 9.006 7.807 14.880 1.00 51.23 H new ATOM 0 HD3 PRO A 148 7.862 8.814 15.746 1.00 51.23 H new TER 2355 PRO A 148