USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 952 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -2.96 K(o=-3,f=-4.2!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 65:sc= 0.0806 USER MOD Single : A 17 SER OG : rot 46:sc= 0.955 USER MOD Single : A 18 ASN : amide:sc= -0.135 X(o=-0.14,f=-0.35) USER MOD Single : A 20 SER OG : rot 41:sc= 0.0572 USER MOD Single : A 21 SER OG : rot 40:sc= 1.11 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= -0.816 K(o=-0.82,f=-3.6!) USER MOD Single : A 41 CYS SG : rot 180:sc= -1.11 USER MOD Single : A 43 HIS : no HD1:sc= -0.0415 X(o=-0.041,f=-0.052) USER MOD Single : A 44 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.0925) USER MOD Single : A 46 THR OG1 : rot -149:sc= -3.2 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 46:sc= 0.281 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.297 USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 62 LYS NZ :NH3+ 148:sc= -0.0764 (180deg=-1.9) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.52 K(o=-0.52,f=-1.5) USER MOD Single : A 74 THR OG1 : rot 31:sc= 0.4 USER MOD Single : A 82 THR OG1 : rot 133:sc= 0.127 USER MOD Single : A 86 SER OG : rot 180:sc= -0.19 USER MOD Single : A 91 GLN : amide:sc= -0.226 X(o=-0.23,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 CYS SG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 133:sc= -1.09 (180deg=-5.21!) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0.00305 USER MOD Single : A 106 GLN : amide:sc= -3.5! C(o=-3.5!,f=-7.3!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.432 X(o=-0.43,f=-0.16) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.083) USER MOD Single : A 122 HIS : no HD1:sc= -0.678 K(o=-0.68,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 81.530 -57.089 12.578 1.00 0.00 N ATOM 2 CA MET A 1 80.760 -56.708 13.800 1.00 0.00 C ATOM 3 C MET A 1 79.314 -57.200 13.687 1.00 0.00 C ATOM 4 O MET A 1 78.408 -56.436 13.419 1.00 0.00 O ATOM 5 CB MET A 1 80.806 -55.181 13.836 1.00 0.00 C ATOM 6 CG MET A 1 80.288 -54.685 15.190 1.00 0.00 C ATOM 7 SD MET A 1 79.308 -53.182 14.955 1.00 0.00 S ATOM 8 CE MET A 1 80.694 -52.024 14.843 1.00 0.00 C ATOM 0 H1 MET A 1 82.509 -56.750 12.665 1.00 0.00 H new ATOM 0 H2 MET A 1 81.529 -58.124 12.476 1.00 0.00 H new ATOM 0 H3 MET A 1 81.088 -56.658 11.741 1.00 0.00 H new ATOM 0 HA MET A 1 81.176 -57.149 14.706 1.00 0.00 H new ATOM 0 HB2 MET A 1 81.827 -54.834 13.676 1.00 0.00 H new ATOM 0 HB3 MET A 1 80.199 -54.769 13.030 1.00 0.00 H new ATOM 0 HG2 MET A 1 79.680 -55.457 15.663 1.00 0.00 H new ATOM 0 HG3 MET A 1 81.125 -54.484 15.859 1.00 0.00 H new ATOM 0 HE1 MET A 1 80.313 -51.014 14.694 1.00 0.00 H new ATOM 0 HE2 MET A 1 81.274 -52.061 15.765 1.00 0.00 H new ATOM 0 HE3 MET A 1 81.331 -52.299 14.002 1.00 0.00 H new ATOM 17 N GLU A 2 79.094 -58.472 13.890 1.00 0.00 N ATOM 18 CA GLU A 2 77.709 -59.014 13.794 1.00 0.00 C ATOM 19 C GLU A 2 77.541 -60.212 14.733 1.00 0.00 C ATOM 20 O GLU A 2 78.461 -60.976 14.950 1.00 0.00 O ATOM 21 CB GLU A 2 77.552 -59.449 12.336 1.00 0.00 C ATOM 22 CG GLU A 2 77.624 -58.221 11.427 1.00 0.00 C ATOM 23 CD GLU A 2 77.136 -58.596 10.026 1.00 0.00 C ATOM 24 OE1 GLU A 2 77.428 -59.698 9.593 1.00 0.00 O ATOM 25 OE2 GLU A 2 76.477 -57.774 9.411 1.00 0.00 O ATOM 0 H GLU A 2 79.814 -59.158 14.118 1.00 0.00 H new ATOM 0 HA GLU A 2 76.958 -58.278 14.083 1.00 0.00 H new ATOM 0 HB2 GLU A 2 78.336 -60.158 12.070 1.00 0.00 H new ATOM 0 HB3 GLU A 2 76.600 -59.961 12.199 1.00 0.00 H new ATOM 0 HG2 GLU A 2 77.011 -57.417 11.834 1.00 0.00 H new ATOM 0 HG3 GLU A 2 78.648 -57.849 11.380 1.00 0.00 H new ATOM 32 N TYR A 3 76.372 -60.381 15.292 1.00 0.00 N ATOM 33 CA TYR A 3 76.142 -61.530 16.217 1.00 0.00 C ATOM 34 C TYR A 3 74.771 -62.156 15.950 1.00 0.00 C ATOM 35 O TYR A 3 74.670 -63.279 15.496 1.00 0.00 O ATOM 36 CB TYR A 3 76.194 -60.922 17.620 1.00 0.00 C ATOM 37 CG TYR A 3 76.008 -62.012 18.651 1.00 0.00 C ATOM 38 CD1 TYR A 3 77.020 -62.957 18.861 1.00 0.00 C ATOM 39 CD2 TYR A 3 74.824 -62.075 19.395 1.00 0.00 C ATOM 40 CE1 TYR A 3 76.846 -63.965 19.814 1.00 0.00 C ATOM 41 CE2 TYR A 3 74.651 -63.085 20.349 1.00 0.00 C ATOM 42 CZ TYR A 3 75.662 -64.030 20.559 1.00 0.00 C ATOM 43 OH TYR A 3 75.491 -65.024 21.500 1.00 0.00 O ATOM 0 H TYR A 3 75.566 -59.773 15.148 1.00 0.00 H new ATOM 0 HA TYR A 3 76.881 -62.321 16.089 1.00 0.00 H new ATOM 0 HB2 TYR A 3 77.149 -60.420 17.775 1.00 0.00 H new ATOM 0 HB3 TYR A 3 75.416 -60.167 17.729 1.00 0.00 H new ATOM 0 HD1 TYR A 3 77.934 -62.907 18.287 1.00 0.00 H new ATOM 0 HD2 TYR A 3 74.045 -61.345 19.233 1.00 0.00 H new ATOM 0 HE1 TYR A 3 77.626 -64.695 19.976 1.00 0.00 H new ATOM 0 HE2 TYR A 3 73.737 -63.135 20.923 1.00 0.00 H new ATOM 0 HH TYR A 3 74.615 -64.923 21.927 1.00 0.00 H new ATOM 53 N LEU A 4 73.716 -61.437 16.223 1.00 0.00 N ATOM 54 CA LEU A 4 72.350 -61.988 15.985 1.00 0.00 C ATOM 55 C LEU A 4 71.329 -60.850 15.903 1.00 0.00 C ATOM 56 O LEU A 4 71.124 -60.118 16.852 1.00 0.00 O ATOM 57 CB LEU A 4 72.065 -62.882 17.194 1.00 0.00 C ATOM 58 CG LEU A 4 71.496 -64.223 16.720 1.00 0.00 C ATOM 59 CD1 LEU A 4 72.611 -65.267 16.684 1.00 0.00 C ATOM 60 CD2 LEU A 4 70.401 -64.684 17.685 1.00 0.00 C ATOM 0 H LEU A 4 73.741 -60.490 16.601 1.00 0.00 H new ATOM 0 HA LEU A 4 72.285 -62.541 15.048 1.00 0.00 H new ATOM 0 HB2 LEU A 4 72.981 -63.045 17.762 1.00 0.00 H new ATOM 0 HB3 LEU A 4 71.358 -62.392 17.863 1.00 0.00 H new ATOM 0 HG LEU A 4 71.076 -64.104 15.721 1.00 0.00 H new ATOM 0 HD11 LEU A 4 72.206 -66.221 16.347 1.00 0.00 H new ATOM 0 HD12 LEU A 4 73.392 -64.941 15.997 1.00 0.00 H new ATOM 0 HD13 LEU A 4 73.032 -65.384 17.683 1.00 0.00 H new ATOM 0 HD21 LEU A 4 69.996 -65.638 17.347 1.00 0.00 H new ATOM 0 HD22 LEU A 4 70.822 -64.801 18.684 1.00 0.00 H new ATOM 0 HD23 LEU A 4 69.604 -63.941 17.712 1.00 0.00 H new ATOM 72 N SER A 5 70.687 -60.696 14.775 1.00 0.00 N ATOM 73 CA SER A 5 69.680 -59.607 14.627 1.00 0.00 C ATOM 74 C SER A 5 68.418 -60.142 13.944 1.00 0.00 C ATOM 75 O SER A 5 68.257 -61.333 13.765 1.00 0.00 O ATOM 76 CB SER A 5 70.359 -58.557 13.750 1.00 0.00 C ATOM 77 OG SER A 5 71.606 -58.197 14.329 1.00 0.00 O ATOM 0 H SER A 5 70.818 -61.279 13.949 1.00 0.00 H new ATOM 0 HA SER A 5 69.371 -59.197 15.589 1.00 0.00 H new ATOM 0 HB2 SER A 5 70.512 -58.950 12.745 1.00 0.00 H new ATOM 0 HB3 SER A 5 69.721 -57.678 13.656 1.00 0.00 H new ATOM 0 HG SER A 5 72.045 -57.524 13.768 1.00 0.00 H new ATOM 83 N ALA A 6 67.523 -59.270 13.561 1.00 0.00 N ATOM 84 CA ALA A 6 66.273 -59.725 12.889 1.00 0.00 C ATOM 85 C ALA A 6 65.828 -58.697 11.844 1.00 0.00 C ATOM 86 O ALA A 6 65.709 -59.000 10.674 1.00 0.00 O ATOM 87 CB ALA A 6 65.238 -59.832 14.007 1.00 0.00 C ATOM 0 H ALA A 6 67.605 -58.261 13.685 1.00 0.00 H new ATOM 0 HA ALA A 6 66.408 -60.672 12.366 1.00 0.00 H new ATOM 0 HB1 ALA A 6 64.286 -60.163 13.591 1.00 0.00 H new ATOM 0 HB2 ALA A 6 65.579 -60.552 14.751 1.00 0.00 H new ATOM 0 HB3 ALA A 6 65.109 -58.857 14.478 1.00 0.00 H new ATOM 93 N LEU A 7 65.583 -57.484 12.262 1.00 0.00 N ATOM 94 CA LEU A 7 65.145 -56.435 11.296 1.00 0.00 C ATOM 95 C LEU A 7 65.382 -55.043 11.885 1.00 0.00 C ATOM 96 O LEU A 7 65.896 -54.159 11.227 1.00 0.00 O ATOM 97 CB LEU A 7 63.649 -56.687 11.089 1.00 0.00 C ATOM 98 CG LEU A 7 63.357 -56.847 9.596 1.00 0.00 C ATOM 99 CD1 LEU A 7 61.986 -57.502 9.412 1.00 0.00 C ATOM 100 CD2 LEU A 7 63.358 -55.471 8.925 1.00 0.00 C ATOM 0 H LEU A 7 65.667 -57.174 13.230 1.00 0.00 H new ATOM 0 HA LEU A 7 65.698 -56.479 10.358 1.00 0.00 H new ATOM 0 HB2 LEU A 7 63.343 -57.584 11.628 1.00 0.00 H new ATOM 0 HB3 LEU A 7 63.071 -55.858 11.496 1.00 0.00 H new ATOM 0 HG LEU A 7 64.124 -57.474 9.141 1.00 0.00 H new ATOM 0 HD11 LEU A 7 61.777 -57.616 8.348 1.00 0.00 H new ATOM 0 HD12 LEU A 7 61.984 -58.482 9.890 1.00 0.00 H new ATOM 0 HD13 LEU A 7 61.219 -56.875 9.867 1.00 0.00 H new ATOM 0 HD21 LEU A 7 63.150 -55.585 7.861 1.00 0.00 H new ATOM 0 HD22 LEU A 7 62.591 -54.844 9.380 1.00 0.00 H new ATOM 0 HD23 LEU A 7 64.334 -55.003 9.056 1.00 0.00 H new ATOM 112 N ASN A 8 65.010 -54.841 13.120 1.00 0.00 N ATOM 113 CA ASN A 8 65.213 -53.506 13.755 1.00 0.00 C ATOM 114 C ASN A 8 66.122 -53.633 14.985 1.00 0.00 C ATOM 115 O ASN A 8 66.292 -54.711 15.518 1.00 0.00 O ATOM 116 CB ASN A 8 63.812 -53.040 14.167 1.00 0.00 C ATOM 117 CG ASN A 8 63.149 -54.100 15.052 1.00 0.00 C ATOM 118 OD1 ASN A 8 63.821 -54.884 15.692 1.00 0.00 O ATOM 119 ND2 ASN A 8 61.846 -54.155 15.116 1.00 0.00 N ATOM 0 H ASN A 8 64.574 -55.543 13.718 1.00 0.00 H new ATOM 0 HA ASN A 8 65.693 -52.799 13.078 1.00 0.00 H new ATOM 0 HB2 ASN A 8 63.877 -52.094 14.705 1.00 0.00 H new ATOM 0 HB3 ASN A 8 63.203 -52.861 13.281 1.00 0.00 H new ATOM 0 HD21 ASN A 8 61.393 -54.856 15.703 1.00 0.00 H new ATOM 0 HD22 ASN A 8 61.281 -53.497 14.579 1.00 0.00 H new ATOM 126 N PRO A 9 66.678 -52.521 15.396 1.00 0.00 N ATOM 127 CA PRO A 9 67.577 -52.516 16.576 1.00 0.00 C ATOM 128 C PRO A 9 66.769 -52.689 17.865 1.00 0.00 C ATOM 129 O PRO A 9 67.188 -53.360 18.786 1.00 0.00 O ATOM 130 CB PRO A 9 68.229 -51.137 16.523 1.00 0.00 C ATOM 131 CG PRO A 9 67.266 -50.281 15.766 1.00 0.00 C ATOM 132 CD PRO A 9 66.526 -51.183 14.811 1.00 0.00 C ATOM 0 HA PRO A 9 68.305 -53.327 16.564 1.00 0.00 H new ATOM 0 HB2 PRO A 9 68.403 -50.744 17.525 1.00 0.00 H new ATOM 0 HB3 PRO A 9 69.197 -51.177 16.024 1.00 0.00 H new ATOM 0 HG2 PRO A 9 66.572 -49.788 16.446 1.00 0.00 H new ATOM 0 HG3 PRO A 9 67.793 -49.496 15.224 1.00 0.00 H new ATOM 0 HD2 PRO A 9 65.476 -50.901 14.728 1.00 0.00 H new ATOM 0 HD3 PRO A 9 66.950 -51.136 13.808 1.00 0.00 H new ATOM 140 N SER A 10 65.611 -52.087 17.932 1.00 0.00 N ATOM 141 CA SER A 10 64.771 -52.215 19.159 1.00 0.00 C ATOM 142 C SER A 10 63.311 -51.879 18.838 1.00 0.00 C ATOM 143 O SER A 10 62.450 -52.737 18.858 1.00 0.00 O ATOM 144 CB SER A 10 65.350 -51.199 20.144 1.00 0.00 C ATOM 145 OG SER A 10 64.526 -51.143 21.299 1.00 0.00 O ATOM 0 H SER A 10 65.211 -51.512 17.190 1.00 0.00 H new ATOM 0 HA SER A 10 64.783 -53.227 19.563 1.00 0.00 H new ATOM 0 HB2 SER A 10 66.366 -51.482 20.421 1.00 0.00 H new ATOM 0 HB3 SER A 10 65.409 -50.216 19.677 1.00 0.00 H new ATOM 0 HG SER A 10 64.895 -50.494 21.933 1.00 0.00 H new ATOM 151 N ASP A 11 63.029 -50.638 18.543 1.00 0.00 N ATOM 152 CA ASP A 11 61.627 -50.245 18.221 1.00 0.00 C ATOM 153 C ASP A 11 61.615 -49.171 17.127 1.00 0.00 C ATOM 154 O ASP A 11 62.608 -48.517 16.876 1.00 0.00 O ATOM 155 CB ASP A 11 61.056 -49.694 19.532 1.00 0.00 C ATOM 156 CG ASP A 11 61.827 -48.439 19.955 1.00 0.00 C ATOM 157 OD1 ASP A 11 63.012 -48.371 19.673 1.00 0.00 O ATOM 158 OD2 ASP A 11 61.219 -47.569 20.554 1.00 0.00 O ATOM 0 H ASP A 11 63.710 -49.879 18.511 1.00 0.00 H new ATOM 0 HA ASP A 11 61.039 -51.082 17.845 1.00 0.00 H new ATOM 0 HB2 ASP A 11 60.000 -49.456 19.406 1.00 0.00 H new ATOM 0 HB3 ASP A 11 61.122 -50.451 20.313 1.00 0.00 H new ATOM 163 N LEU A 12 60.497 -48.988 16.476 1.00 0.00 N ATOM 164 CA LEU A 12 60.415 -47.958 15.399 1.00 0.00 C ATOM 165 C LEU A 12 58.955 -47.574 15.143 1.00 0.00 C ATOM 166 O LEU A 12 58.274 -48.179 14.339 1.00 0.00 O ATOM 167 CB LEU A 12 61.024 -48.624 14.161 1.00 0.00 C ATOM 168 CG LEU A 12 60.295 -49.940 13.865 1.00 0.00 C ATOM 169 CD1 LEU A 12 59.682 -49.886 12.463 1.00 0.00 C ATOM 170 CD2 LEU A 12 61.289 -51.103 13.937 1.00 0.00 C ATOM 0 H LEU A 12 59.636 -49.508 16.644 1.00 0.00 H new ATOM 0 HA LEU A 12 60.941 -47.041 15.665 1.00 0.00 H new ATOM 0 HB2 LEU A 12 60.949 -47.955 13.303 1.00 0.00 H new ATOM 0 HB3 LEU A 12 62.085 -48.814 14.324 1.00 0.00 H new ATOM 0 HG LEU A 12 59.505 -50.086 14.602 1.00 0.00 H new ATOM 0 HD11 LEU A 12 59.165 -50.823 12.256 1.00 0.00 H new ATOM 0 HD12 LEU A 12 58.973 -49.060 12.407 1.00 0.00 H new ATOM 0 HD13 LEU A 12 60.471 -49.737 11.726 1.00 0.00 H new ATOM 0 HD21 LEU A 12 60.770 -52.038 13.727 1.00 0.00 H new ATOM 0 HD22 LEU A 12 62.079 -50.953 13.201 1.00 0.00 H new ATOM 0 HD23 LEU A 12 61.726 -51.147 14.935 1.00 0.00 H new ATOM 182 N LEU A 13 58.470 -46.568 15.825 1.00 0.00 N ATOM 183 CA LEU A 13 57.055 -46.142 15.625 1.00 0.00 C ATOM 184 C LEU A 13 57.005 -44.704 15.097 1.00 0.00 C ATOM 185 O LEU A 13 57.430 -43.777 15.759 1.00 0.00 O ATOM 186 CB LEU A 13 56.415 -46.227 17.012 1.00 0.00 C ATOM 187 CG LEU A 13 55.836 -47.626 17.223 1.00 0.00 C ATOM 188 CD1 LEU A 13 55.562 -47.845 18.712 1.00 0.00 C ATOM 189 CD2 LEU A 13 54.529 -47.761 16.441 1.00 0.00 C ATOM 0 H LEU A 13 58.994 -46.024 16.511 1.00 0.00 H new ATOM 0 HA LEU A 13 56.535 -46.766 14.898 1.00 0.00 H new ATOM 0 HB2 LEU A 13 57.157 -46.010 17.780 1.00 0.00 H new ATOM 0 HB3 LEU A 13 55.629 -45.478 17.108 1.00 0.00 H new ATOM 0 HG LEU A 13 56.550 -48.371 16.870 1.00 0.00 H new ATOM 0 HD11 LEU A 13 55.149 -48.842 18.863 1.00 0.00 H new ATOM 0 HD12 LEU A 13 56.493 -47.749 19.271 1.00 0.00 H new ATOM 0 HD13 LEU A 13 54.849 -47.100 19.064 1.00 0.00 H new ATOM 0 HD21 LEU A 13 54.116 -48.759 16.592 1.00 0.00 H new ATOM 0 HD22 LEU A 13 53.816 -47.016 16.793 1.00 0.00 H new ATOM 0 HD23 LEU A 13 54.722 -47.605 15.380 1.00 0.00 H new ATOM 201 N ARG A 14 56.487 -44.514 13.915 1.00 0.00 N ATOM 202 CA ARG A 14 56.408 -43.138 13.344 1.00 0.00 C ATOM 203 C ARG A 14 54.951 -42.766 13.060 1.00 0.00 C ATOM 204 O ARG A 14 54.230 -43.497 12.410 1.00 0.00 O ATOM 205 CB ARG A 14 57.209 -43.201 12.042 1.00 0.00 C ATOM 206 CG ARG A 14 57.622 -41.785 11.623 1.00 0.00 C ATOM 207 CD ARG A 14 59.140 -41.730 11.427 1.00 0.00 C ATOM 208 NE ARG A 14 59.344 -40.882 10.219 1.00 0.00 N ATOM 209 CZ ARG A 14 60.541 -40.464 9.912 1.00 0.00 C ATOM 210 NH1 ARG A 14 61.521 -41.319 9.796 1.00 0.00 N ATOM 211 NH2 ARG A 14 60.761 -39.191 9.723 1.00 0.00 N ATOM 0 H ARG A 14 56.114 -45.253 13.318 1.00 0.00 H new ATOM 0 HA ARG A 14 56.801 -42.385 14.027 1.00 0.00 H new ATOM 0 HB2 ARG A 14 58.093 -43.824 12.177 1.00 0.00 H new ATOM 0 HB3 ARG A 14 56.611 -43.663 11.257 1.00 0.00 H new ATOM 0 HG2 ARG A 14 57.115 -41.506 10.699 1.00 0.00 H new ATOM 0 HG3 ARG A 14 57.317 -41.066 12.384 1.00 0.00 H new ATOM 0 HD2 ARG A 14 59.635 -41.301 12.298 1.00 0.00 H new ATOM 0 HD3 ARG A 14 59.556 -42.727 11.283 1.00 0.00 H new ATOM 0 HE ARG A 14 58.549 -40.629 9.633 1.00 0.00 H new ATOM 0 HH11 ARG A 14 61.351 -42.313 9.945 1.00 0.00 H new ATOM 0 HH12 ARG A 14 62.457 -40.992 9.556 1.00 0.00 H new ATOM 0 HH21 ARG A 14 59.997 -38.522 9.815 1.00 0.00 H new ATOM 0 HH22 ARG A 14 61.697 -38.865 9.483 1.00 0.00 H new ATOM 225 N SER A 15 54.511 -41.635 13.544 1.00 0.00 N ATOM 226 CA SER A 15 53.101 -41.214 13.304 1.00 0.00 C ATOM 227 C SER A 15 52.924 -39.733 13.648 1.00 0.00 C ATOM 228 O SER A 15 52.248 -39.382 14.595 1.00 0.00 O ATOM 229 CB SER A 15 52.263 -42.087 14.237 1.00 0.00 C ATOM 230 OG SER A 15 52.803 -42.021 15.551 1.00 0.00 O ATOM 0 H SER A 15 55.069 -40.984 14.096 1.00 0.00 H new ATOM 0 HA SER A 15 52.806 -41.333 12.261 1.00 0.00 H new ATOM 0 HB2 SER A 15 51.227 -41.747 14.239 1.00 0.00 H new ATOM 0 HB3 SER A 15 52.260 -43.118 13.884 1.00 0.00 H new ATOM 0 HG SER A 15 52.718 -41.107 15.894 1.00 0.00 H new ATOM 236 N VAL A 16 53.527 -38.861 12.884 1.00 0.00 N ATOM 237 CA VAL A 16 53.394 -37.401 13.164 1.00 0.00 C ATOM 238 C VAL A 16 52.637 -36.714 12.023 1.00 0.00 C ATOM 239 O VAL A 16 53.204 -36.394 10.996 1.00 0.00 O ATOM 240 CB VAL A 16 54.829 -36.877 13.253 1.00 0.00 C ATOM 241 CG1 VAL A 16 54.813 -35.376 13.556 1.00 0.00 C ATOM 242 CG2 VAL A 16 55.575 -37.611 14.372 1.00 0.00 C ATOM 0 H VAL A 16 54.106 -39.097 12.078 1.00 0.00 H new ATOM 0 HA VAL A 16 52.836 -37.205 14.080 1.00 0.00 H new ATOM 0 HB VAL A 16 55.333 -37.050 12.302 1.00 0.00 H new ATOM 0 HG11 VAL A 16 55.837 -35.007 13.619 1.00 0.00 H new ATOM 0 HG12 VAL A 16 54.285 -34.850 12.761 1.00 0.00 H new ATOM 0 HG13 VAL A 16 54.306 -35.202 14.505 1.00 0.00 H new ATOM 0 HG21 VAL A 16 56.597 -37.237 14.434 1.00 0.00 H new ATOM 0 HG22 VAL A 16 55.067 -37.439 15.321 1.00 0.00 H new ATOM 0 HG23 VAL A 16 55.592 -38.680 14.158 1.00 0.00 H new ATOM 252 N SER A 17 51.363 -36.487 12.196 1.00 0.00 N ATOM 253 CA SER A 17 50.569 -35.820 11.122 1.00 0.00 C ATOM 254 C SER A 17 49.204 -35.388 11.665 1.00 0.00 C ATOM 255 O SER A 17 48.415 -36.202 12.108 1.00 0.00 O ATOM 256 CB SER A 17 50.400 -36.884 10.037 1.00 0.00 C ATOM 257 OG SER A 17 51.360 -36.663 9.011 1.00 0.00 O ATOM 0 H SER A 17 50.837 -36.734 13.034 1.00 0.00 H new ATOM 0 HA SER A 17 51.059 -34.923 10.742 1.00 0.00 H new ATOM 0 HB2 SER A 17 50.528 -37.879 10.463 1.00 0.00 H new ATOM 0 HB3 SER A 17 49.392 -36.842 9.624 1.00 0.00 H new ATOM 0 HG SER A 17 52.237 -36.496 9.414 1.00 0.00 H new ATOM 263 N ASN A 18 48.920 -34.115 11.635 1.00 0.00 N ATOM 264 CA ASN A 18 47.608 -33.626 12.150 1.00 0.00 C ATOM 265 C ASN A 18 46.864 -32.850 11.056 1.00 0.00 C ATOM 266 O ASN A 18 47.449 -32.431 10.078 1.00 0.00 O ATOM 267 CB ASN A 18 47.956 -32.707 13.324 1.00 0.00 C ATOM 268 CG ASN A 18 48.848 -31.561 12.838 1.00 0.00 C ATOM 269 OD1 ASN A 18 48.359 -30.550 12.374 1.00 0.00 O ATOM 270 ND2 ASN A 18 50.145 -31.679 12.924 1.00 0.00 N ATOM 0 H ASN A 18 49.541 -33.390 11.275 1.00 0.00 H new ATOM 0 HA ASN A 18 46.955 -34.443 12.456 1.00 0.00 H new ATOM 0 HB2 ASN A 18 47.044 -32.307 13.768 1.00 0.00 H new ATOM 0 HB3 ASN A 18 48.468 -33.273 14.102 1.00 0.00 H new ATOM 0 HD21 ASN A 18 50.748 -30.922 12.602 1.00 0.00 H new ATOM 0 HD22 ASN A 18 50.555 -32.528 13.314 1.00 0.00 H new ATOM 277 N ILE A 19 45.580 -32.657 11.223 1.00 0.00 N ATOM 278 CA ILE A 19 44.782 -31.909 10.201 1.00 0.00 C ATOM 279 C ILE A 19 43.302 -31.899 10.601 1.00 0.00 C ATOM 280 O ILE A 19 42.682 -32.933 10.750 1.00 0.00 O ATOM 281 CB ILE A 19 44.968 -32.674 8.882 1.00 0.00 C ATOM 282 CG1 ILE A 19 44.149 -31.995 7.780 1.00 0.00 C ATOM 283 CG2 ILE A 19 44.491 -34.118 9.050 1.00 0.00 C ATOM 284 CD1 ILE A 19 44.729 -30.609 7.492 1.00 0.00 C ATOM 0 H ILE A 19 45.046 -32.987 12.027 1.00 0.00 H new ATOM 0 HA ILE A 19 45.107 -30.873 10.112 1.00 0.00 H new ATOM 0 HB ILE A 19 46.024 -32.671 8.610 1.00 0.00 H new ATOM 0 HG12 ILE A 19 44.164 -32.602 6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 19 43.107 -31.908 8.088 1.00 0.00 H new ATOM 0 HG21 ILE A 19 44.625 -34.657 8.112 1.00 0.00 H new ATOM 0 HG22 ILE A 19 45.072 -34.604 9.834 1.00 0.00 H new ATOM 0 HG23 ILE A 19 43.436 -34.123 9.324 1.00 0.00 H new ATOM 0 HD11 ILE A 19 44.146 -30.126 6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 19 44.691 -30.003 8.397 1.00 0.00 H new ATOM 0 HD13 ILE A 19 45.764 -30.708 7.165 1.00 0.00 H new ATOM 296 N SER A 20 42.734 -30.734 10.773 1.00 0.00 N ATOM 297 CA SER A 20 41.295 -30.651 11.160 1.00 0.00 C ATOM 298 C SER A 20 40.736 -29.267 10.823 1.00 0.00 C ATOM 299 O SER A 20 41.344 -28.255 11.116 1.00 0.00 O ATOM 300 CB SER A 20 41.278 -30.883 12.671 1.00 0.00 C ATOM 301 OG SER A 20 42.281 -30.081 13.279 1.00 0.00 O ATOM 0 H SER A 20 43.205 -29.836 10.662 1.00 0.00 H new ATOM 0 HA SER A 20 40.681 -31.379 10.629 1.00 0.00 H new ATOM 0 HB2 SER A 20 40.299 -30.632 13.078 1.00 0.00 H new ATOM 0 HB3 SER A 20 41.455 -31.936 12.891 1.00 0.00 H new ATOM 0 HG SER A 20 42.298 -29.199 12.852 1.00 0.00 H new ATOM 307 N SER A 21 39.586 -29.214 10.207 1.00 0.00 N ATOM 308 CA SER A 21 38.989 -27.893 9.849 1.00 0.00 C ATOM 309 C SER A 21 37.466 -27.943 9.995 1.00 0.00 C ATOM 310 O SER A 21 36.773 -28.510 9.175 1.00 0.00 O ATOM 311 CB SER A 21 39.381 -27.666 8.390 1.00 0.00 C ATOM 312 OG SER A 21 38.719 -28.620 7.570 1.00 0.00 O ATOM 0 H SER A 21 39.033 -30.027 9.936 1.00 0.00 H new ATOM 0 HA SER A 21 39.342 -27.090 10.496 1.00 0.00 H new ATOM 0 HB2 SER A 21 39.111 -26.656 8.082 1.00 0.00 H new ATOM 0 HB3 SER A 21 40.461 -27.757 8.274 1.00 0.00 H new ATOM 0 HG SER A 21 37.804 -28.752 7.895 1.00 0.00 H new ATOM 318 N GLU A 22 36.944 -27.350 11.036 1.00 0.00 N ATOM 319 CA GLU A 22 35.464 -27.360 11.238 1.00 0.00 C ATOM 320 C GLU A 22 34.833 -26.128 10.582 1.00 0.00 C ATOM 321 O GLU A 22 34.399 -25.211 11.251 1.00 0.00 O ATOM 322 CB GLU A 22 35.274 -27.319 12.755 1.00 0.00 C ATOM 323 CG GLU A 22 35.717 -28.651 13.363 1.00 0.00 C ATOM 324 CD GLU A 22 36.354 -28.403 14.730 1.00 0.00 C ATOM 325 OE1 GLU A 22 35.622 -28.113 15.662 1.00 0.00 O ATOM 326 OE2 GLU A 22 37.567 -28.506 14.825 1.00 0.00 O ATOM 0 H GLU A 22 37.477 -26.860 11.754 1.00 0.00 H new ATOM 0 HA GLU A 22 34.990 -28.234 10.791 1.00 0.00 H new ATOM 0 HB2 GLU A 22 35.854 -26.501 13.183 1.00 0.00 H new ATOM 0 HB3 GLU A 22 34.228 -27.127 12.996 1.00 0.00 H new ATOM 0 HG2 GLU A 22 34.861 -29.318 13.465 1.00 0.00 H new ATOM 0 HG3 GLU A 22 36.430 -29.145 12.702 1.00 0.00 H new ATOM 333 N PHE A 23 34.782 -26.101 9.277 1.00 0.00 N ATOM 334 CA PHE A 23 34.179 -24.930 8.576 1.00 0.00 C ATOM 335 C PHE A 23 32.652 -25.032 8.592 1.00 0.00 C ATOM 336 O PHE A 23 32.050 -25.615 7.712 1.00 0.00 O ATOM 337 CB PHE A 23 34.707 -25.012 7.142 1.00 0.00 C ATOM 338 CG PHE A 23 34.468 -23.697 6.441 1.00 0.00 C ATOM 339 CD1 PHE A 23 35.271 -22.593 6.734 1.00 0.00 C ATOM 340 CD2 PHE A 23 33.447 -23.584 5.497 1.00 0.00 C ATOM 341 CE1 PHE A 23 35.055 -21.371 6.085 1.00 0.00 C ATOM 342 CE2 PHE A 23 33.221 -22.367 4.843 1.00 0.00 C ATOM 343 CZ PHE A 23 34.025 -21.245 5.130 1.00 0.00 C ATOM 0 H PHE A 23 35.132 -26.839 8.666 1.00 0.00 H new ATOM 0 HA PHE A 23 34.439 -23.985 9.053 1.00 0.00 H new ATOM 0 HB2 PHE A 23 35.772 -25.245 7.148 1.00 0.00 H new ATOM 0 HB3 PHE A 23 34.208 -25.818 6.605 1.00 0.00 H new ATOM 0 HD1 PHE A 23 36.062 -22.682 7.464 1.00 0.00 H new ATOM 0 HD2 PHE A 23 32.828 -24.439 5.270 1.00 0.00 H new ATOM 0 HE1 PHE A 23 35.680 -20.521 6.317 1.00 0.00 H new ATOM 0 HE2 PHE A 23 32.427 -22.287 4.115 1.00 0.00 H new ATOM 0 HZ PHE A 23 33.855 -20.305 4.627 1.00 0.00 H new ATOM 353 N GLY A 24 32.021 -24.470 9.588 1.00 0.00 N ATOM 354 CA GLY A 24 30.533 -24.535 9.665 1.00 0.00 C ATOM 355 C GLY A 24 29.955 -23.121 9.580 1.00 0.00 C ATOM 356 O GLY A 24 29.962 -22.379 10.543 1.00 0.00 O ATOM 0 H GLY A 24 32.473 -23.968 10.353 1.00 0.00 H new ATOM 0 HA2 GLY A 24 30.143 -25.148 8.853 1.00 0.00 H new ATOM 0 HA3 GLY A 24 30.227 -25.009 10.598 1.00 0.00 H new ATOM 360 N ARG A 25 29.451 -22.745 8.435 1.00 0.00 N ATOM 361 CA ARG A 25 28.871 -21.377 8.284 1.00 0.00 C ATOM 362 C ARG A 25 27.991 -21.314 7.033 1.00 0.00 C ATOM 363 O ARG A 25 28.314 -20.649 6.067 1.00 0.00 O ATOM 364 CB ARG A 25 30.079 -20.447 8.144 1.00 0.00 C ATOM 365 CG ARG A 25 30.297 -19.686 9.457 1.00 0.00 C ATOM 366 CD ARG A 25 31.783 -19.718 9.826 1.00 0.00 C ATOM 367 NE ARG A 25 31.985 -18.531 10.703 1.00 0.00 N ATOM 368 CZ ARG A 25 32.582 -18.668 11.854 1.00 0.00 C ATOM 369 NH1 ARG A 25 33.832 -19.044 11.901 1.00 0.00 N ATOM 370 NH2 ARG A 25 31.931 -18.427 12.960 1.00 0.00 N ATOM 0 H ARG A 25 29.415 -23.326 7.597 1.00 0.00 H new ATOM 0 HA ARG A 25 28.241 -21.097 9.128 1.00 0.00 H new ATOM 0 HB2 ARG A 25 30.969 -21.025 7.895 1.00 0.00 H new ATOM 0 HB3 ARG A 25 29.917 -19.744 7.327 1.00 0.00 H new ATOM 0 HG2 ARG A 25 29.960 -18.655 9.352 1.00 0.00 H new ATOM 0 HG3 ARG A 25 29.704 -20.136 10.253 1.00 0.00 H new ATOM 0 HD2 ARG A 25 32.042 -20.641 10.345 1.00 0.00 H new ATOM 0 HD3 ARG A 25 32.412 -19.665 8.937 1.00 0.00 H new ATOM 0 HE ARG A 25 31.657 -17.613 10.404 1.00 0.00 H new ATOM 0 HH11 ARG A 25 34.341 -19.230 11.037 1.00 0.00 H new ATOM 0 HH12 ARG A 25 34.299 -19.151 12.802 1.00 0.00 H new ATOM 0 HH21 ARG A 25 30.955 -18.132 12.924 1.00 0.00 H new ATOM 0 HH22 ARG A 25 32.398 -18.534 13.860 1.00 0.00 H new ATOM 384 N ARG A 26 26.881 -22.004 7.042 1.00 0.00 N ATOM 385 CA ARG A 26 25.979 -21.986 5.854 1.00 0.00 C ATOM 386 C ARG A 26 24.516 -21.922 6.298 1.00 0.00 C ATOM 387 O ARG A 26 23.840 -22.928 6.388 1.00 0.00 O ATOM 388 CB ARG A 26 26.261 -23.297 5.122 1.00 0.00 C ATOM 389 CG ARG A 26 27.378 -23.081 4.098 1.00 0.00 C ATOM 390 CD ARG A 26 27.747 -24.418 3.452 1.00 0.00 C ATOM 391 NE ARG A 26 28.846 -24.094 2.502 1.00 0.00 N ATOM 392 CZ ARG A 26 29.066 -24.861 1.471 1.00 0.00 C ATOM 393 NH1 ARG A 26 29.596 -26.043 1.638 1.00 0.00 N ATOM 394 NH2 ARG A 26 28.754 -24.450 0.272 1.00 0.00 N ATOM 0 H ARG A 26 26.560 -22.579 7.821 1.00 0.00 H new ATOM 0 HA ARG A 26 26.154 -21.118 5.218 1.00 0.00 H new ATOM 0 HB2 ARG A 26 26.551 -24.069 5.835 1.00 0.00 H new ATOM 0 HB3 ARG A 26 25.358 -23.648 4.622 1.00 0.00 H new ATOM 0 HG2 ARG A 26 27.054 -22.374 3.335 1.00 0.00 H new ATOM 0 HG3 ARG A 26 28.252 -22.647 4.584 1.00 0.00 H new ATOM 0 HD2 ARG A 26 28.072 -25.142 4.200 1.00 0.00 H new ATOM 0 HD3 ARG A 26 26.893 -24.856 2.934 1.00 0.00 H new ATOM 0 HE ARG A 26 29.428 -23.271 2.658 1.00 0.00 H new ATOM 0 HH11 ARG A 26 29.838 -26.366 2.575 1.00 0.00 H new ATOM 0 HH12 ARG A 26 29.768 -26.643 0.832 1.00 0.00 H new ATOM 0 HH21 ARG A 26 28.338 -23.528 0.141 1.00 0.00 H new ATOM 0 HH22 ARG A 26 28.927 -25.051 -0.534 1.00 0.00 H new ATOM 408 N VAL A 27 24.024 -20.745 6.581 1.00 0.00 N ATOM 409 CA VAL A 27 22.604 -20.613 7.021 1.00 0.00 C ATOM 410 C VAL A 27 21.883 -19.561 6.173 1.00 0.00 C ATOM 411 O VAL A 27 21.032 -18.840 6.652 1.00 0.00 O ATOM 412 CB VAL A 27 22.679 -20.165 8.484 1.00 0.00 C ATOM 413 CG1 VAL A 27 23.370 -21.252 9.311 1.00 0.00 C ATOM 414 CG2 VAL A 27 23.479 -18.864 8.585 1.00 0.00 C ATOM 0 H VAL A 27 24.544 -19.869 6.527 1.00 0.00 H new ATOM 0 HA VAL A 27 22.050 -21.545 6.910 1.00 0.00 H new ATOM 0 HB VAL A 27 21.671 -19.999 8.864 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.425 -20.937 10.353 1.00 0.00 H new ATOM 0 HG12 VAL A 27 22.800 -22.179 9.242 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.377 -21.416 8.928 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.530 -18.548 9.627 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.488 -19.027 8.205 1.00 0.00 H new ATOM 0 HG23 VAL A 27 22.990 -18.089 7.995 1.00 0.00 H new ATOM 424 N TRP A 28 22.220 -19.472 4.912 1.00 0.00 N ATOM 425 CA TRP A 28 21.558 -18.469 4.027 1.00 0.00 C ATOM 426 C TRP A 28 20.717 -19.178 2.961 1.00 0.00 C ATOM 427 O TRP A 28 21.110 -20.196 2.425 1.00 0.00 O ATOM 428 CB TRP A 28 22.707 -17.692 3.378 1.00 0.00 C ATOM 429 CG TRP A 28 22.820 -16.340 4.007 1.00 0.00 C ATOM 430 CD1 TRP A 28 22.778 -16.094 5.338 1.00 0.00 C ATOM 431 CD2 TRP A 28 22.996 -15.046 3.358 1.00 0.00 C ATOM 432 NE1 TRP A 28 22.917 -14.733 5.546 1.00 0.00 N ATOM 433 CE2 TRP A 28 23.053 -14.045 4.356 1.00 0.00 C ATOM 434 CE3 TRP A 28 23.109 -14.649 2.013 1.00 0.00 C ATOM 435 CZ2 TRP A 28 23.217 -12.697 4.031 1.00 0.00 C ATOM 436 CZ3 TRP A 28 23.273 -13.295 1.683 1.00 0.00 C ATOM 437 CH2 TRP A 28 23.328 -12.321 2.689 1.00 0.00 C ATOM 0 H TRP A 28 22.926 -20.051 4.457 1.00 0.00 H new ATOM 0 HA TRP A 28 20.884 -17.813 4.578 1.00 0.00 H new ATOM 0 HB2 TRP A 28 23.642 -18.239 3.498 1.00 0.00 H new ATOM 0 HB3 TRP A 28 22.532 -17.592 2.307 1.00 0.00 H new ATOM 0 HD1 TRP A 28 22.656 -16.838 6.111 1.00 0.00 H new ATOM 0 HE1 TRP A 28 22.919 -14.292 6.466 1.00 0.00 H new ATOM 0 HE3 TRP A 28 23.069 -15.391 1.229 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 23.258 -11.950 4.810 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 23.357 -13.002 0.647 1.00 0.00 H new ATOM 0 HH2 TRP A 28 23.456 -11.281 2.428 1.00 0.00 H new ATOM 448 N THR A 29 19.566 -18.646 2.652 1.00 0.00 N ATOM 449 CA THR A 29 18.698 -19.287 1.618 1.00 0.00 C ATOM 450 C THR A 29 17.552 -18.345 1.231 1.00 0.00 C ATOM 451 O THR A 29 17.184 -18.246 0.077 1.00 0.00 O ATOM 452 CB THR A 29 18.154 -20.557 2.280 1.00 0.00 C ATOM 453 OG1 THR A 29 17.290 -21.226 1.373 1.00 0.00 O ATOM 454 CG2 THR A 29 17.383 -20.191 3.550 1.00 0.00 C ATOM 0 H THR A 29 19.188 -17.796 3.069 1.00 0.00 H new ATOM 0 HA THR A 29 19.246 -19.512 0.703 1.00 0.00 H new ATOM 0 HB THR A 29 18.984 -21.212 2.544 1.00 0.00 H new ATOM 0 HG1 THR A 29 16.941 -22.040 1.793 1.00 0.00 H new ATOM 0 HG21 THR A 29 16.999 -21.098 4.016 1.00 0.00 H new ATOM 0 HG22 THR A 29 18.049 -19.680 4.245 1.00 0.00 H new ATOM 0 HG23 THR A 29 16.552 -19.534 3.294 1.00 0.00 H new ATOM 462 N SER A 30 16.991 -17.654 2.186 1.00 0.00 N ATOM 463 CA SER A 30 15.872 -16.719 1.874 1.00 0.00 C ATOM 464 C SER A 30 16.051 -15.409 2.649 1.00 0.00 C ATOM 465 O SER A 30 15.276 -15.086 3.530 1.00 0.00 O ATOM 466 CB SER A 30 14.607 -17.446 2.332 1.00 0.00 C ATOM 467 OG SER A 30 14.019 -18.106 1.219 1.00 0.00 O ATOM 0 H SER A 30 17.259 -17.696 3.169 1.00 0.00 H new ATOM 0 HA SER A 30 15.830 -16.461 0.816 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.850 -18.168 3.111 1.00 0.00 H new ATOM 0 HB3 SER A 30 13.901 -16.736 2.764 1.00 0.00 H new ATOM 0 HG SER A 30 13.208 -18.575 1.508 1.00 0.00 H new ATOM 473 N ALA A 31 17.069 -14.656 2.329 1.00 0.00 N ATOM 474 CA ALA A 31 17.303 -13.368 3.047 1.00 0.00 C ATOM 475 C ALA A 31 16.106 -12.424 2.862 1.00 0.00 C ATOM 476 O ALA A 31 15.541 -11.957 3.831 1.00 0.00 O ATOM 477 CB ALA A 31 18.560 -12.775 2.405 1.00 0.00 C ATOM 0 H ALA A 31 17.749 -14.876 1.602 1.00 0.00 H new ATOM 0 HA ALA A 31 17.424 -13.515 4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 31 18.797 -11.823 2.881 1.00 0.00 H new ATOM 0 HB2 ALA A 31 19.395 -13.464 2.535 1.00 0.00 H new ATOM 0 HB3 ALA A 31 18.384 -12.615 1.341 1.00 0.00 H new ATOM 483 N PRO A 32 15.756 -12.168 1.625 1.00 0.00 N ATOM 484 CA PRO A 32 14.614 -11.264 1.340 1.00 0.00 C ATOM 485 C PRO A 32 13.285 -11.970 1.643 1.00 0.00 C ATOM 486 O PRO A 32 13.093 -13.110 1.268 1.00 0.00 O ATOM 487 CB PRO A 32 14.746 -10.976 -0.152 1.00 0.00 C ATOM 488 CG PRO A 32 15.499 -12.142 -0.711 1.00 0.00 C ATOM 489 CD PRO A 32 16.372 -12.680 0.392 1.00 0.00 C ATOM 0 HA PRO A 32 14.624 -10.358 1.946 1.00 0.00 H new ATOM 0 HB2 PRO A 32 13.768 -10.877 -0.622 1.00 0.00 H new ATOM 0 HB3 PRO A 32 15.280 -10.042 -0.327 1.00 0.00 H new ATOM 0 HG2 PRO A 32 14.811 -12.909 -1.066 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.103 -11.836 -1.565 1.00 0.00 H new ATOM 0 HD2 PRO A 32 16.398 -13.770 0.383 1.00 0.00 H new ATOM 0 HD3 PRO A 32 17.401 -12.336 0.289 1.00 0.00 H new ATOM 497 N PRO A 33 12.403 -11.268 2.312 1.00 0.00 N ATOM 498 CA PRO A 33 11.082 -11.849 2.657 1.00 0.00 C ATOM 499 C PRO A 33 10.181 -11.897 1.417 1.00 0.00 C ATOM 500 O PRO A 33 10.475 -11.272 0.416 1.00 0.00 O ATOM 501 CB PRO A 33 10.523 -10.878 3.693 1.00 0.00 C ATOM 502 CG PRO A 33 11.205 -9.577 3.420 1.00 0.00 C ATOM 503 CD PRO A 33 12.545 -9.892 2.805 1.00 0.00 C ATOM 0 HA PRO A 33 11.147 -12.872 3.029 1.00 0.00 H new ATOM 0 HB2 PRO A 33 9.441 -10.783 3.600 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.726 -11.224 4.707 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.607 -8.964 2.745 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.330 -9.008 4.341 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.783 -9.202 1.996 1.00 0.00 H new ATOM 0 HD3 PRO A 33 13.348 -9.813 3.538 1.00 0.00 H new ATOM 511 N PRO A 34 9.108 -12.640 1.522 1.00 0.00 N ATOM 512 CA PRO A 34 8.159 -12.765 0.388 1.00 0.00 C ATOM 513 C PRO A 34 7.349 -11.475 0.224 1.00 0.00 C ATOM 514 O PRO A 34 7.291 -10.651 1.115 1.00 0.00 O ATOM 515 CB PRO A 34 7.258 -13.923 0.801 1.00 0.00 C ATOM 516 CG PRO A 34 7.327 -13.956 2.294 1.00 0.00 C ATOM 517 CD PRO A 34 8.680 -13.423 2.688 1.00 0.00 C ATOM 0 HA PRO A 34 8.654 -12.937 -0.568 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.235 -13.769 0.457 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.601 -14.863 0.369 1.00 0.00 H new ATOM 0 HG2 PRO A 34 6.533 -13.350 2.730 1.00 0.00 H new ATOM 0 HG3 PRO A 34 7.191 -14.973 2.663 1.00 0.00 H new ATOM 0 HD2 PRO A 34 8.620 -12.805 3.584 1.00 0.00 H new ATOM 0 HD3 PRO A 34 9.379 -14.231 2.905 1.00 0.00 H new ATOM 525 N GLN A 35 6.725 -11.296 -0.909 1.00 0.00 N ATOM 526 CA GLN A 35 5.916 -10.061 -1.133 1.00 0.00 C ATOM 527 C GLN A 35 4.424 -10.386 -1.041 1.00 0.00 C ATOM 528 O GLN A 35 3.944 -11.323 -1.652 1.00 0.00 O ATOM 529 CB GLN A 35 6.282 -9.598 -2.543 1.00 0.00 C ATOM 530 CG GLN A 35 5.706 -8.201 -2.786 1.00 0.00 C ATOM 531 CD GLN A 35 5.991 -7.776 -4.227 1.00 0.00 C ATOM 532 OE1 GLN A 35 5.126 -7.249 -4.898 1.00 0.00 O ATOM 533 NE2 GLN A 35 7.174 -7.984 -4.733 1.00 0.00 N ATOM 0 H GLN A 35 6.740 -11.952 -1.690 1.00 0.00 H new ATOM 0 HA GLN A 35 6.119 -9.291 -0.389 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.365 -9.582 -2.663 1.00 0.00 H new ATOM 0 HB3 GLN A 35 5.890 -10.298 -3.281 1.00 0.00 H new ATOM 0 HG2 GLN A 35 4.632 -8.202 -2.601 1.00 0.00 H new ATOM 0 HG3 GLN A 35 6.148 -7.488 -2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 35 7.899 -8.426 -4.169 1.00 0.00 H new ATOM 0 HE22 GLN A 35 7.374 -7.704 -5.693 1.00 0.00 H new ATOM 542 N ARG A 36 3.685 -9.621 -0.284 1.00 0.00 N ATOM 543 CA ARG A 36 2.222 -9.884 -0.152 1.00 0.00 C ATOM 544 C ARG A 36 1.455 -8.562 -0.024 1.00 0.00 C ATOM 545 O ARG A 36 1.904 -7.652 0.644 1.00 0.00 O ATOM 546 CB ARG A 36 2.087 -10.713 1.128 1.00 0.00 C ATOM 547 CG ARG A 36 0.763 -11.483 1.112 1.00 0.00 C ATOM 548 CD ARG A 36 0.778 -12.527 -0.010 1.00 0.00 C ATOM 549 NE ARG A 36 1.993 -13.354 0.241 1.00 0.00 N ATOM 550 CZ ARG A 36 1.873 -14.554 0.744 1.00 0.00 C ATOM 551 NH1 ARG A 36 1.367 -15.516 0.020 1.00 0.00 N ATOM 552 NH2 ARG A 36 2.263 -14.791 1.966 1.00 0.00 N ATOM 0 H ARG A 36 4.031 -8.824 0.250 1.00 0.00 H new ATOM 0 HA ARG A 36 1.813 -10.402 -1.019 1.00 0.00 H new ATOM 0 HB2 ARG A 36 2.922 -11.409 1.211 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.128 -10.061 2.000 1.00 0.00 H new ATOM 0 HG2 ARG A 36 0.606 -11.972 2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -0.067 -10.792 0.966 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -0.125 -13.138 0.008 1.00 0.00 H new ATOM 0 HD3 ARG A 36 0.821 -12.051 -0.990 1.00 0.00 H new ATOM 0 HE ARG A 36 2.917 -12.983 0.020 1.00 0.00 H new ATOM 0 HH11 ARG A 36 1.066 -15.330 -0.937 1.00 0.00 H new ATOM 0 HH12 ARG A 36 1.273 -16.453 0.411 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.662 -14.040 2.529 1.00 0.00 H new ATOM 0 HH22 ARG A 36 2.169 -15.728 2.359 1.00 0.00 H new ATOM 566 N PRO A 37 0.319 -8.493 -0.675 1.00 0.00 N ATOM 567 CA PRO A 37 -0.507 -7.260 -0.627 1.00 0.00 C ATOM 568 C PRO A 37 -1.157 -7.103 0.751 1.00 0.00 C ATOM 569 O PRO A 37 -2.181 -7.691 1.035 1.00 0.00 O ATOM 570 CB PRO A 37 -1.564 -7.489 -1.704 1.00 0.00 C ATOM 571 CG PRO A 37 -1.658 -8.975 -1.839 1.00 0.00 C ATOM 572 CD PRO A 37 -0.301 -9.536 -1.505 1.00 0.00 C ATOM 0 HA PRO A 37 0.073 -6.352 -0.794 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.522 -7.057 -1.416 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -1.275 -7.024 -2.647 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.417 -9.376 -1.167 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.951 -9.252 -2.852 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -0.381 -10.480 -0.966 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.283 -9.730 -2.404 1.00 0.00 H new ATOM 580 N PHE A 38 -0.569 -6.305 1.605 1.00 0.00 N ATOM 581 CA PHE A 38 -1.153 -6.103 2.963 1.00 0.00 C ATOM 582 C PHE A 38 -2.214 -5.001 2.918 1.00 0.00 C ATOM 583 O PHE A 38 -1.934 -3.872 2.563 1.00 0.00 O ATOM 584 CB PHE A 38 0.025 -5.678 3.840 1.00 0.00 C ATOM 585 CG PHE A 38 0.976 -6.839 4.007 1.00 0.00 C ATOM 586 CD1 PHE A 38 0.525 -8.035 4.578 1.00 0.00 C ATOM 587 CD2 PHE A 38 2.305 -6.720 3.590 1.00 0.00 C ATOM 588 CE1 PHE A 38 1.406 -9.112 4.732 1.00 0.00 C ATOM 589 CE2 PHE A 38 3.187 -7.798 3.744 1.00 0.00 C ATOM 590 CZ PHE A 38 2.737 -8.994 4.315 1.00 0.00 C ATOM 0 H PHE A 38 0.289 -5.786 1.420 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.641 -7.000 3.344 1.00 0.00 H new ATOM 0 HB2 PHE A 38 0.543 -4.833 3.387 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.335 -5.346 4.814 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.502 -8.127 4.899 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.652 -5.797 3.149 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.058 -10.035 5.173 1.00 0.00 H new ATOM 0 HE2 PHE A 38 4.214 -7.706 3.422 1.00 0.00 H new ATOM 0 HZ PHE A 38 3.416 -9.825 4.434 1.00 0.00 H new ATOM 600 N ARG A 39 -3.430 -5.319 3.272 1.00 0.00 N ATOM 601 CA ARG A 39 -4.509 -4.289 3.246 1.00 0.00 C ATOM 602 C ARG A 39 -4.383 -3.353 4.451 1.00 0.00 C ATOM 603 O ARG A 39 -4.579 -3.751 5.584 1.00 0.00 O ATOM 604 CB ARG A 39 -5.816 -5.079 3.317 1.00 0.00 C ATOM 605 CG ARG A 39 -6.922 -4.296 2.608 1.00 0.00 C ATOM 606 CD ARG A 39 -8.268 -4.982 2.845 1.00 0.00 C ATOM 607 NE ARG A 39 -8.388 -5.982 1.750 1.00 0.00 N ATOM 608 CZ ARG A 39 -8.978 -7.125 1.972 1.00 0.00 C ATOM 609 NH1 ARG A 39 -10.218 -7.153 2.376 1.00 0.00 N ATOM 610 NH2 ARG A 39 -8.327 -8.242 1.790 1.00 0.00 N ATOM 0 H ARG A 39 -3.723 -6.247 3.578 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.457 -3.665 2.354 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -5.689 -6.055 2.849 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.090 -5.257 4.357 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.953 -3.272 2.981 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -6.714 -4.240 1.539 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.300 -5.462 3.823 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -9.088 -4.264 2.816 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.009 -5.774 0.826 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -10.728 -6.281 2.519 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -10.678 -8.047 2.549 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -7.357 -8.222 1.474 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -8.788 -9.135 1.964 1.00 0.00 H new ATOM 624 N VAL A 40 -4.058 -2.110 4.210 1.00 0.00 N ATOM 625 CA VAL A 40 -3.920 -1.137 5.333 1.00 0.00 C ATOM 626 C VAL A 40 -5.169 -0.255 5.413 1.00 0.00 C ATOM 627 O VAL A 40 -5.816 0.010 4.417 1.00 0.00 O ATOM 628 CB VAL A 40 -2.688 -0.299 4.979 1.00 0.00 C ATOM 629 CG1 VAL A 40 -2.456 0.766 6.055 1.00 0.00 C ATOM 630 CG2 VAL A 40 -1.462 -1.211 4.890 1.00 0.00 C ATOM 0 H VAL A 40 -3.882 -1.726 3.282 1.00 0.00 H new ATOM 0 HA VAL A 40 -3.812 -1.627 6.301 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.850 0.192 4.019 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.578 1.359 5.797 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.328 1.417 6.117 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.296 0.281 7.018 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.584 -0.617 4.638 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.304 -1.703 5.850 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.624 -1.964 4.119 1.00 0.00 H new ATOM 640 N CYS A 41 -5.516 0.200 6.588 1.00 0.00 N ATOM 641 CA CYS A 41 -6.726 1.060 6.726 1.00 0.00 C ATOM 642 C CYS A 41 -6.424 2.276 7.606 1.00 0.00 C ATOM 643 O CYS A 41 -5.554 2.241 8.454 1.00 0.00 O ATOM 644 CB CYS A 41 -7.772 0.166 7.391 1.00 0.00 C ATOM 645 SG CYS A 41 -8.202 -1.194 6.277 1.00 0.00 S ATOM 0 H CYS A 41 -5.014 0.013 7.456 1.00 0.00 H new ATOM 0 HA CYS A 41 -7.066 1.445 5.765 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -7.384 -0.228 8.330 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.662 0.747 7.632 1.00 0.00 H new ATOM 0 HG CYS A 41 -9.090 -1.955 6.844 1.00 0.00 H new ATOM 651 N ASP A 42 -7.141 3.350 7.408 1.00 0.00 N ATOM 652 CA ASP A 42 -6.910 4.573 8.228 1.00 0.00 C ATOM 653 C ASP A 42 -7.828 4.559 9.455 1.00 0.00 C ATOM 654 O ASP A 42 -8.625 3.658 9.627 1.00 0.00 O ATOM 655 CB ASP A 42 -7.255 5.742 7.309 1.00 0.00 C ATOM 656 CG ASP A 42 -6.405 6.956 7.692 1.00 0.00 C ATOM 657 OD1 ASP A 42 -6.614 7.482 8.773 1.00 0.00 O ATOM 658 OD2 ASP A 42 -5.562 7.337 6.899 1.00 0.00 O ATOM 0 H ASP A 42 -7.880 3.432 6.710 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.886 4.640 8.595 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.072 5.469 6.270 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -8.314 5.985 7.393 1.00 0.00 H new ATOM 663 N HIS A 43 -7.703 5.541 10.316 1.00 0.00 N ATOM 664 CA HIS A 43 -8.551 5.594 11.552 1.00 0.00 C ATOM 665 C HIS A 43 -9.969 5.050 11.296 1.00 0.00 C ATOM 666 O HIS A 43 -10.232 3.884 11.520 1.00 0.00 O ATOM 667 CB HIS A 43 -8.590 7.078 11.930 1.00 0.00 C ATOM 668 CG HIS A 43 -9.406 7.261 13.180 1.00 0.00 C ATOM 669 ND1 HIS A 43 -9.197 6.496 14.317 1.00 0.00 N ATOM 670 CD2 HIS A 43 -10.434 8.118 13.489 1.00 0.00 C ATOM 671 CE1 HIS A 43 -10.079 6.904 15.248 1.00 0.00 C ATOM 672 NE2 HIS A 43 -10.857 7.891 14.796 1.00 0.00 N ATOM 0 H HIS A 43 -7.045 6.314 10.215 1.00 0.00 H new ATOM 0 HA HIS A 43 -8.143 4.972 12.349 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.578 7.450 12.087 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -9.020 7.660 11.115 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -10.851 8.856 12.820 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -10.149 6.484 16.241 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -11.601 8.374 15.300 1.00 0.00 H new ATOM 680 N LYS A 44 -10.888 5.867 10.838 1.00 0.00 N ATOM 681 CA LYS A 44 -12.268 5.350 10.592 1.00 0.00 C ATOM 682 C LYS A 44 -12.427 4.873 9.142 1.00 0.00 C ATOM 683 O LYS A 44 -12.544 3.693 8.880 1.00 0.00 O ATOM 684 CB LYS A 44 -13.183 6.548 10.873 1.00 0.00 C ATOM 685 CG LYS A 44 -14.628 6.208 10.489 1.00 0.00 C ATOM 686 CD LYS A 44 -15.175 5.135 11.435 1.00 0.00 C ATOM 687 CE LYS A 44 -16.421 4.497 10.817 1.00 0.00 C ATOM 688 NZ LYS A 44 -17.492 5.521 10.967 1.00 0.00 N ATOM 0 H LYS A 44 -10.744 6.855 10.627 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.503 4.491 11.220 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.132 6.815 11.929 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.843 7.416 10.308 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -15.248 7.103 10.541 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -14.667 5.853 9.459 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.416 4.374 11.617 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.421 5.577 12.400 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.258 4.247 9.769 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.685 3.571 11.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -18.268 5.131 11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.104 6.363 11.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.854 5.785 10.028 1.00 0.00 H new ATOM 702 N ARG A 45 -12.436 5.782 8.201 1.00 0.00 N ATOM 703 CA ARG A 45 -12.591 5.375 6.771 1.00 0.00 C ATOM 704 C ARG A 45 -11.956 6.411 5.833 1.00 0.00 C ATOM 705 O ARG A 45 -12.251 6.447 4.654 1.00 0.00 O ATOM 706 CB ARG A 45 -14.099 5.304 6.545 1.00 0.00 C ATOM 707 CG ARG A 45 -14.400 4.326 5.407 1.00 0.00 C ATOM 708 CD ARG A 45 -15.894 4.366 5.081 1.00 0.00 C ATOM 709 NE ARG A 45 -16.087 3.321 4.037 1.00 0.00 N ATOM 710 CZ ARG A 45 -17.103 3.395 3.221 1.00 0.00 C ATOM 711 NH1 ARG A 45 -16.990 4.048 2.097 1.00 0.00 N ATOM 712 NH2 ARG A 45 -18.231 2.814 3.528 1.00 0.00 N ATOM 0 H ARG A 45 -12.343 6.785 8.360 1.00 0.00 H new ATOM 0 HA ARG A 45 -12.096 4.427 6.563 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.599 4.981 7.458 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.488 6.293 6.301 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -13.817 4.589 4.524 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -14.107 3.316 5.694 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -16.497 4.157 5.965 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -16.193 5.349 4.716 1.00 0.00 H new ATOM 0 HE ARG A 45 -15.426 2.548 3.960 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -16.108 4.500 1.856 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -17.784 4.106 1.459 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -18.319 2.302 4.406 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -19.025 2.872 2.890 1.00 0.00 H new ATOM 726 N THR A 46 -11.108 7.263 6.342 1.00 0.00 N ATOM 727 CA THR A 46 -10.482 8.302 5.469 1.00 0.00 C ATOM 728 C THR A 46 -9.760 7.658 4.279 1.00 0.00 C ATOM 729 O THR A 46 -9.984 8.021 3.141 1.00 0.00 O ATOM 730 CB THR A 46 -9.491 9.038 6.373 1.00 0.00 C ATOM 731 OG1 THR A 46 -8.801 8.097 7.181 1.00 0.00 O ATOM 732 CG2 THR A 46 -10.250 10.019 7.269 1.00 0.00 C ATOM 0 H THR A 46 -10.821 7.286 7.321 1.00 0.00 H new ATOM 0 HA THR A 46 -11.226 8.976 5.045 1.00 0.00 H new ATOM 0 HB THR A 46 -8.775 9.585 5.759 1.00 0.00 H new ATOM 0 HG1 THR A 46 -8.568 8.511 8.038 1.00 0.00 H new ATOM 0 HG21 THR A 46 -9.545 10.544 7.913 1.00 0.00 H new ATOM 0 HG22 THR A 46 -10.782 10.741 6.649 1.00 0.00 H new ATOM 0 HG23 THR A 46 -10.965 9.472 7.883 1.00 0.00 H new ATOM 740 N ILE A 47 -8.895 6.710 4.528 1.00 0.00 N ATOM 741 CA ILE A 47 -8.164 6.055 3.401 1.00 0.00 C ATOM 742 C ILE A 47 -8.080 4.542 3.621 1.00 0.00 C ATOM 743 O ILE A 47 -7.665 4.079 4.665 1.00 0.00 O ATOM 744 CB ILE A 47 -6.766 6.681 3.414 1.00 0.00 C ATOM 745 CG1 ILE A 47 -6.883 8.194 3.197 1.00 0.00 C ATOM 746 CG2 ILE A 47 -5.916 6.068 2.297 1.00 0.00 C ATOM 747 CD1 ILE A 47 -5.499 8.839 3.300 1.00 0.00 C ATOM 0 H ILE A 47 -8.663 6.362 5.458 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.668 6.204 2.446 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.291 6.486 4.376 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.318 8.398 2.219 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -7.553 8.627 3.940 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.922 6.515 2.309 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.832 4.992 2.453 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.388 6.259 1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.586 9.914 3.145 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.081 8.647 4.288 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.843 8.415 2.540 1.00 0.00 H new ATOM 759 N ARG A 48 -8.466 3.768 2.640 1.00 0.00 N ATOM 760 CA ARG A 48 -8.407 2.284 2.783 1.00 0.00 C ATOM 761 C ARG A 48 -7.932 1.646 1.474 1.00 0.00 C ATOM 762 O ARG A 48 -8.703 1.447 0.556 1.00 0.00 O ATOM 763 CB ARG A 48 -9.843 1.859 3.095 1.00 0.00 C ATOM 764 CG ARG A 48 -9.884 0.348 3.346 1.00 0.00 C ATOM 765 CD ARG A 48 -11.284 -0.053 3.816 1.00 0.00 C ATOM 766 NE ARG A 48 -11.480 -1.437 3.301 1.00 0.00 N ATOM 767 CZ ARG A 48 -12.441 -1.688 2.456 1.00 0.00 C ATOM 768 NH1 ARG A 48 -12.621 -0.914 1.421 1.00 0.00 N ATOM 769 NH2 ARG A 48 -13.223 -2.716 2.643 1.00 0.00 N ATOM 0 H ARG A 48 -8.820 4.102 1.744 1.00 0.00 H new ATOM 0 HA ARG A 48 -7.711 1.971 3.561 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -10.210 2.394 3.971 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.499 2.119 2.264 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -9.627 -0.190 2.434 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.144 0.073 4.097 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.360 -0.022 4.903 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.042 0.625 3.424 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.863 -2.188 3.609 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.010 -0.111 1.272 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.373 -1.112 0.761 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -13.083 -3.323 3.450 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.975 -2.912 1.982 1.00 0.00 H new ATOM 783 N LYS A 49 -6.669 1.323 1.383 1.00 0.00 N ATOM 784 CA LYS A 49 -6.145 0.699 0.133 1.00 0.00 C ATOM 785 C LYS A 49 -5.137 -0.405 0.474 1.00 0.00 C ATOM 786 O LYS A 49 -4.506 -0.382 1.512 1.00 0.00 O ATOM 787 CB LYS A 49 -5.462 1.840 -0.622 1.00 0.00 C ATOM 788 CG LYS A 49 -4.884 1.314 -1.938 1.00 0.00 C ATOM 789 CD LYS A 49 -6.023 0.944 -2.890 1.00 0.00 C ATOM 790 CE LYS A 49 -5.443 0.514 -4.238 1.00 0.00 C ATOM 791 NZ LYS A 49 -5.403 1.760 -5.055 1.00 0.00 N ATOM 0 H LYS A 49 -5.978 1.464 2.120 1.00 0.00 H new ATOM 0 HA LYS A 49 -6.933 0.234 -0.460 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.178 2.637 -0.821 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -4.668 2.270 -0.011 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -4.247 2.071 -2.395 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.258 0.442 -1.749 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.619 0.137 -2.464 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -6.690 1.796 -3.024 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -4.447 0.086 -4.121 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.064 -0.248 -4.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.016 1.546 -5.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -6.366 2.141 -5.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.800 2.464 -4.585 1.00 0.00 H new ATOM 805 N GLY A 50 -4.984 -1.369 -0.397 1.00 0.00 N ATOM 806 CA GLY A 50 -4.016 -2.472 -0.126 1.00 0.00 C ATOM 807 C GLY A 50 -2.955 -2.499 -1.227 1.00 0.00 C ATOM 808 O GLY A 50 -3.264 -2.483 -2.401 1.00 0.00 O ATOM 0 H GLY A 50 -5.486 -1.440 -1.282 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.544 -2.326 0.846 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.539 -3.428 -0.086 1.00 0.00 H new ATOM 812 N LEU A 51 -1.703 -2.542 -0.853 1.00 0.00 N ATOM 813 CA LEU A 51 -0.617 -2.569 -1.877 1.00 0.00 C ATOM 814 C LEU A 51 0.394 -3.670 -1.549 1.00 0.00 C ATOM 815 O LEU A 51 0.422 -4.192 -0.451 1.00 0.00 O ATOM 816 CB LEU A 51 0.045 -1.193 -1.788 1.00 0.00 C ATOM 817 CG LEU A 51 -0.886 -0.136 -2.384 1.00 0.00 C ATOM 818 CD1 LEU A 51 -0.495 1.245 -1.855 1.00 0.00 C ATOM 819 CD2 LEU A 51 -0.760 -0.150 -3.910 1.00 0.00 C ATOM 0 H LEU A 51 -1.386 -2.560 0.116 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.999 -2.776 -2.877 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.267 -0.952 -0.749 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.994 -1.200 -2.324 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.915 -0.356 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.158 1.998 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.581 1.256 -0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 51 0.534 1.466 -2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.423 0.603 -4.337 1.00 0.00 H new ATOM 0 HD22 LEU A 51 0.269 0.071 -4.192 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.037 -1.134 -4.289 1.00 0.00 H new ATOM 831 N THR A 52 1.225 -4.025 -2.492 1.00 0.00 N ATOM 832 CA THR A 52 2.239 -5.090 -2.234 1.00 0.00 C ATOM 833 C THR A 52 3.434 -4.503 -1.481 1.00 0.00 C ATOM 834 O THR A 52 4.101 -3.605 -1.961 1.00 0.00 O ATOM 835 CB THR A 52 2.665 -5.586 -3.618 1.00 0.00 C ATOM 836 OG1 THR A 52 2.903 -4.469 -4.468 1.00 0.00 O ATOM 837 CG2 THR A 52 1.558 -6.463 -4.210 1.00 0.00 C ATOM 0 H THR A 52 1.246 -3.624 -3.430 1.00 0.00 H new ATOM 0 HA THR A 52 1.841 -5.899 -1.622 1.00 0.00 H new ATOM 0 HB THR A 52 3.579 -6.173 -3.531 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.434 -3.800 -3.988 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.861 -6.816 -5.196 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.382 -7.318 -3.557 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.641 -5.880 -4.300 1.00 0.00 H new ATOM 845 N ALA A 53 3.712 -4.999 -0.305 1.00 0.00 N ATOM 846 CA ALA A 53 4.862 -4.464 0.480 1.00 0.00 C ATOM 847 C ALA A 53 5.634 -5.604 1.147 1.00 0.00 C ATOM 848 O ALA A 53 5.055 -6.548 1.651 1.00 0.00 O ATOM 849 CB ALA A 53 4.231 -3.557 1.536 1.00 0.00 C ATOM 0 H ALA A 53 3.192 -5.752 0.146 1.00 0.00 H new ATOM 0 HA ALA A 53 5.574 -3.929 -0.149 1.00 0.00 H new ATOM 0 HB1 ALA A 53 5.014 -3.123 2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 53 3.673 -2.760 1.045 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.555 -4.141 2.160 1.00 0.00 H new ATOM 855 N ALA A 54 6.936 -5.520 1.156 1.00 0.00 N ATOM 856 CA ALA A 54 7.755 -6.591 1.796 1.00 0.00 C ATOM 857 C ALA A 54 8.926 -5.966 2.556 1.00 0.00 C ATOM 858 O ALA A 54 9.932 -5.602 1.977 1.00 0.00 O ATOM 859 CB ALA A 54 8.263 -7.448 0.636 1.00 0.00 C ATOM 0 H ALA A 54 7.471 -4.754 0.747 1.00 0.00 H new ATOM 0 HA ALA A 54 7.184 -7.179 2.514 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.876 -8.261 1.025 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.415 -7.862 0.091 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.861 -6.833 -0.036 1.00 0.00 H new ATOM 865 N THR A 55 8.803 -5.834 3.850 1.00 0.00 N ATOM 866 CA THR A 55 9.907 -5.226 4.648 1.00 0.00 C ATOM 867 C THR A 55 9.936 -5.819 6.059 1.00 0.00 C ATOM 868 O THR A 55 8.917 -6.192 6.607 1.00 0.00 O ATOM 869 CB THR A 55 9.581 -3.733 4.696 1.00 0.00 C ATOM 870 OG1 THR A 55 9.434 -3.239 3.371 1.00 0.00 O ATOM 871 CG2 THR A 55 10.713 -2.987 5.399 1.00 0.00 C ATOM 0 H THR A 55 7.986 -6.121 4.389 1.00 0.00 H new ATOM 0 HA THR A 55 10.887 -5.416 4.210 1.00 0.00 H new ATOM 0 HB THR A 55 8.652 -3.580 5.245 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.223 -2.282 3.400 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.481 -1.923 5.433 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.824 -3.367 6.414 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.643 -3.138 4.852 1.00 0.00 H new ATOM 879 N ARG A 56 11.097 -5.916 6.648 1.00 0.00 N ATOM 880 CA ARG A 56 11.199 -6.493 8.020 1.00 0.00 C ATOM 881 C ARG A 56 11.085 -5.396 9.089 1.00 0.00 C ATOM 882 O ARG A 56 10.079 -5.272 9.757 1.00 0.00 O ATOM 883 CB ARG A 56 12.578 -7.157 8.067 1.00 0.00 C ATOM 884 CG ARG A 56 12.807 -7.772 9.449 1.00 0.00 C ATOM 885 CD ARG A 56 13.941 -8.799 9.373 1.00 0.00 C ATOM 886 NE ARG A 56 14.884 -8.414 10.459 1.00 0.00 N ATOM 887 CZ ARG A 56 14.868 -9.056 11.596 1.00 0.00 C ATOM 888 NH1 ARG A 56 14.855 -10.362 11.607 1.00 0.00 N ATOM 889 NH2 ARG A 56 14.870 -8.393 12.719 1.00 0.00 N ATOM 0 H ARG A 56 11.982 -5.620 6.237 1.00 0.00 H new ATOM 0 HA ARG A 56 10.395 -7.200 8.225 1.00 0.00 H new ATOM 0 HB2 ARG A 56 12.648 -7.928 7.299 1.00 0.00 H new ATOM 0 HB3 ARG A 56 13.354 -6.422 7.852 1.00 0.00 H new ATOM 0 HG2 ARG A 56 13.057 -6.992 10.168 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.893 -8.250 9.801 1.00 0.00 H new ATOM 0 HD2 ARG A 56 13.566 -9.812 9.517 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.430 -8.775 8.399 1.00 0.00 H new ATOM 0 HE ARG A 56 15.543 -7.649 10.315 1.00 0.00 H new ATOM 0 HH11 ARG A 56 14.857 -10.879 10.728 1.00 0.00 H new ATOM 0 HH12 ARG A 56 14.843 -10.864 12.495 1.00 0.00 H new ATOM 0 HH21 ARG A 56 14.884 -7.373 12.709 1.00 0.00 H new ATOM 0 HH22 ARG A 56 14.857 -8.894 13.607 1.00 0.00 H new ATOM 903 N GLN A 57 12.121 -4.615 9.268 1.00 0.00 N ATOM 904 CA GLN A 57 12.084 -3.543 10.310 1.00 0.00 C ATOM 905 C GLN A 57 11.550 -2.227 9.731 1.00 0.00 C ATOM 906 O GLN A 57 10.765 -1.541 10.358 1.00 0.00 O ATOM 907 CB GLN A 57 13.537 -3.377 10.751 1.00 0.00 C ATOM 908 CG GLN A 57 13.606 -2.389 11.918 1.00 0.00 C ATOM 909 CD GLN A 57 15.052 -2.276 12.407 1.00 0.00 C ATOM 910 OE1 GLN A 57 15.750 -3.266 12.507 1.00 0.00 O ATOM 911 NE2 GLN A 57 15.533 -1.103 12.715 1.00 0.00 N ATOM 0 H GLN A 57 12.990 -4.673 8.738 1.00 0.00 H new ATOM 0 HA GLN A 57 11.424 -3.806 11.136 1.00 0.00 H new ATOM 0 HB2 GLN A 57 13.949 -4.340 11.051 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.142 -3.016 9.919 1.00 0.00 H new ATOM 0 HG2 GLN A 57 13.240 -1.412 11.603 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.961 -2.724 12.731 1.00 0.00 H new ATOM 0 HE21 GLN A 57 14.946 -0.273 12.631 1.00 0.00 H new ATOM 0 HE22 GLN A 57 16.496 -1.016 13.040 1.00 0.00 H new ATOM 920 N GLU A 58 11.971 -1.865 8.550 1.00 0.00 N ATOM 921 CA GLU A 58 11.489 -0.585 7.945 1.00 0.00 C ATOM 922 C GLU A 58 10.009 -0.690 7.552 1.00 0.00 C ATOM 923 O GLU A 58 9.398 0.280 7.149 1.00 0.00 O ATOM 924 CB GLU A 58 12.366 -0.371 6.709 1.00 0.00 C ATOM 925 CG GLU A 58 11.974 0.939 6.021 1.00 0.00 C ATOM 926 CD GLU A 58 12.918 1.201 4.846 1.00 0.00 C ATOM 927 OE1 GLU A 58 14.100 1.379 5.091 1.00 0.00 O ATOM 928 OE2 GLU A 58 12.444 1.220 3.725 1.00 0.00 O ATOM 0 H GLU A 58 12.626 -2.397 7.977 1.00 0.00 H new ATOM 0 HA GLU A 58 11.562 0.248 8.645 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.417 -0.342 6.997 1.00 0.00 H new ATOM 0 HB3 GLU A 58 12.248 -1.206 6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 58 10.944 0.883 5.668 1.00 0.00 H new ATOM 0 HG3 GLU A 58 12.023 1.764 6.732 1.00 0.00 H new ATOM 935 N LEU A 59 9.423 -1.855 7.669 1.00 0.00 N ATOM 936 CA LEU A 59 7.985 -2.013 7.307 1.00 0.00 C ATOM 937 C LEU A 59 7.124 -1.052 8.134 1.00 0.00 C ATOM 938 O LEU A 59 6.232 -0.402 7.620 1.00 0.00 O ATOM 939 CB LEU A 59 7.656 -3.466 7.650 1.00 0.00 C ATOM 940 CG LEU A 59 6.205 -3.762 7.277 1.00 0.00 C ATOM 941 CD1 LEU A 59 6.124 -4.129 5.794 1.00 0.00 C ATOM 942 CD2 LEU A 59 5.689 -4.929 8.119 1.00 0.00 C ATOM 0 H LEU A 59 9.881 -2.704 8.000 1.00 0.00 H new ATOM 0 HA LEU A 59 7.790 -1.787 6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 59 8.325 -4.138 7.113 1.00 0.00 H new ATOM 0 HB3 LEU A 59 7.813 -3.644 8.714 1.00 0.00 H new ATOM 0 HG LEU A 59 5.595 -2.879 7.467 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.088 -4.340 5.528 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.491 -3.297 5.193 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.735 -5.011 5.604 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.653 -5.140 7.853 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.299 -5.812 7.930 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.746 -4.668 9.176 1.00 0.00 H new ATOM 954 N LEU A 60 7.386 -0.955 9.411 1.00 0.00 N ATOM 955 CA LEU A 60 6.586 -0.032 10.270 1.00 0.00 C ATOM 956 C LEU A 60 6.681 1.399 9.734 1.00 0.00 C ATOM 957 O LEU A 60 5.709 2.128 9.711 1.00 0.00 O ATOM 958 CB LEU A 60 7.220 -0.130 11.659 1.00 0.00 C ATOM 959 CG LEU A 60 6.248 0.424 12.702 1.00 0.00 C ATOM 960 CD1 LEU A 60 5.439 -0.725 13.308 1.00 0.00 C ATOM 961 CD2 LEU A 60 7.036 1.130 13.809 1.00 0.00 C ATOM 0 H LEU A 60 8.118 -1.474 9.896 1.00 0.00 H new ATOM 0 HA LEU A 60 5.529 -0.296 10.288 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.463 -1.168 11.887 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.155 0.429 11.684 1.00 0.00 H new ATOM 0 HG LEU A 60 5.571 1.134 12.226 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.746 -0.330 14.051 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.878 -1.230 12.521 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.116 -1.435 13.784 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.344 1.525 14.553 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.712 0.419 14.284 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.613 1.949 13.379 1.00 0.00 H new ATOM 973 N ALA A 61 7.848 1.800 9.298 1.00 0.00 N ATOM 974 CA ALA A 61 8.011 3.181 8.757 1.00 0.00 C ATOM 975 C ALA A 61 7.007 3.427 7.627 1.00 0.00 C ATOM 976 O ALA A 61 6.599 4.546 7.376 1.00 0.00 O ATOM 977 CB ALA A 61 9.443 3.232 8.223 1.00 0.00 C ATOM 0 H ALA A 61 8.694 1.230 9.294 1.00 0.00 H new ATOM 0 HA ALA A 61 7.832 3.945 9.514 1.00 0.00 H new ATOM 0 HB1 ALA A 61 9.641 4.220 7.807 1.00 0.00 H new ATOM 0 HB2 ALA A 61 10.142 3.034 9.036 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.568 2.479 7.445 1.00 0.00 H new ATOM 983 N LYS A 62 6.605 2.388 6.942 1.00 0.00 N ATOM 984 CA LYS A 62 5.623 2.558 5.830 1.00 0.00 C ATOM 985 C LYS A 62 4.302 3.105 6.373 1.00 0.00 C ATOM 986 O LYS A 62 3.737 4.034 5.834 1.00 0.00 O ATOM 987 CB LYS A 62 5.421 1.155 5.254 1.00 0.00 C ATOM 988 CG LYS A 62 4.553 1.237 3.992 1.00 0.00 C ATOM 989 CD LYS A 62 3.408 0.222 4.086 1.00 0.00 C ATOM 990 CE LYS A 62 2.527 0.323 2.838 1.00 0.00 C ATOM 991 NZ LYS A 62 3.363 -0.215 1.730 1.00 0.00 N ATOM 0 H LYS A 62 6.914 1.430 7.104 1.00 0.00 H new ATOM 0 HA LYS A 62 5.976 3.261 5.075 1.00 0.00 H new ATOM 0 HB2 LYS A 62 6.385 0.706 5.016 1.00 0.00 H new ATOM 0 HB3 LYS A 62 4.945 0.512 5.994 1.00 0.00 H new ATOM 0 HG2 LYS A 62 4.151 2.244 3.880 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.159 1.036 3.108 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.810 -0.787 4.179 1.00 0.00 H new ATOM 0 HD3 LYS A 62 2.813 0.412 4.979 1.00 0.00 H new ATOM 0 HE2 LYS A 62 1.609 -0.253 2.955 1.00 0.00 H new ATOM 0 HE3 LYS A 62 2.233 1.355 2.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 2.752 -0.680 1.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 3.881 0.564 1.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 4.041 -0.906 2.110 1.00 0.00 H new ATOM 1005 N ALA A 63 3.807 2.528 7.440 1.00 0.00 N ATOM 1006 CA ALA A 63 2.516 3.004 8.031 1.00 0.00 C ATOM 1007 C ALA A 63 2.525 4.527 8.198 1.00 0.00 C ATOM 1008 O ALA A 63 1.533 5.193 7.973 1.00 0.00 O ATOM 1009 CB ALA A 63 2.434 2.325 9.398 1.00 0.00 C ATOM 0 H ALA A 63 4.242 1.746 7.929 1.00 0.00 H new ATOM 0 HA ALA A 63 1.665 2.762 7.395 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.512 2.623 9.898 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.442 1.243 9.268 1.00 0.00 H new ATOM 0 HB3 ALA A 63 3.289 2.624 10.005 1.00 0.00 H new ATOM 1015 N LEU A 64 3.633 5.080 8.603 1.00 0.00 N ATOM 1016 CA LEU A 64 3.712 6.557 8.794 1.00 0.00 C ATOM 1017 C LEU A 64 3.857 7.282 7.447 1.00 0.00 C ATOM 1018 O LEU A 64 2.967 7.975 6.999 1.00 0.00 O ATOM 1019 CB LEU A 64 4.956 6.778 9.656 1.00 0.00 C ATOM 1020 CG LEU A 64 4.751 6.126 11.024 1.00 0.00 C ATOM 1021 CD1 LEU A 64 6.042 6.232 11.839 1.00 0.00 C ATOM 1022 CD2 LEU A 64 3.622 6.845 11.767 1.00 0.00 C ATOM 0 H LEU A 64 4.492 4.571 8.811 1.00 0.00 H new ATOM 0 HA LEU A 64 2.809 6.952 9.260 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.831 6.352 9.166 1.00 0.00 H new ATOM 0 HB3 LEU A 64 5.145 7.845 9.774 1.00 0.00 H new ATOM 0 HG LEU A 64 4.490 5.076 10.890 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.896 5.767 12.814 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.848 5.722 11.311 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.303 7.282 11.973 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.475 6.381 12.742 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.885 7.894 11.900 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.701 6.772 11.188 1.00 0.00 H new ATOM 1034 N GLU A 65 4.998 7.144 6.821 1.00 0.00 N ATOM 1035 CA GLU A 65 5.253 7.840 5.521 1.00 0.00 C ATOM 1036 C GLU A 65 4.165 7.556 4.476 1.00 0.00 C ATOM 1037 O GLU A 65 3.902 8.379 3.622 1.00 0.00 O ATOM 1038 CB GLU A 65 6.596 7.288 5.044 1.00 0.00 C ATOM 1039 CG GLU A 65 7.177 8.213 3.973 1.00 0.00 C ATOM 1040 CD GLU A 65 6.496 7.931 2.631 1.00 0.00 C ATOM 1041 OE1 GLU A 65 6.468 6.777 2.235 1.00 0.00 O ATOM 1042 OE2 GLU A 65 6.012 8.872 2.024 1.00 0.00 O ATOM 0 H GLU A 65 5.773 6.573 7.158 1.00 0.00 H new ATOM 0 HA GLU A 65 5.253 8.922 5.654 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.287 7.207 5.883 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.466 6.284 4.641 1.00 0.00 H new ATOM 0 HG2 GLU A 65 7.028 9.255 4.257 1.00 0.00 H new ATOM 0 HG3 GLU A 65 8.252 8.057 3.887 1.00 0.00 H new ATOM 1049 N THR A 66 3.544 6.405 4.512 1.00 0.00 N ATOM 1050 CA THR A 66 2.495 6.100 3.486 1.00 0.00 C ATOM 1051 C THR A 66 1.454 7.228 3.414 1.00 0.00 C ATOM 1052 O THR A 66 1.100 7.680 2.343 1.00 0.00 O ATOM 1053 CB THR A 66 1.848 4.782 3.924 1.00 0.00 C ATOM 1054 OG1 THR A 66 0.825 4.434 3.001 1.00 0.00 O ATOM 1055 CG2 THR A 66 1.243 4.936 5.316 1.00 0.00 C ATOM 0 H THR A 66 3.713 5.669 5.198 1.00 0.00 H new ATOM 0 HA THR A 66 2.927 6.016 2.489 1.00 0.00 H new ATOM 0 HB THR A 66 2.606 3.999 3.949 1.00 0.00 H new ATOM 0 HG1 THR A 66 0.409 3.590 3.276 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.785 3.995 5.620 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.026 5.204 6.025 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.485 5.719 5.299 1.00 0.00 H new ATOM 1063 N LEU A 67 0.967 7.691 4.537 1.00 0.00 N ATOM 1064 CA LEU A 67 -0.039 8.792 4.508 1.00 0.00 C ATOM 1065 C LEU A 67 0.627 10.131 4.838 1.00 0.00 C ATOM 1066 O LEU A 67 0.494 11.096 4.112 1.00 0.00 O ATOM 1067 CB LEU A 67 -1.065 8.424 5.581 1.00 0.00 C ATOM 1068 CG LEU A 67 -1.766 7.118 5.194 1.00 0.00 C ATOM 1069 CD1 LEU A 67 -2.017 6.279 6.449 1.00 0.00 C ATOM 1070 CD2 LEU A 67 -3.104 7.436 4.524 1.00 0.00 C ATOM 0 H LEU A 67 1.221 7.356 5.466 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.499 8.901 3.526 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.572 8.312 6.547 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.798 9.224 5.688 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.134 6.561 4.503 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.516 5.350 6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.066 6.051 6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.648 6.838 7.140 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.603 6.507 4.249 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.734 7.995 5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.930 8.033 3.629 1.00 0.00 H new ATOM 1082 N LEU A 68 1.346 10.194 5.929 1.00 0.00 N ATOM 1083 CA LEU A 68 2.025 11.469 6.304 1.00 0.00 C ATOM 1084 C LEU A 68 3.350 11.180 7.019 1.00 0.00 C ATOM 1085 O LEU A 68 3.458 10.248 7.789 1.00 0.00 O ATOM 1086 CB LEU A 68 1.050 12.176 7.249 1.00 0.00 C ATOM 1087 CG LEU A 68 -0.038 12.875 6.432 1.00 0.00 C ATOM 1088 CD1 LEU A 68 -1.059 13.506 7.378 1.00 0.00 C ATOM 1089 CD2 LEU A 68 0.597 13.969 5.568 1.00 0.00 C ATOM 0 H LEU A 68 1.492 9.418 6.575 1.00 0.00 H new ATOM 0 HA LEU A 68 2.263 12.078 5.432 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.600 11.454 7.931 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.583 12.903 7.861 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.536 12.147 5.792 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.835 14.004 6.796 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.511 12.730 7.996 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.561 14.235 8.018 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.177 14.468 4.985 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.094 14.697 6.210 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.327 13.522 4.893 1.00 0.00 H new ATOM 1101 N LEU A 69 4.353 11.981 6.776 1.00 0.00 N ATOM 1102 CA LEU A 69 5.665 11.757 7.452 1.00 0.00 C ATOM 1103 C LEU A 69 5.712 12.528 8.775 1.00 0.00 C ATOM 1104 O LEU A 69 5.492 13.724 8.816 1.00 0.00 O ATOM 1105 CB LEU A 69 6.718 12.285 6.470 1.00 0.00 C ATOM 1106 CG LEU A 69 6.565 13.801 6.300 1.00 0.00 C ATOM 1107 CD1 LEU A 69 7.559 14.523 7.211 1.00 0.00 C ATOM 1108 CD2 LEU A 69 6.845 14.178 4.843 1.00 0.00 C ATOM 0 H LEU A 69 4.321 12.778 6.141 1.00 0.00 H new ATOM 0 HA LEU A 69 5.835 10.708 7.693 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.718 12.051 6.836 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.608 11.790 5.505 1.00 0.00 H new ATOM 0 HG LEU A 69 5.550 14.095 6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 69 7.448 15.600 7.089 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.363 14.254 8.249 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.575 14.230 6.946 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.737 15.255 4.719 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.860 13.882 4.579 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.137 13.665 4.192 1.00 0.00 H new ATOM 1120 N ASN A 70 5.992 11.855 9.858 1.00 0.00 N ATOM 1121 CA ASN A 70 6.048 12.551 11.177 1.00 0.00 C ATOM 1122 C ASN A 70 7.255 12.065 11.983 1.00 0.00 C ATOM 1123 O ASN A 70 7.819 11.025 11.708 1.00 0.00 O ATOM 1124 CB ASN A 70 4.744 12.172 11.881 1.00 0.00 C ATOM 1125 CG ASN A 70 4.383 13.250 12.904 1.00 0.00 C ATOM 1126 OD1 ASN A 70 4.548 14.428 12.649 1.00 0.00 O ATOM 1127 ND2 ASN A 70 3.894 12.898 14.062 1.00 0.00 N ATOM 0 H ASN A 70 6.184 10.854 9.887 1.00 0.00 H new ATOM 0 HA ASN A 70 6.154 13.630 11.069 1.00 0.00 H new ATOM 0 HB2 ASN A 70 3.942 12.066 11.151 1.00 0.00 H new ATOM 0 HB3 ASN A 70 4.853 11.207 12.377 1.00 0.00 H new ATOM 0 HD21 ASN A 70 3.651 13.610 14.751 1.00 0.00 H new ATOM 0 HD22 ASN A 70 3.755 11.911 14.278 1.00 0.00 H new ATOM 1134 N GLY A 71 7.652 12.811 12.981 1.00 0.00 N ATOM 1135 CA GLY A 71 8.822 12.395 13.807 1.00 0.00 C ATOM 1136 C GLY A 71 8.353 11.450 14.916 1.00 0.00 C ATOM 1137 O GLY A 71 9.033 10.507 15.269 1.00 0.00 O ATOM 0 H GLY A 71 7.216 13.690 13.259 1.00 0.00 H new ATOM 0 HA2 GLY A 71 9.564 11.899 13.182 1.00 0.00 H new ATOM 0 HA3 GLY A 71 9.304 13.271 14.241 1.00 0.00 H new ATOM 1141 N VAL A 72 7.194 11.698 15.466 1.00 0.00 N ATOM 1142 CA VAL A 72 6.676 10.814 16.553 1.00 0.00 C ATOM 1143 C VAL A 72 5.201 10.485 16.308 1.00 0.00 C ATOM 1144 O VAL A 72 4.387 11.364 16.099 1.00 0.00 O ATOM 1145 CB VAL A 72 6.838 11.623 17.841 1.00 0.00 C ATOM 1146 CG1 VAL A 72 6.432 10.758 19.038 1.00 0.00 C ATOM 1147 CG2 VAL A 72 8.300 12.049 18.001 1.00 0.00 C ATOM 0 H VAL A 72 6.583 12.474 15.210 1.00 0.00 H new ATOM 0 HA VAL A 72 7.211 9.865 16.601 1.00 0.00 H new ATOM 0 HB VAL A 72 6.204 12.508 17.793 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.547 11.332 19.957 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.392 10.451 18.929 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.068 9.874 19.081 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.413 12.625 18.919 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.934 11.164 18.048 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.596 12.662 17.150 1.00 0.00 H new ATOM 1157 N LEU A 73 4.851 9.227 16.332 1.00 0.00 N ATOM 1158 CA LEU A 73 3.432 8.838 16.101 1.00 0.00 C ATOM 1159 C LEU A 73 3.060 7.652 16.996 1.00 0.00 C ATOM 1160 O LEU A 73 3.854 6.759 17.221 1.00 0.00 O ATOM 1161 CB LEU A 73 3.368 8.442 14.620 1.00 0.00 C ATOM 1162 CG LEU A 73 1.909 8.337 14.143 1.00 0.00 C ATOM 1163 CD1 LEU A 73 1.243 7.107 14.767 1.00 0.00 C ATOM 1164 CD2 LEU A 73 1.133 9.597 14.542 1.00 0.00 C ATOM 0 H LEU A 73 5.490 8.450 16.502 1.00 0.00 H new ATOM 0 HA LEU A 73 2.735 9.642 16.336 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.899 9.180 14.019 1.00 0.00 H new ATOM 0 HB3 LEU A 73 3.873 7.487 14.472 1.00 0.00 H new ATOM 0 HG LEU A 73 1.901 8.240 13.057 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.210 7.039 14.425 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.784 6.209 14.468 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.260 7.196 15.853 1.00 0.00 H new ATOM 0 HD21 LEU A 73 0.102 9.513 14.200 1.00 0.00 H new ATOM 0 HD22 LEU A 73 1.148 9.705 15.627 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.597 10.470 14.084 1.00 0.00 H new ATOM 1176 N THR A 74 1.857 7.639 17.505 1.00 0.00 N ATOM 1177 CA THR A 74 1.430 6.512 18.384 1.00 0.00 C ATOM 1178 C THR A 74 0.665 5.467 17.566 1.00 0.00 C ATOM 1179 O THR A 74 -0.361 5.752 16.980 1.00 0.00 O ATOM 1180 CB THR A 74 0.514 7.151 19.429 1.00 0.00 C ATOM 1181 OG1 THR A 74 -0.464 7.948 18.775 1.00 0.00 O ATOM 1182 CG2 THR A 74 1.343 8.025 20.370 1.00 0.00 C ATOM 0 H THR A 74 1.152 8.360 17.350 1.00 0.00 H new ATOM 0 HA THR A 74 2.276 6.000 18.843 1.00 0.00 H new ATOM 0 HB THR A 74 0.019 6.370 20.006 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.669 7.560 17.899 1.00 0.00 H new ATOM 0 HG21 THR A 74 0.689 8.480 21.114 1.00 0.00 H new ATOM 0 HG22 THR A 74 2.092 7.412 20.871 1.00 0.00 H new ATOM 0 HG23 THR A 74 1.840 8.808 19.797 1.00 0.00 H new ATOM 1190 N LEU A 75 1.158 4.256 17.527 1.00 0.00 N ATOM 1191 CA LEU A 75 0.460 3.187 16.754 1.00 0.00 C ATOM 1192 C LEU A 75 -0.506 2.427 17.667 1.00 0.00 C ATOM 1193 O LEU A 75 -0.183 2.105 18.793 1.00 0.00 O ATOM 1194 CB LEU A 75 1.572 2.258 16.264 1.00 0.00 C ATOM 1195 CG LEU A 75 2.236 2.859 15.026 1.00 0.00 C ATOM 1196 CD1 LEU A 75 3.711 2.456 14.991 1.00 0.00 C ATOM 1197 CD2 LEU A 75 1.536 2.334 13.769 1.00 0.00 C ATOM 0 H LEU A 75 2.014 3.962 17.997 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.126 3.590 15.928 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.312 2.113 17.051 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.161 1.276 16.028 1.00 0.00 H new ATOM 0 HG LEU A 75 2.157 3.946 15.062 1.00 0.00 H new ATOM 0 HD11 LEU A 75 4.184 2.885 14.108 1.00 0.00 H new ATOM 0 HD12 LEU A 75 4.211 2.826 15.886 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.791 1.370 14.954 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.008 2.761 12.884 1.00 0.00 H new ATOM 0 HD22 LEU A 75 1.617 1.248 13.734 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.484 2.619 13.792 1.00 0.00 H new ATOM 1209 N VAL A 76 -1.687 2.140 17.190 1.00 0.00 N ATOM 1210 CA VAL A 76 -2.671 1.403 18.035 1.00 0.00 C ATOM 1211 C VAL A 76 -3.504 0.448 17.178 1.00 0.00 C ATOM 1212 O VAL A 76 -3.475 0.496 15.962 1.00 0.00 O ATOM 1213 CB VAL A 76 -3.560 2.481 18.655 1.00 0.00 C ATOM 1214 CG1 VAL A 76 -2.719 3.367 19.578 1.00 0.00 C ATOM 1215 CG2 VAL A 76 -4.176 3.342 17.547 1.00 0.00 C ATOM 0 H VAL A 76 -2.013 2.383 16.254 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.179 0.797 18.795 1.00 0.00 H new ATOM 0 HB VAL A 76 -4.356 2.006 19.229 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.352 4.136 20.020 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.282 2.757 20.369 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.923 3.839 19.003 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.809 4.109 17.992 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -3.382 3.816 16.971 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.776 2.713 16.889 1.00 0.00 H new ATOM 1225 N LEU A 77 -4.246 -0.421 17.809 1.00 0.00 N ATOM 1226 CA LEU A 77 -5.087 -1.391 17.050 1.00 0.00 C ATOM 1227 C LEU A 77 -6.441 -1.564 17.748 1.00 0.00 C ATOM 1228 O LEU A 77 -6.511 -1.949 18.898 1.00 0.00 O ATOM 1229 CB LEU A 77 -4.301 -2.706 17.073 1.00 0.00 C ATOM 1230 CG LEU A 77 -3.945 -3.075 18.521 1.00 0.00 C ATOM 1231 CD1 LEU A 77 -4.531 -4.449 18.868 1.00 0.00 C ATOM 1232 CD2 LEU A 77 -2.422 -3.116 18.674 1.00 0.00 C ATOM 0 H LEU A 77 -4.306 -0.501 18.824 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.288 -1.058 16.032 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.893 -3.502 16.620 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.392 -2.607 16.479 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.362 -2.328 19.196 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.275 -4.705 19.896 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.615 -4.420 18.761 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.120 -5.201 18.194 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.166 -3.378 19.701 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.008 -3.862 17.996 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.006 -2.137 18.435 1.00 0.00 H new ATOM 1244 N GLU A 78 -7.515 -1.279 17.062 1.00 0.00 N ATOM 1245 CA GLU A 78 -8.864 -1.422 17.690 1.00 0.00 C ATOM 1246 C GLU A 78 -9.216 -2.903 17.881 1.00 0.00 C ATOM 1247 O GLU A 78 -10.135 -3.239 18.602 1.00 0.00 O ATOM 1248 CB GLU A 78 -9.832 -0.762 16.706 1.00 0.00 C ATOM 1249 CG GLU A 78 -11.242 -0.764 17.302 1.00 0.00 C ATOM 1250 CD GLU A 78 -12.220 -0.153 16.296 1.00 0.00 C ATOM 1251 OE1 GLU A 78 -12.192 -0.564 15.147 1.00 0.00 O ATOM 1252 OE2 GLU A 78 -12.980 0.713 16.690 1.00 0.00 O ATOM 0 H GLU A 78 -7.519 -0.954 16.095 1.00 0.00 H new ATOM 0 HA GLU A 78 -8.906 -0.961 18.677 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -9.515 0.260 16.497 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -9.825 -1.298 15.757 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.544 -1.782 17.547 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.257 -0.195 18.232 1.00 0.00 H new ATOM 1259 N GLU A 79 -8.499 -3.790 17.240 1.00 0.00 N ATOM 1260 CA GLU A 79 -8.803 -5.247 17.385 1.00 0.00 C ATOM 1261 C GLU A 79 -8.765 -5.661 18.862 1.00 0.00 C ATOM 1262 O GLU A 79 -9.785 -5.946 19.459 1.00 0.00 O ATOM 1263 CB GLU A 79 -7.702 -5.962 16.595 1.00 0.00 C ATOM 1264 CG GLU A 79 -7.903 -7.477 16.690 1.00 0.00 C ATOM 1265 CD GLU A 79 -6.662 -8.191 16.151 1.00 0.00 C ATOM 1266 OE1 GLU A 79 -6.310 -7.946 15.010 1.00 0.00 O ATOM 1267 OE2 GLU A 79 -6.085 -8.972 16.889 1.00 0.00 O ATOM 0 H GLU A 79 -7.717 -3.570 16.623 1.00 0.00 H new ATOM 0 HA GLU A 79 -9.798 -5.497 17.017 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -7.726 -5.647 15.552 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -6.723 -5.690 16.988 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -8.081 -7.767 17.726 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.783 -7.774 16.120 1.00 0.00 H new ATOM 1274 N ASP A 80 -7.600 -5.703 19.450 1.00 0.00 N ATOM 1275 CA ASP A 80 -7.500 -6.106 20.885 1.00 0.00 C ATOM 1276 C ASP A 80 -7.623 -4.882 21.795 1.00 0.00 C ATOM 1277 O ASP A 80 -8.047 -4.981 22.931 1.00 0.00 O ATOM 1278 CB ASP A 80 -6.115 -6.738 21.022 1.00 0.00 C ATOM 1279 CG ASP A 80 -5.961 -7.333 22.424 1.00 0.00 C ATOM 1280 OD1 ASP A 80 -6.870 -8.022 22.856 1.00 0.00 O ATOM 1281 OD2 ASP A 80 -4.937 -7.089 23.040 1.00 0.00 O ATOM 0 H ASP A 80 -6.713 -5.476 19.000 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.295 -6.793 21.174 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -5.982 -7.515 20.269 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.343 -5.989 20.847 1.00 0.00 H new ATOM 1286 N GLY A 81 -7.257 -3.726 21.308 1.00 0.00 N ATOM 1287 CA GLY A 81 -7.352 -2.497 22.145 1.00 0.00 C ATOM 1288 C GLY A 81 -6.047 -2.294 22.914 1.00 0.00 C ATOM 1289 O GLY A 81 -6.038 -2.206 24.126 1.00 0.00 O ATOM 0 H GLY A 81 -6.896 -3.581 20.365 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -7.552 -1.631 21.514 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -8.186 -2.584 22.842 1.00 0.00 H new ATOM 1293 N THR A 82 -4.942 -2.217 22.221 1.00 0.00 N ATOM 1294 CA THR A 82 -3.635 -2.017 22.916 1.00 0.00 C ATOM 1295 C THR A 82 -2.754 -1.048 22.121 1.00 0.00 C ATOM 1296 O THR A 82 -2.830 -0.976 20.911 1.00 0.00 O ATOM 1297 CB THR A 82 -2.994 -3.405 22.965 1.00 0.00 C ATOM 1298 OG1 THR A 82 -3.854 -4.296 23.663 1.00 0.00 O ATOM 1299 CG2 THR A 82 -1.647 -3.323 23.685 1.00 0.00 C ATOM 0 H THR A 82 -4.887 -2.284 21.205 1.00 0.00 H new ATOM 0 HA THR A 82 -3.759 -1.590 23.911 1.00 0.00 H new ATOM 0 HB THR A 82 -2.837 -3.770 21.950 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.950 -5.126 23.151 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.192 -4.313 23.719 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.989 -2.639 23.149 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.799 -2.959 24.701 1.00 0.00 H new ATOM 1307 N ALA A 83 -1.918 -0.305 22.797 1.00 0.00 N ATOM 1308 CA ALA A 83 -1.027 0.657 22.086 1.00 0.00 C ATOM 1309 C ALA A 83 0.239 -0.054 21.604 1.00 0.00 C ATOM 1310 O ALA A 83 0.602 -1.099 22.108 1.00 0.00 O ATOM 1311 CB ALA A 83 -0.683 1.722 23.128 1.00 0.00 C ATOM 0 H ALA A 83 -1.814 -0.323 23.812 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.502 1.089 21.205 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.028 2.470 22.681 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.599 2.202 23.474 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.177 1.254 23.973 1.00 0.00 H new ATOM 1317 N VAL A 84 0.910 0.500 20.631 1.00 0.00 N ATOM 1318 CA VAL A 84 2.151 -0.150 20.118 1.00 0.00 C ATOM 1319 C VAL A 84 3.175 0.910 19.701 1.00 0.00 C ATOM 1320 O VAL A 84 2.830 1.961 19.201 1.00 0.00 O ATOM 1321 CB VAL A 84 1.701 -0.963 18.902 1.00 0.00 C ATOM 1322 CG1 VAL A 84 2.899 -1.706 18.304 1.00 0.00 C ATOM 1323 CG2 VAL A 84 0.635 -1.975 19.333 1.00 0.00 C ATOM 0 H VAL A 84 0.654 1.373 20.170 1.00 0.00 H new ATOM 0 HA VAL A 84 2.629 -0.773 20.874 1.00 0.00 H new ATOM 0 HB VAL A 84 1.285 -0.290 18.152 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.574 -2.283 17.439 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.657 -0.986 17.996 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.320 -2.378 19.051 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.313 -2.555 18.468 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.052 -2.645 20.085 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.220 -1.446 19.754 1.00 0.00 H new ATOM 1333 N ASP A 85 4.437 0.632 19.901 1.00 0.00 N ATOM 1334 CA ASP A 85 5.493 1.613 19.513 1.00 0.00 C ATOM 1335 C ASP A 85 6.743 0.879 19.019 1.00 0.00 C ATOM 1336 O ASP A 85 7.819 1.444 18.952 1.00 0.00 O ATOM 1337 CB ASP A 85 5.795 2.400 20.792 1.00 0.00 C ATOM 1338 CG ASP A 85 6.263 1.441 21.889 1.00 0.00 C ATOM 1339 OD1 ASP A 85 7.411 1.031 21.840 1.00 0.00 O ATOM 1340 OD2 ASP A 85 5.466 1.133 22.761 1.00 0.00 O ATOM 0 H ASP A 85 4.782 -0.233 20.317 1.00 0.00 H new ATOM 0 HA ASP A 85 5.172 2.267 18.702 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.563 3.148 20.597 1.00 0.00 H new ATOM 0 HB3 ASP A 85 4.904 2.936 21.120 1.00 0.00 H new ATOM 1345 N SER A 86 6.614 -0.377 18.677 1.00 0.00 N ATOM 1346 CA SER A 86 7.795 -1.149 18.192 1.00 0.00 C ATOM 1347 C SER A 86 7.370 -2.153 17.117 1.00 0.00 C ATOM 1348 O SER A 86 6.201 -2.299 16.818 1.00 0.00 O ATOM 1349 CB SER A 86 8.325 -1.879 19.426 1.00 0.00 C ATOM 1350 OG SER A 86 9.472 -2.636 19.066 1.00 0.00 O ATOM 0 H SER A 86 5.740 -0.901 18.713 1.00 0.00 H new ATOM 0 HA SER A 86 8.551 -0.505 17.742 1.00 0.00 H new ATOM 0 HB2 SER A 86 8.579 -1.162 20.206 1.00 0.00 H new ATOM 0 HB3 SER A 86 7.555 -2.535 19.834 1.00 0.00 H new ATOM 0 HG SER A 86 9.816 -3.104 19.855 1.00 0.00 H new ATOM 1356 N GLU A 87 8.314 -2.846 16.537 1.00 0.00 N ATOM 1357 CA GLU A 87 7.974 -3.846 15.477 1.00 0.00 C ATOM 1358 C GLU A 87 7.126 -4.987 16.059 1.00 0.00 C ATOM 1359 O GLU A 87 6.583 -5.794 15.333 1.00 0.00 O ATOM 1360 CB GLU A 87 9.324 -4.378 14.991 1.00 0.00 C ATOM 1361 CG GLU A 87 9.105 -5.333 13.814 1.00 0.00 C ATOM 1362 CD GLU A 87 9.177 -6.779 14.308 1.00 0.00 C ATOM 1363 OE1 GLU A 87 10.250 -7.194 14.709 1.00 0.00 O ATOM 1364 OE2 GLU A 87 8.156 -7.447 14.273 1.00 0.00 O ATOM 0 H GLU A 87 9.308 -2.764 16.751 1.00 0.00 H new ATOM 0 HA GLU A 87 7.390 -3.403 14.670 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.964 -3.550 14.687 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.836 -4.896 15.802 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.135 -5.143 13.354 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.861 -5.162 13.048 1.00 0.00 H new ATOM 1371 N ASP A 88 7.010 -5.059 17.361 1.00 0.00 N ATOM 1372 CA ASP A 88 6.195 -6.148 17.984 1.00 0.00 C ATOM 1373 C ASP A 88 4.721 -6.037 17.576 1.00 0.00 C ATOM 1374 O ASP A 88 3.934 -6.924 17.843 1.00 0.00 O ATOM 1375 CB ASP A 88 6.348 -5.937 19.493 1.00 0.00 C ATOM 1376 CG ASP A 88 5.624 -7.057 20.241 1.00 0.00 C ATOM 1377 OD1 ASP A 88 5.955 -8.208 20.010 1.00 0.00 O ATOM 1378 OD2 ASP A 88 4.749 -6.747 21.033 1.00 0.00 O ATOM 0 H ASP A 88 7.444 -4.412 18.020 1.00 0.00 H new ATOM 0 HA ASP A 88 6.528 -7.136 17.665 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.404 -5.927 19.764 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.937 -4.969 19.779 1.00 0.00 H new ATOM 1383 N PHE A 89 4.336 -4.954 16.940 1.00 0.00 N ATOM 1384 CA PHE A 89 2.908 -4.779 16.517 1.00 0.00 C ATOM 1385 C PHE A 89 2.337 -6.085 15.946 1.00 0.00 C ATOM 1386 O PHE A 89 1.506 -6.726 16.557 1.00 0.00 O ATOM 1387 CB PHE A 89 2.949 -3.694 15.439 1.00 0.00 C ATOM 1388 CG PHE A 89 1.561 -3.471 14.886 1.00 0.00 C ATOM 1389 CD1 PHE A 89 0.709 -2.542 15.487 1.00 0.00 C ATOM 1390 CD2 PHE A 89 1.128 -4.196 13.774 1.00 0.00 C ATOM 1391 CE1 PHE A 89 -0.578 -2.333 14.977 1.00 0.00 C ATOM 1392 CE2 PHE A 89 -0.156 -3.996 13.256 1.00 0.00 C ATOM 1393 CZ PHE A 89 -1.026 -3.060 13.855 1.00 0.00 C ATOM 0 H PHE A 89 4.953 -4.180 16.695 1.00 0.00 H new ATOM 0 HA PHE A 89 2.267 -4.507 17.355 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.337 -2.766 15.859 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.627 -3.989 14.638 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.044 -1.983 16.348 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.788 -4.915 13.311 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.231 -1.611 15.445 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.483 -4.560 12.395 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.019 -2.903 13.460 1.00 0.00 H new ATOM 1403 N PHE A 90 2.773 -6.477 14.779 1.00 0.00 N ATOM 1404 CA PHE A 90 2.250 -7.737 14.167 1.00 0.00 C ATOM 1405 C PHE A 90 2.504 -8.931 15.093 1.00 0.00 C ATOM 1406 O PHE A 90 1.793 -9.915 15.056 1.00 0.00 O ATOM 1407 CB PHE A 90 3.029 -7.896 12.862 1.00 0.00 C ATOM 1408 CG PHE A 90 2.505 -6.914 11.841 1.00 0.00 C ATOM 1409 CD1 PHE A 90 1.264 -7.129 11.239 1.00 0.00 C ATOM 1410 CD2 PHE A 90 3.261 -5.791 11.501 1.00 0.00 C ATOM 1411 CE1 PHE A 90 0.773 -6.221 10.292 1.00 0.00 C ATOM 1412 CE2 PHE A 90 2.781 -4.876 10.555 1.00 0.00 C ATOM 1413 CZ PHE A 90 1.528 -5.082 9.941 1.00 0.00 C ATOM 0 H PHE A 90 3.468 -5.981 14.222 1.00 0.00 H new ATOM 0 HA PHE A 90 1.174 -7.694 13.999 1.00 0.00 H new ATOM 0 HB2 PHE A 90 4.091 -7.724 13.037 1.00 0.00 H new ATOM 0 HB3 PHE A 90 2.929 -8.915 12.488 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.681 -7.998 11.504 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.220 -5.627 11.969 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.187 -6.394 9.829 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.372 -4.010 10.295 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.152 -4.378 9.213 1.00 0.00 H new ATOM 1423 N GLN A 91 3.511 -8.850 15.920 1.00 0.00 N ATOM 1424 CA GLN A 91 3.810 -9.980 16.847 1.00 0.00 C ATOM 1425 C GLN A 91 2.848 -9.965 18.042 1.00 0.00 C ATOM 1426 O GLN A 91 2.797 -10.902 18.817 1.00 0.00 O ATOM 1427 CB GLN A 91 5.246 -9.739 17.314 1.00 0.00 C ATOM 1428 CG GLN A 91 5.741 -10.953 18.109 1.00 0.00 C ATOM 1429 CD GLN A 91 6.663 -11.801 17.232 1.00 0.00 C ATOM 1430 OE1 GLN A 91 7.761 -12.134 17.628 1.00 0.00 O ATOM 1431 NE2 GLN A 91 6.258 -12.170 16.047 1.00 0.00 N ATOM 0 H GLN A 91 4.140 -8.050 15.994 1.00 0.00 H new ATOM 0 HA GLN A 91 3.693 -10.949 16.362 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.894 -9.566 16.455 1.00 0.00 H new ATOM 0 HB3 GLN A 91 5.292 -8.843 17.933 1.00 0.00 H new ATOM 0 HG2 GLN A 91 6.273 -10.623 19.001 1.00 0.00 H new ATOM 0 HG3 GLN A 91 4.893 -11.550 18.446 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.335 -11.891 15.713 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.864 -12.738 15.455 1.00 0.00 H new ATOM 1440 N LEU A 92 2.090 -8.913 18.201 1.00 0.00 N ATOM 1441 CA LEU A 92 1.136 -8.842 19.349 1.00 0.00 C ATOM 1442 C LEU A 92 -0.223 -9.434 18.959 1.00 0.00 C ATOM 1443 O LEU A 92 -1.002 -9.825 19.805 1.00 0.00 O ATOM 1444 CB LEU A 92 1.003 -7.351 19.658 1.00 0.00 C ATOM 1445 CG LEU A 92 0.380 -7.167 21.044 1.00 0.00 C ATOM 1446 CD1 LEU A 92 1.484 -6.929 22.075 1.00 0.00 C ATOM 1447 CD2 LEU A 92 -0.564 -5.960 21.023 1.00 0.00 C ATOM 0 H LEU A 92 2.089 -8.099 17.586 1.00 0.00 H new ATOM 0 HA LEU A 92 1.488 -9.410 20.210 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.982 -6.873 19.622 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.384 -6.867 18.903 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.179 -8.064 21.311 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.039 -6.798 23.061 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.157 -7.786 22.092 1.00 0.00 H new ATOM 0 HD13 LEU A 92 2.044 -6.033 21.808 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.008 -5.828 22.010 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.004 -5.064 20.755 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.353 -6.128 20.290 1.00 0.00 H new ATOM 1459 N LEU A 93 -0.516 -9.504 17.685 1.00 0.00 N ATOM 1460 CA LEU A 93 -1.830 -10.071 17.250 1.00 0.00 C ATOM 1461 C LEU A 93 -1.610 -11.233 16.276 1.00 0.00 C ATOM 1462 O LEU A 93 -0.535 -11.408 15.738 1.00 0.00 O ATOM 1463 CB LEU A 93 -2.563 -8.924 16.539 1.00 0.00 C ATOM 1464 CG LEU A 93 -2.374 -7.614 17.310 1.00 0.00 C ATOM 1465 CD1 LEU A 93 -1.234 -6.811 16.678 1.00 0.00 C ATOM 1466 CD2 LEU A 93 -3.665 -6.790 17.245 1.00 0.00 C ATOM 0 H LEU A 93 0.095 -9.194 16.929 1.00 0.00 H new ATOM 0 HA LEU A 93 -2.400 -10.456 18.096 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.183 -8.814 15.523 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.625 -9.157 16.458 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.134 -7.838 18.349 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -1.099 -5.878 17.226 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.313 -7.393 16.719 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.478 -6.589 15.639 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.530 -5.858 17.794 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -3.903 -6.567 16.205 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.482 -7.358 17.690 1.00 0.00 H new ATOM 1478 N GLU A 94 -2.627 -12.020 16.037 1.00 0.00 N ATOM 1479 CA GLU A 94 -2.478 -13.162 15.084 1.00 0.00 C ATOM 1480 C GLU A 94 -2.202 -12.618 13.683 1.00 0.00 C ATOM 1481 O GLU A 94 -2.204 -11.420 13.469 1.00 0.00 O ATOM 1482 CB GLU A 94 -3.817 -13.898 15.125 1.00 0.00 C ATOM 1483 CG GLU A 94 -3.826 -14.881 16.298 1.00 0.00 C ATOM 1484 CD GLU A 94 -3.788 -14.103 17.615 1.00 0.00 C ATOM 1485 OE1 GLU A 94 -4.845 -13.703 18.075 1.00 0.00 O ATOM 1486 OE2 GLU A 94 -2.703 -13.923 18.142 1.00 0.00 O ATOM 0 H GLU A 94 -3.551 -11.923 16.458 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.653 -13.824 15.346 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -4.633 -13.183 15.230 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.979 -14.432 14.189 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.719 -15.505 16.257 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.967 -15.549 16.233 1.00 0.00 H new ATOM 1493 N ASP A 95 -1.954 -13.469 12.724 1.00 0.00 N ATOM 1494 CA ASP A 95 -1.672 -12.959 11.349 1.00 0.00 C ATOM 1495 C ASP A 95 -2.887 -12.198 10.812 1.00 0.00 C ATOM 1496 O ASP A 95 -3.970 -12.735 10.689 1.00 0.00 O ATOM 1497 CB ASP A 95 -1.400 -14.206 10.507 1.00 0.00 C ATOM 1498 CG ASP A 95 -1.074 -13.792 9.070 1.00 0.00 C ATOM 1499 OD1 ASP A 95 -0.218 -12.941 8.898 1.00 0.00 O ATOM 1500 OD2 ASP A 95 -1.687 -14.335 8.166 1.00 0.00 O ATOM 0 H ASP A 95 -1.934 -14.483 12.829 1.00 0.00 H new ATOM 0 HA ASP A 95 -0.829 -12.268 11.329 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -0.569 -14.770 10.931 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -2.270 -14.862 10.519 1.00 0.00 H new ATOM 1505 N ASP A 96 -2.700 -10.951 10.483 1.00 0.00 N ATOM 1506 CA ASP A 96 -3.820 -10.130 9.940 1.00 0.00 C ATOM 1507 C ASP A 96 -3.265 -8.815 9.390 1.00 0.00 C ATOM 1508 O ASP A 96 -2.092 -8.526 9.532 1.00 0.00 O ATOM 1509 CB ASP A 96 -4.752 -9.872 11.130 1.00 0.00 C ATOM 1510 CG ASP A 96 -3.976 -9.194 12.263 1.00 0.00 C ATOM 1511 OD1 ASP A 96 -3.375 -8.162 12.011 1.00 0.00 O ATOM 1512 OD2 ASP A 96 -3.999 -9.717 13.365 1.00 0.00 O ATOM 0 H ASP A 96 -1.810 -10.460 10.568 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.348 -10.628 9.126 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -5.585 -9.241 10.820 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -5.177 -10.812 11.481 1.00 0.00 H new ATOM 1517 N THR A 97 -4.090 -8.003 8.786 1.00 0.00 N ATOM 1518 CA THR A 97 -3.582 -6.703 8.265 1.00 0.00 C ATOM 1519 C THR A 97 -4.422 -5.555 8.827 1.00 0.00 C ATOM 1520 O THR A 97 -5.516 -5.287 8.371 1.00 0.00 O ATOM 1521 CB THR A 97 -3.726 -6.782 6.743 1.00 0.00 C ATOM 1522 OG1 THR A 97 -3.708 -8.143 6.332 1.00 0.00 O ATOM 1523 CG2 THR A 97 -2.562 -6.035 6.090 1.00 0.00 C ATOM 0 H THR A 97 -5.083 -8.181 8.632 1.00 0.00 H new ATOM 0 HA THR A 97 -2.548 -6.521 8.556 1.00 0.00 H new ATOM 0 HB THR A 97 -4.670 -6.328 6.440 1.00 0.00 H new ATOM 0 HG1 THR A 97 -3.802 -8.192 5.358 1.00 0.00 H new ATOM 0 HG21 THR A 97 -2.659 -6.087 5.006 1.00 0.00 H new ATOM 0 HG22 THR A 97 -2.576 -4.992 6.406 1.00 0.00 H new ATOM 0 HG23 THR A 97 -1.620 -6.493 6.393 1.00 0.00 H new ATOM 1531 N CYS A 98 -3.904 -4.870 9.810 1.00 0.00 N ATOM 1532 CA CYS A 98 -4.647 -3.726 10.410 1.00 0.00 C ATOM 1533 C CYS A 98 -3.663 -2.605 10.748 1.00 0.00 C ATOM 1534 O CYS A 98 -2.613 -2.848 11.309 1.00 0.00 O ATOM 1535 CB CYS A 98 -5.284 -4.286 11.682 1.00 0.00 C ATOM 1536 SG CYS A 98 -6.503 -3.108 12.316 1.00 0.00 S ATOM 0 H CYS A 98 -2.991 -5.056 10.226 1.00 0.00 H new ATOM 0 HA CYS A 98 -5.397 -3.311 9.737 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.762 -5.242 11.471 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.517 -4.472 12.434 1.00 0.00 H new ATOM 0 HG CYS A 98 -7.046 -3.585 13.396 1.00 0.00 H new ATOM 1542 N LEU A 99 -3.982 -1.387 10.409 1.00 0.00 N ATOM 1543 CA LEU A 99 -3.040 -0.275 10.719 1.00 0.00 C ATOM 1544 C LEU A 99 -3.799 0.980 11.157 1.00 0.00 C ATOM 1545 O LEU A 99 -4.832 1.316 10.616 1.00 0.00 O ATOM 1546 CB LEU A 99 -2.294 -0.019 9.411 1.00 0.00 C ATOM 1547 CG LEU A 99 -1.007 0.760 9.699 1.00 0.00 C ATOM 1548 CD1 LEU A 99 0.100 0.290 8.751 1.00 0.00 C ATOM 1549 CD2 LEU A 99 -1.261 2.255 9.494 1.00 0.00 C ATOM 0 H LEU A 99 -4.844 -1.115 9.936 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.367 -0.529 11.538 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.057 -0.965 8.924 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.926 0.544 8.724 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.697 0.583 10.729 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.015 0.845 8.957 1.00 0.00 H new ATOM 0 HD12 LEU A 99 0.280 -0.775 8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -0.206 0.465 7.719 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.346 2.811 9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.572 2.433 8.465 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.047 2.587 10.173 1.00 0.00 H new ATOM 1561 N MET A 100 -3.275 1.681 12.124 1.00 0.00 N ATOM 1562 CA MET A 100 -3.939 2.926 12.595 1.00 0.00 C ATOM 1563 C MET A 100 -2.873 3.943 13.008 1.00 0.00 C ATOM 1564 O MET A 100 -1.929 3.613 13.701 1.00 0.00 O ATOM 1565 CB MET A 100 -4.779 2.503 13.799 1.00 0.00 C ATOM 1566 CG MET A 100 -5.872 3.544 14.052 1.00 0.00 C ATOM 1567 SD MET A 100 -7.358 2.723 14.683 1.00 0.00 S ATOM 1568 CE MET A 100 -7.280 3.366 16.372 1.00 0.00 C ATOM 0 H MET A 100 -2.411 1.443 12.610 1.00 0.00 H new ATOM 0 HA MET A 100 -4.555 3.392 11.826 1.00 0.00 H new ATOM 0 HB2 MET A 100 -5.228 1.526 13.617 1.00 0.00 H new ATOM 0 HB3 MET A 100 -4.146 2.404 14.681 1.00 0.00 H new ATOM 0 HG2 MET A 100 -5.522 4.287 14.769 1.00 0.00 H new ATOM 0 HG3 MET A 100 -6.102 4.076 13.129 1.00 0.00 H new ATOM 0 HE1 MET A 100 -8.263 3.735 16.667 1.00 0.00 H new ATOM 0 HE2 MET A 100 -6.972 2.570 17.050 1.00 0.00 H new ATOM 0 HE3 MET A 100 -6.558 4.181 16.418 1.00 0.00 H new ATOM 1578 N VAL A 101 -3.010 5.172 12.592 1.00 0.00 N ATOM 1579 CA VAL A 101 -1.994 6.198 12.965 1.00 0.00 C ATOM 1580 C VAL A 101 -2.687 7.508 13.350 1.00 0.00 C ATOM 1581 O VAL A 101 -3.286 8.172 12.527 1.00 0.00 O ATOM 1582 CB VAL A 101 -1.146 6.378 11.702 1.00 0.00 C ATOM 1583 CG1 VAL A 101 -0.167 7.544 11.887 1.00 0.00 C ATOM 1584 CG2 VAL A 101 -0.361 5.091 11.434 1.00 0.00 C ATOM 0 H VAL A 101 -3.778 5.510 12.012 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.390 5.901 13.822 1.00 0.00 H new ATOM 0 HB VAL A 101 -1.801 6.595 10.858 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.431 7.664 10.984 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.725 8.461 12.077 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.490 7.337 12.732 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.244 5.214 10.536 1.00 0.00 H new ATOM 0 HG22 VAL A 101 0.289 4.878 12.283 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.056 4.264 11.292 1.00 0.00 H new ATOM 1594 N LEU A 102 -2.604 7.881 14.599 1.00 0.00 N ATOM 1595 CA LEU A 102 -3.248 9.149 15.046 1.00 0.00 C ATOM 1596 C LEU A 102 -2.430 9.785 16.172 1.00 0.00 C ATOM 1597 O LEU A 102 -1.464 9.217 16.645 1.00 0.00 O ATOM 1598 CB LEU A 102 -4.643 8.743 15.537 1.00 0.00 C ATOM 1599 CG LEU A 102 -4.531 7.666 16.620 1.00 0.00 C ATOM 1600 CD1 LEU A 102 -5.784 7.702 17.495 1.00 0.00 C ATOM 1601 CD2 LEU A 102 -4.415 6.286 15.965 1.00 0.00 C ATOM 0 H LEU A 102 -2.117 7.361 15.329 1.00 0.00 H new ATOM 0 HA LEU A 102 -3.308 9.888 14.247 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -5.165 9.614 15.933 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.236 8.369 14.702 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.647 7.854 17.229 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.710 6.937 18.268 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.873 8.683 17.962 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -6.663 7.512 16.879 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.335 5.522 16.738 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.300 6.096 15.357 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -3.527 6.257 15.333 1.00 0.00 H new ATOM 1613 N GLN A 103 -2.809 10.956 16.608 1.00 0.00 N ATOM 1614 CA GLN A 103 -2.052 11.624 17.707 1.00 0.00 C ATOM 1615 C GLN A 103 -2.485 11.056 19.063 1.00 0.00 C ATOM 1616 O GLN A 103 -3.546 10.481 19.193 1.00 0.00 O ATOM 1617 CB GLN A 103 -2.417 13.104 17.604 1.00 0.00 C ATOM 1618 CG GLN A 103 -1.503 13.922 18.519 1.00 0.00 C ATOM 1619 CD GLN A 103 -1.934 15.389 18.495 1.00 0.00 C ATOM 1620 OE1 GLN A 103 -1.473 16.157 17.673 1.00 0.00 O ATOM 1621 NE2 GLN A 103 -2.804 15.816 19.369 1.00 0.00 N ATOM 0 H GLN A 103 -3.609 11.479 16.252 1.00 0.00 H new ATOM 0 HA GLN A 103 -0.977 11.467 17.622 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.315 13.443 16.573 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.459 13.253 17.887 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -1.550 13.535 19.537 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -0.467 13.831 18.191 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -3.191 15.173 20.059 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -3.097 16.793 19.362 1.00 0.00 H new ATOM 1630 N SER A 104 -1.666 11.211 20.069 1.00 0.00 N ATOM 1631 CA SER A 104 -2.030 10.678 21.417 1.00 0.00 C ATOM 1632 C SER A 104 -3.216 11.456 21.991 1.00 0.00 C ATOM 1633 O SER A 104 -3.666 12.431 21.421 1.00 0.00 O ATOM 1634 CB SER A 104 -0.785 10.889 22.277 1.00 0.00 C ATOM 1635 OG SER A 104 -0.429 12.264 22.259 1.00 0.00 O ATOM 0 H SER A 104 -0.763 11.682 20.017 1.00 0.00 H new ATOM 0 HA SER A 104 -2.326 9.630 21.379 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.976 10.565 23.300 1.00 0.00 H new ATOM 0 HB3 SER A 104 0.039 10.283 21.899 1.00 0.00 H new ATOM 0 HG SER A 104 0.369 12.403 22.811 1.00 0.00 H new ATOM 1641 N GLY A 105 -3.725 11.033 23.118 1.00 0.00 N ATOM 1642 CA GLY A 105 -4.881 11.746 23.732 1.00 0.00 C ATOM 1643 C GLY A 105 -6.190 11.145 23.216 1.00 0.00 C ATOM 1644 O GLY A 105 -7.194 11.821 23.113 1.00 0.00 O ATOM 0 H GLY A 105 -3.389 10.223 23.640 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -4.836 11.665 24.818 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.836 12.808 23.489 1.00 0.00 H new ATOM 1648 N GLN A 106 -6.185 9.880 22.891 1.00 0.00 N ATOM 1649 CA GLN A 106 -7.430 9.236 22.383 1.00 0.00 C ATOM 1650 C GLN A 106 -7.577 7.830 22.971 1.00 0.00 C ATOM 1651 O GLN A 106 -6.607 7.194 23.334 1.00 0.00 O ATOM 1652 CB GLN A 106 -7.251 9.168 20.865 1.00 0.00 C ATOM 1653 CG GLN A 106 -8.584 8.807 20.207 1.00 0.00 C ATOM 1654 CD GLN A 106 -8.559 9.216 18.732 1.00 0.00 C ATOM 1655 OE1 GLN A 106 -7.548 9.662 18.226 1.00 0.00 O ATOM 1656 NE2 GLN A 106 -9.642 9.082 18.014 1.00 0.00 N ATOM 0 H GLN A 106 -5.373 9.266 22.955 1.00 0.00 H new ATOM 0 HA GLN A 106 -8.325 9.791 22.663 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -6.895 10.127 20.487 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.495 8.425 20.611 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -8.765 7.736 20.294 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -9.402 9.312 20.720 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -10.491 8.708 18.437 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -9.638 9.351 17.030 1.00 0.00 H new ATOM 1665 N SER A 107 -8.786 7.343 23.071 1.00 0.00 N ATOM 1666 CA SER A 107 -9.000 5.981 23.640 1.00 0.00 C ATOM 1667 C SER A 107 -9.864 5.141 22.695 1.00 0.00 C ATOM 1668 O SER A 107 -10.352 5.624 21.693 1.00 0.00 O ATOM 1669 CB SER A 107 -9.725 6.216 24.964 1.00 0.00 C ATOM 1670 OG SER A 107 -8.928 7.053 25.793 1.00 0.00 O ATOM 0 H SER A 107 -9.634 7.830 22.783 1.00 0.00 H new ATOM 0 HA SER A 107 -8.064 5.439 23.778 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.695 6.680 24.784 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.914 5.265 25.462 1.00 0.00 H new ATOM 0 HG SER A 107 -9.391 7.207 26.643 1.00 0.00 H new ATOM 1676 N TRP A 108 -10.060 3.889 23.011 1.00 0.00 N ATOM 1677 CA TRP A 108 -10.894 3.013 22.137 1.00 0.00 C ATOM 1678 C TRP A 108 -12.381 3.266 22.405 1.00 0.00 C ATOM 1679 O TRP A 108 -12.808 3.359 23.539 1.00 0.00 O ATOM 1680 CB TRP A 108 -10.516 1.585 22.526 1.00 0.00 C ATOM 1681 CG TRP A 108 -9.233 1.205 21.858 1.00 0.00 C ATOM 1682 CD1 TRP A 108 -9.114 0.830 20.563 1.00 0.00 C ATOM 1683 CD2 TRP A 108 -7.893 1.157 22.423 1.00 0.00 C ATOM 1684 NE1 TRP A 108 -7.783 0.552 20.300 1.00 0.00 N ATOM 1685 CE2 TRP A 108 -6.991 0.738 21.414 1.00 0.00 C ATOM 1686 CE3 TRP A 108 -7.375 1.430 23.701 1.00 0.00 C ATOM 1687 CZ2 TRP A 108 -5.627 0.598 21.665 1.00 0.00 C ATOM 1688 CZ3 TRP A 108 -6.001 1.289 23.959 1.00 0.00 C ATOM 1689 CH2 TRP A 108 -5.128 0.874 22.944 1.00 0.00 C ATOM 0 H TRP A 108 -9.677 3.433 23.839 1.00 0.00 H new ATOM 0 HA TRP A 108 -10.723 3.204 21.078 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -10.411 1.508 23.608 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.308 0.896 22.233 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -9.924 0.759 19.852 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -7.431 0.247 19.393 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -8.038 1.751 24.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -4.959 0.279 20.878 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -5.615 1.502 24.945 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -4.073 0.767 23.148 1.00 0.00 H new ATOM 1700 N SER A 109 -13.170 3.375 21.371 1.00 0.00 N ATOM 1701 CA SER A 109 -14.630 3.619 21.565 1.00 0.00 C ATOM 1702 C SER A 109 -15.405 2.297 21.477 1.00 0.00 C ATOM 1703 O SER A 109 -15.397 1.649 20.449 1.00 0.00 O ATOM 1704 CB SER A 109 -15.029 4.551 20.421 1.00 0.00 C ATOM 1705 OG SER A 109 -16.440 4.716 20.421 1.00 0.00 O ATOM 0 H SER A 109 -12.868 3.306 20.399 1.00 0.00 H new ATOM 0 HA SER A 109 -14.851 4.052 22.541 1.00 0.00 H new ATOM 0 HB2 SER A 109 -14.538 5.517 20.536 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.700 4.137 19.468 1.00 0.00 H new ATOM 0 HG SER A 109 -16.699 5.314 19.690 1.00 0.00 H new ATOM 1711 N PRO A 110 -16.054 1.937 22.558 1.00 0.00 N ATOM 1712 CA PRO A 110 -16.838 0.675 22.581 1.00 0.00 C ATOM 1713 C PRO A 110 -18.104 0.818 21.729 1.00 0.00 C ATOM 1714 O PRO A 110 -18.579 1.911 21.488 1.00 0.00 O ATOM 1715 CB PRO A 110 -17.190 0.498 24.056 1.00 0.00 C ATOM 1716 CG PRO A 110 -17.145 1.875 24.633 1.00 0.00 C ATOM 1717 CD PRO A 110 -16.124 2.651 23.841 1.00 0.00 C ATOM 0 HA PRO A 110 -16.293 -0.177 22.174 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -18.178 0.052 24.175 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -16.480 -0.162 24.555 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -18.124 2.351 24.572 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -16.872 1.843 25.688 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -16.429 3.689 23.705 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -15.157 2.666 24.343 1.00 0.00 H new ATOM 1725 N THR A 111 -18.650 -0.277 21.273 1.00 0.00 N ATOM 1726 CA THR A 111 -19.884 -0.208 20.437 1.00 0.00 C ATOM 1727 C THR A 111 -21.105 -0.631 21.256 1.00 0.00 C ATOM 1728 O THR A 111 -21.012 -1.451 22.150 1.00 0.00 O ATOM 1729 CB THR A 111 -19.640 -1.188 19.289 1.00 0.00 C ATOM 1730 OG1 THR A 111 -18.457 -0.817 18.596 1.00 0.00 O ATOM 1731 CG2 THR A 111 -20.829 -1.158 18.327 1.00 0.00 C ATOM 0 H THR A 111 -18.295 -1.218 21.443 1.00 0.00 H new ATOM 0 HA THR A 111 -20.081 0.801 20.076 1.00 0.00 H new ATOM 0 HB THR A 111 -19.526 -2.196 19.689 1.00 0.00 H new ATOM 0 HG1 THR A 111 -18.298 -1.445 17.861 1.00 0.00 H new ATOM 0 HG21 THR A 111 -20.653 -1.857 17.509 1.00 0.00 H new ATOM 0 HG22 THR A 111 -21.736 -1.444 18.860 1.00 0.00 H new ATOM 0 HG23 THR A 111 -20.946 -0.152 17.925 1.00 0.00 H new ATOM 1739 N ARG A 112 -22.251 -0.078 20.960 1.00 0.00 N ATOM 1740 CA ARG A 112 -23.481 -0.448 21.720 1.00 0.00 C ATOM 1741 C ARG A 112 -24.725 -0.217 20.857 1.00 0.00 C ATOM 1742 O ARG A 112 -24.721 0.591 19.951 1.00 0.00 O ATOM 1743 CB ARG A 112 -23.493 0.478 22.940 1.00 0.00 C ATOM 1744 CG ARG A 112 -23.456 1.940 22.482 1.00 0.00 C ATOM 1745 CD ARG A 112 -22.085 2.542 22.796 1.00 0.00 C ATOM 1746 NE ARG A 112 -21.765 3.403 21.624 1.00 0.00 N ATOM 1747 CZ ARG A 112 -22.132 4.655 21.614 1.00 0.00 C ATOM 1748 NH1 ARG A 112 -23.392 4.965 21.476 1.00 0.00 N ATOM 1749 NH2 ARG A 112 -21.238 5.597 21.741 1.00 0.00 N ATOM 0 H ARG A 112 -22.389 0.615 20.224 1.00 0.00 H new ATOM 0 HA ARG A 112 -23.485 -1.499 22.009 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -24.387 0.297 23.537 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -22.635 0.265 23.578 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -23.655 2.002 21.412 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -24.238 2.509 22.985 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -22.111 3.123 23.718 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -21.334 1.764 22.931 1.00 0.00 H new ATOM 0 HE ARG A 112 -21.259 3.014 20.829 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -24.090 4.228 21.376 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -23.678 5.944 21.468 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -20.253 5.354 21.848 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -21.524 6.576 21.733 1.00 0.00 H new ATOM 1763 N SER A 113 -25.790 -0.920 21.137 1.00 0.00 N ATOM 1764 CA SER A 113 -27.036 -0.742 20.337 1.00 0.00 C ATOM 1765 C SER A 113 -27.777 0.524 20.788 1.00 0.00 C ATOM 1766 O SER A 113 -27.621 1.581 20.206 1.00 0.00 O ATOM 1767 CB SER A 113 -27.871 -1.993 20.614 1.00 0.00 C ATOM 1768 OG SER A 113 -27.361 -3.076 19.847 1.00 0.00 O ATOM 0 H SER A 113 -25.851 -1.610 21.886 1.00 0.00 H new ATOM 0 HA SER A 113 -26.833 -0.624 19.273 1.00 0.00 H new ATOM 0 HB2 SER A 113 -27.840 -2.238 21.676 1.00 0.00 H new ATOM 0 HB3 SER A 113 -28.915 -1.811 20.359 1.00 0.00 H new ATOM 0 HG SER A 113 -27.892 -3.880 20.023 1.00 0.00 H new ATOM 1774 N GLY A 114 -28.576 0.429 21.817 1.00 0.00 N ATOM 1775 CA GLY A 114 -29.319 1.630 22.300 1.00 0.00 C ATOM 1776 C GLY A 114 -28.435 2.427 23.259 1.00 0.00 C ATOM 1777 O GLY A 114 -27.514 1.897 23.851 1.00 0.00 O ATOM 0 H GLY A 114 -28.747 -0.428 22.344 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.611 2.254 21.455 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -30.236 1.325 22.803 1.00 0.00 H new ATOM 1781 N VAL A 115 -28.705 3.695 23.416 1.00 0.00 N ATOM 1782 CA VAL A 115 -27.878 4.525 24.339 1.00 0.00 C ATOM 1783 C VAL A 115 -28.006 4.008 25.776 1.00 0.00 C ATOM 1784 O VAL A 115 -28.895 3.244 26.092 1.00 0.00 O ATOM 1785 CB VAL A 115 -28.444 5.943 24.219 1.00 0.00 C ATOM 1786 CG1 VAL A 115 -29.912 5.953 24.653 1.00 0.00 C ATOM 1787 CG2 VAL A 115 -27.643 6.892 25.116 1.00 0.00 C ATOM 0 H VAL A 115 -29.462 4.192 22.946 1.00 0.00 H new ATOM 0 HA VAL A 115 -26.818 4.491 24.086 1.00 0.00 H new ATOM 0 HB VAL A 115 -28.371 6.271 23.182 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -30.310 6.964 24.566 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -30.485 5.281 24.014 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -29.988 5.621 25.689 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -28.046 7.901 25.030 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -27.714 6.560 26.152 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -26.598 6.891 24.805 1.00 0.00 H new ATOM 1797 N LEU A 116 -27.121 4.419 26.645 1.00 0.00 N ATOM 1798 CA LEU A 116 -27.189 3.953 28.060 1.00 0.00 C ATOM 1799 C LEU A 116 -27.817 5.030 28.946 1.00 0.00 C ATOM 1800 O LEU A 116 -27.460 6.190 28.876 1.00 0.00 O ATOM 1801 CB LEU A 116 -25.734 3.709 28.464 1.00 0.00 C ATOM 1802 CG LEU A 116 -25.396 2.228 28.288 1.00 0.00 C ATOM 1803 CD1 LEU A 116 -23.937 2.086 27.844 1.00 0.00 C ATOM 1804 CD2 LEU A 116 -25.595 1.499 29.620 1.00 0.00 C ATOM 0 H LEU A 116 -26.354 5.058 26.436 1.00 0.00 H new ATOM 0 HA LEU A 116 -27.801 3.058 28.170 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -25.069 4.320 27.853 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -25.579 4.007 29.501 1.00 0.00 H new ATOM 0 HG LEU A 116 -26.050 1.793 27.532 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -23.696 1.030 27.719 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -23.793 2.606 26.897 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -23.283 2.520 28.600 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -25.355 0.443 29.496 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -24.940 1.934 30.375 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -26.633 1.600 29.939 1.00 0.00 H new ATOM 1816 N HIS A 117 -28.749 4.656 29.781 1.00 0.00 N ATOM 1817 CA HIS A 117 -29.401 5.657 30.674 1.00 0.00 C ATOM 1818 C HIS A 117 -28.568 5.853 31.941 1.00 0.00 C ATOM 1819 O HIS A 117 -28.273 4.913 32.652 1.00 0.00 O ATOM 1820 CB HIS A 117 -30.766 5.055 31.016 1.00 0.00 C ATOM 1821 CG HIS A 117 -31.813 5.608 30.088 1.00 0.00 C ATOM 1822 ND1 HIS A 117 -33.025 4.970 29.878 1.00 0.00 N ATOM 1823 CD2 HIS A 117 -31.845 6.738 29.308 1.00 0.00 C ATOM 1824 CE1 HIS A 117 -33.729 5.713 29.004 1.00 0.00 C ATOM 1825 NE2 HIS A 117 -33.056 6.802 28.626 1.00 0.00 N ATOM 0 H HIS A 117 -29.087 3.699 29.883 1.00 0.00 H new ATOM 0 HA HIS A 117 -29.495 6.634 30.201 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -30.727 3.969 30.929 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -31.026 5.283 32.050 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -31.051 7.466 29.235 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -34.718 5.459 28.652 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -33.364 7.526 27.976 1.00 0.00 H new ATOM 1833 N HIS A 118 -28.185 7.070 32.229 1.00 0.00 N ATOM 1834 CA HIS A 118 -27.369 7.328 33.450 1.00 0.00 C ATOM 1835 C HIS A 118 -28.186 8.121 34.474 1.00 0.00 C ATOM 1836 O HIS A 118 -28.895 9.050 34.132 1.00 0.00 O ATOM 1837 CB HIS A 118 -26.174 8.149 32.962 1.00 0.00 C ATOM 1838 CG HIS A 118 -24.968 7.259 32.847 1.00 0.00 C ATOM 1839 ND1 HIS A 118 -24.352 6.703 33.957 1.00 0.00 N ATOM 1840 CD2 HIS A 118 -24.251 6.819 31.761 1.00 0.00 C ATOM 1841 CE1 HIS A 118 -23.315 5.964 33.520 1.00 0.00 C ATOM 1842 NE2 HIS A 118 -23.210 6.001 32.189 1.00 0.00 N ATOM 0 H HIS A 118 -28.403 7.895 31.671 1.00 0.00 H new ATOM 0 HA HIS A 118 -27.056 6.406 33.941 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -26.400 8.600 31.996 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -25.972 8.965 33.656 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -24.463 7.070 30.732 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -22.650 5.410 34.166 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -22.515 5.530 31.610 1.00 0.00 H new ATOM 1850 N HIS A 119 -28.095 7.759 35.725 1.00 0.00 N ATOM 1851 CA HIS A 119 -28.868 8.486 36.775 1.00 0.00 C ATOM 1852 C HIS A 119 -27.994 9.559 37.429 1.00 0.00 C ATOM 1853 O HIS A 119 -26.799 9.620 37.213 1.00 0.00 O ATOM 1854 CB HIS A 119 -29.253 7.415 37.794 1.00 0.00 C ATOM 1855 CG HIS A 119 -30.189 6.426 37.154 1.00 0.00 C ATOM 1856 ND1 HIS A 119 -31.552 6.655 37.056 1.00 0.00 N ATOM 1857 CD2 HIS A 119 -29.972 5.200 36.574 1.00 0.00 C ATOM 1858 CE1 HIS A 119 -32.099 5.592 36.440 1.00 0.00 C ATOM 1859 NE2 HIS A 119 -31.179 4.676 36.124 1.00 0.00 N ATOM 0 H HIS A 119 -27.518 6.990 36.067 1.00 0.00 H new ATOM 0 HA HIS A 119 -29.742 8.994 36.367 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -28.360 6.905 38.156 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -29.730 7.876 38.659 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -29.011 4.717 36.482 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -33.153 5.491 36.227 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -31.330 3.784 35.654 1.00 0.00 H new ATOM 1867 N HIS A 120 -28.584 10.409 38.229 1.00 0.00 N ATOM 1868 CA HIS A 120 -27.793 11.482 38.901 1.00 0.00 C ATOM 1869 C HIS A 120 -28.081 11.482 40.405 1.00 0.00 C ATOM 1870 O HIS A 120 -29.213 11.370 40.829 1.00 0.00 O ATOM 1871 CB HIS A 120 -28.272 12.787 38.260 1.00 0.00 C ATOM 1872 CG HIS A 120 -27.086 13.624 37.867 1.00 0.00 C ATOM 1873 ND1 HIS A 120 -26.918 14.106 36.577 1.00 0.00 N ATOM 1874 CD2 HIS A 120 -26.004 14.077 38.581 1.00 0.00 C ATOM 1875 CE1 HIS A 120 -25.773 14.813 36.555 1.00 0.00 C ATOM 1876 NE2 HIS A 120 -25.177 14.826 37.750 1.00 0.00 N ATOM 0 H HIS A 120 -29.581 10.406 38.446 1.00 0.00 H new ATOM 0 HA HIS A 120 -26.718 11.343 38.783 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -28.883 12.570 37.384 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -28.902 13.337 38.959 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -25.823 13.882 39.628 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -25.384 15.309 35.678 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -24.302 15.287 38.000 1.00 0.00 H new ATOM 1884 N HIS A 121 -27.061 11.607 41.213 1.00 0.00 N ATOM 1885 CA HIS A 121 -27.275 11.616 42.691 1.00 0.00 C ATOM 1886 C HIS A 121 -28.003 12.895 43.111 1.00 0.00 C ATOM 1887 O HIS A 121 -29.128 12.858 43.571 1.00 0.00 O ATOM 1888 CB HIS A 121 -25.872 11.573 43.298 1.00 0.00 C ATOM 1889 CG HIS A 121 -25.475 10.143 43.553 1.00 0.00 C ATOM 1890 ND1 HIS A 121 -24.269 9.807 44.150 1.00 0.00 N ATOM 1891 CD2 HIS A 121 -26.111 8.953 43.299 1.00 0.00 C ATOM 1892 CE1 HIS A 121 -24.219 8.464 44.234 1.00 0.00 C ATOM 1893 NE2 HIS A 121 -25.317 7.894 43.730 1.00 0.00 N ATOM 0 H HIS A 121 -26.090 11.703 40.914 1.00 0.00 H new ATOM 0 HA HIS A 121 -27.887 10.778 43.024 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -25.158 12.044 42.622 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -25.850 12.139 44.230 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -27.081 8.854 42.835 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -23.391 7.914 44.658 1.00 0.00 H new ATOM 0 HE2 HIS A 121 -25.528 6.898 43.673 1.00 0.00 H new ATOM 1901 N HIS A 122 -27.370 14.027 42.954 1.00 0.00 N ATOM 1902 CA HIS A 122 -28.025 15.310 43.343 1.00 0.00 C ATOM 1903 C HIS A 122 -27.765 16.380 42.280 1.00 0.00 C ATOM 1904 O HIS A 122 -26.698 16.351 41.687 1.00 0.00 O ATOM 1905 CB HIS A 122 -27.371 15.702 44.670 1.00 0.00 C ATOM 1906 CG HIS A 122 -27.821 14.757 45.748 1.00 0.00 C ATOM 1907 ND1 HIS A 122 -29.141 14.348 45.869 1.00 0.00 N ATOM 1908 CD2 HIS A 122 -27.140 14.135 46.765 1.00 0.00 C ATOM 1909 CE1 HIS A 122 -29.211 13.515 46.924 1.00 0.00 C ATOM 1910 NE2 HIS A 122 -28.020 13.351 47.505 1.00 0.00 N ATOM 1911 OXT HIS A 122 -28.635 17.211 42.078 1.00 0.00 O ATOM 0 H HIS A 122 -26.428 14.119 42.573 1.00 0.00 H new ATOM 0 HA HIS A 122 -29.107 15.210 43.435 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -26.286 15.673 44.576 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -27.641 16.725 44.932 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -26.083 14.238 46.961 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -30.120 13.037 47.260 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -27.802 12.774 48.318 1.00 0.00 H new TER 1919 HIS A 122