USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1298 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 3 MET CE :methyl -178:sc= -0.439 (180deg=-0.409) USER MOD Set 1.2: A 168 MET CE :methyl -177:sc= -3.36 (180deg=-3.57) USER MOD Set 2.1: A 105 HIS : no HD1:sc= -2.38 K(o=-2.2,f=-5.8!) USER MOD Set 2.2: A 118 TYR OH : rot 180:sc= 0.162 USER MOD Set 3.1: A 114 LYS NZ :NH3+ -168:sc= 1.28 (180deg=0) USER MOD Set 3.2: A 171 HIS : no HD1:sc= -0.801 K(o=0.48,f=-3.3) USER MOD Set 4.1: A 90 GLN : amide:sc= -5.76! K(o=-6.2!,f=0.98) USER MOD Set 4.2: A 148 ASN : amide:sc= -0.435 K(o=-6.2,f=-2.5!) USER MOD Set 5.1: A 10 SER OG : rot 180:sc= 0.624 USER MOD Set 5.2: A 62 GLN : amide:sc= 1.51 K(o=2.1,f=-8.6!) USER MOD Set 6.1: A 33 HIS : no HD1:sc= -0.115 K(o=-0.11,f=-1.3) USER MOD Set 6.2: A 46 TYR OH : rot 165:sc= 0 USER MOD Set 7.1: A 12 CYS SG : rot 180:sc=-0.00385 USER MOD Set 7.2: A 16 MET CE :methyl -169:sc= -0.99 (180deg=-1.11) USER MOD Set 8.1: A 7 TYR OH : rot 178:sc= 1.09 USER MOD Set 8.2: A 34 ASN : amide:sc= 1.14 K(o=2.2,f=1.3) USER MOD Single : A 1 MET CE :methyl 175:sc= -0.397 (180deg=-0.46) USER MOD Single : A 1 MET N :NH3+ -145:sc= 0.253 (180deg=0.00598) USER MOD Single : A 2 ASN : amide:sc= 0.369 X(o=0.37,f=-0.0098) USER MOD Single : A 9 SER OG : rot -98:sc= 0.165 USER MOD Single : A 11 THR OG1 : rot 153:sc= 2.26 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 159:sc= 0.3 USER MOD Single : A 20 LYS NZ :NH3+ -164:sc= 1.3 (180deg=1.16) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= 1.27 (180deg=0.816) USER MOD Single : A 43 MET CE :methyl 174:sc= -0.469 (180deg=-0.472) USER MOD Single : A 45 GLN : amide:sc= 0.346 X(o=0.35,f=0) USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.364 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -170:sc= 2.05 (180deg=1.79) USER MOD Single : A 85 TYR OH : rot 180:sc=-0.00823 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 168:sc= -0.107 (180deg=-0.365) USER MOD Single : A 107 LYS NZ :NH3+ -170:sc= 0.00448 (180deg=3.03e-05) USER MOD Single : A 109 SER OG : rot 180:sc=-0.00141 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 176:sc= 1.63 (180deg=1.62) USER MOD Single : A 121 THR OG1 : rot -166:sc= 0.414 USER MOD Single : A 127 THR OG1 : rot -40:sc= 0.0198 USER MOD Single : A 128 SER OG : rot 173:sc= 0.853 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 176:sc= 1.3 USER MOD Single : A 158 GLN : amide:sc= 0.992 K(o=0.99,f=-0.022) USER MOD Single : A 159 SER OG : rot 82:sc= 0.134 USER MOD Single : A 161 CYS SG : rot 75:sc= -1.15! USER MOD Single : A 163 GLN : amide:sc= 1.36 K(o=1.4,f=-0.49) USER MOD Single : A 166 ASN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 172 TYR OH : rot 170:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.417 0.307 -0.076 1.00 0.00 N ATOM 2 CA MET A 1 2.341 0.441 -1.249 1.00 0.00 C ATOM 3 C MET A 1 2.449 1.893 -1.729 1.00 0.00 C ATOM 4 O MET A 1 1.552 2.697 -1.500 1.00 0.00 O ATOM 5 CB MET A 1 1.992 -0.520 -2.422 1.00 0.00 C ATOM 6 CG MET A 1 0.771 -0.153 -3.289 1.00 0.00 C ATOM 7 SD MET A 1 -0.851 -0.436 -2.523 1.00 0.00 S ATOM 8 CE MET A 1 -1.874 -0.653 -4.006 1.00 0.00 C ATOM 0 H1 MET A 1 1.773 -0.431 0.564 1.00 0.00 H new ATOM 0 H2 MET A 1 1.369 1.213 0.433 1.00 0.00 H new ATOM 0 H3 MET A 1 0.467 0.047 -0.410 1.00 0.00 H new ATOM 0 HA MET A 1 3.322 0.135 -0.886 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.862 -0.588 -3.075 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.826 -1.514 -2.007 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.845 0.900 -3.562 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.820 -0.726 -4.215 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.888 -0.925 -3.712 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.897 0.279 -4.571 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.452 -1.444 -4.627 1.00 0.00 H new ATOM 20 N ASN A 2 3.529 2.211 -2.453 1.00 0.00 N ATOM 21 CA ASN A 2 3.718 3.471 -3.177 1.00 0.00 C ATOM 22 C ASN A 2 3.670 3.185 -4.675 1.00 0.00 C ATOM 23 O ASN A 2 4.181 2.162 -5.127 1.00 0.00 O ATOM 24 CB ASN A 2 5.009 4.191 -2.747 1.00 0.00 C ATOM 25 CG ASN A 2 6.278 3.344 -2.596 1.00 0.00 C ATOM 26 OD1 ASN A 2 7.023 3.511 -1.635 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.564 2.413 -3.500 1.00 0.00 N ATOM 0 H ASN A 2 4.321 1.576 -2.553 1.00 0.00 H new ATOM 0 HA ASN A 2 2.911 4.161 -2.929 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.214 4.976 -3.475 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.818 4.682 -1.793 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.401 1.839 -3.394 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.947 2.272 -4.300 1.00 0.00 H new ATOM 34 N MET A 3 3.057 4.085 -5.431 1.00 0.00 N ATOM 35 CA MET A 3 2.695 3.958 -6.838 1.00 0.00 C ATOM 36 C MET A 3 3.384 5.067 -7.620 1.00 0.00 C ATOM 37 O MET A 3 3.549 6.173 -7.110 1.00 0.00 O ATOM 38 CB MET A 3 1.165 4.045 -6.998 1.00 0.00 C ATOM 39 CG MET A 3 0.426 3.213 -5.932 1.00 0.00 C ATOM 40 SD MET A 3 -1.291 2.744 -6.281 1.00 0.00 S ATOM 41 CE MET A 3 -2.068 4.329 -6.665 1.00 0.00 C ATOM 0 H MET A 3 2.779 4.989 -5.050 1.00 0.00 H new ATOM 0 HA MET A 3 3.019 2.991 -7.223 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.851 5.087 -6.927 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.884 3.695 -7.991 1.00 0.00 H new ATOM 0 HG2 MET A 3 0.997 2.300 -5.762 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.438 3.775 -4.998 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.129 4.176 -6.861 1.00 0.00 H new ATOM 0 HE2 MET A 3 -1.949 5.007 -5.820 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.595 4.762 -7.547 1.00 0.00 H new ATOM 51 N GLY A 4 3.748 4.804 -8.869 1.00 0.00 N ATOM 52 CA GLY A 4 4.442 5.785 -9.692 1.00 0.00 C ATOM 53 C GLY A 4 3.536 6.294 -10.800 1.00 0.00 C ATOM 54 O GLY A 4 3.087 5.488 -11.611 1.00 0.00 O ATOM 0 H GLY A 4 3.573 3.914 -9.336 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.771 6.619 -9.072 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.337 5.337 -10.124 1.00 0.00 H new ATOM 58 N LEU A 5 3.256 7.601 -10.855 1.00 0.00 N ATOM 59 CA LEU A 5 2.587 8.221 -11.992 1.00 0.00 C ATOM 60 C LEU A 5 3.648 8.664 -13.000 1.00 0.00 C ATOM 61 O LEU A 5 4.414 9.574 -12.712 1.00 0.00 O ATOM 62 CB LEU A 5 1.722 9.402 -11.496 1.00 0.00 C ATOM 63 CG LEU A 5 0.761 10.056 -12.510 1.00 0.00 C ATOM 64 CD1 LEU A 5 1.387 10.502 -13.826 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.362 9.098 -12.873 1.00 0.00 C ATOM 0 H LEU A 5 3.490 8.255 -10.108 1.00 0.00 H new ATOM 0 HA LEU A 5 1.921 7.515 -12.488 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.131 9.054 -10.649 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.392 10.175 -11.121 1.00 0.00 H new ATOM 0 HG LEU A 5 0.415 10.949 -11.989 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.621 10.947 -14.461 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.166 11.238 -13.627 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.822 9.640 -14.332 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.031 9.576 -13.589 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.059 8.195 -13.316 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.921 8.835 -11.975 1.00 0.00 H new ATOM 77 N PHE A 6 3.648 8.086 -14.194 1.00 0.00 N ATOM 78 CA PHE A 6 4.514 8.444 -15.319 1.00 0.00 C ATOM 79 C PHE A 6 3.720 9.077 -16.451 1.00 0.00 C ATOM 80 O PHE A 6 2.580 8.690 -16.708 1.00 0.00 O ATOM 81 CB PHE A 6 5.183 7.178 -15.839 1.00 0.00 C ATOM 82 CG PHE A 6 6.135 6.563 -14.852 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.665 5.747 -13.811 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.497 6.869 -14.938 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.553 5.282 -12.830 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.387 6.374 -13.981 1.00 0.00 C ATOM 87 CZ PHE A 6 7.922 5.596 -12.904 1.00 0.00 C ATOM 0 H PHE A 6 3.016 7.318 -14.419 1.00 0.00 H new ATOM 0 HA PHE A 6 5.253 9.166 -14.971 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.415 6.448 -16.096 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.722 7.411 -16.757 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.620 5.477 -13.765 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.861 7.488 -15.744 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.184 4.680 -12.013 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.441 6.590 -14.069 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.606 5.245 -12.146 1.00 0.00 H new ATOM 97 N TYR A 7 4.338 10.006 -17.173 1.00 0.00 N ATOM 98 CA TYR A 7 3.757 10.647 -18.350 1.00 0.00 C ATOM 99 C TYR A 7 4.840 11.313 -19.195 1.00 0.00 C ATOM 100 O TYR A 7 5.993 11.423 -18.774 1.00 0.00 O ATOM 101 CB TYR A 7 2.733 11.706 -17.909 1.00 0.00 C ATOM 102 CG TYR A 7 3.327 12.872 -17.145 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.606 12.725 -15.777 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.622 14.089 -17.791 1.00 0.00 C ATOM 105 CE1 TYR A 7 4.110 13.801 -15.031 1.00 0.00 C ATOM 106 CE2 TYR A 7 4.152 15.165 -17.057 1.00 0.00 C ATOM 107 CZ TYR A 7 4.362 15.035 -15.662 1.00 0.00 C ATOM 108 OH TYR A 7 4.793 16.073 -14.900 1.00 0.00 O ATOM 0 H TYR A 7 5.276 10.342 -16.953 1.00 0.00 H new ATOM 0 HA TYR A 7 3.265 9.882 -18.951 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.222 12.089 -18.792 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.978 11.226 -17.286 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.431 11.775 -15.294 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.441 14.195 -18.850 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.304 13.683 -13.975 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.399 16.090 -17.557 1.00 0.00 H new ATOM 0 HH TYR A 7 4.958 16.852 -15.471 1.00 0.00 H new ATOM 118 N GLY A 8 4.425 11.817 -20.359 1.00 0.00 N ATOM 119 CA GLY A 8 5.199 12.693 -21.224 1.00 0.00 C ATOM 120 C GLY A 8 4.210 13.673 -21.843 1.00 0.00 C ATOM 121 O GLY A 8 3.085 13.289 -22.166 1.00 0.00 O ATOM 0 H GLY A 8 3.499 11.613 -20.736 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.965 13.221 -20.656 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.713 12.121 -21.996 1.00 0.00 H new ATOM 125 N SER A 9 4.582 14.943 -21.937 1.00 0.00 N ATOM 126 CA SER A 9 3.732 16.037 -22.370 1.00 0.00 C ATOM 127 C SER A 9 4.558 16.984 -23.247 1.00 0.00 C ATOM 128 O SER A 9 5.657 17.374 -22.848 1.00 0.00 O ATOM 129 CB SER A 9 3.163 16.732 -21.118 1.00 0.00 C ATOM 130 OG SER A 9 4.127 16.830 -20.081 1.00 0.00 O ATOM 0 H SER A 9 5.526 15.249 -21.703 1.00 0.00 H new ATOM 0 HA SER A 9 2.892 15.686 -22.969 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.814 17.730 -21.384 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.297 16.177 -20.757 1.00 0.00 H new ATOM 0 HG SER A 9 3.993 16.101 -19.440 1.00 0.00 H new ATOM 136 N SER A 10 4.034 17.367 -24.417 1.00 0.00 N ATOM 137 CA SER A 10 4.655 18.391 -25.253 1.00 0.00 C ATOM 138 C SER A 10 4.103 19.769 -24.879 1.00 0.00 C ATOM 139 O SER A 10 4.851 20.751 -24.877 1.00 0.00 O ATOM 140 CB SER A 10 4.390 18.093 -26.725 1.00 0.00 C ATOM 141 OG SER A 10 4.767 16.763 -27.039 1.00 0.00 O ATOM 0 H SER A 10 3.175 16.977 -24.805 1.00 0.00 H new ATOM 0 HA SER A 10 5.732 18.387 -25.086 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.333 18.239 -26.947 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.947 18.792 -27.349 1.00 0.00 H new ATOM 0 HG SER A 10 4.589 16.588 -27.987 1.00 0.00 H new ATOM 147 N THR A 11 2.810 19.842 -24.549 1.00 0.00 N ATOM 148 CA THR A 11 2.119 21.079 -24.242 1.00 0.00 C ATOM 149 C THR A 11 2.157 21.249 -22.718 1.00 0.00 C ATOM 150 O THR A 11 3.074 21.876 -22.177 1.00 0.00 O ATOM 151 CB THR A 11 0.722 21.032 -24.885 1.00 0.00 C ATOM 152 OG1 THR A 11 0.066 19.868 -24.426 1.00 0.00 O ATOM 153 CG2 THR A 11 0.786 20.909 -26.409 1.00 0.00 C ATOM 0 H THR A 11 2.209 19.020 -24.489 1.00 0.00 H new ATOM 0 HA THR A 11 2.587 21.969 -24.661 1.00 0.00 H new ATOM 0 HB THR A 11 0.209 21.956 -24.617 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.904 20.008 -24.450 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.225 20.880 -26.814 1.00 0.00 H new ATOM 0 HG22 THR A 11 1.318 21.767 -26.821 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.311 19.993 -26.678 1.00 0.00 H new ATOM 161 N CYS A 12 1.193 20.625 -22.031 1.00 0.00 N ATOM 162 CA CYS A 12 1.051 20.570 -20.578 1.00 0.00 C ATOM 163 C CYS A 12 -0.099 19.658 -20.118 1.00 0.00 C ATOM 164 O CYS A 12 -0.267 19.450 -18.921 1.00 0.00 O ATOM 165 CB CYS A 12 0.805 21.990 -20.019 1.00 0.00 C ATOM 166 SG CYS A 12 -0.495 22.879 -20.938 1.00 0.00 S ATOM 0 H CYS A 12 0.448 20.115 -22.507 1.00 0.00 H new ATOM 0 HA CYS A 12 1.982 20.152 -20.194 1.00 0.00 H new ATOM 0 HB2 CYS A 12 0.522 21.921 -18.969 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.733 22.561 -20.062 1.00 0.00 H new ATOM 0 HG CYS A 12 -0.659 24.061 -20.423 1.00 0.00 H new ATOM 172 N TYR A 13 -0.933 19.117 -21.010 1.00 0.00 N ATOM 173 CA TYR A 13 -2.176 18.463 -20.586 1.00 0.00 C ATOM 174 C TYR A 13 -1.917 17.165 -19.835 1.00 0.00 C ATOM 175 O TYR A 13 -2.537 16.925 -18.797 1.00 0.00 O ATOM 176 CB TYR A 13 -3.095 18.204 -21.775 1.00 0.00 C ATOM 177 CG TYR A 13 -3.373 19.389 -22.674 1.00 0.00 C ATOM 178 CD1 TYR A 13 -4.147 20.480 -22.238 1.00 0.00 C ATOM 179 CD2 TYR A 13 -2.869 19.363 -23.981 1.00 0.00 C ATOM 180 CE1 TYR A 13 -4.387 21.561 -23.105 1.00 0.00 C ATOM 181 CE2 TYR A 13 -3.108 20.435 -24.861 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.867 21.544 -24.422 1.00 0.00 C ATOM 183 OH TYR A 13 -4.093 22.587 -25.275 1.00 0.00 O ATOM 0 H TYR A 13 -0.775 19.118 -22.018 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.670 19.151 -19.900 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.657 17.410 -22.380 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.046 17.829 -21.398 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -4.556 20.487 -21.239 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.292 18.513 -24.316 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.969 22.405 -22.766 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.714 20.411 -25.866 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.661 22.405 -26.136 1.00 0.00 H new ATOM 193 N THR A 14 -0.974 16.348 -20.312 1.00 0.00 N ATOM 194 CA THR A 14 -0.630 15.089 -19.649 1.00 0.00 C ATOM 195 C THR A 14 -0.031 15.416 -18.278 1.00 0.00 C ATOM 196 O THR A 14 -0.317 14.731 -17.300 1.00 0.00 O ATOM 197 CB THR A 14 0.324 14.229 -20.503 1.00 0.00 C ATOM 198 OG1 THR A 14 0.436 14.754 -21.815 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.141 12.779 -20.628 1.00 0.00 C ATOM 0 H THR A 14 -0.435 16.537 -21.157 1.00 0.00 H new ATOM 0 HA THR A 14 -1.531 14.489 -19.520 1.00 0.00 H new ATOM 0 HB THR A 14 1.284 14.253 -19.987 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.266 14.433 -22.226 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.568 12.221 -21.239 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.199 12.329 -19.637 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.125 12.751 -21.097 1.00 0.00 H new ATOM 207 N GLU A 15 0.727 16.513 -18.195 1.00 0.00 N ATOM 208 CA GLU A 15 1.302 16.999 -16.956 1.00 0.00 C ATOM 209 C GLU A 15 0.200 17.369 -15.966 1.00 0.00 C ATOM 210 O GLU A 15 0.228 16.918 -14.826 1.00 0.00 O ATOM 211 CB GLU A 15 2.259 18.163 -17.264 1.00 0.00 C ATOM 212 CG GLU A 15 2.924 18.719 -16.002 1.00 0.00 C ATOM 213 CD GLU A 15 4.373 19.158 -16.275 1.00 0.00 C ATOM 214 OE1 GLU A 15 5.279 18.291 -16.180 1.00 0.00 O1- ATOM 215 OE2 GLU A 15 4.608 20.359 -16.555 1.00 0.00 O ATOM 0 H GLU A 15 0.957 17.091 -19.004 1.00 0.00 H new ATOM 0 HA GLU A 15 1.888 16.215 -16.476 1.00 0.00 H new ATOM 0 HB2 GLU A 15 3.028 17.824 -17.958 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.709 18.960 -17.763 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.350 19.568 -15.630 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.914 17.960 -15.220 1.00 0.00 H new ATOM 222 N MET A 16 -0.811 18.117 -16.402 1.00 0.00 N ATOM 223 CA MET A 16 -1.896 18.532 -15.522 1.00 0.00 C ATOM 224 C MET A 16 -2.731 17.337 -15.070 1.00 0.00 C ATOM 225 O MET A 16 -3.078 17.230 -13.895 1.00 0.00 O ATOM 226 CB MET A 16 -2.759 19.612 -16.193 1.00 0.00 C ATOM 227 CG MET A 16 -1.980 20.916 -16.392 1.00 0.00 C ATOM 228 SD MET A 16 -2.899 22.249 -17.214 1.00 0.00 S ATOM 229 CE MET A 16 -3.129 21.533 -18.865 1.00 0.00 C ATOM 0 H MET A 16 -0.900 18.448 -17.363 1.00 0.00 H new ATOM 0 HA MET A 16 -1.458 18.971 -14.626 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.112 19.248 -17.158 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.641 19.804 -15.582 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.647 21.274 -15.418 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.085 20.700 -16.976 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.501 22.299 -19.545 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.176 21.153 -19.233 1.00 0.00 H new ATOM 0 HE3 MET A 16 -3.848 20.716 -18.810 1.00 0.00 H new ATOM 239 N ALA A 17 -3.011 16.401 -15.977 1.00 0.00 N ATOM 240 CA ALA A 17 -3.706 15.164 -15.650 1.00 0.00 C ATOM 241 C ALA A 17 -2.920 14.362 -14.620 1.00 0.00 C ATOM 242 O ALA A 17 -3.522 13.861 -13.675 1.00 0.00 O ATOM 243 CB ALA A 17 -3.989 14.347 -16.912 1.00 0.00 C ATOM 0 H ALA A 17 -2.760 16.483 -16.962 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.669 15.415 -15.205 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.509 13.428 -16.641 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.612 14.930 -17.591 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.048 14.100 -17.404 1.00 0.00 H new ATOM 249 N ALA A 18 -1.594 14.290 -14.744 1.00 0.00 N ATOM 250 CA ALA A 18 -0.726 13.609 -13.799 1.00 0.00 C ATOM 251 C ALA A 18 -0.914 14.162 -12.395 1.00 0.00 C ATOM 252 O ALA A 18 -1.102 13.387 -11.457 1.00 0.00 O ATOM 253 CB ALA A 18 0.733 13.759 -14.243 1.00 0.00 C ATOM 0 H ALA A 18 -1.089 14.714 -15.522 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.989 12.551 -13.780 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.384 13.248 -13.533 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.859 13.320 -15.233 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.995 14.816 -14.279 1.00 0.00 H new ATOM 259 N GLU A 19 -0.915 15.489 -12.257 1.00 0.00 N ATOM 260 CA GLU A 19 -1.090 16.133 -10.957 1.00 0.00 C ATOM 261 C GLU A 19 -2.412 15.708 -10.354 1.00 0.00 C ATOM 262 O GLU A 19 -2.458 15.363 -9.172 1.00 0.00 O ATOM 263 CB GLU A 19 -1.063 17.670 -10.991 1.00 0.00 C ATOM 264 CG GLU A 19 0.058 18.258 -11.833 1.00 0.00 C ATOM 265 CD GLU A 19 0.287 19.746 -11.512 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.358 20.618 -12.145 1.00 0.00 O1- ATOM 267 OE2 GLU A 19 1.115 20.050 -10.620 1.00 0.00 O ATOM 0 H GLU A 19 -0.796 16.139 -13.034 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.236 15.810 -10.361 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.017 18.030 -11.375 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.969 18.043 -9.971 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.978 17.701 -11.655 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.183 18.146 -12.890 1.00 0.00 H new ATOM 274 N LYS A 20 -3.456 15.699 -11.186 1.00 0.00 N ATOM 275 CA LYS A 20 -4.813 15.379 -10.804 1.00 0.00 C ATOM 276 C LYS A 20 -4.859 13.953 -10.326 1.00 0.00 C ATOM 277 O LYS A 20 -5.257 13.737 -9.193 1.00 0.00 O ATOM 278 CB LYS A 20 -5.772 15.668 -11.971 1.00 0.00 C ATOM 279 CG LYS A 20 -5.932 17.179 -12.192 1.00 0.00 C ATOM 280 CD LYS A 20 -6.645 17.430 -13.525 1.00 0.00 C ATOM 281 CE LYS A 20 -6.661 18.904 -13.946 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.389 19.782 -12.984 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.365 15.924 -12.177 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.146 16.009 -9.979 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.394 15.202 -12.881 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.745 15.222 -11.765 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.503 17.618 -11.374 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.955 17.662 -12.194 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.157 16.844 -14.304 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.672 17.071 -13.451 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.635 19.258 -14.046 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.125 18.990 -14.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.602 20.693 -13.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.277 19.322 -12.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -6.796 19.944 -12.145 1.00 0.00 H new ATOM 296 N ILE A 21 -4.412 12.991 -11.125 1.00 0.00 N ATOM 297 CA ILE A 21 -4.472 11.580 -10.757 1.00 0.00 C ATOM 298 C ILE A 21 -3.834 11.375 -9.387 1.00 0.00 C ATOM 299 O ILE A 21 -4.474 10.874 -8.468 1.00 0.00 O ATOM 300 CB ILE A 21 -3.770 10.741 -11.850 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.645 10.629 -13.108 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.465 9.330 -11.344 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.812 10.675 -14.389 1.00 0.00 C ATOM 0 H ILE A 21 -4.000 13.165 -12.042 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.509 11.251 -10.688 1.00 0.00 H new ATOM 0 HB ILE A 21 -2.840 11.252 -12.097 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.209 9.697 -13.076 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.371 11.442 -13.118 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -2.971 8.760 -12.131 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -2.811 9.389 -10.474 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.395 8.834 -11.066 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.470 10.593 -15.254 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.268 11.618 -14.435 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.103 9.847 -14.392 1.00 0.00 H new ATOM 315 N ARG A 22 -2.572 11.785 -9.245 1.00 0.00 N ATOM 316 CA ARG A 22 -1.826 11.624 -8.003 1.00 0.00 C ATOM 317 C ARG A 22 -2.543 12.314 -6.849 1.00 0.00 C ATOM 318 O ARG A 22 -2.580 11.763 -5.759 1.00 0.00 O ATOM 319 CB ARG A 22 -0.395 12.137 -8.278 1.00 0.00 C ATOM 320 CG ARG A 22 0.507 12.360 -7.043 1.00 0.00 C ATOM 321 CD ARG A 22 1.149 13.752 -6.932 1.00 0.00 C ATOM 322 NE ARG A 22 0.181 14.820 -7.236 1.00 0.00 N ATOM 323 CZ ARG A 22 0.214 16.103 -6.838 1.00 0.00 C ATOM 324 NH1 ARG A 22 1.205 16.559 -6.081 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -0.759 16.925 -7.218 1.00 0.00 N ATOM 0 H ARG A 22 -2.042 12.237 -9.990 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.761 10.583 -7.686 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.101 11.426 -8.939 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.469 13.079 -8.821 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.085 12.180 -6.146 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.301 11.613 -7.056 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.543 13.893 -5.925 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.994 13.820 -7.617 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.611 14.553 -7.820 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.957 15.932 -5.793 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.215 17.536 -5.788 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.519 16.579 -7.805 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.746 17.901 -6.923 1.00 0.00 H new ATOM 339 N ASP A 23 -3.123 13.478 -7.095 1.00 0.00 N ATOM 340 CA ASP A 23 -3.826 14.245 -6.066 1.00 0.00 C ATOM 341 C ASP A 23 -5.099 13.533 -5.606 1.00 0.00 C ATOM 342 O ASP A 23 -5.339 13.384 -4.405 1.00 0.00 O ATOM 343 CB ASP A 23 -4.188 15.651 -6.552 1.00 0.00 C ATOM 344 CG ASP A 23 -4.980 16.404 -5.471 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.360 16.856 -4.477 1.00 0.00 O ATOM 346 OD2 ASP A 23 -6.215 16.565 -5.618 1.00 0.00 O1- ATOM 0 H ASP A 23 -3.122 13.922 -8.013 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.138 14.328 -5.225 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.281 16.203 -6.798 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -4.779 15.586 -7.466 1.00 0.00 H new ATOM 351 N ILE A 24 -5.894 13.068 -6.574 1.00 0.00 N ATOM 352 CA ILE A 24 -7.191 12.449 -6.355 1.00 0.00 C ATOM 353 C ILE A 24 -6.978 11.127 -5.609 1.00 0.00 C ATOM 354 O ILE A 24 -7.682 10.834 -4.640 1.00 0.00 O ATOM 355 CB ILE A 24 -7.949 12.294 -7.704 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.303 13.665 -8.352 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.250 11.505 -7.463 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.277 13.695 -9.887 1.00 0.00 C ATOM 0 H ILE A 24 -5.639 13.117 -7.560 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.828 13.077 -5.732 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.288 11.765 -8.391 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.297 13.960 -8.017 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.605 14.415 -7.979 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.787 11.392 -8.405 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.009 10.520 -7.062 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.875 12.043 -6.751 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.538 14.694 -10.236 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.278 13.437 -10.239 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.997 12.975 -10.277 1.00 0.00 H new ATOM 370 N ILE A 25 -6.001 10.333 -6.056 1.00 0.00 N ATOM 371 CA ILE A 25 -5.708 9.021 -5.496 1.00 0.00 C ATOM 372 C ILE A 25 -5.055 9.160 -4.121 1.00 0.00 C ATOM 373 O ILE A 25 -5.516 8.560 -3.149 1.00 0.00 O ATOM 374 CB ILE A 25 -4.873 8.221 -6.516 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.741 7.981 -7.765 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.359 6.884 -5.966 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.000 7.263 -8.880 1.00 0.00 C ATOM 0 H ILE A 25 -5.386 10.592 -6.828 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.624 8.457 -5.321 1.00 0.00 H new ATOM 0 HB ILE A 25 -3.986 8.807 -6.757 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.617 7.396 -7.484 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.104 8.939 -8.137 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.780 6.373 -6.735 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.727 7.067 -5.097 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.205 6.261 -5.675 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.668 7.125 -9.731 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.140 7.858 -9.187 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.660 6.290 -8.524 1.00 0.00 H new ATOM 389 N GLY A 26 -3.997 9.964 -4.044 1.00 0.00 N ATOM 390 CA GLY A 26 -3.342 10.346 -2.801 1.00 0.00 C ATOM 391 C GLY A 26 -1.851 10.564 -3.026 1.00 0.00 C ATOM 392 O GLY A 26 -1.124 9.595 -3.257 1.00 0.00 O ATOM 0 H GLY A 26 -3.562 10.378 -4.869 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.794 11.258 -2.411 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.492 9.570 -2.051 1.00 0.00 H new ATOM 396 N PRO A 27 -1.332 11.796 -2.882 1.00 0.00 N ATOM 397 CA PRO A 27 0.086 12.098 -3.071 1.00 0.00 C ATOM 398 C PRO A 27 0.968 11.555 -1.927 1.00 0.00 C ATOM 399 O PRO A 27 2.181 11.768 -1.914 1.00 0.00 O ATOM 400 CB PRO A 27 0.131 13.624 -3.214 1.00 0.00 C ATOM 401 CG PRO A 27 -1.032 14.093 -2.350 1.00 0.00 C ATOM 402 CD PRO A 27 -2.077 13.010 -2.565 1.00 0.00 C ATOM 0 HA PRO A 27 0.503 11.605 -3.949 1.00 0.00 H new ATOM 0 HB2 PRO A 27 1.080 14.032 -2.867 1.00 0.00 H new ATOM 0 HB3 PRO A 27 0.011 13.934 -4.252 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.747 14.177 -1.301 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.396 15.072 -2.660 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.687 12.873 -1.672 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.755 13.276 -3.376 1.00 0.00 H new ATOM 410 N GLU A 28 0.367 10.833 -0.972 1.00 0.00 N ATOM 411 CA GLU A 28 1.048 10.155 0.122 1.00 0.00 C ATOM 412 C GLU A 28 1.779 8.926 -0.427 1.00 0.00 C ATOM 413 O GLU A 28 2.850 8.553 0.055 1.00 0.00 O ATOM 414 CB GLU A 28 0.056 9.698 1.215 1.00 0.00 C ATOM 415 CG GLU A 28 -1.251 10.497 1.288 1.00 0.00 C ATOM 416 CD GLU A 28 -2.075 10.121 2.533 1.00 0.00 C ATOM 417 OE1 GLU A 28 -1.895 10.754 3.603 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -2.924 9.201 2.447 1.00 0.00 O ATOM 0 H GLU A 28 -0.645 10.705 -0.946 1.00 0.00 H new ATOM 0 HA GLU A 28 1.751 10.858 0.569 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.187 8.649 1.046 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.554 9.758 2.183 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.026 11.563 1.308 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.842 10.313 0.391 1.00 0.00 H new ATOM 425 N LEU A 29 1.159 8.291 -1.432 1.00 0.00 N ATOM 426 CA LEU A 29 1.575 7.040 -2.030 1.00 0.00 C ATOM 427 C LEU A 29 1.841 7.197 -3.518 1.00 0.00 C ATOM 428 O LEU A 29 2.618 6.408 -4.034 1.00 0.00 O ATOM 429 CB LEU A 29 0.559 5.925 -1.720 1.00 0.00 C ATOM 430 CG LEU A 29 -0.910 6.180 -2.131 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.483 4.917 -2.779 1.00 0.00 C ATOM 432 CD2 LEU A 29 -1.781 6.571 -0.938 1.00 0.00 C ATOM 0 H LEU A 29 0.313 8.665 -1.862 1.00 0.00 H new ATOM 0 HA LEU A 29 2.523 6.741 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.895 5.013 -2.214 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.582 5.734 -0.647 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.916 7.011 -2.836 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.518 5.095 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.897 4.663 -3.662 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.442 4.092 -2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.804 6.740 -1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.770 5.768 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.392 7.484 -0.487 1.00 0.00 H new ATOM 444 N VAL A 30 1.256 8.168 -4.225 1.00 0.00 N ATOM 445 CA VAL A 30 1.555 8.370 -5.648 1.00 0.00 C ATOM 446 C VAL A 30 2.668 9.415 -5.787 1.00 0.00 C ATOM 447 O VAL A 30 2.635 10.432 -5.097 1.00 0.00 O ATOM 448 CB VAL A 30 0.283 8.727 -6.442 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.545 8.740 -7.961 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.872 7.769 -6.146 1.00 0.00 C ATOM 0 H VAL A 30 0.576 8.824 -3.839 1.00 0.00 H new ATOM 0 HA VAL A 30 1.918 7.439 -6.084 1.00 0.00 H new ATOM 0 HB VAL A 30 0.000 9.728 -6.116 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.375 8.996 -8.487 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.312 9.479 -8.192 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.883 7.754 -8.280 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.746 8.061 -6.729 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.580 6.754 -6.414 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.114 7.808 -5.084 1.00 0.00 H new ATOM 460 N THR A 31 3.596 9.204 -6.731 1.00 0.00 N ATOM 461 CA THR A 31 4.673 10.126 -7.048 1.00 0.00 C ATOM 462 C THR A 31 4.729 10.357 -8.559 1.00 0.00 C ATOM 463 O THR A 31 4.696 9.389 -9.309 1.00 0.00 O ATOM 464 CB THR A 31 5.994 9.577 -6.468 1.00 0.00 C ATOM 465 OG1 THR A 31 5.869 9.297 -5.080 1.00 0.00 O ATOM 466 CG2 THR A 31 7.152 10.565 -6.649 1.00 0.00 C ATOM 0 H THR A 31 3.610 8.361 -7.306 1.00 0.00 H new ATOM 0 HA THR A 31 4.498 11.100 -6.591 1.00 0.00 H new ATOM 0 HB THR A 31 6.209 8.661 -7.018 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.719 8.949 -4.739 1.00 0.00 H new ATOM 0 HG21 THR A 31 8.063 10.140 -6.227 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.301 10.760 -7.711 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.917 11.499 -6.138 1.00 0.00 H new ATOM 474 N LEU A 32 4.772 11.619 -9.013 1.00 0.00 N ATOM 475 CA LEU A 32 4.942 11.971 -10.428 1.00 0.00 C ATOM 476 C LEU A 32 6.363 11.692 -10.923 1.00 0.00 C ATOM 477 O LEU A 32 7.327 11.911 -10.187 1.00 0.00 O ATOM 478 CB LEU A 32 4.654 13.460 -10.717 1.00 0.00 C ATOM 479 CG LEU A 32 3.282 14.020 -10.326 1.00 0.00 C ATOM 480 CD1 LEU A 32 3.005 15.323 -11.078 1.00 0.00 C ATOM 481 CD2 LEU A 32 2.151 13.026 -10.600 1.00 0.00 C ATOM 0 H LEU A 32 4.689 12.431 -8.401 1.00 0.00 H new ATOM 0 HA LEU A 32 4.219 11.345 -10.951 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.413 14.052 -10.206 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.789 13.624 -11.786 1.00 0.00 H new ATOM 0 HG LEU A 32 3.311 14.209 -9.253 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.027 15.709 -10.790 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.772 16.057 -10.829 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.018 15.134 -12.151 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.199 13.468 -10.307 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.127 12.786 -11.663 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.320 12.115 -10.026 1.00 0.00 H new ATOM 493 N HIS A 33 6.475 11.346 -12.209 1.00 0.00 N ATOM 494 CA HIS A 33 7.718 11.136 -12.928 1.00 0.00 C ATOM 495 C HIS A 33 7.590 11.757 -14.317 1.00 0.00 C ATOM 496 O HIS A 33 6.783 11.308 -15.134 1.00 0.00 O ATOM 497 CB HIS A 33 8.016 9.635 -13.010 1.00 0.00 C ATOM 498 CG HIS A 33 8.303 9.057 -11.653 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.451 9.312 -10.900 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.424 8.326 -10.909 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.236 8.723 -9.714 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.032 8.119 -9.694 1.00 0.00 N ATOM 0 H HIS A 33 5.656 11.200 -12.799 1.00 0.00 H new ATOM 0 HA HIS A 33 8.548 11.613 -12.407 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.166 9.118 -13.455 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.870 9.468 -13.666 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.447 7.980 -11.213 1.00 0.00 H new ATOM 0 HE1 HIS A 33 9.932 8.732 -8.889 1.00 0.00 H new ATOM 0 HE2 HIS A 33 7.639 7.597 -8.911 1.00 0.00 H new ATOM 510 N ASN A 34 8.395 12.788 -14.580 1.00 0.00 N ATOM 511 CA ASN A 34 8.494 13.467 -15.872 1.00 0.00 C ATOM 512 C ASN A 34 9.411 12.615 -16.745 1.00 0.00 C ATOM 513 O ASN A 34 10.622 12.741 -16.612 1.00 0.00 O ATOM 514 CB ASN A 34 9.106 14.874 -15.659 1.00 0.00 C ATOM 515 CG ASN A 34 8.087 15.978 -15.395 1.00 0.00 C ATOM 516 OD1 ASN A 34 7.963 16.457 -14.272 1.00 0.00 O ATOM 517 ND2 ASN A 34 7.379 16.431 -16.424 1.00 0.00 N ATOM 0 H ASN A 34 9.016 13.186 -13.876 1.00 0.00 H new ATOM 0 HA ASN A 34 7.519 13.587 -16.343 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.800 14.830 -14.820 1.00 0.00 H new ATOM 0 HB3 ASN A 34 9.689 15.139 -16.541 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.715 17.193 -16.290 1.00 0.00 H new ATOM 0 HD22 ASN A 34 7.500 16.016 -17.348 1.00 0.00 H new ATOM 524 N LEU A 35 8.907 11.791 -17.667 1.00 0.00 N ATOM 525 CA LEU A 35 9.780 10.961 -18.519 1.00 0.00 C ATOM 526 C LEU A 35 10.646 11.794 -19.476 1.00 0.00 C ATOM 527 O LEU A 35 11.696 11.340 -19.928 1.00 0.00 O ATOM 528 CB LEU A 35 8.945 9.934 -19.299 1.00 0.00 C ATOM 529 CG LEU A 35 8.415 8.809 -18.398 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.399 7.979 -19.182 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.555 7.909 -17.894 1.00 0.00 C ATOM 0 H LEU A 35 7.909 11.677 -17.846 1.00 0.00 H new ATOM 0 HA LEU A 35 10.467 10.437 -17.854 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.106 10.439 -19.777 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.553 9.503 -20.094 1.00 0.00 H new ATOM 0 HG LEU A 35 7.938 9.256 -17.526 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.018 7.178 -18.549 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.573 8.617 -19.497 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.880 7.549 -20.060 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.145 7.123 -17.259 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.066 7.458 -18.745 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.263 8.506 -17.320 1.00 0.00 H new ATOM 543 N LYS A 36 10.233 13.035 -19.763 1.00 0.00 N ATOM 544 CA LYS A 36 11.066 14.022 -20.453 1.00 0.00 C ATOM 545 C LYS A 36 12.353 14.346 -19.681 1.00 0.00 C ATOM 546 O LYS A 36 13.348 14.722 -20.303 1.00 0.00 O ATOM 547 CB LYS A 36 10.272 15.312 -20.754 1.00 0.00 C ATOM 548 CG LYS A 36 9.336 15.783 -19.625 1.00 0.00 C ATOM 549 CD LYS A 36 9.176 17.307 -19.546 1.00 0.00 C ATOM 550 CE LYS A 36 10.194 17.900 -18.555 1.00 0.00 C ATOM 551 NZ LYS A 36 10.125 19.386 -18.498 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.305 13.382 -19.520 1.00 0.00 H new ATOM 0 HA LYS A 36 11.363 13.570 -21.399 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.979 16.112 -20.976 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.678 15.153 -21.654 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.354 15.331 -19.768 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.719 15.418 -18.672 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.321 17.746 -20.533 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.163 17.557 -19.231 1.00 0.00 H new ATOM 0 HE2 LYS A 36 10.011 17.491 -17.561 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.200 17.596 -18.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.828 19.740 -17.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.325 19.779 -19.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.174 19.678 -18.196 1.00 0.00 H new ATOM 565 N ASP A 37 12.330 14.234 -18.352 1.00 0.00 N ATOM 566 CA ASP A 37 13.438 14.611 -17.472 1.00 0.00 C ATOM 567 C ASP A 37 14.126 13.404 -16.825 1.00 0.00 C ATOM 568 O ASP A 37 15.338 13.448 -16.597 1.00 0.00 O ATOM 569 CB ASP A 37 12.909 15.532 -16.373 1.00 0.00 C ATOM 570 CG ASP A 37 14.047 16.011 -15.455 1.00 0.00 C ATOM 571 OD1 ASP A 37 14.886 16.824 -15.914 1.00 0.00 O ATOM 572 OD2 ASP A 37 14.077 15.625 -14.263 1.00 0.00 O1- ATOM 0 H ASP A 37 11.522 13.871 -17.846 1.00 0.00 H new ATOM 0 HA ASP A 37 14.183 15.115 -18.088 1.00 0.00 H new ATOM 0 HB2 ASP A 37 12.414 16.393 -16.823 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.159 15.005 -15.783 1.00 0.00 H new ATOM 577 N ASP A 38 13.382 12.327 -16.538 1.00 0.00 N ATOM 578 CA ASP A 38 13.834 11.198 -15.734 1.00 0.00 C ATOM 579 C ASP A 38 13.615 9.869 -16.461 1.00 0.00 C ATOM 580 O ASP A 38 12.923 9.797 -17.479 1.00 0.00 O ATOM 581 CB ASP A 38 13.164 11.201 -14.345 1.00 0.00 C ATOM 582 CG ASP A 38 14.150 10.773 -13.235 1.00 0.00 C ATOM 583 OD1 ASP A 38 14.924 9.804 -13.424 1.00 0.00 O ATOM 584 OD2 ASP A 38 14.166 11.425 -12.164 1.00 0.00 O1- ATOM 0 H ASP A 38 12.424 12.220 -16.871 1.00 0.00 H new ATOM 0 HA ASP A 38 14.908 11.309 -15.582 1.00 0.00 H new ATOM 0 HB2 ASP A 38 12.781 12.198 -14.127 1.00 0.00 H new ATOM 0 HB3 ASP A 38 12.308 10.526 -14.352 1.00 0.00 H new ATOM 589 N SER A 39 14.215 8.808 -15.939 1.00 0.00 N ATOM 590 CA SER A 39 14.302 7.497 -16.550 1.00 0.00 C ATOM 591 C SER A 39 13.148 6.638 -16.051 1.00 0.00 C ATOM 592 O SER A 39 12.802 6.733 -14.880 1.00 0.00 O ATOM 593 CB SER A 39 15.648 6.855 -16.174 1.00 0.00 C ATOM 594 OG SER A 39 16.736 7.712 -16.509 1.00 0.00 O ATOM 0 H SER A 39 14.677 8.845 -15.030 1.00 0.00 H new ATOM 0 HA SER A 39 14.239 7.581 -17.635 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.666 6.640 -15.106 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.758 5.903 -16.693 1.00 0.00 H new ATOM 0 HG SER A 39 17.580 7.282 -16.259 1.00 0.00 H new ATOM 600 N PRO A 40 12.599 5.710 -16.849 1.00 0.00 N ATOM 601 CA PRO A 40 11.577 4.801 -16.366 1.00 0.00 C ATOM 602 C PRO A 40 12.188 3.696 -15.492 1.00 0.00 C ATOM 603 O PRO A 40 11.438 2.911 -14.952 1.00 0.00 O ATOM 604 CB PRO A 40 10.900 4.302 -17.644 1.00 0.00 C ATOM 605 CG PRO A 40 12.082 4.170 -18.594 1.00 0.00 C ATOM 606 CD PRO A 40 12.895 5.422 -18.244 1.00 0.00 C ATOM 0 HA PRO A 40 10.847 5.265 -15.703 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.390 3.351 -17.492 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.155 5.007 -18.014 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.646 3.253 -18.422 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.770 4.162 -19.638 1.00 0.00 H new ATOM 0 HD2 PRO A 40 13.961 5.249 -18.390 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.618 6.260 -18.884 1.00 0.00 H new ATOM 614 N LYS A 41 13.503 3.609 -15.264 1.00 0.00 N ATOM 615 CA LYS A 41 14.094 2.575 -14.398 1.00 0.00 C ATOM 616 C LYS A 41 13.486 2.590 -12.995 1.00 0.00 C ATOM 617 O LYS A 41 13.257 1.545 -12.399 1.00 0.00 O ATOM 618 CB LYS A 41 15.617 2.776 -14.318 1.00 0.00 C ATOM 619 CG LYS A 41 16.370 2.433 -15.619 1.00 0.00 C ATOM 620 CD LYS A 41 16.783 0.955 -15.714 1.00 0.00 C ATOM 621 CE LYS A 41 17.753 0.773 -16.895 1.00 0.00 C ATOM 622 NZ LYS A 41 18.265 -0.620 -17.010 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.187 4.248 -15.670 1.00 0.00 H new ATOM 0 HA LYS A 41 13.873 1.603 -14.838 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.822 3.814 -14.056 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.011 2.160 -13.510 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.738 2.682 -16.472 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.261 3.057 -15.690 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.258 0.638 -14.786 1.00 0.00 H new ATOM 0 HD3 LYS A 41 15.902 0.328 -15.852 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.247 1.047 -17.821 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.594 1.456 -16.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.198 -0.610 -17.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.351 -1.038 -16.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.604 -1.187 -17.579 1.00 0.00 H new ATOM 636 N LEU A 42 13.118 3.767 -12.493 1.00 0.00 N ATOM 637 CA LEU A 42 12.475 3.904 -11.186 1.00 0.00 C ATOM 638 C LEU A 42 11.076 3.278 -11.126 1.00 0.00 C ATOM 639 O LEU A 42 10.612 2.911 -10.051 1.00 0.00 O ATOM 640 CB LEU A 42 12.512 5.356 -10.683 1.00 0.00 C ATOM 641 CG LEU A 42 12.615 6.520 -11.675 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.278 6.697 -12.375 1.00 0.00 C ATOM 643 CD2 LEU A 42 12.996 7.825 -10.980 1.00 0.00 C ATOM 0 H LEU A 42 13.257 4.653 -12.980 1.00 0.00 H new ATOM 0 HA LEU A 42 13.070 3.316 -10.487 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.610 5.515 -10.093 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.358 5.439 -10.001 1.00 0.00 H new ATOM 0 HG LEU A 42 13.398 6.282 -12.395 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.344 7.524 -13.082 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.023 5.782 -12.909 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.506 6.913 -11.636 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.059 8.625 -11.718 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.240 8.075 -10.236 1.00 0.00 H new ATOM 0 HD23 LEU A 42 13.962 7.707 -10.489 1.00 0.00 H new ATOM 655 N MET A 43 10.441 3.063 -12.273 1.00 0.00 N ATOM 656 CA MET A 43 9.202 2.285 -12.468 1.00 0.00 C ATOM 657 C MET A 43 9.366 0.831 -11.997 1.00 0.00 C ATOM 658 O MET A 43 8.375 0.139 -11.802 1.00 0.00 O ATOM 659 CB MET A 43 8.858 2.355 -13.971 1.00 0.00 C ATOM 660 CG MET A 43 7.505 1.958 -14.521 1.00 0.00 C ATOM 661 SD MET A 43 7.435 1.957 -16.335 1.00 0.00 S ATOM 662 CE MET A 43 7.477 3.742 -16.656 1.00 0.00 C ATOM 0 H MET A 43 10.791 3.447 -13.151 1.00 0.00 H new ATOM 0 HA MET A 43 8.393 2.703 -11.869 1.00 0.00 H new ATOM 0 HB2 MET A 43 9.029 3.386 -14.281 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.596 1.741 -14.487 1.00 0.00 H new ATOM 0 HG2 MET A 43 7.250 0.964 -14.155 1.00 0.00 H new ATOM 0 HG3 MET A 43 6.750 2.643 -14.136 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.548 3.917 -17.729 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.566 4.202 -16.273 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.342 4.181 -16.158 1.00 0.00 H new ATOM 672 N GLU A 44 10.598 0.350 -11.798 1.00 0.00 N ATOM 673 CA GLU A 44 10.862 -0.986 -11.277 1.00 0.00 C ATOM 674 C GLU A 44 10.615 -1.038 -9.765 1.00 0.00 C ATOM 675 O GLU A 44 10.249 -2.095 -9.256 1.00 0.00 O ATOM 676 CB GLU A 44 12.297 -1.423 -11.621 1.00 0.00 C ATOM 677 CG GLU A 44 12.524 -1.513 -13.137 1.00 0.00 C ATOM 678 CD GLU A 44 13.939 -2.010 -13.482 1.00 0.00 C ATOM 679 OE1 GLU A 44 14.947 -1.366 -13.104 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 14.038 -3.057 -14.162 1.00 0.00 O ATOM 0 H GLU A 44 11.443 0.885 -11.997 1.00 0.00 H new ATOM 0 HA GLU A 44 10.173 -1.685 -11.751 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.005 -0.715 -11.190 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.499 -2.393 -11.166 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.787 -2.187 -13.574 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.365 -0.532 -13.586 1.00 0.00 H new ATOM 687 N GLN A 45 10.766 0.083 -9.045 1.00 0.00 N ATOM 688 CA GLN A 45 10.666 0.114 -7.584 1.00 0.00 C ATOM 689 C GLN A 45 9.203 0.028 -7.166 1.00 0.00 C ATOM 690 O GLN A 45 8.820 -0.787 -6.327 1.00 0.00 O ATOM 691 CB GLN A 45 11.261 1.397 -6.972 1.00 0.00 C ATOM 692 CG GLN A 45 12.559 1.930 -7.595 1.00 0.00 C ATOM 693 CD GLN A 45 12.721 3.414 -7.267 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.628 3.830 -6.549 1.00 0.00 O ATOM 695 NE2 GLN A 45 11.816 4.231 -7.791 1.00 0.00 N ATOM 0 H GLN A 45 10.961 0.993 -9.462 1.00 0.00 H new ATOM 0 HA GLN A 45 11.237 -0.738 -7.216 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.508 2.183 -7.034 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.444 1.214 -5.913 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.413 1.369 -7.215 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.540 1.787 -8.675 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.074 3.858 -8.383 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.862 5.232 -7.601 1.00 0.00 H new ATOM 704 N TYR A 46 8.397 0.912 -7.762 1.00 0.00 N ATOM 705 CA TYR A 46 7.002 1.103 -7.415 1.00 0.00 C ATOM 706 C TYR A 46 6.273 -0.143 -7.867 1.00 0.00 C ATOM 707 O TYR A 46 6.495 -0.620 -8.979 1.00 0.00 O ATOM 708 CB TYR A 46 6.428 2.357 -8.090 1.00 0.00 C ATOM 709 CG TYR A 46 7.203 3.628 -7.823 1.00 0.00 C ATOM 710 CD1 TYR A 46 7.114 4.283 -6.580 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.047 4.141 -8.826 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.916 5.407 -6.316 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.834 5.274 -8.575 1.00 0.00 C ATOM 714 CZ TYR A 46 8.798 5.895 -7.305 1.00 0.00 C ATOM 715 OH TYR A 46 9.608 6.962 -7.057 1.00 0.00 O ATOM 0 H TYR A 46 8.712 1.524 -8.515 1.00 0.00 H new ATOM 0 HA TYR A 46 6.885 1.255 -6.342 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.391 2.189 -9.166 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.401 2.496 -7.754 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.428 3.921 -5.828 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.089 3.660 -9.792 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.858 5.898 -5.356 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.469 5.673 -9.353 1.00 0.00 H new ATOM 0 HH TYR A 46 10.300 7.015 -7.749 1.00 0.00 H new ATOM 725 N ASP A 47 5.426 -0.705 -7.018 1.00 0.00 N ATOM 726 CA ASP A 47 4.777 -1.975 -7.354 1.00 0.00 C ATOM 727 C ASP A 47 3.491 -1.773 -8.149 1.00 0.00 C ATOM 728 O ASP A 47 2.934 -2.717 -8.706 1.00 0.00 O ATOM 729 CB ASP A 47 4.578 -2.833 -6.107 1.00 0.00 C ATOM 730 CG ASP A 47 4.473 -4.314 -6.508 1.00 0.00 C ATOM 731 OD1 ASP A 47 5.390 -4.816 -7.204 1.00 0.00 O ATOM 732 OD2 ASP A 47 3.509 -4.982 -6.069 1.00 0.00 O1- ATOM 0 H ASP A 47 5.172 -0.317 -6.109 1.00 0.00 H new ATOM 0 HA ASP A 47 5.446 -2.526 -8.016 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.412 -2.691 -5.419 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.675 -2.524 -5.581 1.00 0.00 H new ATOM 737 N VAL A 48 3.034 -0.523 -8.240 1.00 0.00 N ATOM 738 CA VAL A 48 1.857 -0.134 -8.987 1.00 0.00 C ATOM 739 C VAL A 48 2.247 1.099 -9.781 1.00 0.00 C ATOM 740 O VAL A 48 3.023 1.921 -9.292 1.00 0.00 O ATOM 741 CB VAL A 48 0.726 0.135 -7.996 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.479 0.695 -8.736 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.349 -1.126 -7.218 1.00 0.00 C ATOM 0 H VAL A 48 3.493 0.263 -7.779 1.00 0.00 H new ATOM 0 HA VAL A 48 1.504 -0.904 -9.673 1.00 0.00 H new ATOM 0 HB VAL A 48 1.072 0.869 -7.269 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.285 0.886 -8.027 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.202 1.626 -9.230 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.815 -0.025 -9.482 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.459 -0.897 -6.523 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.021 -1.898 -7.914 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.216 -1.483 -6.662 1.00 0.00 H new ATOM 753 N LEU A 49 1.734 1.243 -10.999 1.00 0.00 N ATOM 754 CA LEU A 49 2.127 2.314 -11.882 1.00 0.00 C ATOM 755 C LEU A 49 0.913 2.834 -12.613 1.00 0.00 C ATOM 756 O LEU A 49 0.005 2.070 -12.929 1.00 0.00 O ATOM 757 CB LEU A 49 3.177 1.833 -12.903 1.00 0.00 C ATOM 758 CG LEU A 49 4.328 0.962 -12.367 1.00 0.00 C ATOM 759 CD1 LEU A 49 4.957 0.172 -13.512 1.00 0.00 C ATOM 760 CD2 LEU A 49 5.396 1.805 -11.665 1.00 0.00 C ATOM 0 H LEU A 49 1.034 0.615 -11.394 1.00 0.00 H new ATOM 0 HA LEU A 49 2.570 3.110 -11.283 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.660 1.270 -13.680 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.611 2.711 -13.381 1.00 0.00 H new ATOM 0 HG LEU A 49 3.912 0.273 -11.632 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.771 -0.442 -13.126 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.203 -0.469 -13.969 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.347 0.863 -14.260 1.00 0.00 H new ATOM 0 HD21 LEU A 49 6.191 1.155 -11.301 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.811 2.526 -12.369 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.947 2.335 -10.825 1.00 0.00 H new ATOM 772 N ILE A 50 0.915 4.118 -12.943 1.00 0.00 N ATOM 773 CA ILE A 50 -0.077 4.706 -13.830 1.00 0.00 C ATOM 774 C ILE A 50 0.733 5.428 -14.889 1.00 0.00 C ATOM 775 O ILE A 50 1.568 6.252 -14.537 1.00 0.00 O ATOM 776 CB ILE A 50 -1.040 5.599 -13.037 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.819 4.767 -11.996 1.00 0.00 C ATOM 778 CG2 ILE A 50 -2.044 6.306 -13.954 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.363 5.162 -10.601 1.00 0.00 C ATOM 0 H ILE A 50 1.608 4.783 -12.601 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.732 3.977 -14.307 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.433 6.352 -12.534 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.890 4.938 -12.104 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.648 3.703 -12.160 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.708 6.929 -13.355 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.507 6.931 -14.668 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.631 5.562 -14.492 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.909 4.578 -9.861 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.295 4.969 -10.499 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.557 6.223 -10.442 1.00 0.00 H new ATOM 791 N LEU A 51 0.558 5.081 -16.156 1.00 0.00 N ATOM 792 CA LEU A 51 1.329 5.628 -17.268 1.00 0.00 C ATOM 793 C LEU A 51 0.352 6.310 -18.205 1.00 0.00 C ATOM 794 O LEU A 51 -0.762 5.814 -18.372 1.00 0.00 O ATOM 795 CB LEU A 51 2.072 4.507 -18.018 1.00 0.00 C ATOM 796 CG LEU A 51 3.428 4.080 -17.437 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.342 3.630 -15.980 1.00 0.00 C ATOM 798 CD2 LEU A 51 3.941 2.897 -18.253 1.00 0.00 C ATOM 0 H LEU A 51 -0.139 4.396 -16.448 1.00 0.00 H new ATOM 0 HA LEU A 51 2.074 6.332 -16.898 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.424 3.631 -18.053 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.228 4.829 -19.048 1.00 0.00 H new ATOM 0 HG LEU A 51 4.088 4.946 -17.482 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.333 3.342 -15.629 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.965 4.449 -15.368 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.667 2.778 -15.902 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.905 2.574 -17.860 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.229 2.074 -18.188 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.056 3.196 -19.295 1.00 0.00 H new ATOM 810 N GLY A 52 0.767 7.387 -18.868 1.00 0.00 N ATOM 811 CA GLY A 52 -0.089 7.980 -19.880 1.00 0.00 C ATOM 812 C GLY A 52 0.624 8.710 -20.994 1.00 0.00 C ATOM 813 O GLY A 52 1.694 9.280 -20.790 1.00 0.00 O ATOM 0 H GLY A 52 1.664 7.852 -18.726 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.701 7.192 -20.320 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.770 8.677 -19.391 1.00 0.00 H new ATOM 817 N ILE A 53 0.017 8.657 -22.182 1.00 0.00 N ATOM 818 CA ILE A 53 0.552 9.117 -23.462 1.00 0.00 C ATOM 819 C ILE A 53 -0.526 9.900 -24.218 1.00 0.00 C ATOM 820 O ILE A 53 -1.669 9.448 -24.281 1.00 0.00 O ATOM 821 CB ILE A 53 1.037 7.961 -24.383 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.047 6.806 -24.626 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.382 7.363 -23.964 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.316 5.966 -23.403 1.00 0.00 C ATOM 0 H ILE A 53 -0.920 8.267 -22.280 1.00 0.00 H new ATOM 0 HA ILE A 53 1.415 9.739 -23.223 1.00 0.00 H new ATOM 0 HB ILE A 53 1.138 8.492 -25.329 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.871 7.222 -25.042 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.469 6.145 -25.383 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.655 6.563 -24.652 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.148 8.138 -23.987 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.303 6.961 -22.954 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.018 5.185 -23.694 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.586 5.510 -22.994 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.775 6.603 -22.647 1.00 0.00 H new ATOM 836 N PRO A 54 -0.202 11.047 -24.821 1.00 0.00 N ATOM 837 CA PRO A 54 -1.075 11.673 -25.802 1.00 0.00 C ATOM 838 C PRO A 54 -0.736 11.061 -27.176 1.00 0.00 C ATOM 839 O PRO A 54 0.433 10.772 -27.445 1.00 0.00 O ATOM 840 CB PRO A 54 -0.754 13.160 -25.703 1.00 0.00 C ATOM 841 CG PRO A 54 0.734 13.175 -25.335 1.00 0.00 C ATOM 842 CD PRO A 54 0.959 11.883 -24.549 1.00 0.00 C ATOM 0 HA PRO A 54 -2.143 11.519 -25.645 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.941 13.676 -26.645 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -1.361 13.653 -24.944 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.361 13.209 -26.226 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.984 14.050 -24.736 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.879 11.389 -24.863 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.054 12.086 -23.482 1.00 0.00 H new ATOM 850 N THR A 55 -1.722 10.857 -28.053 1.00 0.00 N ATOM 851 CA THR A 55 -1.443 10.365 -29.401 1.00 0.00 C ATOM 852 C THR A 55 -1.185 11.573 -30.303 1.00 0.00 C ATOM 853 O THR A 55 -2.089 12.384 -30.499 1.00 0.00 O ATOM 854 CB THR A 55 -2.588 9.486 -29.901 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.800 8.416 -28.990 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.216 8.862 -31.239 1.00 0.00 C ATOM 0 H THR A 55 -2.709 11.023 -27.856 1.00 0.00 H new ATOM 0 HA THR A 55 -0.556 9.732 -29.407 1.00 0.00 H new ATOM 0 HB THR A 55 -3.480 10.106 -29.995 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.322 8.736 -28.225 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.037 8.237 -31.590 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.024 9.650 -31.967 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.321 8.252 -31.120 1.00 0.00 H new ATOM 864 N TRP A 56 0.013 11.699 -30.865 1.00 0.00 N ATOM 865 CA TRP A 56 0.371 12.732 -31.816 1.00 0.00 C ATOM 866 C TRP A 56 0.294 12.194 -33.250 1.00 0.00 C ATOM 867 O TRP A 56 0.131 10.995 -33.455 1.00 0.00 O ATOM 868 CB TRP A 56 1.765 13.283 -31.474 1.00 0.00 C ATOM 869 CG TRP A 56 1.811 14.326 -30.394 1.00 0.00 C ATOM 870 CD1 TRP A 56 2.195 14.129 -29.113 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.481 15.749 -30.491 1.00 0.00 C ATOM 872 NE1 TRP A 56 2.199 15.335 -28.435 1.00 0.00 N ATOM 873 CE2 TRP A 56 1.698 16.351 -29.219 1.00 0.00 C ATOM 874 CE3 TRP A 56 1.004 16.593 -31.519 1.00 0.00 C ATOM 875 CZ2 TRP A 56 1.413 17.701 -28.969 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.745 17.957 -31.285 1.00 0.00 C ATOM 877 CH2 TRP A 56 0.931 18.511 -30.005 1.00 0.00 C ATOM 0 H TRP A 56 0.783 11.061 -30.661 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.340 13.555 -31.750 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.401 12.450 -31.175 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.200 13.706 -32.380 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.459 13.174 -28.683 1.00 0.00 H new ATOM 0 HE1 TRP A 56 2.530 15.456 -27.478 1.00 0.00 H new ATOM 0 HE3 TRP A 56 0.835 16.184 -32.504 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 1.564 18.114 -27.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 0.401 18.583 -32.095 1.00 0.00 H new ATOM 0 HH2 TRP A 56 0.704 19.551 -29.823 1.00 0.00 H new ATOM 888 N ASP A 57 0.399 13.111 -34.219 1.00 0.00 N ATOM 889 CA ASP A 57 0.605 12.912 -35.657 1.00 0.00 C ATOM 890 C ASP A 57 0.184 11.539 -36.202 1.00 0.00 C ATOM 891 O ASP A 57 1.014 10.760 -36.679 1.00 0.00 O ATOM 892 CB ASP A 57 2.054 13.273 -36.019 1.00 0.00 C ATOM 893 CG ASP A 57 2.293 13.261 -37.542 1.00 0.00 C ATOM 894 OD1 ASP A 57 1.422 13.744 -38.308 1.00 0.00 O1- ATOM 895 OD2 ASP A 57 3.396 12.851 -37.979 1.00 0.00 O ATOM 0 H ASP A 57 0.336 14.104 -33.994 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.081 13.591 -36.164 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.290 14.261 -35.623 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.733 12.567 -35.541 1.00 0.00 H new ATOM 900 N PHE A 58 -1.123 11.253 -36.143 1.00 0.00 N ATOM 901 CA PHE A 58 -1.729 10.024 -36.659 1.00 0.00 C ATOM 902 C PHE A 58 -1.086 8.764 -36.055 1.00 0.00 C ATOM 903 O PHE A 58 -0.395 7.999 -36.742 1.00 0.00 O ATOM 904 CB PHE A 58 -1.740 10.025 -38.198 1.00 0.00 C ATOM 905 CG PHE A 58 -2.419 11.227 -38.823 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.780 11.464 -38.567 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.705 12.100 -39.666 1.00 0.00 C ATOM 908 CE1 PHE A 58 -4.436 12.554 -39.166 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.354 13.200 -40.255 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.720 13.425 -40.010 1.00 0.00 C ATOM 0 H PHE A 58 -1.803 11.887 -35.724 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.770 9.998 -36.337 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.711 9.978 -38.556 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.239 9.121 -38.545 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.325 10.806 -37.907 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.657 11.925 -39.861 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.486 12.723 -38.979 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.803 13.872 -40.896 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.220 14.265 -40.469 1.00 0.00 H new ATOM 920 N GLY A 59 -1.346 8.516 -34.766 1.00 0.00 N ATOM 921 CA GLY A 59 -0.882 7.310 -34.097 1.00 0.00 C ATOM 922 C GLY A 59 0.611 7.276 -33.763 1.00 0.00 C ATOM 923 O GLY A 59 1.154 6.208 -33.474 1.00 0.00 O ATOM 0 H GLY A 59 -1.881 9.145 -34.167 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.446 7.188 -33.172 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.115 6.452 -34.728 1.00 0.00 H new ATOM 927 N GLU A 60 1.271 8.427 -33.773 1.00 0.00 N ATOM 928 CA GLU A 60 2.611 8.600 -33.267 1.00 0.00 C ATOM 929 C GLU A 60 2.566 8.776 -31.748 1.00 0.00 C ATOM 930 O GLU A 60 1.594 9.274 -31.169 1.00 0.00 O ATOM 931 CB GLU A 60 3.338 9.768 -33.956 1.00 0.00 C ATOM 932 CG GLU A 60 3.706 9.465 -35.416 1.00 0.00 C ATOM 933 CD GLU A 60 4.940 8.550 -35.529 1.00 0.00 C ATOM 934 OE1 GLU A 60 4.810 7.311 -35.377 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 6.054 9.065 -35.799 1.00 0.00 O ATOM 0 H GLU A 60 0.869 9.287 -34.146 1.00 0.00 H new ATOM 0 HA GLU A 60 3.188 7.704 -33.498 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.704 10.654 -33.923 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.245 10.004 -33.399 1.00 0.00 H new ATOM 0 HG2 GLU A 60 2.858 8.991 -35.911 1.00 0.00 H new ATOM 0 HG3 GLU A 60 3.900 10.400 -35.941 1.00 0.00 H new ATOM 942 N ILE A 61 3.649 8.359 -31.103 1.00 0.00 N ATOM 943 CA ILE A 61 3.869 8.535 -29.678 1.00 0.00 C ATOM 944 C ILE A 61 4.481 9.933 -29.491 1.00 0.00 C ATOM 945 O ILE A 61 5.150 10.462 -30.385 1.00 0.00 O ATOM 946 CB ILE A 61 4.782 7.401 -29.159 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.201 5.992 -29.417 1.00 0.00 C ATOM 948 CG2 ILE A 61 5.068 7.521 -27.654 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.318 4.947 -29.481 1.00 0.00 C ATOM 0 H ILE A 61 4.416 7.877 -31.571 1.00 0.00 H new ATOM 0 HA ILE A 61 2.946 8.475 -29.101 1.00 0.00 H new ATOM 0 HB ILE A 61 5.707 7.519 -29.724 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.499 5.732 -28.625 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.641 5.990 -30.352 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.713 6.701 -27.340 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.564 8.471 -27.452 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.130 7.477 -27.101 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.886 3.963 -29.663 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.005 5.197 -30.290 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.860 4.936 -28.535 1.00 0.00 H new ATOM 961 N GLN A 62 4.259 10.522 -28.315 1.00 0.00 N ATOM 962 CA GLN A 62 4.912 11.745 -27.896 1.00 0.00 C ATOM 963 C GLN A 62 6.425 11.503 -27.842 1.00 0.00 C ATOM 964 O GLN A 62 6.900 10.455 -27.406 1.00 0.00 O ATOM 965 CB GLN A 62 4.286 12.191 -26.570 1.00 0.00 C ATOM 966 CG GLN A 62 4.580 13.643 -26.164 1.00 0.00 C ATOM 967 CD GLN A 62 5.935 13.819 -25.486 1.00 0.00 C ATOM 968 OE1 GLN A 62 6.490 12.860 -24.969 1.00 0.00 O ATOM 969 NE2 GLN A 62 6.496 15.011 -25.504 1.00 0.00 N ATOM 0 H GLN A 62 3.609 10.150 -27.622 1.00 0.00 H new ATOM 0 HA GLN A 62 4.765 12.564 -28.600 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.206 12.060 -26.634 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.641 11.530 -25.779 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.541 14.276 -27.051 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.797 13.990 -25.490 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.013 15.796 -25.942 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.414 15.149 -25.080 1.00 0.00 H new ATOM 978 N GLU A 63 7.183 12.502 -28.266 1.00 0.00 N ATOM 979 CA GLU A 63 8.611 12.349 -28.559 1.00 0.00 C ATOM 980 C GLU A 63 9.470 12.025 -27.329 1.00 0.00 C ATOM 981 O GLU A 63 10.511 11.380 -27.457 1.00 0.00 O ATOM 982 CB GLU A 63 9.144 13.580 -29.313 1.00 0.00 C ATOM 983 CG GLU A 63 9.177 14.860 -28.467 1.00 0.00 C ATOM 984 CD GLU A 63 9.684 16.056 -29.296 1.00 0.00 C ATOM 985 OE1 GLU A 63 10.916 16.300 -29.330 1.00 0.00 O ATOM 986 OE2 GLU A 63 8.859 16.764 -29.924 1.00 0.00 O1- ATOM 0 H GLU A 63 6.830 13.447 -28.419 1.00 0.00 H new ATOM 0 HA GLU A 63 8.697 11.475 -29.204 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.151 13.367 -29.671 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.523 13.753 -30.192 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.179 15.074 -28.086 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.824 14.712 -27.602 1.00 0.00 H new ATOM 993 N ASP A 64 9.041 12.443 -26.140 1.00 0.00 N ATOM 994 CA ASP A 64 9.752 12.168 -24.895 1.00 0.00 C ATOM 995 C ASP A 64 9.411 10.768 -24.385 1.00 0.00 C ATOM 996 O ASP A 64 10.213 10.158 -23.677 1.00 0.00 O ATOM 997 CB ASP A 64 9.462 13.232 -23.829 1.00 0.00 C ATOM 998 CG ASP A 64 9.965 14.618 -24.252 1.00 0.00 C ATOM 999 OD1 ASP A 64 11.202 14.833 -24.270 1.00 0.00 O1- ATOM 1000 OD2 ASP A 64 9.118 15.493 -24.554 1.00 0.00 O ATOM 0 H ASP A 64 8.186 12.985 -26.013 1.00 0.00 H new ATOM 0 HA ASP A 64 10.821 12.208 -25.104 1.00 0.00 H new ATOM 0 HB2 ASP A 64 8.389 13.276 -23.643 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.936 12.944 -22.891 1.00 0.00 H new ATOM 1005 N TRP A 65 8.255 10.222 -24.781 1.00 0.00 N ATOM 1006 CA TRP A 65 7.923 8.835 -24.541 1.00 0.00 C ATOM 1007 C TRP A 65 8.728 7.925 -25.459 1.00 0.00 C ATOM 1008 O TRP A 65 9.287 6.940 -24.981 1.00 0.00 O ATOM 1009 CB TRP A 65 6.418 8.597 -24.672 1.00 0.00 C ATOM 1010 CG TRP A 65 5.698 8.524 -23.373 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.828 9.436 -22.893 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.735 7.443 -22.399 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.250 8.937 -21.742 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.783 7.725 -21.381 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.468 6.244 -22.281 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.546 6.859 -20.308 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.269 5.386 -21.185 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.317 5.692 -20.204 1.00 0.00 C ATOM 0 H TRP A 65 7.530 10.741 -25.277 1.00 0.00 H new ATOM 0 HA TRP A 65 8.194 8.588 -23.515 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.985 9.399 -25.270 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.254 7.668 -25.218 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.618 10.398 -23.336 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.513 9.413 -21.221 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.190 5.982 -23.040 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.785 7.084 -19.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.855 4.483 -21.099 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.176 5.027 -19.365 1.00 0.00 H new ATOM 1029 N GLU A 66 8.848 8.268 -26.744 1.00 0.00 N ATOM 1030 CA GLU A 66 9.679 7.530 -27.701 1.00 0.00 C ATOM 1031 C GLU A 66 11.116 7.379 -27.183 1.00 0.00 C ATOM 1032 O GLU A 66 11.750 6.344 -27.401 1.00 0.00 O ATOM 1033 CB GLU A 66 9.716 8.232 -29.069 1.00 0.00 C ATOM 1034 CG GLU A 66 8.370 8.222 -29.797 1.00 0.00 C ATOM 1035 CD GLU A 66 8.518 8.726 -31.244 1.00 0.00 C ATOM 1036 OE1 GLU A 66 8.845 9.920 -31.457 1.00 0.00 O ATOM 1037 OE2 GLU A 66 8.316 7.916 -32.182 1.00 0.00 O1- ATOM 0 H GLU A 66 8.369 9.070 -27.153 1.00 0.00 H new ATOM 0 HA GLU A 66 9.228 6.544 -27.816 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.037 9.264 -28.930 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.463 7.747 -29.697 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.963 7.211 -29.801 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.659 8.850 -29.261 1.00 0.00 H new ATOM 1044 N ALA A 67 11.612 8.387 -26.460 1.00 0.00 N ATOM 1045 CA ALA A 67 12.962 8.416 -25.928 1.00 0.00 C ATOM 1046 C ALA A 67 13.179 7.336 -24.864 1.00 0.00 C ATOM 1047 O ALA A 67 14.294 6.825 -24.743 1.00 0.00 O ATOM 1048 CB ALA A 67 13.268 9.807 -25.361 1.00 0.00 C ATOM 0 H ALA A 67 11.069 9.219 -26.228 1.00 0.00 H new ATOM 0 HA ALA A 67 13.651 8.203 -26.745 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.283 9.823 -24.963 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.177 10.551 -26.153 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.562 10.038 -24.563 1.00 0.00 H new ATOM 1054 N VAL A 68 12.137 6.970 -24.105 1.00 0.00 N ATOM 1055 CA VAL A 68 12.230 5.948 -23.067 1.00 0.00 C ATOM 1056 C VAL A 68 11.588 4.625 -23.477 1.00 0.00 C ATOM 1057 O VAL A 68 11.784 3.632 -22.781 1.00 0.00 O ATOM 1058 CB VAL A 68 11.694 6.487 -21.731 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.407 7.772 -21.291 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.173 6.687 -21.709 1.00 0.00 C ATOM 0 H VAL A 68 11.207 7.378 -24.198 1.00 0.00 H new ATOM 0 HA VAL A 68 13.285 5.715 -22.927 1.00 0.00 H new ATOM 0 HB VAL A 68 11.920 5.702 -21.009 1.00 0.00 H new ATOM 0 HG11 VAL A 68 11.992 8.112 -20.342 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.472 7.574 -21.171 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.264 8.544 -22.047 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.870 7.069 -20.734 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.889 7.400 -22.483 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.678 5.734 -21.895 1.00 0.00 H new ATOM 1070 N TRP A 69 10.869 4.588 -24.599 1.00 0.00 N ATOM 1071 CA TRP A 69 10.151 3.421 -25.116 1.00 0.00 C ATOM 1072 C TRP A 69 11.058 2.199 -25.232 1.00 0.00 C ATOM 1073 O TRP A 69 10.618 1.063 -25.068 1.00 0.00 O ATOM 1074 CB TRP A 69 9.558 3.792 -26.482 1.00 0.00 C ATOM 1075 CG TRP A 69 8.276 3.106 -26.823 1.00 0.00 C ATOM 1076 CD1 TRP A 69 8.119 2.029 -27.625 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.930 3.516 -26.451 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.772 1.727 -27.735 1.00 0.00 N ATOM 1079 CE2 TRP A 69 5.997 2.636 -27.062 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.407 4.581 -25.696 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.616 2.816 -26.963 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 5.019 4.793 -25.606 1.00 0.00 C ATOM 1083 CH2 TRP A 69 4.125 3.938 -26.279 1.00 0.00 C ATOM 0 H TRP A 69 10.766 5.406 -25.199 1.00 0.00 H new ATOM 0 HA TRP A 69 9.358 3.151 -24.419 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.394 4.869 -26.509 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.292 3.562 -27.254 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.920 1.488 -28.106 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.403 0.929 -28.252 1.00 0.00 H new ATOM 0 HE3 TRP A 69 7.081 5.246 -25.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.937 2.103 -27.406 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.638 5.615 -25.018 1.00 0.00 H new ATOM 0 HH2 TRP A 69 3.065 4.145 -26.269 1.00 0.00 H new ATOM 1094 N ASP A 70 12.344 2.458 -25.462 1.00 0.00 N ATOM 1095 CA ASP A 70 13.386 1.445 -25.587 1.00 0.00 C ATOM 1096 C ASP A 70 13.650 0.746 -24.253 1.00 0.00 C ATOM 1097 O ASP A 70 13.718 -0.481 -24.184 1.00 0.00 O ATOM 1098 CB ASP A 70 14.668 2.092 -26.113 1.00 0.00 C ATOM 1099 CG ASP A 70 15.814 1.066 -26.160 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.828 0.219 -27.085 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 16.709 1.122 -25.284 1.00 0.00 O ATOM 0 H ASP A 70 12.699 3.408 -25.570 1.00 0.00 H new ATOM 0 HA ASP A 70 13.046 0.687 -26.292 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.494 2.497 -27.110 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.948 2.929 -25.473 1.00 0.00 H new ATOM 1106 N GLN A 71 13.722 1.534 -23.177 1.00 0.00 N ATOM 1107 CA GLN A 71 13.966 1.054 -21.827 1.00 0.00 C ATOM 1108 C GLN A 71 12.789 0.288 -21.271 1.00 0.00 C ATOM 1109 O GLN A 71 13.020 -0.611 -20.480 1.00 0.00 O ATOM 1110 CB GLN A 71 14.314 2.221 -20.887 1.00 0.00 C ATOM 1111 CG GLN A 71 15.794 2.598 -20.953 1.00 0.00 C ATOM 1112 CD GLN A 71 16.046 3.924 -20.241 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.327 3.963 -19.047 1.00 0.00 O ATOM 1114 NE2 GLN A 71 15.879 5.039 -20.941 1.00 0.00 N ATOM 0 H GLN A 71 13.609 2.546 -23.229 1.00 0.00 H new ATOM 0 HA GLN A 71 14.813 0.371 -21.886 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.708 3.089 -21.149 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.056 1.949 -19.863 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.395 1.813 -20.494 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.109 2.673 -21.994 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.646 4.988 -21.933 1.00 0.00 H new ATOM 0 HE22 GLN A 71 15.984 5.947 -20.487 1.00 0.00 H new ATOM 1123 N LEU A 72 11.553 0.589 -21.671 1.00 0.00 N ATOM 1124 CA LEU A 72 10.368 -0.069 -21.102 1.00 0.00 C ATOM 1125 C LEU A 72 10.435 -1.586 -21.290 1.00 0.00 C ATOM 1126 O LEU A 72 9.951 -2.343 -20.452 1.00 0.00 O ATOM 1127 CB LEU A 72 9.081 0.447 -21.764 1.00 0.00 C ATOM 1128 CG LEU A 72 8.931 1.972 -21.851 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.627 2.322 -22.566 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.034 2.665 -20.491 1.00 0.00 C ATOM 0 H LEU A 72 11.343 1.284 -22.387 1.00 0.00 H new ATOM 0 HA LEU A 72 10.354 0.166 -20.038 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.027 0.039 -22.773 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.229 0.049 -21.213 1.00 0.00 H new ATOM 0 HG LEU A 72 9.770 2.352 -22.433 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.524 3.406 -22.626 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.640 1.903 -23.572 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.785 1.908 -22.011 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.920 3.741 -20.621 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.248 2.294 -19.833 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.008 2.455 -20.048 1.00 0.00 H new ATOM 1142 N ASP A 73 11.074 -2.024 -22.378 1.00 0.00 N ATOM 1143 CA ASP A 73 11.273 -3.440 -22.683 1.00 0.00 C ATOM 1144 C ASP A 73 12.299 -4.075 -21.751 1.00 0.00 C ATOM 1145 O ASP A 73 12.205 -5.266 -21.453 1.00 0.00 O ATOM 1146 CB ASP A 73 11.717 -3.608 -24.139 1.00 0.00 C ATOM 1147 CG ASP A 73 11.925 -5.091 -24.487 1.00 0.00 C ATOM 1148 OD1 ASP A 73 10.921 -5.842 -24.536 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 13.080 -5.501 -24.750 1.00 0.00 O ATOM 0 H ASP A 73 11.471 -1.398 -23.078 1.00 0.00 H new ATOM 0 HA ASP A 73 10.321 -3.949 -22.532 1.00 0.00 H new ATOM 0 HB2 ASP A 73 10.968 -3.177 -24.803 1.00 0.00 H new ATOM 0 HB3 ASP A 73 12.644 -3.059 -24.305 1.00 0.00 H new ATOM 1154 N ASP A 74 13.235 -3.284 -21.221 1.00 0.00 N ATOM 1155 CA ASP A 74 14.302 -3.774 -20.357 1.00 0.00 C ATOM 1156 C ASP A 74 13.812 -3.926 -18.916 1.00 0.00 C ATOM 1157 O ASP A 74 14.374 -4.707 -18.147 1.00 0.00 O ATOM 1158 CB ASP A 74 15.501 -2.820 -20.423 1.00 0.00 C ATOM 1159 CG ASP A 74 16.612 -3.223 -19.440 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.310 -4.235 -19.694 1.00 0.00 O1- ATOM 1161 OD2 ASP A 74 16.822 -2.491 -18.443 1.00 0.00 O ATOM 0 H ASP A 74 13.270 -2.278 -21.383 1.00 0.00 H new ATOM 0 HA ASP A 74 14.612 -4.758 -20.708 1.00 0.00 H new ATOM 0 HB2 ASP A 74 15.900 -2.809 -21.437 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.170 -1.806 -20.200 1.00 0.00 H new ATOM 1166 N LEU A 75 12.741 -3.206 -18.551 1.00 0.00 N ATOM 1167 CA LEU A 75 12.344 -3.067 -17.159 1.00 0.00 C ATOM 1168 C LEU A 75 11.712 -4.329 -16.613 1.00 0.00 C ATOM 1169 O LEU A 75 11.097 -5.130 -17.318 1.00 0.00 O ATOM 1170 CB LEU A 75 11.400 -1.882 -16.905 1.00 0.00 C ATOM 1171 CG LEU A 75 11.869 -0.580 -17.530 1.00 0.00 C ATOM 1172 CD1 LEU A 75 10.920 0.567 -17.229 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.323 -0.156 -17.273 1.00 0.00 C ATOM 0 H LEU A 75 12.138 -2.713 -19.210 1.00 0.00 H new ATOM 0 HA LEU A 75 13.277 -2.873 -16.629 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.412 -2.126 -17.295 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.292 -1.740 -15.830 1.00 0.00 H new ATOM 0 HG LEU A 75 11.851 -0.818 -18.594 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.293 1.479 -17.695 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.932 0.335 -17.626 1.00 0.00 H new ATOM 0 HD13 LEU A 75 10.854 0.711 -16.151 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.521 0.790 -17.778 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.483 -0.036 -16.202 1.00 0.00 H new ATOM 0 HD23 LEU A 75 13.998 -0.920 -17.657 1.00 0.00 H new ATOM 1185 N ASN A 76 11.791 -4.410 -15.300 1.00 0.00 N ATOM 1186 CA ASN A 76 11.169 -5.422 -14.466 1.00 0.00 C ATOM 1187 C ASN A 76 9.781 -4.936 -14.062 1.00 0.00 C ATOM 1188 O ASN A 76 9.677 -4.150 -13.120 1.00 0.00 O ATOM 1189 CB ASN A 76 12.056 -5.717 -13.244 1.00 0.00 C ATOM 1190 CG ASN A 76 11.381 -6.691 -12.279 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.413 -7.900 -12.479 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.728 -6.189 -11.240 1.00 0.00 N ATOM 0 H ASN A 76 12.322 -3.732 -14.753 1.00 0.00 H new ATOM 0 HA ASN A 76 11.061 -6.357 -15.016 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.007 -6.134 -13.576 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.281 -4.786 -12.724 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.243 -6.811 -10.593 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.711 -5.181 -11.087 1.00 0.00 H new ATOM 1199 N LEU A 77 8.718 -5.365 -14.764 1.00 0.00 N ATOM 1200 CA LEU A 77 7.331 -4.998 -14.439 1.00 0.00 C ATOM 1201 C LEU A 77 6.440 -6.181 -14.103 1.00 0.00 C ATOM 1202 O LEU A 77 5.229 -6.040 -13.975 1.00 0.00 O ATOM 1203 CB LEU A 77 6.663 -4.120 -15.523 1.00 0.00 C ATOM 1204 CG LEU A 77 7.507 -3.024 -16.185 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.709 -2.386 -17.321 1.00 0.00 C ATOM 1206 CD2 LEU A 77 7.928 -1.918 -15.212 1.00 0.00 C ATOM 0 H LEU A 77 8.798 -5.978 -15.575 1.00 0.00 H new ATOM 0 HA LEU A 77 7.429 -4.401 -13.532 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.298 -4.781 -16.309 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.790 -3.644 -15.076 1.00 0.00 H new ATOM 0 HG LEU A 77 8.413 -3.506 -16.552 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.307 -1.607 -17.793 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.456 -3.147 -18.060 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.794 -1.949 -16.922 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.522 -1.174 -15.742 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.040 -1.443 -14.795 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.522 -2.349 -14.406 1.00 0.00 H new ATOM 1218 N GLU A 78 7.036 -7.347 -13.963 1.00 0.00 N ATOM 1219 CA GLU A 78 6.292 -8.584 -13.803 1.00 0.00 C ATOM 1220 C GLU A 78 5.500 -8.534 -12.492 1.00 0.00 C ATOM 1221 O GLU A 78 6.060 -8.310 -11.415 1.00 0.00 O ATOM 1222 CB GLU A 78 7.215 -9.812 -13.868 1.00 0.00 C ATOM 1223 CG GLU A 78 7.722 -10.080 -15.292 1.00 0.00 C ATOM 1224 CD GLU A 78 8.653 -11.305 -15.328 1.00 0.00 C ATOM 1225 OE1 GLU A 78 8.150 -12.452 -15.409 1.00 0.00 O1- ATOM 1226 OE2 GLU A 78 9.895 -11.133 -15.281 1.00 0.00 O ATOM 0 H GLU A 78 8.049 -7.466 -13.957 1.00 0.00 H new ATOM 0 HA GLU A 78 5.590 -8.685 -14.631 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.066 -9.661 -13.203 1.00 0.00 H new ATOM 0 HB3 GLU A 78 6.678 -10.688 -13.504 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.875 -10.244 -15.958 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.254 -9.204 -15.663 1.00 0.00 H new ATOM 1233 N GLY A 79 4.185 -8.725 -12.605 1.00 0.00 N ATOM 1234 CA GLY A 79 3.232 -8.722 -11.503 1.00 0.00 C ATOM 1235 C GLY A 79 2.867 -7.331 -10.991 1.00 0.00 C ATOM 1236 O GLY A 79 2.180 -7.211 -9.975 1.00 0.00 O ATOM 0 H GLY A 79 3.740 -8.893 -13.507 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.322 -9.228 -11.824 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.646 -9.303 -10.679 1.00 0.00 H new ATOM 1240 N LYS A 80 3.291 -6.281 -11.696 1.00 0.00 N ATOM 1241 CA LYS A 80 2.927 -4.914 -11.370 1.00 0.00 C ATOM 1242 C LYS A 80 1.540 -4.634 -11.856 1.00 0.00 C ATOM 1243 O LYS A 80 1.136 -5.115 -12.915 1.00 0.00 O ATOM 1244 CB LYS A 80 3.882 -3.867 -11.963 1.00 0.00 C ATOM 1245 CG LYS A 80 5.208 -3.958 -11.232 1.00 0.00 C ATOM 1246 CD LYS A 80 6.099 -2.755 -11.549 1.00 0.00 C ATOM 1247 CE LYS A 80 7.542 -2.980 -11.074 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.669 -3.090 -9.594 1.00 0.00 N1+ ATOM 0 H LYS A 80 3.899 -6.362 -12.511 1.00 0.00 H new ATOM 0 HA LYS A 80 2.990 -4.829 -10.285 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.024 -4.044 -13.029 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.460 -2.867 -11.860 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.031 -4.010 -10.158 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.720 -4.878 -11.515 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.093 -2.570 -12.623 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.692 -1.864 -11.070 1.00 0.00 H new ATOM 0 HE2 LYS A 80 7.930 -3.890 -11.533 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.164 -2.156 -11.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.675 -3.070 -9.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.177 -2.293 -9.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.244 -3.984 -9.275 1.00 0.00 H new ATOM 1262 N ILE A 81 0.839 -3.794 -11.113 1.00 0.00 N ATOM 1263 CA ILE A 81 -0.395 -3.240 -11.635 1.00 0.00 C ATOM 1264 C ILE A 81 -0.039 -2.015 -12.453 1.00 0.00 C ATOM 1265 O ILE A 81 0.802 -1.221 -12.038 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.433 -2.956 -10.546 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.758 -4.236 -9.754 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.722 -2.481 -11.239 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.786 -4.021 -8.253 1.00 0.00 C ATOM 0 H ILE A 81 1.094 -3.489 -10.174 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.885 -3.975 -12.274 1.00 0.00 H new ATOM 0 HB ILE A 81 -1.040 -2.206 -9.860 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.726 -4.619 -10.077 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -1.017 -5.000 -9.991 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.483 -2.270 -10.487 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.516 -1.576 -11.810 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.082 -3.260 -11.911 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.021 -4.962 -7.755 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.811 -3.666 -7.918 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.546 -3.280 -8.006 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.699 -1.853 -13.593 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.555 -0.722 -14.475 1.00 0.00 C ATOM 1283 C VAL A 82 -1.939 -0.179 -14.823 1.00 0.00 C ATOM 1284 O VAL A 82 -2.823 -0.941 -15.201 1.00 0.00 O ATOM 1285 CB VAL A 82 0.259 -1.124 -15.719 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.444 0.056 -16.680 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.646 -1.648 -15.315 1.00 0.00 C ATOM 0 H VAL A 82 -1.374 -2.538 -13.934 1.00 0.00 H new ATOM 0 HA VAL A 82 -0.001 0.078 -13.984 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.304 -1.909 -16.224 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.023 -0.267 -17.545 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.532 0.414 -17.009 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.972 0.861 -16.170 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.204 -1.926 -16.209 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.187 -0.869 -14.777 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.532 -2.521 -14.672 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.146 1.129 -14.734 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.302 1.806 -15.269 1.00 0.00 C ATOM 1299 C ALA A 83 -2.842 2.703 -16.411 1.00 0.00 C ATOM 1300 O ALA A 83 -2.031 3.595 -16.174 1.00 0.00 O ATOM 1301 CB ALA A 83 -4.002 2.585 -14.153 1.00 0.00 C ATOM 0 H ALA A 83 -1.490 1.759 -14.272 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.030 1.098 -15.664 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.875 3.096 -14.558 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.316 1.895 -13.370 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.314 3.319 -13.735 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.329 2.496 -17.636 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.055 3.409 -18.744 1.00 0.00 C ATOM 1309 C LEU A 84 -4.093 4.516 -18.841 1.00 0.00 C ATOM 1310 O LEU A 84 -5.287 4.277 -18.683 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.980 2.667 -20.089 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.809 1.692 -20.244 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.775 1.175 -21.685 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.474 2.371 -19.915 1.00 0.00 C ATOM 0 H LEU A 84 -3.917 1.701 -17.885 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.084 3.857 -18.531 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.909 2.116 -20.231 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.922 3.406 -20.888 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.952 0.866 -19.548 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.944 0.480 -21.803 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.711 0.663 -21.910 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.647 2.014 -22.369 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.338 1.654 -20.034 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.317 3.212 -20.590 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.493 2.731 -18.886 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.646 5.710 -19.213 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.510 6.830 -19.582 1.00 0.00 C ATOM 1328 C TYR A 85 -3.907 7.557 -20.772 1.00 0.00 C ATOM 1329 O TYR A 85 -2.715 7.436 -21.023 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.736 7.760 -18.383 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.596 8.677 -18.000 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.533 8.198 -17.213 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.622 10.025 -18.406 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.489 9.061 -16.832 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.587 10.892 -18.025 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.523 10.415 -17.234 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.530 11.268 -16.875 1.00 0.00 O ATOM 0 H TYR A 85 -2.652 5.933 -19.268 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.492 6.458 -19.875 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.610 8.376 -18.592 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.980 7.144 -17.518 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.518 7.164 -16.900 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.439 10.391 -19.011 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.668 8.691 -16.236 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.606 11.925 -18.338 1.00 0.00 H new ATOM 0 HH TYR A 85 -0.716 12.158 -17.240 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.686 8.299 -21.549 1.00 0.00 N ATOM 1348 CA GLY A 86 -4.107 9.062 -22.640 1.00 0.00 C ATOM 1349 C GLY A 86 -5.013 10.160 -23.131 1.00 0.00 C ATOM 1350 O GLY A 86 -6.141 10.310 -22.656 1.00 0.00 O ATOM 0 H GLY A 86 -5.697 8.387 -21.446 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.163 9.496 -22.312 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.879 8.389 -23.467 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.499 10.927 -24.091 1.00 0.00 N ATOM 1355 CA LEU A 87 -5.177 12.080 -24.669 1.00 0.00 C ATOM 1356 C LEU A 87 -5.249 11.891 -26.178 1.00 0.00 C ATOM 1357 O LEU A 87 -4.400 11.201 -26.755 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.453 13.411 -24.376 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.717 13.557 -23.032 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.098 14.950 -22.985 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.607 13.429 -21.794 1.00 0.00 C ATOM 0 H LEU A 87 -3.578 10.758 -24.496 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.167 12.139 -24.217 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.728 13.578 -25.173 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.189 14.212 -24.441 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.993 12.743 -22.995 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.569 15.081 -22.041 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.398 15.065 -23.813 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.884 15.700 -23.068 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.000 13.546 -20.896 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.375 14.202 -21.816 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.081 12.447 -21.787 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.197 12.558 -26.821 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.288 12.612 -28.263 1.00 0.00 C ATOM 1375 C GLY A 88 -7.398 13.576 -28.672 1.00 0.00 C ATOM 1376 O GLY A 88 -7.710 14.503 -27.925 1.00 0.00 O ATOM 0 H GLY A 88 -6.931 13.082 -26.345 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.337 12.937 -28.685 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.491 11.618 -28.662 1.00 0.00 H new ATOM 1380 N ASP A 89 -7.997 13.362 -29.839 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.235 13.985 -30.281 1.00 0.00 C ATOM 1382 C ASP A 89 -9.878 13.053 -31.302 1.00 0.00 C ATOM 1383 O ASP A 89 -9.210 12.537 -32.196 1.00 0.00 O ATOM 1384 CB ASP A 89 -9.065 15.362 -30.913 1.00 0.00 C ATOM 1385 CG ASP A 89 -10.315 15.679 -31.759 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -11.470 15.602 -31.258 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -10.137 15.907 -32.972 1.00 0.00 O ATOM 0 H ASP A 89 -7.613 12.720 -30.532 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.850 14.140 -29.394 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.931 16.118 -30.139 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.172 15.383 -31.537 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.181 12.845 -31.171 1.00 0.00 N ATOM 1393 CA GLN A 90 -11.960 11.983 -32.013 1.00 0.00 C ATOM 1394 C GLN A 90 -12.494 12.680 -33.259 1.00 0.00 C ATOM 1395 O GLN A 90 -12.816 11.981 -34.218 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.091 11.327 -31.202 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.087 12.309 -30.560 1.00 0.00 C ATOM 1398 CD GLN A 90 -13.622 12.865 -29.212 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -13.863 12.278 -28.163 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -12.960 14.008 -29.164 1.00 0.00 N ATOM 0 H GLN A 90 -11.735 13.296 -30.443 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.291 11.204 -32.379 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.641 10.651 -31.856 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.647 10.718 -30.415 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.258 13.139 -31.246 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.044 11.805 -30.424 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -12.749 14.512 -30.025 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -12.660 14.386 -28.266 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.630 14.011 -33.275 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.316 14.653 -34.383 1.00 0.00 C ATOM 1411 C LEU A 91 -12.425 14.743 -35.617 1.00 0.00 C ATOM 1412 O LEU A 91 -12.884 14.518 -36.738 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.849 16.027 -33.973 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.891 15.990 -32.839 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -15.528 17.376 -32.727 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -16.034 14.982 -33.051 1.00 0.00 C ATOM 0 H LEU A 91 -12.283 14.642 -32.553 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.170 14.031 -34.650 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -13.011 16.650 -33.661 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.295 16.506 -34.845 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.351 15.682 -31.944 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -16.270 17.372 -31.929 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -14.757 18.114 -32.502 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -16.011 17.632 -33.670 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.719 15.025 -32.204 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.572 15.229 -33.966 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.622 13.976 -33.133 1.00 0.00 H new ATOM 1428 N GLY A 92 -11.150 15.051 -35.401 1.00 0.00 N ATOM 1429 CA GLY A 92 -10.133 15.142 -36.433 1.00 0.00 C ATOM 1430 C GLY A 92 -9.372 13.832 -36.608 1.00 0.00 C ATOM 1431 O GLY A 92 -8.902 13.544 -37.712 1.00 0.00 O ATOM 0 H GLY A 92 -10.788 15.250 -34.469 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.600 15.418 -37.378 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.431 15.937 -36.180 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.266 13.033 -35.537 1.00 0.00 N ATOM 1436 CA TYR A 93 -8.369 11.885 -35.484 1.00 0.00 C ATOM 1437 C TYR A 93 -9.023 10.623 -34.902 1.00 0.00 C ATOM 1438 O TYR A 93 -8.330 9.855 -34.239 1.00 0.00 O ATOM 1439 CB TYR A 93 -7.064 12.233 -34.733 1.00 0.00 C ATOM 1440 CG TYR A 93 -6.444 13.584 -35.023 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -6.885 14.719 -34.318 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -5.425 13.708 -35.983 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -6.335 15.981 -34.588 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -4.868 14.968 -36.263 1.00 0.00 C ATOM 1445 CZ TYR A 93 -5.327 16.116 -35.574 1.00 0.00 C ATOM 1446 OH TYR A 93 -4.803 17.340 -35.880 1.00 0.00 O ATOM 0 H TYR A 93 -9.805 13.171 -34.682 1.00 0.00 H new ATOM 0 HA TYR A 93 -8.123 11.646 -36.519 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -7.263 12.174 -33.663 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.326 11.465 -34.963 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -7.652 14.618 -33.564 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -5.069 12.833 -36.507 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.680 16.848 -34.045 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -4.089 15.060 -37.005 1.00 0.00 H new ATOM 0 HH TYR A 93 -4.123 17.239 -36.578 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.318 10.373 -35.133 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.023 9.212 -34.577 1.00 0.00 C ATOM 1458 C GLY A 94 -10.288 7.912 -34.891 1.00 0.00 C ATOM 1459 O GLY A 94 -10.049 7.115 -33.988 1.00 0.00 O ATOM 0 H GLY A 94 -10.907 10.971 -35.712 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.119 9.326 -33.497 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.033 9.168 -34.984 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.820 7.747 -36.127 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.147 6.533 -36.581 1.00 0.00 C ATOM 1465 C GLU A 95 -7.841 6.268 -35.807 1.00 0.00 C ATOM 1466 O GLU A 95 -7.334 5.143 -35.833 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.850 6.598 -38.092 1.00 0.00 C ATOM 1468 CG GLU A 95 -10.050 6.846 -39.020 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.338 8.338 -39.318 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -10.653 9.118 -38.387 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -10.320 8.721 -40.514 1.00 0.00 O ATOM 0 H GLU A 95 -9.899 8.462 -36.850 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.830 5.706 -36.384 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.119 7.389 -38.262 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.379 5.660 -38.387 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.876 6.328 -39.963 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.938 6.401 -38.571 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.314 7.279 -35.105 1.00 0.00 N ATOM 1479 CA TRP A 96 -6.096 7.240 -34.316 1.00 0.00 C ATOM 1480 C TRP A 96 -6.330 7.696 -32.869 1.00 0.00 C ATOM 1481 O TRP A 96 -5.364 7.932 -32.143 1.00 0.00 O ATOM 1482 CB TRP A 96 -4.988 8.049 -34.998 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.828 7.813 -36.469 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -4.005 6.922 -37.069 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.565 8.453 -37.553 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -4.197 6.964 -38.438 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -5.164 7.877 -38.789 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.559 9.452 -37.603 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.737 8.253 -40.011 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -7.111 9.875 -38.827 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -6.709 9.269 -40.032 1.00 0.00 C ATOM 0 H TRP A 96 -7.760 8.196 -35.077 1.00 0.00 H new ATOM 0 HA TRP A 96 -5.769 6.202 -34.260 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -5.185 9.109 -34.837 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.042 7.822 -34.506 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -3.306 6.277 -36.557 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.684 6.388 -39.106 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.904 9.902 -36.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -5.435 7.768 -40.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.845 10.667 -38.841 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -7.145 9.583 -40.969 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.578 7.870 -32.436 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.960 8.127 -31.067 1.00 0.00 C ATOM 1504 C PHE A 97 -7.253 7.151 -30.157 1.00 0.00 C ATOM 1505 O PHE A 97 -7.381 5.944 -30.361 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.485 8.027 -30.906 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.049 8.849 -29.770 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.715 10.208 -29.696 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.934 8.292 -28.829 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.257 11.009 -28.676 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.503 9.107 -27.832 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.175 10.474 -27.763 1.00 0.00 C ATOM 0 H PHE A 97 -8.379 7.832 -33.066 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.664 9.140 -30.793 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.958 8.343 -31.836 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.754 6.982 -30.750 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -9.042 10.639 -30.422 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.177 7.240 -28.871 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -9.963 12.045 -28.596 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.193 8.682 -27.118 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.627 11.105 -27.012 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.515 7.677 -29.175 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.818 6.894 -28.156 1.00 0.00 C ATOM 1524 C LEU A 98 -4.923 5.806 -28.754 1.00 0.00 C ATOM 1525 O LEU A 98 -4.657 4.791 -28.120 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.815 6.361 -27.116 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.328 7.363 -26.075 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.232 8.178 -25.395 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.388 8.323 -26.604 1.00 0.00 C ATOM 0 H LEU A 98 -6.384 8.683 -29.066 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.130 7.558 -27.634 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.675 5.953 -27.647 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.344 5.532 -26.587 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.786 6.710 -25.332 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.681 8.861 -24.674 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.546 7.506 -24.879 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.685 8.750 -26.145 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.698 8.998 -25.806 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.975 8.902 -27.430 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.250 7.756 -26.955 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.423 5.992 -29.964 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.697 4.926 -30.652 1.00 0.00 C ATOM 1543 C ASP A 99 -2.405 4.589 -29.909 1.00 0.00 C ATOM 1544 O ASP A 99 -2.089 3.413 -29.704 1.00 0.00 O ATOM 1545 CB ASP A 99 -3.456 5.261 -32.118 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.754 4.087 -32.821 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -3.460 3.147 -33.255 1.00 0.00 O ATOM 1548 OD2 ASP A 99 -1.512 4.128 -32.974 1.00 0.00 O1- ATOM 0 H ASP A 99 -4.503 6.862 -30.491 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.320 4.031 -30.645 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.404 5.475 -32.611 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.845 6.160 -32.198 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.740 5.611 -29.357 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.576 5.428 -28.503 1.00 0.00 C ATOM 1555 C ALA A 100 -0.926 4.653 -27.225 1.00 0.00 C ATOM 1556 O ALA A 100 -0.106 3.879 -26.736 1.00 0.00 O ATOM 1557 CB ALA A 100 0.040 6.794 -28.182 1.00 0.00 C ATOM 0 H ALA A 100 -2.000 6.588 -29.495 1.00 0.00 H new ATOM 0 HA ALA A 100 0.159 4.826 -29.038 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.912 6.659 -27.542 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.342 7.284 -29.108 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.695 7.413 -27.667 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.141 4.827 -26.692 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.645 4.085 -25.539 1.00 0.00 C ATOM 1565 C LEU A 101 -2.660 2.594 -25.837 1.00 0.00 C ATOM 1566 O LEU A 101 -2.158 1.799 -25.047 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.070 4.563 -25.200 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.550 4.235 -23.787 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.805 5.086 -22.781 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -6.051 4.541 -23.662 1.00 0.00 C ATOM 0 H LEU A 101 -2.812 5.502 -27.060 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.989 4.266 -24.688 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.116 5.643 -25.340 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.764 4.119 -25.914 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.366 3.178 -23.593 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.151 4.848 -21.775 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.736 4.884 -22.854 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.990 6.140 -22.988 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.388 4.305 -22.652 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.225 5.598 -23.865 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.606 3.937 -24.380 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.196 2.234 -27.005 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.216 0.855 -27.474 1.00 0.00 C ATOM 1584 C GLY A 102 -1.794 0.321 -27.608 1.00 0.00 C ATOM 1585 O GLY A 102 -1.523 -0.801 -27.180 1.00 0.00 O ATOM 0 H GLY A 102 -3.628 2.895 -27.650 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.780 0.235 -26.778 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.725 0.798 -28.436 1.00 0.00 H new ATOM 1589 N MET A 103 -0.864 1.139 -28.116 1.00 0.00 N ATOM 1590 CA MET A 103 0.519 0.710 -28.268 1.00 0.00 C ATOM 1591 C MET A 103 1.179 0.440 -26.925 1.00 0.00 C ATOM 1592 O MET A 103 1.826 -0.595 -26.784 1.00 0.00 O ATOM 1593 CB MET A 103 1.333 1.661 -29.158 1.00 0.00 C ATOM 1594 CG MET A 103 0.776 1.707 -30.590 1.00 0.00 C ATOM 1595 SD MET A 103 2.006 1.986 -31.894 1.00 0.00 S ATOM 1596 CE MET A 103 2.510 3.670 -31.474 1.00 0.00 C ATOM 0 H MET A 103 -1.048 2.093 -28.425 1.00 0.00 H new ATOM 0 HA MET A 103 0.501 -0.243 -28.796 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.320 2.663 -28.729 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.374 1.338 -29.181 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.263 0.767 -30.793 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.027 2.497 -30.645 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.408 3.931 -32.034 1.00 0.00 H new ATOM 0 HE2 MET A 103 1.709 4.364 -31.729 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.717 3.732 -30.406 1.00 0.00 H new ATOM 1606 N LEU A 104 0.981 1.281 -25.907 1.00 0.00 N ATOM 1607 CA LEU A 104 1.537 0.967 -24.600 1.00 0.00 C ATOM 1608 C LEU A 104 0.894 -0.268 -23.994 1.00 0.00 C ATOM 1609 O LEU A 104 1.547 -1.019 -23.279 1.00 0.00 O ATOM 1610 CB LEU A 104 1.410 2.127 -23.609 1.00 0.00 C ATOM 1611 CG LEU A 104 2.792 2.751 -23.389 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.688 4.032 -22.592 1.00 0.00 C ATOM 1613 CD2 LEU A 104 3.867 1.800 -22.854 1.00 0.00 C ATOM 0 H LEU A 104 0.457 2.155 -25.962 1.00 0.00 H new ATOM 0 HA LEU A 104 2.596 0.776 -24.776 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.716 2.875 -23.993 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.003 1.770 -22.663 1.00 0.00 H new ATOM 0 HG LEU A 104 3.158 2.997 -24.386 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.683 4.454 -22.450 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.064 4.746 -23.130 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.242 3.821 -21.620 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.805 2.342 -22.735 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.553 1.401 -21.889 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.009 0.979 -23.557 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.386 -0.489 -24.251 1.00 0.00 N ATOM 1626 CA HIS A 105 -1.075 -1.633 -23.674 1.00 0.00 C ATOM 1627 C HIS A 105 -0.441 -2.937 -24.162 1.00 0.00 C ATOM 1628 O HIS A 105 -0.178 -3.830 -23.367 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.575 -1.534 -23.955 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.385 -2.095 -22.824 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.530 -1.519 -21.567 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -4.136 -3.221 -22.883 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.375 -2.315 -20.902 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.763 -3.350 -21.665 1.00 0.00 N ATOM 0 H HIS A 105 -0.964 0.102 -24.849 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.963 -1.631 -22.590 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.848 -0.491 -24.117 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.810 -2.071 -24.874 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.226 -3.890 -23.726 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.702 -2.148 -19.886 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -5.404 -4.095 -21.392 1.00 0.00 H new ATOM 1642 N ASP A 106 -0.083 -2.993 -25.442 1.00 0.00 N ATOM 1643 CA ASP A 106 0.636 -4.094 -26.071 1.00 0.00 C ATOM 1644 C ASP A 106 2.098 -4.145 -25.627 1.00 0.00 C ATOM 1645 O ASP A 106 2.671 -5.218 -25.432 1.00 0.00 O ATOM 1646 CB ASP A 106 0.557 -3.958 -27.592 1.00 0.00 C ATOM 1647 CG ASP A 106 1.374 -5.062 -28.284 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.877 -6.208 -28.382 1.00 0.00 O ATOM 1649 OD2 ASP A 106 2.495 -4.773 -28.766 1.00 0.00 O1- ATOM 0 H ASP A 106 -0.296 -2.240 -26.096 1.00 0.00 H new ATOM 0 HA ASP A 106 0.164 -5.025 -25.758 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.483 -4.014 -27.913 1.00 0.00 H new ATOM 0 HB3 ASP A 106 0.931 -2.980 -27.894 1.00 0.00 H new ATOM 1654 N LYS A 107 2.698 -2.972 -25.407 1.00 0.00 N ATOM 1655 CA LYS A 107 4.039 -2.844 -24.861 1.00 0.00 C ATOM 1656 C LYS A 107 4.113 -3.526 -23.504 1.00 0.00 C ATOM 1657 O LYS A 107 5.100 -4.197 -23.228 1.00 0.00 O ATOM 1658 CB LYS A 107 4.437 -1.367 -24.794 1.00 0.00 C ATOM 1659 CG LYS A 107 5.885 -1.174 -24.350 1.00 0.00 C ATOM 1660 CD LYS A 107 6.908 -1.755 -25.323 1.00 0.00 C ATOM 1661 CE LYS A 107 8.098 -0.799 -25.481 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.043 -1.247 -26.548 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.254 -2.076 -25.608 1.00 0.00 H new ATOM 0 HA LYS A 107 4.755 -3.343 -25.514 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.296 -0.911 -25.774 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.775 -0.846 -24.102 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.079 -0.109 -24.226 1.00 0.00 H new ATOM 0 HG3 LYS A 107 6.021 -1.638 -23.373 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.256 -2.722 -24.960 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.440 -1.927 -26.292 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.731 0.199 -25.719 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.631 -0.725 -24.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 9.910 -0.674 -26.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.283 -2.248 -26.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.595 -1.131 -27.479 1.00 0.00 H new ATOM 1676 N LEU A 108 3.117 -3.330 -22.639 1.00 0.00 N ATOM 1677 CA LEU A 108 3.192 -3.767 -21.253 1.00 0.00 C ATOM 1678 C LEU A 108 2.479 -5.090 -21.022 1.00 0.00 C ATOM 1679 O LEU A 108 2.821 -5.766 -20.057 1.00 0.00 O ATOM 1680 CB LEU A 108 2.745 -2.649 -20.297 1.00 0.00 C ATOM 1681 CG LEU A 108 3.455 -1.311 -20.572 1.00 0.00 C ATOM 1682 CD1 LEU A 108 2.896 -0.240 -19.636 1.00 0.00 C ATOM 1683 CD2 LEU A 108 4.991 -1.373 -20.538 1.00 0.00 C ATOM 0 H LEU A 108 2.242 -2.866 -22.882 1.00 0.00 H new ATOM 0 HA LEU A 108 4.238 -3.970 -21.023 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.668 -2.509 -20.387 1.00 0.00 H new ATOM 0 HB3 LEU A 108 2.942 -2.955 -19.270 1.00 0.00 H new ATOM 0 HG LEU A 108 3.236 -1.046 -21.606 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.397 0.709 -19.828 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.826 -0.127 -19.810 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.066 -0.537 -18.601 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.400 -0.384 -20.743 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.320 -1.705 -19.553 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.344 -2.075 -21.294 1.00 0.00 H new ATOM 1695 N SER A 109 1.586 -5.540 -21.904 1.00 0.00 N ATOM 1696 CA SER A 109 0.942 -6.844 -21.739 1.00 0.00 C ATOM 1697 C SER A 109 1.969 -7.986 -21.738 1.00 0.00 C ATOM 1698 O SER A 109 1.808 -8.968 -21.012 1.00 0.00 O ATOM 1699 CB SER A 109 -0.108 -7.038 -22.840 1.00 0.00 C ATOM 1700 OG SER A 109 0.477 -6.956 -24.128 1.00 0.00 O ATOM 0 H SER A 109 1.293 -5.025 -22.735 1.00 0.00 H new ATOM 0 HA SER A 109 0.446 -6.868 -20.769 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.591 -8.008 -22.718 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.885 -6.280 -22.742 1.00 0.00 H new ATOM 0 HG SER A 109 -0.215 -7.085 -24.810 1.00 0.00 H new ATOM 1706 N THR A 110 3.067 -7.830 -22.488 1.00 0.00 N ATOM 1707 CA THR A 110 4.096 -8.861 -22.622 1.00 0.00 C ATOM 1708 C THR A 110 5.027 -8.848 -21.393 1.00 0.00 C ATOM 1709 O THR A 110 5.697 -9.837 -21.091 1.00 0.00 O ATOM 1710 CB THR A 110 4.793 -8.683 -23.991 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.423 -9.884 -24.402 1.00 0.00 O ATOM 1712 CG2 THR A 110 5.809 -7.534 -24.003 1.00 0.00 C ATOM 0 H THR A 110 3.265 -6.982 -23.019 1.00 0.00 H new ATOM 0 HA THR A 110 3.671 -9.865 -22.626 1.00 0.00 H new ATOM 0 HB THR A 110 4.004 -8.426 -24.697 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.855 -9.746 -25.271 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.264 -7.461 -24.991 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.303 -6.598 -23.766 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.584 -7.726 -23.261 1.00 0.00 H new ATOM 1720 N LYS A 111 5.034 -7.740 -20.635 1.00 0.00 N ATOM 1721 CA LYS A 111 5.821 -7.551 -19.423 1.00 0.00 C ATOM 1722 C LYS A 111 5.179 -8.234 -18.210 1.00 0.00 C ATOM 1723 O LYS A 111 5.703 -8.107 -17.110 1.00 0.00 O ATOM 1724 CB LYS A 111 6.034 -6.042 -19.190 1.00 0.00 C ATOM 1725 CG LYS A 111 6.675 -5.283 -20.358 1.00 0.00 C ATOM 1726 CD LYS A 111 8.117 -5.719 -20.649 1.00 0.00 C ATOM 1727 CE LYS A 111 9.070 -5.694 -19.437 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.345 -6.431 -19.691 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.467 -6.924 -20.865 1.00 0.00 H new ATOM 0 HA LYS A 111 6.792 -8.029 -19.554 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.069 -5.586 -18.967 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.659 -5.912 -18.307 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.071 -5.431 -21.253 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.663 -4.215 -20.138 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.098 -6.730 -21.055 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.525 -5.072 -21.425 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.298 -4.659 -19.180 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.567 -6.133 -18.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.976 -6.326 -18.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.139 -7.439 -19.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.809 -6.042 -20.537 1.00 0.00 H new ATOM 1742 N GLY A 112 4.045 -8.918 -18.387 1.00 0.00 N ATOM 1743 CA GLY A 112 3.411 -9.704 -17.333 1.00 0.00 C ATOM 1744 C GLY A 112 2.781 -8.819 -16.266 1.00 0.00 C ATOM 1745 O GLY A 112 2.809 -9.168 -15.087 1.00 0.00 O ATOM 0 H GLY A 112 3.540 -8.940 -19.273 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.646 -10.347 -17.769 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.152 -10.357 -16.872 1.00 0.00 H new ATOM 1749 N VAL A 113 2.273 -7.645 -16.652 1.00 0.00 N ATOM 1750 CA VAL A 113 1.587 -6.727 -15.758 1.00 0.00 C ATOM 1751 C VAL A 113 0.109 -7.125 -15.656 1.00 0.00 C ATOM 1752 O VAL A 113 -0.378 -7.950 -16.437 1.00 0.00 O ATOM 1753 CB VAL A 113 1.829 -5.256 -16.173 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.277 -5.034 -16.629 1.00 0.00 C ATOM 1755 CG2 VAL A 113 0.878 -4.725 -17.257 1.00 0.00 C ATOM 0 H VAL A 113 2.332 -7.306 -17.612 1.00 0.00 H new ATOM 0 HA VAL A 113 2.000 -6.800 -14.752 1.00 0.00 H new ATOM 0 HB VAL A 113 1.621 -4.688 -15.266 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.413 -3.991 -16.913 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.957 -5.279 -15.813 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.491 -5.674 -17.485 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.125 -3.687 -17.481 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.984 -5.326 -18.160 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.150 -4.784 -16.900 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.623 -6.514 -14.724 1.00 0.00 N ATOM 1766 CA LYS A 114 -2.078 -6.610 -14.648 1.00 0.00 C ATOM 1767 C LYS A 114 -2.630 -5.204 -14.828 1.00 0.00 C ATOM 1768 O LYS A 114 -2.014 -4.265 -14.330 1.00 0.00 O ATOM 1769 CB LYS A 114 -2.505 -7.346 -13.389 1.00 0.00 C ATOM 1770 CG LYS A 114 -2.069 -6.668 -12.085 1.00 0.00 C ATOM 1771 CD LYS A 114 -2.788 -7.365 -10.930 1.00 0.00 C ATOM 1772 CE LYS A 114 -4.261 -6.916 -10.916 1.00 0.00 C ATOM 1773 NZ LYS A 114 -5.197 -7.988 -10.459 1.00 0.00 N1+ ATOM 0 H LYS A 114 -0.215 -5.932 -13.992 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.504 -7.221 -15.444 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.591 -7.443 -13.389 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.095 -8.355 -13.415 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.988 -6.740 -11.961 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.318 -5.607 -12.105 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.725 -8.447 -11.045 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.309 -7.116 -9.983 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.364 -6.049 -10.263 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.546 -6.596 -11.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -6.177 -7.703 -10.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.983 -8.873 -10.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.083 -8.135 -9.436 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.738 -5.026 -15.538 1.00 0.00 N ATOM 1788 CA PHE A 115 -4.232 -3.716 -15.908 1.00 0.00 C ATOM 1789 C PHE A 115 -5.458 -3.327 -15.086 1.00 0.00 C ATOM 1790 O PHE A 115 -6.266 -4.189 -14.735 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.479 -3.630 -17.415 1.00 0.00 C ATOM 1792 CG PHE A 115 -3.213 -3.655 -18.255 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.377 -2.519 -18.309 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.919 -4.775 -19.058 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.279 -2.491 -19.189 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.819 -4.745 -19.933 1.00 0.00 C ATOM 1797 CZ PHE A 115 -1.013 -3.599 -20.011 1.00 0.00 C ATOM 0 H PHE A 115 -4.319 -5.795 -15.873 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.461 -2.982 -15.672 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -5.118 -4.461 -17.715 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -5.027 -2.713 -17.631 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.580 -1.670 -17.674 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.539 -5.657 -19.001 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.642 -1.620 -19.232 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.594 -5.605 -20.546 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.186 -3.569 -20.705 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.607 -2.030 -14.805 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.806 -1.439 -14.226 1.00 0.00 C ATOM 1809 C VAL A 116 -7.254 -0.266 -15.102 1.00 0.00 C ATOM 1810 O VAL A 116 -6.567 0.090 -16.067 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.578 -1.055 -12.750 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -6.112 -2.256 -11.922 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.618 0.122 -12.556 1.00 0.00 C ATOM 0 H VAL A 116 -4.872 -1.345 -14.981 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.617 -2.167 -14.211 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.553 -0.726 -12.390 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.961 -1.948 -10.887 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.868 -3.040 -11.961 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.174 -2.636 -12.328 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.509 0.331 -11.492 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.645 -0.129 -12.978 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -6.016 1.003 -13.060 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.369 0.379 -14.758 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.774 1.601 -15.406 1.00 0.00 C ATOM 1825 C GLY A 117 -9.424 1.404 -16.774 1.00 0.00 C ATOM 1826 O GLY A 117 -9.232 2.252 -17.643 1.00 0.00 O ATOM 0 H GLY A 117 -9.005 0.062 -14.026 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.474 2.127 -14.757 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.901 2.244 -15.521 1.00 0.00 H new ATOM 1830 N TYR A 118 -10.202 0.348 -16.992 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.984 0.220 -18.218 1.00 0.00 C ATOM 1832 C TYR A 118 -12.251 1.073 -18.097 1.00 0.00 C ATOM 1833 O TYR A 118 -12.809 1.221 -17.011 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.285 -1.258 -18.520 1.00 0.00 C ATOM 1835 CG TYR A 118 -10.093 -2.160 -18.837 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.856 -1.634 -19.260 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -10.248 -3.559 -18.763 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.804 -2.486 -19.625 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -9.197 -4.422 -19.129 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.967 -3.885 -19.574 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.939 -4.691 -19.969 1.00 0.00 O ATOM 0 H TYR A 118 -10.308 -0.428 -16.339 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.411 0.592 -19.068 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.809 -1.679 -17.662 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.973 -1.297 -19.364 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.717 -0.564 -19.303 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -11.185 -3.974 -18.421 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.862 -2.067 -19.947 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.330 -5.492 -19.070 1.00 0.00 H new ATOM 0 HH TYR A 118 -7.204 -5.630 -19.875 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.708 1.628 -19.216 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.997 2.317 -19.348 1.00 0.00 C ATOM 1853 C TRP A 119 -14.797 1.637 -20.449 1.00 0.00 C ATOM 1854 O TRP A 119 -14.176 1.219 -21.422 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.821 3.774 -19.757 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.507 4.765 -18.692 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.731 5.836 -18.933 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -14.004 4.918 -17.318 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.673 6.620 -17.804 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.457 6.122 -16.786 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.880 4.204 -16.465 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.737 6.582 -15.490 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -15.167 4.648 -15.160 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.597 5.833 -14.670 1.00 0.00 C ATOM 0 H TRP A 119 -12.177 1.612 -20.087 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.499 2.274 -18.381 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -13.025 3.819 -20.500 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.737 4.095 -20.252 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.231 6.048 -19.867 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -12.115 7.470 -17.729 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.340 3.295 -16.825 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.297 7.500 -15.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.831 4.072 -14.532 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.818 6.167 -13.667 1.00 0.00 H new ATOM 1875 N PRO A 120 -16.135 1.590 -20.398 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.924 1.147 -21.533 1.00 0.00 C ATOM 1877 C PRO A 120 -16.900 2.206 -22.652 1.00 0.00 C ATOM 1878 O PRO A 120 -17.021 3.406 -22.401 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.319 0.874 -20.968 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.432 1.891 -19.829 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.997 2.004 -19.300 1.00 0.00 C ATOM 0 HA PRO A 120 -16.533 0.245 -22.004 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.095 1.021 -21.719 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.415 -0.150 -20.606 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.804 2.852 -20.185 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -19.119 1.550 -19.054 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.773 3.025 -18.991 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.851 1.368 -18.427 1.00 0.00 H new ATOM 1889 N THR A 121 -16.765 1.750 -23.895 1.00 0.00 N ATOM 1890 CA THR A 121 -16.782 2.546 -25.113 1.00 0.00 C ATOM 1891 C THR A 121 -18.204 2.954 -25.544 1.00 0.00 C ATOM 1892 O THR A 121 -18.357 3.705 -26.512 1.00 0.00 O ATOM 1893 CB THR A 121 -16.063 1.761 -26.229 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.808 0.601 -26.549 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.648 1.305 -25.863 1.00 0.00 C ATOM 0 H THR A 121 -16.633 0.757 -24.087 1.00 0.00 H new ATOM 0 HA THR A 121 -16.256 3.481 -24.917 1.00 0.00 H new ATOM 0 HB THR A 121 -15.985 2.453 -27.067 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.255 -0.006 -27.084 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.213 0.761 -26.701 1.00 0.00 H new ATOM 0 HG22 THR A 121 -14.032 2.176 -25.637 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.690 0.654 -24.990 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.716 7.900 -29.708 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.382 7.939 -31.124 1.00 0.00 C ATOM 1948 C GLU A 125 -15.858 8.026 -31.237 1.00 0.00 C ATOM 1949 O GLU A 125 -15.252 8.899 -30.614 1.00 0.00 O ATOM 1950 CB GLU A 125 -18.071 9.135 -31.810 1.00 0.00 C ATOM 1951 CG GLU A 125 -19.587 9.150 -31.586 1.00 0.00 C ATOM 1952 CD GLU A 125 -20.267 10.272 -32.390 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -20.398 11.406 -31.867 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -20.687 10.025 -33.547 1.00 0.00 O ATOM 0 HA GLU A 125 -17.737 7.041 -31.630 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.642 10.063 -31.431 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -17.866 9.103 -32.880 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -20.008 8.187 -31.876 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -19.797 9.283 -30.525 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.231 7.097 -31.969 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.775 7.013 -32.110 1.00 0.00 C ATOM 1963 C PHE A 126 -13.442 6.089 -33.286 1.00 0.00 C ATOM 1964 O PHE A 126 -12.821 6.524 -34.243 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.105 6.520 -30.807 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.553 5.163 -30.276 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.829 5.016 -29.699 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.736 4.028 -30.438 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.307 3.746 -29.342 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.209 2.755 -30.075 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.499 2.611 -29.536 1.00 0.00 C ATOM 0 H PHE A 126 -15.729 6.373 -32.487 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.380 8.009 -32.308 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.028 6.482 -30.972 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.283 7.264 -30.031 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.444 5.887 -29.530 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.741 4.136 -30.843 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.295 3.640 -28.918 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.581 1.887 -30.210 1.00 0.00 H new ATOM 0 HZ PHE A 126 -14.869 1.631 -29.271 1.00 0.00 H new ATOM 1981 N THR A 127 -13.922 4.842 -33.225 1.00 0.00 N ATOM 1982 CA THR A 127 -13.780 3.754 -34.195 1.00 0.00 C ATOM 1983 C THR A 127 -12.322 3.331 -34.490 1.00 0.00 C ATOM 1984 O THR A 127 -12.075 2.525 -35.392 1.00 0.00 O ATOM 1985 CB THR A 127 -14.726 3.994 -35.395 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.044 2.811 -36.117 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.233 5.068 -36.367 1.00 0.00 C ATOM 0 H THR A 127 -14.471 4.543 -32.419 1.00 0.00 H new ATOM 0 HA THR A 127 -14.128 2.825 -33.743 1.00 0.00 H new ATOM 0 HB THR A 127 -15.638 4.360 -34.923 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.243 2.252 -36.198 1.00 0.00 H new ATOM 0 HG21 THR A 127 -14.949 5.179 -37.181 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.133 6.017 -35.840 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.265 4.775 -36.773 1.00 0.00 H new ATOM 1995 N SER A 128 -11.346 3.811 -33.713 1.00 0.00 N ATOM 1996 CA SER A 128 -9.986 3.269 -33.749 1.00 0.00 C ATOM 1997 C SER A 128 -10.013 1.828 -33.195 1.00 0.00 C ATOM 1998 O SER A 128 -10.694 1.574 -32.197 1.00 0.00 O ATOM 1999 CB SER A 128 -8.993 4.162 -32.986 1.00 0.00 C ATOM 2000 OG SER A 128 -9.481 4.529 -31.709 1.00 0.00 O ATOM 0 H SER A 128 -11.474 4.576 -33.050 1.00 0.00 H new ATOM 0 HA SER A 128 -9.634 3.249 -34.780 1.00 0.00 H new ATOM 0 HB2 SER A 128 -8.045 3.636 -32.874 1.00 0.00 H new ATOM 0 HB3 SER A 128 -8.792 5.061 -33.569 1.00 0.00 H new ATOM 0 HG SER A 128 -8.779 5.001 -31.214 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.278 0.868 -33.791 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.322 -0.532 -33.359 1.00 0.00 C ATOM 2008 C PRO A 129 -8.338 -0.855 -32.221 1.00 0.00 C ATOM 2009 O PRO A 129 -8.434 -1.917 -31.605 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.000 -1.328 -34.630 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.027 -0.412 -35.374 1.00 0.00 C ATOM 2012 CD PRO A 129 -8.571 0.984 -35.063 1.00 0.00 C ATOM 0 HA PRO A 129 -10.294 -0.782 -32.935 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.549 -2.293 -34.398 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -9.895 -1.528 -35.218 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.004 -0.536 -35.019 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.020 -0.614 -36.445 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -7.762 1.711 -34.994 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.241 1.326 -35.852 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.364 0.026 -31.952 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.228 -0.253 -31.072 1.00 0.00 C ATOM 2022 C LYS A 130 -6.522 -0.093 -29.575 1.00 0.00 C ATOM 2023 O LYS A 130 -6.115 -0.970 -28.816 1.00 0.00 O ATOM 2024 CB LYS A 130 -4.991 0.561 -31.530 1.00 0.00 C ATOM 2025 CG LYS A 130 -3.658 -0.174 -31.332 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.456 -1.301 -32.361 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.007 -1.803 -32.292 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.738 -2.880 -33.284 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.346 0.966 -32.347 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.008 -1.316 -31.175 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.103 0.813 -32.585 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.962 1.501 -30.979 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -2.837 0.539 -31.411 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.622 -0.592 -30.326 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -4.146 -2.120 -32.159 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.679 -0.937 -33.364 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.327 -0.970 -32.469 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.801 -2.175 -31.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.748 -3.188 -33.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.368 -3.686 -33.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.909 -2.518 -34.244 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.171 0.984 -29.086 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.257 1.252 -27.645 1.00 0.00 C ATOM 2044 C PRO A 131 -8.436 0.533 -26.988 1.00 0.00 C ATOM 2045 O PRO A 131 -9.080 1.093 -26.107 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.375 2.776 -27.548 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.252 3.093 -28.755 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.718 2.130 -29.816 1.00 0.00 C ATOM 0 HA PRO A 131 -6.387 0.875 -27.107 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.836 3.093 -26.612 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.404 3.267 -27.607 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.308 2.921 -28.546 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.154 4.133 -29.065 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.512 1.817 -30.494 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -6.950 2.607 -30.424 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.739 -0.693 -27.388 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.969 -1.381 -27.046 1.00 0.00 C ATOM 2058 C VAL A 132 -9.647 -2.845 -26.715 1.00 0.00 C ATOM 2059 O VAL A 132 -8.723 -3.409 -27.304 1.00 0.00 O ATOM 2060 CB VAL A 132 -11.012 -1.238 -28.180 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.362 -0.824 -27.588 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.687 -0.231 -29.307 1.00 0.00 C ATOM 0 H VAL A 132 -8.118 -1.249 -27.975 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.419 -0.927 -26.163 1.00 0.00 H new ATOM 0 HB VAL A 132 -11.015 -2.224 -28.644 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.095 -0.724 -28.389 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.698 -1.583 -26.881 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.256 0.130 -27.072 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.497 -0.227 -30.036 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.576 0.767 -28.883 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.758 -0.521 -29.798 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.387 -3.454 -25.780 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.272 -4.844 -25.381 1.00 0.00 C ATOM 2074 C ILE A 133 -11.625 -5.520 -25.487 1.00 0.00 C ATOM 2075 O ILE A 133 -12.615 -4.910 -25.900 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.634 -5.044 -23.984 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.497 -4.523 -22.817 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -8.239 -4.443 -24.026 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -10.280 -3.045 -22.533 1.00 0.00 C ATOM 0 H ILE A 133 -11.114 -2.959 -25.263 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.577 -5.320 -26.073 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.568 -6.111 -23.770 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.549 -4.693 -23.046 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -10.269 -5.097 -21.919 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.760 -4.567 -23.055 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.648 -4.949 -24.789 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.307 -3.381 -24.264 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.915 -2.737 -21.702 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -9.235 -2.874 -22.274 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.535 -2.463 -23.419 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.672 -6.757 -25.005 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.832 -7.610 -25.004 1.00 0.00 C ATOM 2093 C ALA A 134 -13.270 -7.787 -26.459 1.00 0.00 C ATOM 2094 O ALA A 134 -12.496 -8.300 -27.270 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.845 -7.061 -23.986 1.00 0.00 C ATOM 0 H ALA A 134 -10.857 -7.204 -24.586 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.662 -8.627 -24.651 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.730 -7.697 -23.974 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.394 -7.048 -22.994 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -14.131 -6.047 -24.267 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.463 -7.309 -26.805 1.00 0.00 N ATOM 2102 CA ASP A 135 -15.006 -7.321 -28.159 1.00 0.00 C ATOM 2103 C ASP A 135 -14.964 -5.928 -28.805 1.00 0.00 C ATOM 2104 O ASP A 135 -15.533 -5.698 -29.874 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.420 -7.891 -28.123 1.00 0.00 C ATOM 2106 CG ASP A 135 -16.983 -8.200 -29.524 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.331 -8.950 -30.292 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -18.112 -7.751 -29.840 1.00 0.00 O ATOM 0 H ASP A 135 -15.099 -6.889 -26.127 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.383 -7.960 -28.786 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.422 -8.804 -27.528 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.079 -7.182 -27.622 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.316 -4.968 -28.135 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.287 -3.563 -28.512 1.00 0.00 C ATOM 2115 C GLY A 136 -15.289 -2.724 -27.725 1.00 0.00 C ATOM 2116 O GLY A 136 -15.668 -1.643 -28.169 1.00 0.00 O ATOM 0 H GLY A 136 -13.782 -5.162 -27.288 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.284 -3.168 -28.352 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.500 -3.472 -29.577 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.729 -3.220 -26.559 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.798 -2.640 -25.755 1.00 0.00 C ATOM 2122 C GLN A 137 -16.226 -1.833 -24.591 1.00 0.00 C ATOM 2123 O GLN A 137 -16.945 -1.067 -23.954 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.742 -3.735 -25.225 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.862 -4.938 -26.158 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.775 -6.019 -25.582 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.929 -6.176 -25.974 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.261 -6.777 -24.621 1.00 0.00 N ATOM 0 H GLN A 137 -15.333 -4.063 -26.142 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.370 -1.969 -26.396 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.384 -4.073 -24.253 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.732 -3.306 -25.068 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.250 -4.611 -27.123 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.872 -5.357 -26.338 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.300 -6.628 -24.312 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.827 -7.509 -24.191 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.945 -2.048 -24.270 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.224 -1.269 -23.258 1.00 0.00 C ATOM 2139 C LEU A 138 -12.862 -0.831 -23.779 1.00 0.00 C ATOM 2140 O LEU A 138 -12.230 -1.560 -24.539 1.00 0.00 O ATOM 2141 CB LEU A 138 -14.115 -1.943 -21.867 1.00 0.00 C ATOM 2142 CG LEU A 138 -14.210 -3.478 -21.783 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.525 -4.007 -20.520 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.675 -3.923 -21.723 1.00 0.00 C ATOM 0 H LEU A 138 -14.376 -2.772 -24.708 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.839 -0.387 -23.083 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -13.162 -1.646 -21.429 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.900 -1.528 -21.235 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.719 -3.874 -22.672 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.609 -5.093 -20.489 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.472 -3.724 -20.531 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -14.006 -3.581 -19.640 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.723 -5.010 -21.664 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -16.151 -3.491 -20.843 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -16.195 -3.585 -22.619 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.420 0.362 -23.375 1.00 0.00 N ATOM 2157 CA PHE A 139 -11.137 0.944 -23.706 1.00 0.00 C ATOM 2158 C PHE A 139 -10.067 0.348 -22.804 1.00 0.00 C ATOM 2159 O PHE A 139 -10.334 0.013 -21.649 1.00 0.00 O ATOM 2160 CB PHE A 139 -11.149 2.466 -23.500 1.00 0.00 C ATOM 2161 CG PHE A 139 -12.086 3.243 -24.394 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.893 3.241 -25.787 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -13.153 3.974 -23.836 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.729 4.016 -26.610 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -14.010 4.711 -24.667 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.779 4.764 -26.053 1.00 0.00 C ATOM 0 H PHE A 139 -12.982 0.970 -22.779 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.928 0.728 -24.754 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.413 2.671 -22.463 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -10.137 2.842 -23.651 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -11.105 2.646 -26.223 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -13.311 3.967 -22.768 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.563 4.036 -27.677 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.850 5.239 -24.241 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.405 5.376 -26.685 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.829 0.341 -23.291 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.652 -0.094 -22.555 1.00 0.00 C ATOM 2178 C VAL A 140 -7.316 0.836 -21.371 1.00 0.00 C ATOM 2179 O VAL A 140 -6.463 0.484 -20.557 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.454 -0.196 -23.521 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.606 -1.285 -24.584 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -6.134 1.143 -24.181 1.00 0.00 C ATOM 0 H VAL A 140 -8.614 0.648 -24.239 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.869 -1.073 -22.128 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.614 -0.487 -22.890 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.724 -1.294 -25.224 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.712 -2.255 -24.098 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.491 -1.083 -25.188 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.284 1.024 -24.853 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -7.000 1.485 -24.748 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.890 1.878 -23.414 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.920 2.029 -21.276 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.515 3.020 -20.284 1.00 0.00 C ATOM 2194 C GLY A 141 -8.440 4.230 -20.275 1.00 0.00 C ATOM 2195 O GLY A 141 -9.400 4.275 -21.045 1.00 0.00 O ATOM 0 H GLY A 141 -8.690 2.326 -21.876 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.509 2.561 -19.295 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.495 3.345 -20.491 1.00 0.00 H new ATOM 2199 N LEU A 142 -8.129 5.226 -19.438 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.834 6.508 -19.426 1.00 0.00 C ATOM 2201 C LEU A 142 -8.557 7.220 -20.738 1.00 0.00 C ATOM 2202 O LEU A 142 -7.403 7.381 -21.131 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.416 7.357 -18.212 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.735 8.868 -18.187 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.245 9.135 -18.165 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -8.132 9.507 -16.940 1.00 0.00 C ATOM 0 H LEU A 142 -7.379 5.163 -18.749 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.907 6.343 -19.330 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.877 6.913 -17.330 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.337 7.250 -18.096 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.309 9.297 -19.094 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.424 10.210 -18.148 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.704 8.705 -19.055 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.682 8.680 -17.276 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.361 10.573 -16.930 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.552 9.037 -16.051 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -7.051 9.369 -16.947 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.630 7.670 -21.378 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.579 8.410 -22.626 1.00 0.00 C ATOM 2220 C ALA A 143 -9.933 9.859 -22.326 1.00 0.00 C ATOM 2221 O ALA A 143 -11.006 10.112 -21.779 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.550 7.760 -23.623 1.00 0.00 C ATOM 0 H ALA A 143 -10.579 7.526 -21.033 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.586 8.389 -23.076 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.522 8.306 -24.566 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -10.256 6.724 -23.794 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.561 7.788 -23.217 1.00 0.00 H new ATOM 2228 N LEU A 144 -9.058 10.797 -22.675 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.299 12.235 -22.567 1.00 0.00 C ATOM 2230 C LEU A 144 -9.205 12.839 -23.966 1.00 0.00 C ATOM 2231 O LEU A 144 -8.549 12.276 -24.847 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.271 12.899 -21.629 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.245 12.364 -20.188 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.250 13.147 -19.331 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.627 12.448 -19.528 1.00 0.00 C ATOM 0 H LEU A 144 -8.137 10.574 -23.051 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.288 12.409 -22.144 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.278 12.775 -22.062 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.474 13.970 -21.597 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.940 11.319 -20.249 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.251 12.748 -18.316 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.251 13.053 -19.756 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.538 14.198 -19.308 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.569 12.061 -18.511 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -9.955 13.487 -19.503 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.340 11.856 -20.101 1.00 0.00 H new ATOM 2247 N ASP A 145 -9.820 14.000 -24.169 1.00 0.00 N ATOM 2248 CA ASP A 145 -9.708 14.744 -25.414 1.00 0.00 C ATOM 2249 C ASP A 145 -9.669 16.219 -25.092 1.00 0.00 C ATOM 2250 O ASP A 145 -10.601 16.775 -24.514 1.00 0.00 O ATOM 2251 CB ASP A 145 -10.804 14.374 -26.408 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.345 15.599 -27.141 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -10.585 16.325 -27.804 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -12.578 15.804 -27.115 1.00 0.00 O ATOM 0 H ASP A 145 -10.411 14.451 -23.471 1.00 0.00 H new ATOM 0 HA ASP A 145 -8.779 14.475 -25.917 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -10.411 13.661 -27.133 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -11.619 13.877 -25.882 1.00 0.00 H new ATOM 2259 N GLU A 146 -8.576 16.850 -25.490 1.00 0.00 N ATOM 2260 CA GLU A 146 -8.261 18.208 -25.076 1.00 0.00 C ATOM 2261 C GLU A 146 -8.671 19.219 -26.153 1.00 0.00 C ATOM 2262 O GLU A 146 -8.298 20.391 -26.072 1.00 0.00 O ATOM 2263 CB GLU A 146 -6.789 18.302 -24.633 1.00 0.00 C ATOM 2264 CG GLU A 146 -6.457 17.330 -23.488 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.385 17.511 -22.268 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -7.268 18.538 -21.557 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -8.228 16.617 -22.009 1.00 0.00 O1- ATOM 0 H GLU A 146 -7.881 16.434 -26.110 1.00 0.00 H new ATOM 0 HA GLU A 146 -8.852 18.475 -24.200 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.142 18.090 -25.484 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.573 19.322 -24.314 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.537 16.305 -23.852 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -5.423 17.479 -23.178 1.00 0.00 H new ATOM 2274 N THR A 147 -9.462 18.786 -27.144 1.00 0.00 N ATOM 2275 CA THR A 147 -10.034 19.640 -28.163 1.00 0.00 C ATOM 2276 C THR A 147 -11.560 19.728 -28.021 1.00 0.00 C ATOM 2277 O THR A 147 -12.123 20.733 -28.462 1.00 0.00 O ATOM 2278 CB THR A 147 -9.492 19.239 -29.554 1.00 0.00 C ATOM 2279 OG1 THR A 147 -9.022 20.372 -30.268 1.00 0.00 O ATOM 2280 CG2 THR A 147 -10.509 18.511 -30.426 1.00 0.00 C ATOM 0 H THR A 147 -9.721 17.805 -27.251 1.00 0.00 H new ATOM 0 HA THR A 147 -9.711 20.672 -28.028 1.00 0.00 H new ATOM 0 HB THR A 147 -8.675 18.548 -29.346 1.00 0.00 H new ATOM 0 HG1 THR A 147 -8.683 20.090 -31.143 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.054 18.263 -31.385 1.00 0.00 H new ATOM 0 HG22 THR A 147 -10.827 17.595 -29.927 1.00 0.00 H new ATOM 0 HG23 THR A 147 -11.374 19.154 -30.590 1.00 0.00 H new ATOM 2288 N ASN A 148 -12.239 18.770 -27.360 1.00 0.00 N ATOM 2289 CA ASN A 148 -13.672 18.896 -27.061 1.00 0.00 C ATOM 2290 C ASN A 148 -14.014 18.586 -25.603 1.00 0.00 C ATOM 2291 O ASN A 148 -14.821 19.305 -25.017 1.00 0.00 O ATOM 2292 CB ASN A 148 -14.568 18.066 -28.003 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.009 17.905 -29.410 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -14.208 18.751 -30.273 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.282 16.826 -29.629 1.00 0.00 N ATOM 0 H ASN A 148 -11.816 17.904 -27.025 1.00 0.00 H new ATOM 0 HA ASN A 148 -13.890 19.949 -27.238 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -14.718 17.078 -27.568 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -15.548 18.539 -28.065 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -12.861 16.672 -30.545 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -13.141 16.146 -28.882 1.00 0.00 H new ATOM 2302 N GLN A 149 -13.410 17.563 -24.991 1.00 0.00 N ATOM 2303 CA GLN A 149 -13.650 17.222 -23.584 1.00 0.00 C ATOM 2304 C GLN A 149 -12.852 18.105 -22.621 1.00 0.00 C ATOM 2305 O GLN A 149 -12.925 17.868 -21.421 1.00 0.00 O ATOM 2306 CB GLN A 149 -13.375 15.749 -23.221 1.00 0.00 C ATOM 2307 CG GLN A 149 -13.923 14.665 -24.147 1.00 0.00 C ATOM 2308 CD GLN A 149 -15.446 14.618 -24.226 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.109 14.045 -23.368 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -16.033 15.213 -25.253 1.00 0.00 N ATOM 0 H GLN A 149 -12.742 16.948 -25.455 1.00 0.00 H new ATOM 0 HA GLN A 149 -14.718 17.403 -23.467 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -12.295 15.618 -23.157 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -13.778 15.571 -22.224 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -13.524 14.823 -25.149 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -13.558 13.695 -23.808 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -15.469 15.686 -25.959 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -17.049 15.199 -25.338 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.122 19.124 -23.084 1.00 0.00 N ATOM 2320 CA TYR A 150 -11.195 19.897 -22.244 1.00 0.00 C ATOM 2321 C TYR A 150 -11.876 20.486 -20.997 1.00 0.00 C ATOM 2322 O TYR A 150 -11.218 20.749 -19.988 1.00 0.00 O ATOM 2323 CB TYR A 150 -10.541 21.017 -23.073 1.00 0.00 C ATOM 2324 CG TYR A 150 -11.495 21.956 -23.807 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -12.292 22.878 -23.099 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -11.574 21.921 -25.212 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -13.179 23.733 -23.775 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -12.449 22.782 -25.900 1.00 0.00 C ATOM 2329 CZ TYR A 150 -13.265 23.687 -25.185 1.00 0.00 C ATOM 2330 OH TYR A 150 -14.117 24.510 -25.867 1.00 0.00 O ATOM 0 H TYR A 150 -12.155 19.439 -24.054 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.429 19.206 -21.891 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -9.915 21.614 -22.409 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -9.879 20.558 -23.807 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -12.220 22.928 -22.023 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.958 21.228 -25.766 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -13.794 24.424 -23.218 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -12.497 22.751 -26.978 1.00 0.00 H new ATOM 0 HH TYR A 150 -14.039 24.338 -26.829 1.00 0.00 H new ATOM 2340 N ASP A 151 -13.194 20.691 -21.072 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.007 21.278 -20.010 1.00 0.00 C ATOM 2342 C ASP A 151 -14.301 20.262 -18.901 1.00 0.00 C ATOM 2343 O ASP A 151 -14.505 20.653 -17.747 1.00 0.00 O ATOM 2344 CB ASP A 151 -15.316 21.795 -20.618 1.00 0.00 C ATOM 2345 CG ASP A 151 -16.233 22.407 -19.543 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -15.924 23.515 -19.040 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -17.293 21.808 -19.235 1.00 0.00 O ATOM 0 H ASP A 151 -13.738 20.445 -21.899 1.00 0.00 H new ATOM 0 HA ASP A 151 -13.454 22.101 -19.558 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -15.095 22.544 -21.378 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -15.835 20.977 -21.118 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.296 18.962 -19.230 1.00 0.00 N ATOM 2353 CA LEU A 152 -14.760 17.893 -18.358 1.00 0.00 C ATOM 2354 C LEU A 152 -13.719 16.798 -18.163 1.00 0.00 C ATOM 2355 O LEU A 152 -13.935 15.929 -17.328 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.088 17.353 -18.903 1.00 0.00 C ATOM 2357 CG LEU A 152 -15.945 16.470 -20.157 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -15.848 14.979 -19.808 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.101 16.742 -21.119 1.00 0.00 C ATOM 0 H LEU A 152 -13.960 18.625 -20.132 1.00 0.00 H new ATOM 0 HA LEU A 152 -14.925 18.299 -17.360 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -16.581 16.776 -18.121 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -16.740 18.194 -19.137 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.008 16.733 -20.648 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -15.749 14.397 -20.724 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -14.978 14.810 -19.174 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -16.749 14.670 -19.278 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -16.994 16.114 -22.004 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.046 16.515 -20.626 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.089 17.791 -21.415 1.00 0.00 H new ATOM 2371 N SER A 153 -12.582 16.819 -18.864 1.00 0.00 N ATOM 2372 CA SER A 153 -11.510 15.842 -18.674 1.00 0.00 C ATOM 2373 C SER A 153 -11.133 15.753 -17.192 1.00 0.00 C ATOM 2374 O SER A 153 -10.873 14.670 -16.677 1.00 0.00 O ATOM 2375 CB SER A 153 -10.283 16.238 -19.516 1.00 0.00 C ATOM 2376 OG SER A 153 -10.511 16.014 -20.891 1.00 0.00 O ATOM 0 H SER A 153 -12.380 17.516 -19.581 1.00 0.00 H new ATOM 0 HA SER A 153 -11.860 14.863 -19.002 1.00 0.00 H new ATOM 0 HB2 SER A 153 -10.050 17.290 -19.350 1.00 0.00 H new ATOM 0 HB3 SER A 153 -9.415 15.664 -19.191 1.00 0.00 H new ATOM 0 HG SER A 153 -9.744 16.339 -21.407 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.217 16.878 -16.481 1.00 0.00 N ATOM 2383 CA ASP A 154 -10.990 16.974 -15.043 1.00 0.00 C ATOM 2384 C ASP A 154 -11.907 16.031 -14.267 1.00 0.00 C ATOM 2385 O ASP A 154 -11.464 15.321 -13.364 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.227 18.420 -14.594 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.046 18.569 -13.077 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -9.875 18.626 -12.636 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.057 18.658 -12.344 1.00 0.00 O ATOM 0 H ASP A 154 -11.453 17.775 -16.906 1.00 0.00 H new ATOM 0 HA ASP A 154 -9.961 16.680 -14.835 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.533 19.082 -15.112 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.234 18.730 -14.875 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.175 15.965 -14.662 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.206 15.182 -14.008 1.00 0.00 C ATOM 2396 C GLU A 155 -14.018 13.700 -14.336 1.00 0.00 C ATOM 2397 O GLU A 155 -14.254 12.828 -13.502 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.599 15.741 -14.374 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.394 14.907 -15.393 1.00 0.00 C ATOM 2400 CD GLU A 155 -17.783 15.490 -15.738 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.045 16.697 -15.516 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.640 14.723 -16.243 1.00 0.00 O ATOM 0 H GLU A 155 -13.520 16.475 -15.475 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.124 15.263 -12.924 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.189 15.828 -13.461 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.475 16.749 -14.771 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -15.810 14.820 -16.310 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.522 13.899 -15.000 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.535 13.403 -15.543 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.348 12.022 -15.979 1.00 0.00 C ATOM 2411 C ARG A 156 -12.113 11.443 -15.321 1.00 0.00 C ATOM 2412 O ARG A 156 -12.081 10.249 -15.039 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.298 11.947 -17.513 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.723 10.542 -17.969 1.00 0.00 C ATOM 2415 CD ARG A 156 -13.527 10.363 -19.470 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.173 9.115 -19.939 1.00 0.00 N ATOM 2417 CZ ARG A 156 -14.351 8.754 -21.218 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -13.677 9.358 -22.189 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -15.200 7.780 -21.515 1.00 0.00 N ATOM 0 H ARG A 156 -13.266 14.102 -16.235 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.197 11.415 -15.666 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -13.959 12.698 -17.947 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.291 12.167 -17.866 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.142 9.792 -17.432 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.770 10.376 -17.715 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.947 11.217 -20.001 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -12.462 10.336 -19.702 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.513 8.472 -19.224 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -13.017 10.103 -21.965 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -13.819 9.077 -23.159 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.715 7.308 -20.772 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.338 7.503 -22.487 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.110 12.272 -15.038 1.00 0.00 N ATOM 2434 CA ILE A 157 -9.902 11.817 -14.380 1.00 0.00 C ATOM 2435 C ILE A 157 -10.291 11.311 -13.005 1.00 0.00 C ATOM 2436 O ILE A 157 -9.994 10.175 -12.669 1.00 0.00 O ATOM 2437 CB ILE A 157 -8.832 12.931 -14.324 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.188 13.210 -15.696 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.742 12.490 -13.335 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.527 14.594 -15.763 1.00 0.00 C ATOM 0 H ILE A 157 -11.118 13.268 -15.259 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.442 11.007 -14.945 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.318 13.854 -14.008 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.442 12.444 -15.906 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -8.949 13.136 -16.473 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -6.972 13.259 -13.275 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.183 12.341 -12.350 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.296 11.556 -13.677 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.089 14.740 -16.750 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.276 15.364 -15.581 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.746 14.661 -15.006 1.00 0.00 H new ATOM 2452 N GLN A 158 -10.941 12.142 -12.204 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.277 11.793 -10.829 1.00 0.00 C ATOM 2454 C GLN A 158 -12.123 10.542 -10.756 1.00 0.00 C ATOM 2455 O GLN A 158 -11.822 9.650 -9.972 1.00 0.00 O ATOM 2456 CB GLN A 158 -11.918 12.956 -10.062 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.061 13.658 -10.775 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.270 15.069 -10.244 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.968 15.309 -9.262 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.636 16.022 -10.905 1.00 0.00 N ATOM 0 H GLN A 158 -11.250 13.073 -12.485 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.332 11.578 -10.330 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.285 12.580 -9.107 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -11.145 13.692 -9.840 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.854 13.698 -11.844 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.978 13.082 -10.649 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.065 15.786 -11.716 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.718 16.993 -10.604 1.00 0.00 H new ATOM 2469 N SER A 159 -13.105 10.429 -11.633 1.00 0.00 N ATOM 2470 CA SER A 159 -13.931 9.224 -11.650 1.00 0.00 C ATOM 2471 C SER A 159 -13.103 7.997 -12.047 1.00 0.00 C ATOM 2472 O SER A 159 -13.306 6.916 -11.496 1.00 0.00 O ATOM 2473 CB SER A 159 -15.119 9.390 -12.587 1.00 0.00 C ATOM 2474 OG SER A 159 -15.917 10.493 -12.184 1.00 0.00 O ATOM 0 H SER A 159 -13.350 11.134 -12.328 1.00 0.00 H new ATOM 0 HA SER A 159 -14.311 9.068 -10.640 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.767 9.541 -13.607 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.719 8.480 -12.588 1.00 0.00 H new ATOM 0 HG SER A 159 -15.522 11.323 -12.523 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.124 8.151 -12.949 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.235 7.056 -13.311 1.00 0.00 C ATOM 2482 C TRP A 160 -10.375 6.665 -12.126 1.00 0.00 C ATOM 2483 O TRP A 160 -10.244 5.495 -11.779 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.353 7.501 -14.471 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.517 6.399 -15.002 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.997 5.346 -15.693 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -8.066 6.256 -14.986 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.943 4.560 -16.097 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.734 5.068 -15.688 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.997 7.053 -14.531 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.414 4.669 -15.907 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.661 6.684 -14.780 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.370 5.493 -15.464 1.00 0.00 C ATOM 0 H TRP A 160 -11.934 9.026 -13.437 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.826 6.189 -13.608 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.981 7.895 -15.271 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.708 8.316 -14.142 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -11.040 5.151 -15.896 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -9.047 3.701 -16.637 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.205 7.960 -13.983 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -6.200 3.738 -16.411 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.856 7.320 -14.443 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.344 5.212 -15.649 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.835 7.677 -11.463 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.031 7.530 -10.280 1.00 0.00 C ATOM 2506 C CYS A 161 -9.824 6.787 -9.220 1.00 0.00 C ATOM 2507 O CYS A 161 -9.247 5.953 -8.528 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.594 8.909 -9.784 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.447 9.623 -10.987 1.00 0.00 S ATOM 0 H CYS A 161 -9.954 8.649 -11.750 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.135 6.951 -10.505 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.461 9.557 -9.658 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.115 8.825 -8.809 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.110 10.036 -12.027 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.135 7.031 -9.135 1.00 0.00 N ATOM 2516 CA GLU A 162 -11.945 6.418 -8.094 1.00 0.00 C ATOM 2517 C GLU A 162 -12.094 4.917 -8.319 1.00 0.00 C ATOM 2518 O GLU A 162 -12.192 4.171 -7.344 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.302 7.110 -7.934 1.00 0.00 C ATOM 2520 CG GLU A 162 -13.185 8.384 -7.091 1.00 0.00 C ATOM 2521 CD GLU A 162 -14.541 9.100 -6.958 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -15.352 8.708 -6.083 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -14.799 10.071 -7.708 1.00 0.00 O ATOM 0 H GLU A 162 -11.648 7.643 -9.770 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.415 6.556 -7.152 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.704 7.358 -8.917 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -14.008 6.425 -7.465 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -12.807 8.132 -6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -12.460 9.058 -7.547 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.044 4.443 -9.569 1.00 0.00 N ATOM 2531 CA GLN A 163 -11.998 3.011 -9.810 1.00 0.00 C ATOM 2532 C GLN A 163 -10.590 2.467 -9.649 1.00 0.00 C ATOM 2533 O GLN A 163 -10.431 1.478 -8.940 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.678 2.596 -11.113 1.00 0.00 C ATOM 2535 CG GLN A 163 -12.143 3.243 -12.393 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.716 2.571 -13.644 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.708 1.840 -13.608 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -12.093 2.793 -14.790 1.00 0.00 N ATOM 0 H GLN A 163 -12.035 5.022 -10.408 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.599 2.537 -9.034 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.592 1.514 -11.215 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.741 2.825 -11.032 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.397 4.303 -12.400 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -11.055 3.176 -12.409 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.273 3.399 -14.816 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.433 2.359 -15.648 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.546 3.097 -10.189 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.224 2.481 -10.156 1.00 0.00 C ATOM 2549 C ILE A 164 -7.742 2.355 -8.712 1.00 0.00 C ATOM 2550 O ILE A 164 -7.194 1.318 -8.342 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.220 3.173 -11.099 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.584 4.487 -10.596 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.798 3.277 -12.513 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.694 5.199 -11.631 1.00 0.00 C ATOM 0 H ILE A 164 -9.588 4.010 -10.643 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.302 1.470 -10.555 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.353 2.513 -11.119 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.379 5.167 -10.289 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -5.988 4.272 -9.709 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -7.076 3.768 -13.166 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -8.011 2.278 -12.894 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.719 3.859 -12.488 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.288 6.112 -11.195 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.875 4.540 -11.921 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.287 5.449 -12.510 1.00 0.00 H new ATOM 2566 N LEU A 165 -8.008 3.353 -7.864 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.620 3.325 -6.452 1.00 0.00 C ATOM 2568 C LEU A 165 -8.336 2.215 -5.680 1.00 0.00 C ATOM 2569 O LEU A 165 -7.924 1.891 -4.571 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.821 4.712 -5.801 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.271 5.172 -5.504 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.880 4.608 -4.214 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.306 6.701 -5.368 1.00 0.00 C ATOM 0 H LEU A 165 -8.499 4.204 -8.138 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.557 3.089 -6.405 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.268 4.724 -4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.361 5.456 -6.451 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.857 4.796 -6.342 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.895 4.987 -4.095 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.904 3.520 -4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.275 4.916 -3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.326 7.024 -5.159 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.653 7.009 -4.551 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.964 7.157 -6.297 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.388 1.629 -6.257 1.00 0.00 N ATOM 2586 CA ASN A 166 -10.074 0.469 -5.719 1.00 0.00 C ATOM 2587 C ASN A 166 -9.479 -0.763 -6.370 1.00 0.00 C ATOM 2588 O ASN A 166 -9.089 -1.679 -5.668 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.593 0.572 -5.950 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.289 1.347 -4.838 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.469 0.835 -3.737 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.684 2.589 -5.079 1.00 0.00 N ATOM 0 H ASN A 166 -9.790 1.962 -7.133 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.937 0.409 -4.639 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.782 1.061 -6.906 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -12.018 -0.429 -6.015 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -13.143 3.130 -4.346 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.529 3.004 -5.998 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.309 -0.769 -7.691 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.900 -1.955 -8.442 1.00 0.00 C ATOM 2601 C GLU A 167 -7.511 -2.430 -7.983 1.00 0.00 C ATOM 2602 O GLU A 167 -7.239 -3.627 -7.922 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.886 -1.643 -9.949 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.260 -1.447 -10.598 1.00 0.00 C ATOM 2605 CD GLU A 167 -10.117 -1.017 -12.071 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.963 0.198 -12.343 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 -10.121 -1.897 -12.965 1.00 0.00 O ATOM 0 H GLU A 167 -9.452 0.055 -8.275 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.617 -2.754 -8.253 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.296 -0.740 -10.109 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.373 -2.455 -10.465 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.830 -2.374 -10.540 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.822 -0.692 -10.048 1.00 0.00 H new ATOM 2614 N MET A 168 -6.640 -1.481 -7.627 1.00 0.00 N ATOM 2615 CA MET A 168 -5.275 -1.742 -7.183 1.00 0.00 C ATOM 2616 C MET A 168 -5.267 -2.132 -5.716 1.00 0.00 C ATOM 2617 O MET A 168 -4.611 -3.093 -5.343 1.00 0.00 O ATOM 2618 CB MET A 168 -4.399 -0.510 -7.492 1.00 0.00 C ATOM 2619 CG MET A 168 -4.420 -0.288 -9.006 1.00 0.00 C ATOM 2620 SD MET A 168 -3.432 1.033 -9.744 1.00 0.00 S ATOM 2621 CE MET A 168 -4.268 2.449 -9.024 1.00 0.00 C ATOM 0 H MET A 168 -6.874 -0.488 -7.641 1.00 0.00 H new ATOM 0 HA MET A 168 -4.850 -2.587 -7.725 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.779 0.369 -6.972 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.379 -0.670 -7.144 1.00 0.00 H new ATOM 0 HG2 MET A 168 -4.111 -1.223 -9.474 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.457 -0.115 -9.293 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.826 3.368 -9.410 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.326 2.418 -9.284 1.00 0.00 H new ATOM 0 HE3 MET A 168 -4.160 2.423 -7.940 1.00 0.00 H new ATOM 2631 N ALA A 169 -6.039 -1.431 -4.893 1.00 0.00 N ATOM 2632 CA ALA A 169 -6.062 -1.608 -3.446 1.00 0.00 C ATOM 2633 C ALA A 169 -6.707 -2.933 -3.063 1.00 0.00 C ATOM 2634 O ALA A 169 -6.215 -3.642 -2.193 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.843 -0.461 -2.796 1.00 0.00 C ATOM 0 H ALA A 169 -6.680 -0.708 -5.221 1.00 0.00 H new ATOM 0 HA ALA A 169 -5.032 -1.608 -3.090 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.858 -0.598 -1.715 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.363 0.488 -3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.865 -0.456 -3.175 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.799 -3.267 -3.739 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.590 -4.457 -3.497 1.00 0.00 C ATOM 2643 C GLU A 170 -7.814 -5.693 -3.961 1.00 0.00 C ATOM 2644 O GLU A 170 -7.941 -6.760 -3.358 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.931 -4.317 -4.228 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.809 -3.184 -3.653 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.485 -3.595 -2.332 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -12.582 -4.205 -2.368 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -10.933 -3.307 -1.243 1.00 0.00 O ATOM 0 H GLU A 170 -8.168 -2.693 -4.497 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.790 -4.575 -2.432 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.746 -4.126 -5.285 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.475 -5.260 -4.165 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -10.196 -2.298 -3.487 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.572 -2.911 -4.382 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.964 -5.554 -4.990 1.00 0.00 N ATOM 2657 CA HIS A 171 -6.017 -6.589 -5.362 1.00 0.00 C ATOM 2658 C HIS A 171 -4.975 -6.760 -4.251 1.00 0.00 C ATOM 2659 O HIS A 171 -4.671 -7.881 -3.837 1.00 0.00 O ATOM 2660 CB HIS A 171 -5.335 -6.197 -6.674 1.00 0.00 C ATOM 2661 CG HIS A 171 -4.189 -7.126 -6.999 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -4.289 -8.341 -7.682 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -2.910 -6.971 -6.553 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -3.061 -8.891 -7.623 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -2.211 -8.084 -6.965 1.00 0.00 N ATOM 0 H HIS A 171 -6.922 -4.722 -5.578 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.539 -7.536 -5.498 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -6.063 -6.218 -7.485 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.967 -5.174 -6.603 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -2.521 -6.138 -5.987 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -2.796 -9.849 -8.046 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -1.221 -8.264 -6.800 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.423 -5.635 -3.780 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.341 -5.592 -2.810 1.00 0.00 C ATOM 2675 C TYR A 172 -3.772 -6.005 -1.400 1.00 0.00 C ATOM 2676 O TYR A 172 -2.912 -6.223 -0.537 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.704 -4.190 -2.836 1.00 0.00 C ATOM 2678 CG TYR A 172 -1.207 -4.207 -3.006 1.00 0.00 C ATOM 2679 CD1 TYR A 172 -0.359 -4.377 -1.899 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -0.679 -4.073 -4.300 1.00 0.00 C ATOM 2681 CE1 TYR A 172 1.031 -4.454 -2.091 1.00 0.00 C ATOM 2682 CE2 TYR A 172 0.708 -4.144 -4.499 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.568 -4.365 -3.397 1.00 0.00 C ATOM 2684 OH TYR A 172 2.906 -4.516 -3.581 1.00 0.00 O ATOM 0 H TYR A 172 -4.731 -4.709 -4.076 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.597 -6.335 -3.098 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -3.146 -3.615 -3.649 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -2.949 -3.672 -1.909 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.774 -4.448 -0.904 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.339 -3.916 -5.140 1.00 0.00 H new ATOM 0 HE1 TYR A 172 1.688 -4.581 -1.243 1.00 0.00 H new ATOM 0 HE2 TYR A 172 1.119 -4.030 -5.491 1.00 0.00 H new ATOM 0 HH TYR A 172 3.098 -4.590 -4.539 1.00 0.00 H new ATOM 2694 N ALA A 173 -5.081 -6.111 -1.156 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.614 -6.462 0.143 1.00 0.00 C ATOM 2696 C ALA A 173 -5.328 -7.929 0.469 1.00 0.00 C ATOM 2697 O ALA A 173 -5.555 -8.808 -0.395 1.00 0.00 O ATOM 2698 CB ALA A 173 -7.113 -6.148 0.217 1.00 0.00 C ATOM 2699 OXT ALA A 173 -4.899 -8.207 1.612 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.797 -5.953 -1.865 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.113 -5.855 0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.493 -6.419 1.202 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.270 -5.083 0.048 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.642 -6.718 -0.546 1.00 0.00 H new