USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1330 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 166 HIS : no HE2:sc= -1.05 K(o=-2.2,f=-1.7) USER MOD Set 1.2: A 167 HIS : no HD1:sc= -1.19 X(o=-2.2,f=-1.8) USER MOD Set 2.1: A 32 THR OG1 : rot 180:sc= 0.113 USER MOD Set 2.2: A 158 MET CE :methyl 180:sc= -0.602 (180deg=-0.577) USER MOD Set 3.1: A 147 THR OG1 : rot -170:sc= 0 USER MOD Set 3.2: A 152 ASN : amide:sc=-0.00576 X(o=-0.0058,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= -0.0445 (180deg=-0.217) USER MOD Single : A 2 ASN : amide:sc= -0.775 K(o=-0.78,f=-2.4!) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot -150:sc= -0.67 USER MOD Single : A 9 THR OG1 : rot -27:sc= 0.281 USER MOD Single : A 13 ASN : amide:sc= -0.44 X(o=-0.44,f=-0.043) USER MOD Single : A 16 GLN : amide:sc= -0.0572 X(o=-0.057,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.4!) USER MOD Single : A 20 GLN : amide:sc= -1.34 X(o=-1.3,f=-1.3) USER MOD Single : A 23 HIS : no HD1:sc= -0.0217 X(o=-0.022,f=-0.41) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0.833 USER MOD Single : A 34 HIS : no HD1:sc= -1.01 K(o=-1,f=-0.23) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00127 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.285 K(o=-0.29,f=-2.7!) USER MOD Single : A 68 HIS : no HD1:sc= 0.0153 X(o=0.015,f=-0.41) USER MOD Single : A 71 TYR OH : rot 180:sc= -2.57! USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0589) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.215 K(o=-0.22,f=-2.6!) USER MOD Single : A 81 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0155) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -128:sc= 1.3 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 109 THR OG1 : rot 180:sc= -2.02! USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.722 USER MOD Single : A 117 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.4!) USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.0166 K(o=-0.017,f=-1.3) USER MOD Single : A 141 MET CE :methyl -165:sc=-0.00196 (180deg=-0.192) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -0.126 X(o=-0.13,f=-0.26) USER MOD Single : A 150 ASN : amide:sc= -1.87 K(o=-1.9,f=-2.6!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 161 GLN : amide:sc= -0.193 K(o=-0.19,f=-3.6!) USER MOD Single : A 165 HIS : no HD1:sc= -0.195 X(o=-0.2,f=-0.048) USER MOD Single : A 168 HIS : no HD1:sc= -0.296 X(o=-0.3,f=-0.02) USER MOD Single : A 169 HIS : no HD1:sc= -0.0052 X(o=-0.0052,f=0) USER MOD Single : A 170 HIS : no HD1:sc= -0.0409 X(o=-0.041,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.426 -6.408 33.568 1.00 0.00 N ATOM 2 CA MET A 1 -31.395 -7.197 32.763 1.00 0.00 C ATOM 3 C MET A 1 -30.894 -7.399 31.338 1.00 0.00 C ATOM 4 O MET A 1 -31.684 -7.506 30.400 1.00 0.00 O ATOM 5 CB MET A 1 -32.734 -6.458 32.751 1.00 0.00 C ATOM 6 CG MET A 1 -33.601 -6.748 33.966 1.00 0.00 C ATOM 7 SD MET A 1 -35.363 -6.716 33.585 1.00 0.00 S ATOM 8 CE MET A 1 -35.813 -8.417 33.917 1.00 0.00 C ATOM 0 H1 MET A 1 -30.874 -6.113 34.459 1.00 0.00 H new ATOM 0 H2 MET A 1 -29.591 -6.992 33.777 1.00 0.00 H new ATOM 0 H3 MET A 1 -30.134 -5.566 33.032 1.00 0.00 H new ATOM 0 HA MET A 1 -31.513 -8.183 33.212 1.00 0.00 H new ATOM 0 HB2 MET A 1 -32.547 -5.386 32.696 1.00 0.00 H new ATOM 0 HB3 MET A 1 -33.283 -6.732 31.850 1.00 0.00 H new ATOM 0 HG2 MET A 1 -33.338 -7.726 34.370 1.00 0.00 H new ATOM 0 HG3 MET A 1 -33.388 -6.014 34.743 1.00 0.00 H new ATOM 0 HE1 MET A 1 -36.877 -8.556 33.727 1.00 0.00 H new ATOM 0 HE2 MET A 1 -35.239 -9.078 33.268 1.00 0.00 H new ATOM 0 HE3 MET A 1 -35.597 -8.654 34.959 1.00 0.00 H new ATOM 20 N ASN A 2 -29.575 -7.451 31.181 1.00 0.00 N ATOM 21 CA ASN A 2 -28.968 -7.642 29.869 1.00 0.00 C ATOM 22 C ASN A 2 -27.773 -8.587 29.953 1.00 0.00 C ATOM 23 O ASN A 2 -26.826 -8.476 29.175 1.00 0.00 O ATOM 24 CB ASN A 2 -28.531 -6.295 29.287 1.00 0.00 C ATOM 25 CG ASN A 2 -29.019 -6.094 27.865 1.00 0.00 C ATOM 26 OD1 ASN A 2 -28.765 -6.919 26.987 1.00 0.00 O ATOM 27 ND2 ASN A 2 -29.723 -4.993 27.632 1.00 0.00 N ATOM 0 H ASN A 2 -28.906 -7.364 31.946 1.00 0.00 H new ATOM 0 HA ASN A 2 -29.714 -8.090 29.212 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -28.911 -5.490 29.916 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -27.443 -6.229 29.308 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -30.078 -4.803 26.695 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -29.909 -4.337 28.390 1.00 0.00 H new ATOM 34 N ALA A 3 -27.826 -9.518 30.901 1.00 0.00 N ATOM 35 CA ALA A 3 -26.750 -10.484 31.087 1.00 0.00 C ATOM 36 C ALA A 3 -26.590 -11.386 29.866 1.00 0.00 C ATOM 37 O ALA A 3 -25.561 -12.041 29.700 1.00 0.00 O ATOM 38 CB ALA A 3 -27.004 -11.321 32.332 1.00 0.00 C ATOM 0 H ALA A 3 -28.604 -9.623 31.552 1.00 0.00 H new ATOM 0 HA ALA A 3 -25.821 -9.928 31.214 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -26.193 -12.038 32.460 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -27.053 -10.670 33.205 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -27.948 -11.855 32.225 1.00 0.00 H new ATOM 44 N ASP A 4 -27.608 -11.415 29.011 1.00 0.00 N ATOM 45 CA ASP A 4 -27.571 -12.236 27.807 1.00 0.00 C ATOM 46 C ASP A 4 -26.706 -11.578 26.740 1.00 0.00 C ATOM 47 O ASP A 4 -25.823 -12.212 26.162 1.00 0.00 O ATOM 48 CB ASP A 4 -28.986 -12.462 27.269 1.00 0.00 C ATOM 49 CG ASP A 4 -29.771 -11.171 27.140 1.00 0.00 C ATOM 50 OD1 ASP A 4 -29.962 -10.704 25.996 1.00 0.00 O ATOM 51 OD2 ASP A 4 -30.195 -10.627 28.181 1.00 0.00 O ATOM 0 H ASP A 4 -28.468 -10.879 29.130 1.00 0.00 H new ATOM 0 HA ASP A 4 -27.136 -13.202 28.065 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -28.928 -12.947 26.295 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -29.519 -13.143 27.932 1.00 0.00 H new ATOM 57 N GLU A 5 -26.960 -10.298 26.493 1.00 0.00 N ATOM 58 CA GLU A 5 -26.201 -9.545 25.506 1.00 0.00 C ATOM 59 C GLU A 5 -24.818 -9.194 26.047 1.00 0.00 C ATOM 60 O GLU A 5 -23.873 -9.001 25.283 1.00 0.00 O ATOM 61 CB GLU A 5 -26.951 -8.269 25.118 1.00 0.00 C ATOM 62 CG GLU A 5 -26.829 -7.917 23.645 1.00 0.00 C ATOM 63 CD GLU A 5 -27.979 -8.461 22.819 1.00 0.00 C ATOM 64 OE1 GLU A 5 -28.828 -7.658 22.380 1.00 0.00 O ATOM 65 OE2 GLU A 5 -28.030 -9.692 22.612 1.00 0.00 O ATOM 0 H GLU A 5 -27.687 -9.761 26.965 1.00 0.00 H new ATOM 0 HA GLU A 5 -26.081 -10.167 24.619 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -28.005 -8.386 25.369 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -26.572 -7.439 25.714 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -26.789 -6.833 23.536 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -25.890 -8.311 23.257 1.00 0.00 H new ATOM 73 N TRP A 6 -24.708 -9.116 27.371 1.00 0.00 N ATOM 74 CA TRP A 6 -23.440 -8.789 28.013 1.00 0.00 C ATOM 75 C TRP A 6 -22.410 -9.887 27.767 1.00 0.00 C ATOM 76 O TRP A 6 -21.250 -9.607 27.465 1.00 0.00 O ATOM 77 CB TRP A 6 -23.642 -8.586 29.517 1.00 0.00 C ATOM 78 CG TRP A 6 -23.197 -7.238 29.999 1.00 0.00 C ATOM 79 CD1 TRP A 6 -23.315 -6.051 29.335 1.00 0.00 C ATOM 80 CD2 TRP A 6 -22.564 -6.940 31.248 1.00 0.00 C ATOM 81 NE1 TRP A 6 -22.793 -5.033 30.095 1.00 0.00 N ATOM 82 CE2 TRP A 6 -22.326 -5.552 31.274 1.00 0.00 C ATOM 83 CE3 TRP A 6 -22.176 -7.711 32.347 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -21.717 -4.921 32.355 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -21.571 -7.083 33.421 1.00 0.00 C ATOM 86 CH2 TRP A 6 -21.348 -5.701 33.418 1.00 0.00 C ATOM 0 H TRP A 6 -25.480 -9.275 28.018 1.00 0.00 H new ATOM 0 HA TRP A 6 -23.067 -7.862 27.578 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -24.697 -8.719 29.756 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -23.093 -9.357 30.058 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -23.754 -5.930 28.356 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -22.759 -4.050 29.825 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -22.345 -8.778 32.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -21.542 -3.855 32.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -21.266 -7.668 34.276 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -20.875 -5.240 34.272 1.00 0.00 H new ATOM 97 N MET A 7 -22.843 -11.137 27.898 1.00 0.00 N ATOM 98 CA MET A 7 -21.959 -12.278 27.690 1.00 0.00 C ATOM 99 C MET A 7 -21.500 -12.354 26.237 1.00 0.00 C ATOM 100 O MET A 7 -20.397 -12.817 25.948 1.00 0.00 O ATOM 101 CB MET A 7 -22.667 -13.576 28.081 1.00 0.00 C ATOM 102 CG MET A 7 -22.491 -13.948 29.545 1.00 0.00 C ATOM 103 SD MET A 7 -22.847 -15.686 29.866 1.00 0.00 S ATOM 104 CE MET A 7 -21.310 -16.210 30.624 1.00 0.00 C ATOM 0 H MET A 7 -23.800 -11.385 28.147 1.00 0.00 H new ATOM 0 HA MET A 7 -21.081 -12.145 28.323 1.00 0.00 H new ATOM 0 HB2 MET A 7 -23.731 -13.479 27.865 1.00 0.00 H new ATOM 0 HB3 MET A 7 -22.288 -14.388 27.460 1.00 0.00 H new ATOM 0 HG2 MET A 7 -21.469 -13.728 29.852 1.00 0.00 H new ATOM 0 HG3 MET A 7 -23.147 -13.328 30.155 1.00 0.00 H new ATOM 0 HE1 MET A 7 -21.373 -17.267 30.881 1.00 0.00 H new ATOM 0 HE2 MET A 7 -20.488 -16.055 29.925 1.00 0.00 H new ATOM 0 HE3 MET A 7 -21.133 -15.627 31.528 1.00 0.00 H new ATOM 114 N THR A 8 -22.355 -11.898 25.326 1.00 0.00 N ATOM 115 CA THR A 8 -22.037 -11.915 23.903 1.00 0.00 C ATOM 116 C THR A 8 -20.783 -11.097 23.615 1.00 0.00 C ATOM 117 O THR A 8 -19.840 -11.588 22.994 1.00 0.00 O ATOM 118 CB THR A 8 -23.213 -11.370 23.092 1.00 0.00 C ATOM 119 OG1 THR A 8 -24.425 -11.503 23.811 1.00 0.00 O ATOM 120 CG2 THR A 8 -23.391 -12.063 21.758 1.00 0.00 C ATOM 0 H THR A 8 -23.273 -11.512 25.548 1.00 0.00 H new ATOM 0 HA THR A 8 -21.849 -12.948 23.610 1.00 0.00 H new ATOM 0 HB THR A 8 -22.977 -10.321 22.911 1.00 0.00 H new ATOM 0 HG1 THR A 8 -25.168 -11.616 23.182 1.00 0.00 H new ATOM 0 HG21 THR A 8 -24.242 -11.629 21.233 1.00 0.00 H new ATOM 0 HG22 THR A 8 -22.490 -11.934 21.158 1.00 0.00 H new ATOM 0 HG23 THR A 8 -23.569 -13.126 21.921 1.00 0.00 H new ATOM 128 N THR A 9 -20.777 -9.849 24.070 1.00 0.00 N ATOM 129 CA THR A 9 -19.637 -8.964 23.859 1.00 0.00 C ATOM 130 C THR A 9 -18.428 -9.435 24.660 1.00 0.00 C ATOM 131 O THR A 9 -17.284 -9.246 24.245 1.00 0.00 O ATOM 132 CB THR A 9 -19.998 -7.531 24.254 1.00 0.00 C ATOM 133 OG1 THR A 9 -20.245 -7.441 25.646 1.00 0.00 O ATOM 134 CG2 THR A 9 -21.221 -7.003 23.536 1.00 0.00 C ATOM 0 H THR A 9 -21.548 -9.427 24.587 1.00 0.00 H new ATOM 0 HA THR A 9 -19.381 -8.988 22.800 1.00 0.00 H new ATOM 0 HB THR A 9 -19.138 -6.927 23.966 1.00 0.00 H new ATOM 0 HG1 THR A 9 -20.554 -8.309 25.980 1.00 0.00 H new ATOM 0 HG21 THR A 9 -21.422 -5.982 23.862 1.00 0.00 H new ATOM 0 HG22 THR A 9 -21.044 -7.012 22.461 1.00 0.00 H new ATOM 0 HG23 THR A 9 -22.079 -7.633 23.768 1.00 0.00 H new ATOM 142 N PHE A 10 -18.688 -10.050 25.809 1.00 0.00 N ATOM 143 CA PHE A 10 -17.619 -10.548 26.668 1.00 0.00 C ATOM 144 C PHE A 10 -16.853 -11.675 25.983 1.00 0.00 C ATOM 145 O PHE A 10 -15.634 -11.781 26.115 1.00 0.00 O ATOM 146 CB PHE A 10 -18.193 -11.042 27.997 1.00 0.00 C ATOM 147 CG PHE A 10 -17.249 -10.883 29.154 1.00 0.00 C ATOM 148 CD1 PHE A 10 -17.117 -9.660 29.794 1.00 0.00 C ATOM 149 CD2 PHE A 10 -16.493 -11.954 29.602 1.00 0.00 C ATOM 150 CE1 PHE A 10 -16.250 -9.511 30.860 1.00 0.00 C ATOM 151 CE2 PHE A 10 -15.624 -11.810 30.667 1.00 0.00 C ATOM 152 CZ PHE A 10 -15.502 -10.586 31.296 1.00 0.00 C ATOM 0 H PHE A 10 -19.629 -10.216 26.167 1.00 0.00 H new ATOM 0 HA PHE A 10 -16.929 -9.727 26.861 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -19.113 -10.497 28.211 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -18.461 -12.094 27.899 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -17.698 -8.815 29.456 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -16.584 -12.913 29.113 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -16.158 -8.554 31.352 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -15.041 -12.653 31.007 1.00 0.00 H new ATOM 0 HZ PHE A 10 -14.822 -10.470 32.127 1.00 0.00 H new ATOM 162 N ARG A 11 -17.577 -12.514 25.249 1.00 0.00 N ATOM 163 CA ARG A 11 -16.965 -13.633 24.542 1.00 0.00 C ATOM 164 C ARG A 11 -16.183 -13.148 23.326 1.00 0.00 C ATOM 165 O ARG A 11 -15.173 -13.741 22.947 1.00 0.00 O ATOM 166 CB ARG A 11 -18.037 -14.634 24.105 1.00 0.00 C ATOM 167 CG ARG A 11 -18.639 -15.422 25.258 1.00 0.00 C ATOM 168 CD ARG A 11 -20.139 -15.604 25.088 1.00 0.00 C ATOM 169 NE ARG A 11 -20.459 -16.753 24.245 1.00 0.00 N ATOM 170 CZ ARG A 11 -21.698 -17.170 23.999 1.00 0.00 C ATOM 171 NH1 ARG A 11 -22.737 -16.536 24.530 1.00 0.00 N ATOM 172 NH2 ARG A 11 -21.902 -18.223 23.220 1.00 0.00 N ATOM 0 H ARG A 11 -18.587 -12.440 25.128 1.00 0.00 H new ATOM 0 HA ARG A 11 -16.272 -14.125 25.224 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -18.833 -14.099 23.587 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -17.602 -15.330 23.388 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -18.158 -16.398 25.323 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -18.439 -14.905 26.197 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -20.602 -15.732 26.067 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -20.566 -14.702 24.649 1.00 0.00 H new ATOM 0 HE ARG A 11 -19.687 -17.266 23.820 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -22.587 -15.725 25.130 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -23.685 -16.860 24.338 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -21.108 -18.714 22.809 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -22.852 -18.542 23.032 1.00 0.00 H new ATOM 186 N GLU A 12 -16.657 -12.065 22.717 1.00 0.00 N ATOM 187 CA GLU A 12 -16.001 -11.500 21.544 1.00 0.00 C ATOM 188 C GLU A 12 -14.777 -10.683 21.944 1.00 0.00 C ATOM 189 O GLU A 12 -13.789 -10.628 21.211 1.00 0.00 O ATOM 190 CB GLU A 12 -16.980 -10.623 20.761 1.00 0.00 C ATOM 191 CG GLU A 12 -16.788 -10.693 19.254 1.00 0.00 C ATOM 192 CD GLU A 12 -17.820 -11.571 18.575 1.00 0.00 C ATOM 193 OE1 GLU A 12 -19.004 -11.173 18.535 1.00 0.00 O ATOM 194 OE2 GLU A 12 -17.446 -12.657 18.085 1.00 0.00 O ATOM 0 H GLU A 12 -17.492 -11.562 23.017 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.673 -12.324 20.910 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -17.999 -10.925 21.004 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -16.868 -9.589 21.086 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.842 -9.687 18.838 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.791 -11.076 19.036 1.00 0.00 H new ATOM 202 N ASN A 13 -14.848 -10.051 23.110 1.00 0.00 N ATOM 203 CA ASN A 13 -13.745 -9.237 23.607 1.00 0.00 C ATOM 204 C ASN A 13 -12.600 -10.116 24.101 1.00 0.00 C ATOM 205 O ASN A 13 -11.430 -9.812 23.875 1.00 0.00 O ATOM 206 CB ASN A 13 -14.225 -8.324 24.737 1.00 0.00 C ATOM 207 CG ASN A 13 -13.168 -7.322 25.159 1.00 0.00 C ATOM 208 OD1 ASN A 13 -13.205 -6.158 24.761 1.00 0.00 O ATOM 209 ND2 ASN A 13 -12.217 -7.772 25.969 1.00 0.00 N ATOM 0 H ASN A 13 -15.658 -10.087 23.729 1.00 0.00 H new ATOM 0 HA ASN A 13 -13.380 -8.623 22.783 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -15.119 -7.791 24.414 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -14.509 -8.932 25.596 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -11.478 -7.144 26.286 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -12.225 -8.745 26.274 1.00 0.00 H new ATOM 216 N ILE A 14 -12.948 -11.208 24.776 1.00 0.00 N ATOM 217 CA ILE A 14 -11.949 -12.132 25.299 1.00 0.00 C ATOM 218 C ILE A 14 -11.236 -12.866 24.169 1.00 0.00 C ATOM 219 O ILE A 14 -10.014 -13.008 24.181 1.00 0.00 O ATOM 220 CB ILE A 14 -12.586 -13.163 26.254 1.00 0.00 C ATOM 221 CG1 ILE A 14 -11.508 -14.054 26.875 1.00 0.00 C ATOM 222 CG2 ILE A 14 -13.617 -14.005 25.517 1.00 0.00 C ATOM 223 CD1 ILE A 14 -12.019 -14.925 28.002 1.00 0.00 C ATOM 0 H ILE A 14 -13.913 -11.474 24.973 1.00 0.00 H new ATOM 0 HA ILE A 14 -11.223 -11.538 25.853 1.00 0.00 H new ATOM 0 HB ILE A 14 -13.092 -12.625 27.056 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.083 -14.690 26.099 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -10.700 -13.426 27.250 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -14.056 -14.727 26.205 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -14.400 -13.358 25.121 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -13.134 -14.534 24.695 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.201 -15.529 28.394 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -12.418 -14.295 28.797 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -12.806 -15.579 27.628 1.00 0.00 H new ATOM 235 N ALA A 15 -12.008 -13.330 23.192 1.00 0.00 N ATOM 236 CA ALA A 15 -11.451 -14.050 22.053 1.00 0.00 C ATOM 237 C ALA A 15 -10.525 -13.153 21.238 1.00 0.00 C ATOM 238 O ALA A 15 -9.460 -13.584 20.794 1.00 0.00 O ATOM 239 CB ALA A 15 -12.568 -14.595 21.176 1.00 0.00 C ATOM 0 H ALA A 15 -13.022 -13.220 23.166 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.863 -14.885 22.434 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -12.138 -15.130 20.329 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -13.188 -15.276 21.758 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -13.179 -13.770 20.811 1.00 0.00 H new ATOM 245 N GLN A 16 -10.939 -11.905 21.044 1.00 0.00 N ATOM 246 CA GLN A 16 -10.147 -10.947 20.282 1.00 0.00 C ATOM 247 C GLN A 16 -8.784 -10.728 20.931 1.00 0.00 C ATOM 248 O GLN A 16 -7.747 -10.862 20.282 1.00 0.00 O ATOM 249 CB GLN A 16 -10.890 -9.614 20.168 1.00 0.00 C ATOM 250 CG GLN A 16 -10.515 -8.813 18.933 1.00 0.00 C ATOM 251 CD GLN A 16 -9.402 -7.819 19.199 1.00 0.00 C ATOM 252 OE1 GLN A 16 -8.309 -7.930 18.644 1.00 0.00 O ATOM 253 NE2 GLN A 16 -9.673 -6.839 20.053 1.00 0.00 N ATOM 0 H GLN A 16 -11.818 -11.534 21.404 1.00 0.00 H new ATOM 0 HA GLN A 16 -9.992 -11.356 19.283 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -11.963 -9.806 20.155 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -10.684 -9.016 21.055 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -10.206 -9.496 18.142 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -11.394 -8.280 18.569 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -10.593 -6.784 20.491 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -8.962 -6.141 20.271 1.00 0.00 H new ATOM 262 N THR A 17 -8.795 -10.392 22.217 1.00 0.00 N ATOM 263 CA THR A 17 -7.560 -10.155 22.955 1.00 0.00 C ATOM 264 C THR A 17 -6.684 -11.404 22.968 1.00 0.00 C ATOM 265 O THR A 17 -5.457 -11.314 22.995 1.00 0.00 O ATOM 266 CB THR A 17 -7.872 -9.722 24.388 1.00 0.00 C ATOM 267 OG1 THR A 17 -6.681 -9.408 25.088 1.00 0.00 O ATOM 268 CG2 THR A 17 -8.608 -10.777 25.185 1.00 0.00 C ATOM 0 H THR A 17 -9.645 -10.278 22.769 1.00 0.00 H new ATOM 0 HA THR A 17 -7.014 -9.356 22.452 1.00 0.00 H new ATOM 0 HB THR A 17 -8.516 -8.848 24.292 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.902 -9.132 26.002 1.00 0.00 H new ATOM 0 HG21 THR A 17 -8.798 -10.406 26.192 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.556 -11.006 24.698 1.00 0.00 H new ATOM 0 HG23 THR A 17 -8.001 -11.681 25.240 1.00 0.00 H new ATOM 276 N TRP A 18 -7.324 -12.569 22.948 1.00 0.00 N ATOM 277 CA TRP A 18 -6.604 -13.837 22.956 1.00 0.00 C ATOM 278 C TRP A 18 -5.988 -14.122 21.589 1.00 0.00 C ATOM 279 O TRP A 18 -4.936 -14.753 21.491 1.00 0.00 O ATOM 280 CB TRP A 18 -7.541 -14.978 23.358 1.00 0.00 C ATOM 281 CG TRP A 18 -6.963 -15.879 24.407 1.00 0.00 C ATOM 282 CD1 TRP A 18 -6.939 -17.244 24.392 1.00 0.00 C ATOM 283 CD2 TRP A 18 -6.327 -15.479 25.627 1.00 0.00 C ATOM 284 NE1 TRP A 18 -6.326 -17.718 25.527 1.00 0.00 N ATOM 285 CE2 TRP A 18 -5.941 -16.654 26.300 1.00 0.00 C ATOM 286 CE3 TRP A 18 -6.045 -14.242 26.213 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -5.289 -16.627 27.531 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -5.398 -14.217 27.434 1.00 0.00 C ATOM 289 CH2 TRP A 18 -5.026 -15.402 28.081 1.00 0.00 C ATOM 0 H TRP A 18 -8.340 -12.661 22.926 1.00 0.00 H new ATOM 0 HA TRP A 18 -5.799 -13.765 23.687 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -8.477 -14.558 23.726 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.782 -15.569 22.474 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -7.343 -17.861 23.603 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -6.181 -18.701 25.757 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -6.327 -13.323 25.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -5.002 -17.539 28.033 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -5.175 -13.267 27.897 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.521 -15.348 29.034 1.00 0.00 H new ATOM 300 N GLN A 19 -6.652 -13.653 20.539 1.00 0.00 N ATOM 301 CA GLN A 19 -6.172 -13.857 19.177 1.00 0.00 C ATOM 302 C GLN A 19 -4.977 -12.956 18.881 1.00 0.00 C ATOM 303 O GLN A 19 -3.871 -13.437 18.629 1.00 0.00 O ATOM 304 CB GLN A 19 -7.294 -13.587 18.172 1.00 0.00 C ATOM 305 CG GLN A 19 -7.879 -14.849 17.559 1.00 0.00 C ATOM 306 CD GLN A 19 -7.393 -15.088 16.143 1.00 0.00 C ATOM 307 OE1 GLN A 19 -7.138 -14.145 15.394 1.00 0.00 O ATOM 308 NE2 GLN A 19 -7.263 -16.356 15.767 1.00 0.00 N ATOM 0 H GLN A 19 -7.525 -13.129 20.604 1.00 0.00 H new ATOM 0 HA GLN A 19 -5.853 -14.895 19.082 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.090 -13.032 18.669 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -6.911 -12.950 17.375 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.615 -15.706 18.179 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.967 -14.778 17.559 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.485 -17.107 16.420 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -6.941 -16.578 14.825 1.00 0.00 H new ATOM 317 N GLN A 20 -5.207 -11.647 18.914 1.00 0.00 N ATOM 318 CA GLN A 20 -4.149 -10.679 18.649 1.00 0.00 C ATOM 319 C GLN A 20 -3.590 -10.854 17.238 1.00 0.00 C ATOM 320 O GLN A 20 -3.798 -11.889 16.604 1.00 0.00 O ATOM 321 CB GLN A 20 -3.025 -10.826 19.678 1.00 0.00 C ATOM 322 CG GLN A 20 -3.193 -9.930 20.894 1.00 0.00 C ATOM 323 CD GLN A 20 -2.184 -8.797 20.928 1.00 0.00 C ATOM 324 OE1 GLN A 20 -0.984 -9.024 21.086 1.00 0.00 O ATOM 325 NE2 GLN A 20 -2.667 -7.570 20.779 1.00 0.00 N ATOM 0 H GLN A 20 -6.116 -11.233 19.121 1.00 0.00 H new ATOM 0 HA GLN A 20 -4.577 -9.680 18.729 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.977 -11.864 20.006 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -2.073 -10.599 19.199 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.201 -9.514 20.898 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -3.092 -10.529 21.799 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -3.669 -7.428 20.651 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -2.036 -6.768 20.793 1.00 0.00 H new ATOM 334 N PRO A 21 -2.871 -9.841 16.728 1.00 0.00 N ATOM 335 CA PRO A 21 -2.280 -9.889 15.386 1.00 0.00 C ATOM 336 C PRO A 21 -1.163 -10.922 15.284 1.00 0.00 C ATOM 337 O PRO A 21 -0.201 -10.888 16.052 1.00 0.00 O ATOM 338 CB PRO A 21 -1.724 -8.477 15.186 1.00 0.00 C ATOM 339 CG PRO A 21 -1.499 -7.957 16.563 1.00 0.00 C ATOM 340 CD PRO A 21 -2.574 -8.572 17.417 1.00 0.00 C ATOM 0 HA PRO A 21 -3.010 -10.181 14.631 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.797 -8.495 14.614 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -2.426 -7.850 14.636 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -0.508 -8.229 16.926 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -1.558 -6.869 16.584 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.230 -8.740 18.438 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.454 -7.932 17.478 1.00 0.00 H new ATOM 348 N GLU A 22 -1.298 -11.840 14.333 1.00 0.00 N ATOM 349 CA GLU A 22 -0.301 -12.884 14.130 1.00 0.00 C ATOM 350 C GLU A 22 0.904 -12.349 13.362 1.00 0.00 C ATOM 351 O GLU A 22 2.032 -12.799 13.566 1.00 0.00 O ATOM 352 CB GLU A 22 -0.915 -14.065 13.378 1.00 0.00 C ATOM 353 CG GLU A 22 -1.551 -13.679 12.053 1.00 0.00 C ATOM 354 CD GLU A 22 -3.051 -13.487 12.159 1.00 0.00 C ATOM 355 OE1 GLU A 22 -3.770 -14.497 12.307 1.00 0.00 O ATOM 356 OE2 GLU A 22 -3.506 -12.325 12.096 1.00 0.00 O ATOM 0 H GLU A 22 -2.089 -11.882 13.690 1.00 0.00 H new ATOM 0 HA GLU A 22 0.038 -13.221 15.110 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.141 -14.811 13.196 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.669 -14.535 14.010 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.095 -12.757 11.691 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.339 -14.452 11.314 1.00 0.00 H new ATOM 364 N HIS A 23 0.659 -11.387 12.479 1.00 0.00 N ATOM 365 CA HIS A 23 1.724 -10.793 11.680 1.00 0.00 C ATOM 366 C HIS A 23 1.893 -9.313 12.011 1.00 0.00 C ATOM 367 O HIS A 23 0.928 -8.549 11.993 1.00 0.00 O ATOM 368 CB HIS A 23 1.429 -10.963 10.189 1.00 0.00 C ATOM 369 CG HIS A 23 1.670 -12.353 9.686 1.00 0.00 C ATOM 370 ND1 HIS A 23 2.822 -13.062 9.956 1.00 0.00 N ATOM 371 CD2 HIS A 23 0.900 -13.167 8.927 1.00 0.00 C ATOM 372 CE1 HIS A 23 2.750 -14.251 9.383 1.00 0.00 C ATOM 373 NE2 HIS A 23 1.593 -14.340 8.753 1.00 0.00 N ATOM 0 H HIS A 23 -0.268 -11.002 12.299 1.00 0.00 H new ATOM 0 HA HIS A 23 2.654 -11.309 11.920 1.00 0.00 H new ATOM 0 HB2 HIS A 23 0.391 -10.692 9.999 1.00 0.00 H new ATOM 0 HB3 HIS A 23 2.049 -10.268 9.623 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -0.078 -12.937 8.531 1.00 0.00 H new ATOM 0 HE1 HIS A 23 3.508 -15.019 9.423 1.00 0.00 H new ATOM 0 HE2 HIS A 23 1.267 -15.148 8.223 1.00 0.00 H new ATOM 382 N TYR A 24 3.125 -8.915 12.311 1.00 0.00 N ATOM 383 CA TYR A 24 3.422 -7.527 12.645 1.00 0.00 C ATOM 384 C TYR A 24 4.255 -6.870 11.548 1.00 0.00 C ATOM 385 O TYR A 24 5.396 -7.260 11.304 1.00 0.00 O ATOM 386 CB TYR A 24 4.163 -7.450 13.980 1.00 0.00 C ATOM 387 CG TYR A 24 3.724 -6.297 14.854 1.00 0.00 C ATOM 388 CD1 TYR A 24 2.472 -6.294 15.456 1.00 0.00 C ATOM 389 CD2 TYR A 24 4.561 -5.210 15.075 1.00 0.00 C ATOM 390 CE1 TYR A 24 2.067 -5.241 16.255 1.00 0.00 C ATOM 391 CE2 TYR A 24 4.163 -4.153 15.872 1.00 0.00 C ATOM 392 CZ TYR A 24 2.916 -4.174 16.460 1.00 0.00 C ATOM 393 OH TYR A 24 2.517 -3.124 17.254 1.00 0.00 O ATOM 0 H TYR A 24 3.935 -9.535 12.330 1.00 0.00 H new ATOM 0 HA TYR A 24 2.478 -6.989 12.730 1.00 0.00 H new ATOM 0 HB2 TYR A 24 4.013 -8.383 14.523 1.00 0.00 H new ATOM 0 HB3 TYR A 24 5.232 -7.362 13.787 1.00 0.00 H new ATOM 0 HD1 TYR A 24 1.804 -7.128 15.297 1.00 0.00 H new ATOM 0 HD2 TYR A 24 5.539 -5.191 14.616 1.00 0.00 H new ATOM 0 HE1 TYR A 24 1.091 -5.254 16.716 1.00 0.00 H new ATOM 0 HE2 TYR A 24 4.825 -3.315 16.033 1.00 0.00 H new ATOM 0 HH TYR A 24 3.232 -2.455 17.296 1.00 0.00 H new ATOM 403 N ASP A 25 3.675 -5.871 10.891 1.00 0.00 N ATOM 404 CA ASP A 25 4.364 -5.159 9.820 1.00 0.00 C ATOM 405 C ASP A 25 4.851 -3.795 10.297 1.00 0.00 C ATOM 406 O ASP A 25 4.387 -3.281 11.315 1.00 0.00 O ATOM 407 CB ASP A 25 3.438 -4.989 8.614 1.00 0.00 C ATOM 408 CG ASP A 25 2.960 -6.318 8.060 1.00 0.00 C ATOM 409 OD1 ASP A 25 1.887 -6.343 7.422 1.00 0.00 O ATOM 410 OD2 ASP A 25 3.660 -7.332 8.264 1.00 0.00 O ATOM 0 H ASP A 25 2.730 -5.536 11.081 1.00 0.00 H new ATOM 0 HA ASP A 25 5.230 -5.751 9.524 1.00 0.00 H new ATOM 0 HB2 ASP A 25 2.576 -4.388 8.903 1.00 0.00 H new ATOM 0 HB3 ASP A 25 3.962 -4.440 7.832 1.00 0.00 H new ATOM 416 N LEU A 26 5.790 -3.215 9.555 1.00 0.00 N ATOM 417 CA LEU A 26 6.341 -1.911 9.903 1.00 0.00 C ATOM 418 C LEU A 26 6.719 -1.129 8.650 1.00 0.00 C ATOM 419 O LEU A 26 7.620 -1.523 7.909 1.00 0.00 O ATOM 420 CB LEU A 26 7.565 -2.074 10.806 1.00 0.00 C ATOM 421 CG LEU A 26 7.256 -2.249 12.293 1.00 0.00 C ATOM 422 CD1 LEU A 26 7.091 -3.722 12.635 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.350 -1.622 13.143 1.00 0.00 C ATOM 0 H LEU A 26 6.184 -3.628 8.710 1.00 0.00 H new ATOM 0 HA LEU A 26 5.575 -1.353 10.441 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.136 -2.938 10.465 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.206 -1.201 10.684 1.00 0.00 H new ATOM 0 HG LEU A 26 6.317 -1.739 12.511 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.872 -3.826 13.698 1.00 0.00 H new ATOM 0 HD12 LEU A 26 6.271 -4.141 12.052 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.012 -4.255 12.401 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.113 -1.756 14.198 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.303 -2.102 12.921 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.419 -0.557 12.919 1.00 0.00 H new ATOM 435 N TYR A 27 6.026 -0.018 8.418 1.00 0.00 N ATOM 436 CA TYR A 27 6.291 0.819 7.254 1.00 0.00 C ATOM 437 C TYR A 27 7.238 1.961 7.609 1.00 0.00 C ATOM 438 O TYR A 27 7.026 2.673 8.591 1.00 0.00 O ATOM 439 CB TYR A 27 4.984 1.382 6.696 1.00 0.00 C ATOM 440 CG TYR A 27 3.959 0.320 6.360 1.00 0.00 C ATOM 441 CD1 TYR A 27 4.042 -0.402 5.177 1.00 0.00 C ATOM 442 CD2 TYR A 27 2.912 0.040 7.228 1.00 0.00 C ATOM 443 CE1 TYR A 27 3.108 -1.373 4.867 1.00 0.00 C ATOM 444 CE2 TYR A 27 1.975 -0.929 6.925 1.00 0.00 C ATOM 445 CZ TYR A 27 2.077 -1.633 5.744 1.00 0.00 C ATOM 446 OH TYR A 27 1.146 -2.598 5.439 1.00 0.00 O ATOM 0 H TYR A 27 5.277 0.323 9.021 1.00 0.00 H new ATOM 0 HA TYR A 27 6.766 0.199 6.494 1.00 0.00 H new ATOM 0 HB2 TYR A 27 4.555 2.071 7.424 1.00 0.00 H new ATOM 0 HB3 TYR A 27 5.202 1.961 5.799 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.849 -0.202 4.488 1.00 0.00 H new ATOM 0 HD2 TYR A 27 2.829 0.588 8.155 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.186 -1.925 3.942 1.00 0.00 H new ATOM 0 HE2 TYR A 27 1.166 -1.134 7.610 1.00 0.00 H new ATOM 0 HH TYR A 27 0.487 -2.657 6.162 1.00 0.00 H new ATOM 456 N ILE A 28 8.283 2.128 6.805 1.00 0.00 N ATOM 457 CA ILE A 28 9.261 3.185 7.037 1.00 0.00 C ATOM 458 C ILE A 28 9.588 3.924 5.740 1.00 0.00 C ATOM 459 O ILE A 28 9.836 3.300 4.709 1.00 0.00 O ATOM 460 CB ILE A 28 10.565 2.621 7.635 1.00 0.00 C ATOM 461 CG1 ILE A 28 11.039 1.409 6.831 1.00 0.00 C ATOM 462 CG2 ILE A 28 10.361 2.249 9.095 1.00 0.00 C ATOM 463 CD1 ILE A 28 12.543 1.331 6.686 1.00 0.00 C ATOM 0 H ILE A 28 8.474 1.547 5.989 1.00 0.00 H new ATOM 0 HA ILE A 28 8.815 3.881 7.747 1.00 0.00 H new ATOM 0 HB ILE A 28 11.334 3.391 7.581 1.00 0.00 H new ATOM 0 HG12 ILE A 28 10.681 0.500 7.314 1.00 0.00 H new ATOM 0 HG13 ILE A 28 10.588 1.442 5.839 1.00 0.00 H new ATOM 0 HG21 ILE A 28 11.291 1.852 9.503 1.00 0.00 H new ATOM 0 HG22 ILE A 28 10.066 3.134 9.658 1.00 0.00 H new ATOM 0 HG23 ILE A 28 9.579 1.493 9.172 1.00 0.00 H new ATOM 0 HD11 ILE A 28 12.807 0.447 6.105 1.00 0.00 H new ATOM 0 HD12 ILE A 28 12.906 2.223 6.175 1.00 0.00 H new ATOM 0 HD13 ILE A 28 13.001 1.266 7.673 1.00 0.00 H new ATOM 475 N PRO A 29 9.594 5.269 5.773 1.00 0.00 N ATOM 476 CA PRO A 29 9.893 6.085 4.593 1.00 0.00 C ATOM 477 C PRO A 29 11.387 6.137 4.287 1.00 0.00 C ATOM 478 O PRO A 29 12.185 5.454 4.927 1.00 0.00 O ATOM 479 CB PRO A 29 9.380 7.467 4.991 1.00 0.00 C ATOM 480 CG PRO A 29 9.536 7.510 6.472 1.00 0.00 C ATOM 481 CD PRO A 29 9.311 6.102 6.960 1.00 0.00 C ATOM 0 HA PRO A 29 9.434 5.685 3.689 1.00 0.00 H new ATOM 0 HB2 PRO A 29 9.954 8.258 4.508 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.339 7.604 4.697 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.529 7.864 6.749 1.00 0.00 H new ATOM 0 HG3 PRO A 29 8.817 8.196 6.919 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.974 5.855 7.789 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.290 5.960 7.315 1.00 0.00 H new ATOM 489 N ALA A 30 11.755 6.951 3.304 1.00 0.00 N ATOM 490 CA ALA A 30 13.153 7.094 2.912 1.00 0.00 C ATOM 491 C ALA A 30 13.750 5.752 2.502 1.00 0.00 C ATOM 492 O ALA A 30 13.033 4.763 2.348 1.00 0.00 O ATOM 493 CB ALA A 30 13.958 7.706 4.049 1.00 0.00 C ATOM 0 H ALA A 30 11.105 7.522 2.764 1.00 0.00 H new ATOM 0 HA ALA A 30 13.197 7.759 2.049 1.00 0.00 H new ATOM 0 HB1 ALA A 30 15.000 7.807 3.744 1.00 0.00 H new ATOM 0 HB2 ALA A 30 13.554 8.689 4.293 1.00 0.00 H new ATOM 0 HB3 ALA A 30 13.898 7.061 4.926 1.00 0.00 H new ATOM 499 N ILE A 31 15.067 5.726 2.324 1.00 0.00 N ATOM 500 CA ILE A 31 15.762 4.506 1.931 1.00 0.00 C ATOM 501 C ILE A 31 16.693 4.023 3.040 1.00 0.00 C ATOM 502 O ILE A 31 17.488 4.794 3.576 1.00 0.00 O ATOM 503 CB ILE A 31 16.577 4.716 0.638 1.00 0.00 C ATOM 504 CG1 ILE A 31 17.198 3.395 0.179 1.00 0.00 C ATOM 505 CG2 ILE A 31 17.656 5.769 0.851 1.00 0.00 C ATOM 506 CD1 ILE A 31 17.353 3.292 -1.323 1.00 0.00 C ATOM 0 H ILE A 31 15.674 6.536 2.446 1.00 0.00 H new ATOM 0 HA ILE A 31 14.999 3.749 1.749 1.00 0.00 H new ATOM 0 HB ILE A 31 15.903 5.070 -0.142 1.00 0.00 H new ATOM 0 HG12 ILE A 31 18.176 3.280 0.646 1.00 0.00 H new ATOM 0 HG13 ILE A 31 16.578 2.570 0.530 1.00 0.00 H new ATOM 0 HG21 ILE A 31 18.220 5.903 -0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 31 17.192 6.714 1.133 1.00 0.00 H new ATOM 0 HG23 ILE A 31 18.329 5.445 1.644 1.00 0.00 H new ATOM 0 HD11 ILE A 31 17.799 2.331 -1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 31 16.375 3.375 -1.796 1.00 0.00 H new ATOM 0 HD13 ILE A 31 17.997 4.096 -1.678 1.00 0.00 H new ATOM 518 N THR A 32 16.587 2.742 3.380 1.00 0.00 N ATOM 519 CA THR A 32 17.418 2.157 4.424 1.00 0.00 C ATOM 520 C THR A 32 18.828 1.884 3.909 1.00 0.00 C ATOM 521 O THR A 32 19.782 2.558 4.298 1.00 0.00 O ATOM 522 CB THR A 32 16.790 0.860 4.937 1.00 0.00 C ATOM 523 OG1 THR A 32 16.310 0.075 3.861 1.00 0.00 O ATOM 524 CG2 THR A 32 15.637 1.089 5.889 1.00 0.00 C ATOM 0 H THR A 32 15.933 2.090 2.947 1.00 0.00 H new ATOM 0 HA THR A 32 17.483 2.871 5.245 1.00 0.00 H new ATOM 0 HB THR A 32 17.587 0.347 5.475 1.00 0.00 H new ATOM 0 HG1 THR A 32 15.914 -0.751 4.210 1.00 0.00 H new ATOM 0 HG21 THR A 32 15.238 0.128 6.215 1.00 0.00 H new ATOM 0 HG22 THR A 32 15.987 1.649 6.756 1.00 0.00 H new ATOM 0 HG23 THR A 32 14.854 1.655 5.383 1.00 0.00 H new ATOM 532 N TRP A 33 18.950 0.893 3.033 1.00 0.00 N ATOM 533 CA TRP A 33 20.244 0.530 2.464 1.00 0.00 C ATOM 534 C TRP A 33 21.201 0.047 3.550 1.00 0.00 C ATOM 535 O TRP A 33 21.508 0.778 4.491 1.00 0.00 O ATOM 536 CB TRP A 33 20.852 1.722 1.720 1.00 0.00 C ATOM 537 CG TRP A 33 21.250 1.402 0.312 1.00 0.00 C ATOM 538 CD1 TRP A 33 20.431 1.336 -0.778 1.00 0.00 C ATOM 539 CD2 TRP A 33 22.569 1.103 -0.159 1.00 0.00 C ATOM 540 NE1 TRP A 33 21.159 1.015 -1.898 1.00 0.00 N ATOM 541 CE2 TRP A 33 22.476 0.867 -1.544 1.00 0.00 C ATOM 542 CE3 TRP A 33 23.822 1.014 0.456 1.00 0.00 C ATOM 543 CZ2 TRP A 33 23.584 0.547 -2.322 1.00 0.00 C ATOM 544 CZ3 TRP A 33 24.922 0.696 -0.319 1.00 0.00 C ATOM 545 CH2 TRP A 33 24.797 0.467 -1.695 1.00 0.00 C ATOM 0 H TRP A 33 18.169 0.326 2.701 1.00 0.00 H new ATOM 0 HA TRP A 33 20.086 -0.285 1.758 1.00 0.00 H new ATOM 0 HB2 TRP A 33 20.132 2.540 1.709 1.00 0.00 H new ATOM 0 HB3 TRP A 33 21.727 2.074 2.266 1.00 0.00 H new ATOM 0 HD1 TRP A 33 19.365 1.511 -0.762 1.00 0.00 H new ATOM 0 HE1 TRP A 33 20.782 0.905 -2.839 1.00 0.00 H new ATOM 0 HE3 TRP A 33 23.928 1.190 1.516 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 23.490 0.368 -3.383 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 25.895 0.623 0.145 1.00 0.00 H new ATOM 0 HH2 TRP A 33 25.676 0.222 -2.273 1.00 0.00 H new ATOM 556 N HIS A 34 21.670 -1.189 3.411 1.00 0.00 N ATOM 557 CA HIS A 34 22.592 -1.770 4.380 1.00 0.00 C ATOM 558 C HIS A 34 23.932 -1.043 4.360 1.00 0.00 C ATOM 559 O HIS A 34 24.446 -0.638 5.402 1.00 0.00 O ATOM 560 CB HIS A 34 22.801 -3.258 4.090 1.00 0.00 C ATOM 561 CG HIS A 34 21.538 -4.061 4.142 1.00 0.00 C ATOM 562 ND1 HIS A 34 21.503 -5.383 4.533 1.00 0.00 N ATOM 563 CD2 HIS A 34 20.260 -3.722 3.852 1.00 0.00 C ATOM 564 CE1 HIS A 34 20.259 -5.823 4.479 1.00 0.00 C ATOM 565 NE2 HIS A 34 19.485 -4.835 4.070 1.00 0.00 N ATOM 0 H HIS A 34 21.427 -1.807 2.637 1.00 0.00 H new ATOM 0 HA HIS A 34 22.154 -1.659 5.372 1.00 0.00 H new ATOM 0 HB2 HIS A 34 23.251 -3.368 3.103 1.00 0.00 H new ATOM 0 HB3 HIS A 34 23.510 -3.664 4.811 1.00 0.00 H new ATOM 0 HD2 HIS A 34 19.914 -2.757 3.513 1.00 0.00 H new ATOM 0 HE1 HIS A 34 19.931 -6.821 4.727 1.00 0.00 H new ATOM 0 HE2 HIS A 34 18.475 -4.889 3.937 1.00 0.00 H new ATOM 574 N ALA A 35 24.495 -0.882 3.166 1.00 0.00 N ATOM 575 CA ALA A 35 25.775 -0.205 3.010 1.00 0.00 C ATOM 576 C ALA A 35 26.880 -0.938 3.764 1.00 0.00 C ATOM 577 O ALA A 35 26.652 -2.001 4.340 1.00 0.00 O ATOM 578 CB ALA A 35 25.673 1.236 3.489 1.00 0.00 C ATOM 0 H ALA A 35 24.083 -1.212 2.293 1.00 0.00 H new ATOM 0 HA ALA A 35 26.031 -0.207 1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 35 26.637 1.729 3.366 1.00 0.00 H new ATOM 0 HB2 ALA A 35 24.919 1.762 2.903 1.00 0.00 H new ATOM 0 HB3 ALA A 35 25.389 1.250 4.541 1.00 0.00 H new ATOM 584 N ARG A 36 28.077 -0.361 3.757 1.00 0.00 N ATOM 585 CA ARG A 36 29.218 -0.959 4.441 1.00 0.00 C ATOM 586 C ARG A 36 29.535 -0.207 5.729 1.00 0.00 C ATOM 587 O ARG A 36 29.731 -0.813 6.782 1.00 0.00 O ATOM 588 CB ARG A 36 30.442 -0.966 3.525 1.00 0.00 C ATOM 589 CG ARG A 36 30.578 -2.237 2.702 1.00 0.00 C ATOM 590 CD ARG A 36 31.295 -1.975 1.387 1.00 0.00 C ATOM 591 NE ARG A 36 30.956 -2.970 0.371 1.00 0.00 N ATOM 592 CZ ARG A 36 31.682 -3.189 -0.723 1.00 0.00 C ATOM 593 NH1 ARG A 36 32.786 -2.487 -0.947 1.00 0.00 N ATOM 594 NH2 ARG A 36 31.303 -4.112 -1.596 1.00 0.00 N ATOM 0 H ARG A 36 28.282 0.520 3.285 1.00 0.00 H new ATOM 0 HA ARG A 36 28.959 -1.987 4.696 1.00 0.00 H new ATOM 0 HB2 ARG A 36 30.386 -0.111 2.851 1.00 0.00 H new ATOM 0 HB3 ARG A 36 31.339 -0.837 4.130 1.00 0.00 H new ATOM 0 HG2 ARG A 36 31.127 -2.985 3.274 1.00 0.00 H new ATOM 0 HG3 ARG A 36 29.589 -2.650 2.503 1.00 0.00 H new ATOM 0 HD2 ARG A 36 31.033 -0.981 1.023 1.00 0.00 H new ATOM 0 HD3 ARG A 36 32.372 -1.980 1.554 1.00 0.00 H new ATOM 0 HE ARG A 36 30.114 -3.529 0.508 1.00 0.00 H new ATOM 0 HH11 ARG A 36 33.082 -1.775 -0.279 1.00 0.00 H new ATOM 0 HH12 ARG A 36 33.338 -2.659 -1.787 1.00 0.00 H new ATOM 0 HH21 ARG A 36 30.455 -4.654 -1.429 1.00 0.00 H new ATOM 0 HH22 ARG A 36 31.859 -4.280 -2.434 1.00 0.00 H new ATOM 608 N PHE A 37 29.586 1.119 5.637 1.00 0.00 N ATOM 609 CA PHE A 37 29.881 1.955 6.795 1.00 0.00 C ATOM 610 C PHE A 37 29.572 3.420 6.501 1.00 0.00 C ATOM 611 O PHE A 37 28.667 4.005 7.094 1.00 0.00 O ATOM 612 CB PHE A 37 31.347 1.801 7.201 1.00 0.00 C ATOM 613 CG PHE A 37 31.601 2.088 8.653 1.00 0.00 C ATOM 614 CD1 PHE A 37 31.324 1.135 9.620 1.00 0.00 C ATOM 615 CD2 PHE A 37 32.116 3.311 9.051 1.00 0.00 C ATOM 616 CE1 PHE A 37 31.557 1.396 10.958 1.00 0.00 C ATOM 617 CE2 PHE A 37 32.351 3.578 10.387 1.00 0.00 C ATOM 618 CZ PHE A 37 32.071 2.620 11.341 1.00 0.00 C ATOM 0 H PHE A 37 29.427 1.637 4.773 1.00 0.00 H new ATOM 0 HA PHE A 37 29.248 1.628 7.620 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.673 0.785 6.977 1.00 0.00 H new ATOM 0 HB3 PHE A 37 31.956 2.472 6.595 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.921 0.177 9.325 1.00 0.00 H new ATOM 0 HD2 PHE A 37 32.336 4.064 8.309 1.00 0.00 H new ATOM 0 HE1 PHE A 37 31.338 0.645 11.702 1.00 0.00 H new ATOM 0 HE2 PHE A 37 32.753 4.535 10.684 1.00 0.00 H new ATOM 0 HZ PHE A 37 32.253 2.827 12.385 1.00 0.00 H new ATOM 628 N ALA A 38 30.333 4.005 5.582 1.00 0.00 N ATOM 629 CA ALA A 38 30.142 5.402 5.209 1.00 0.00 C ATOM 630 C ALA A 38 29.073 5.540 4.131 1.00 0.00 C ATOM 631 O ALA A 38 29.246 5.070 3.007 1.00 0.00 O ATOM 632 CB ALA A 38 31.455 6.005 4.733 1.00 0.00 C ATOM 0 H ALA A 38 31.087 3.534 5.082 1.00 0.00 H new ATOM 0 HA ALA A 38 29.804 5.946 6.091 1.00 0.00 H new ATOM 0 HB1 ALA A 38 31.298 7.048 4.458 1.00 0.00 H new ATOM 0 HB2 ALA A 38 32.193 5.948 5.533 1.00 0.00 H new ATOM 0 HB3 ALA A 38 31.816 5.452 3.866 1.00 0.00 H new ATOM 638 N TYR A 39 27.967 6.189 4.482 1.00 0.00 N ATOM 639 CA TYR A 39 26.868 6.389 3.544 1.00 0.00 C ATOM 640 C TYR A 39 27.166 7.549 2.598 1.00 0.00 C ATOM 641 O TYR A 39 28.025 8.385 2.876 1.00 0.00 O ATOM 642 CB TYR A 39 25.565 6.654 4.301 1.00 0.00 C ATOM 643 CG TYR A 39 25.687 7.724 5.361 1.00 0.00 C ATOM 644 CD1 TYR A 39 25.930 9.047 5.016 1.00 0.00 C ATOM 645 CD2 TYR A 39 25.559 7.411 6.708 1.00 0.00 C ATOM 646 CE1 TYR A 39 26.042 10.028 5.983 1.00 0.00 C ATOM 647 CE2 TYR A 39 25.668 8.386 7.682 1.00 0.00 C ATOM 648 CZ TYR A 39 25.911 9.693 7.313 1.00 0.00 C ATOM 649 OH TYR A 39 26.021 10.667 8.279 1.00 0.00 O ATOM 0 H TYR A 39 27.808 6.585 5.408 1.00 0.00 H new ATOM 0 HA TYR A 39 26.757 5.480 2.953 1.00 0.00 H new ATOM 0 HB2 TYR A 39 24.794 6.947 3.588 1.00 0.00 H new ATOM 0 HB3 TYR A 39 25.232 5.728 4.769 1.00 0.00 H new ATOM 0 HD1 TYR A 39 26.033 9.314 3.975 1.00 0.00 H new ATOM 0 HD2 TYR A 39 25.371 6.388 7.000 1.00 0.00 H new ATOM 0 HE1 TYR A 39 26.231 11.052 5.698 1.00 0.00 H new ATOM 0 HE2 TYR A 39 25.564 8.126 8.725 1.00 0.00 H new ATOM 0 HH TYR A 39 25.902 10.264 9.165 1.00 0.00 H new ATOM 659 N ASP A 40 26.447 7.593 1.481 1.00 0.00 N ATOM 660 CA ASP A 40 26.634 8.650 0.494 1.00 0.00 C ATOM 661 C ASP A 40 25.657 9.796 0.733 1.00 0.00 C ATOM 662 O ASP A 40 24.490 9.573 1.056 1.00 0.00 O ATOM 663 CB ASP A 40 26.451 8.095 -0.920 1.00 0.00 C ATOM 664 CG ASP A 40 27.477 7.032 -1.260 1.00 0.00 C ATOM 665 OD1 ASP A 40 27.187 5.837 -1.042 1.00 0.00 O ATOM 666 OD2 ASP A 40 28.569 7.394 -1.746 1.00 0.00 O ATOM 0 H ASP A 40 25.730 6.910 1.237 1.00 0.00 H new ATOM 0 HA ASP A 40 27.649 9.034 0.597 1.00 0.00 H new ATOM 0 HB2 ASP A 40 25.450 7.674 -1.016 1.00 0.00 H new ATOM 0 HB3 ASP A 40 26.524 8.910 -1.640 1.00 0.00 H new ATOM 672 N LYS A 41 26.141 11.023 0.573 1.00 0.00 N ATOM 673 CA LYS A 41 25.310 12.206 0.770 1.00 0.00 C ATOM 674 C LYS A 41 25.066 12.927 -0.551 1.00 0.00 C ATOM 675 O LYS A 41 26.008 13.342 -1.227 1.00 0.00 O ATOM 676 CB LYS A 41 25.971 13.157 1.769 1.00 0.00 C ATOM 677 CG LYS A 41 24.989 14.081 2.471 1.00 0.00 C ATOM 678 CD LYS A 41 25.409 14.355 3.906 1.00 0.00 C ATOM 679 CE LYS A 41 26.661 15.216 3.965 1.00 0.00 C ATOM 680 NZ LYS A 41 26.805 15.896 5.282 1.00 0.00 N ATOM 0 H LYS A 41 27.105 11.225 0.307 1.00 0.00 H new ATOM 0 HA LYS A 41 24.348 11.882 1.168 1.00 0.00 H new ATOM 0 HB2 LYS A 41 26.504 12.571 2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 41 26.714 13.760 1.247 1.00 0.00 H new ATOM 0 HG2 LYS A 41 24.920 15.022 1.925 1.00 0.00 H new ATOM 0 HG3 LYS A 41 23.995 13.633 2.461 1.00 0.00 H new ATOM 0 HD2 LYS A 41 24.597 14.855 4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 41 25.591 13.411 4.420 1.00 0.00 H new ATOM 0 HE2 LYS A 41 27.538 14.595 3.779 1.00 0.00 H new ATOM 0 HE3 LYS A 41 26.625 15.963 3.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 27.670 16.473 5.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 25.981 16.508 5.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 26.865 15.183 6.036 1.00 0.00 H new ATOM 694 N GLU A 42 23.795 13.073 -0.913 1.00 0.00 N ATOM 695 CA GLU A 42 23.427 13.744 -2.154 1.00 0.00 C ATOM 696 C GLU A 42 23.308 15.251 -1.944 1.00 0.00 C ATOM 697 O GLU A 42 22.212 15.773 -1.742 1.00 0.00 O ATOM 698 CB GLU A 42 22.107 13.185 -2.690 1.00 0.00 C ATOM 699 CG GLU A 42 22.132 11.684 -2.920 1.00 0.00 C ATOM 700 CD GLU A 42 20.828 11.160 -3.490 1.00 0.00 C ATOM 701 OE1 GLU A 42 20.031 10.585 -2.719 1.00 0.00 O ATOM 702 OE2 GLU A 42 20.604 11.325 -4.708 1.00 0.00 O ATOM 0 H GLU A 42 23.004 12.736 -0.365 1.00 0.00 H new ATOM 0 HA GLU A 42 24.214 13.559 -2.885 1.00 0.00 H new ATOM 0 HB2 GLU A 42 21.309 13.423 -1.987 1.00 0.00 H new ATOM 0 HB3 GLU A 42 21.865 13.684 -3.628 1.00 0.00 H new ATOM 0 HG2 GLU A 42 22.947 11.438 -3.601 1.00 0.00 H new ATOM 0 HG3 GLU A 42 22.341 11.179 -1.977 1.00 0.00 H new ATOM 710 N LYS A 43 24.441 15.942 -1.992 1.00 0.00 N ATOM 711 CA LYS A 43 24.464 17.387 -1.807 1.00 0.00 C ATOM 712 C LYS A 43 25.399 18.051 -2.814 1.00 0.00 C ATOM 713 O LYS A 43 26.610 18.113 -2.604 1.00 0.00 O ATOM 714 CB LYS A 43 24.899 17.733 -0.381 1.00 0.00 C ATOM 715 CG LYS A 43 23.741 18.089 0.539 1.00 0.00 C ATOM 716 CD LYS A 43 23.821 19.534 1.005 1.00 0.00 C ATOM 717 CE LYS A 43 23.135 19.724 2.348 1.00 0.00 C ATOM 718 NZ LYS A 43 23.487 21.030 2.972 1.00 0.00 N ATOM 0 H LYS A 43 25.356 15.524 -2.158 1.00 0.00 H new ATOM 0 HA LYS A 43 23.455 17.765 -1.973 1.00 0.00 H new ATOM 0 HB2 LYS A 43 25.440 16.886 0.041 1.00 0.00 H new ATOM 0 HB3 LYS A 43 25.596 18.571 -0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 43 22.798 17.926 0.018 1.00 0.00 H new ATOM 0 HG3 LYS A 43 23.746 17.426 1.404 1.00 0.00 H new ATOM 0 HD2 LYS A 43 24.866 19.835 1.083 1.00 0.00 H new ATOM 0 HD3 LYS A 43 23.357 20.183 0.263 1.00 0.00 H new ATOM 0 HE2 LYS A 43 22.055 19.665 2.215 1.00 0.00 H new ATOM 0 HE3 LYS A 43 23.419 18.913 3.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 22.999 21.121 3.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 24.515 21.077 3.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 23.193 21.805 2.344 1.00 0.00 H new ATOM 732 N THR A 44 24.828 18.545 -3.908 1.00 0.00 N ATOM 733 CA THR A 44 25.611 19.203 -4.948 1.00 0.00 C ATOM 734 C THR A 44 24.851 20.389 -5.531 1.00 0.00 C ATOM 735 O THR A 44 25.263 21.539 -5.379 1.00 0.00 O ATOM 736 CB THR A 44 25.962 18.210 -6.057 1.00 0.00 C ATOM 737 OG1 THR A 44 26.502 17.020 -5.512 1.00 0.00 O ATOM 738 CG2 THR A 44 26.963 18.755 -7.052 1.00 0.00 C ATOM 0 H THR A 44 23.827 18.502 -4.097 1.00 0.00 H new ATOM 0 HA THR A 44 26.532 19.572 -4.497 1.00 0.00 H new ATOM 0 HB THR A 44 25.025 18.015 -6.578 1.00 0.00 H new ATOM 0 HG1 THR A 44 26.719 16.397 -6.237 1.00 0.00 H new ATOM 0 HG21 THR A 44 27.168 18.001 -7.812 1.00 0.00 H new ATOM 0 HG22 THR A 44 26.555 19.647 -7.527 1.00 0.00 H new ATOM 0 HG23 THR A 44 27.888 19.010 -6.535 1.00 0.00 H new ATOM 746 N ASP A 45 23.739 20.102 -6.201 1.00 0.00 N ATOM 747 CA ASP A 45 22.921 21.145 -6.809 1.00 0.00 C ATOM 748 C ASP A 45 21.464 20.705 -6.909 1.00 0.00 C ATOM 749 O ASP A 45 20.778 21.013 -7.883 1.00 0.00 O ATOM 750 CB ASP A 45 23.457 21.498 -8.196 1.00 0.00 C ATOM 751 CG ASP A 45 24.842 22.110 -8.143 1.00 0.00 C ATOM 752 OD1 ASP A 45 24.940 23.354 -8.071 1.00 0.00 O ATOM 753 OD2 ASP A 45 25.831 21.347 -8.173 1.00 0.00 O ATOM 0 H ASP A 45 23.384 19.155 -6.336 1.00 0.00 H new ATOM 0 HA ASP A 45 22.971 22.029 -6.173 1.00 0.00 H new ATOM 0 HB2 ASP A 45 23.484 20.599 -8.812 1.00 0.00 H new ATOM 0 HB3 ASP A 45 22.773 22.195 -8.680 1.00 0.00 H new ATOM 759 N ARG A 46 20.998 19.982 -5.895 1.00 0.00 N ATOM 760 CA ARG A 46 19.622 19.499 -5.870 1.00 0.00 C ATOM 761 C ARG A 46 19.018 19.651 -4.478 1.00 0.00 C ATOM 762 O ARG A 46 19.649 19.313 -3.476 1.00 0.00 O ATOM 763 CB ARG A 46 19.565 18.033 -6.306 1.00 0.00 C ATOM 764 CG ARG A 46 19.458 17.852 -7.812 1.00 0.00 C ATOM 765 CD ARG A 46 20.252 16.644 -8.284 1.00 0.00 C ATOM 766 NE ARG A 46 20.628 16.754 -9.692 1.00 0.00 N ATOM 767 CZ ARG A 46 19.802 16.494 -10.703 1.00 0.00 C ATOM 768 NH1 ARG A 46 18.554 16.110 -10.467 1.00 0.00 N ATOM 769 NH2 ARG A 46 20.225 16.618 -11.954 1.00 0.00 N ATOM 0 H ARG A 46 21.553 19.718 -5.081 1.00 0.00 H new ATOM 0 HA ARG A 46 19.039 20.101 -6.568 1.00 0.00 H new ATOM 0 HB2 ARG A 46 20.459 17.521 -5.949 1.00 0.00 H new ATOM 0 HB3 ARG A 46 18.711 17.553 -5.829 1.00 0.00 H new ATOM 0 HG2 ARG A 46 18.411 17.733 -8.092 1.00 0.00 H new ATOM 0 HG3 ARG A 46 19.823 18.748 -8.314 1.00 0.00 H new ATOM 0 HD2 ARG A 46 21.150 16.540 -7.676 1.00 0.00 H new ATOM 0 HD3 ARG A 46 19.660 15.741 -8.136 1.00 0.00 H new ATOM 0 HE ARG A 46 21.580 17.047 -9.913 1.00 0.00 H new ATOM 0 HH11 ARG A 46 18.223 16.013 -9.507 1.00 0.00 H new ATOM 0 HH12 ARG A 46 17.925 15.912 -11.246 1.00 0.00 H new ATOM 0 HH21 ARG A 46 21.183 16.913 -12.141 1.00 0.00 H new ATOM 0 HH22 ARG A 46 19.592 16.419 -12.729 1.00 0.00 H new ATOM 783 N TYR A 47 17.792 20.161 -4.422 1.00 0.00 N ATOM 784 CA TYR A 47 17.103 20.358 -3.153 1.00 0.00 C ATOM 785 C TYR A 47 16.736 19.020 -2.519 1.00 0.00 C ATOM 786 O TYR A 47 16.267 18.108 -3.200 1.00 0.00 O ATOM 787 CB TYR A 47 15.843 21.201 -3.358 1.00 0.00 C ATOM 788 CG TYR A 47 16.108 22.541 -4.006 1.00 0.00 C ATOM 789 CD1 TYR A 47 16.460 23.646 -3.240 1.00 0.00 C ATOM 790 CD2 TYR A 47 16.008 22.701 -5.382 1.00 0.00 C ATOM 791 CE1 TYR A 47 16.703 24.872 -3.829 1.00 0.00 C ATOM 792 CE2 TYR A 47 16.250 23.924 -5.978 1.00 0.00 C ATOM 793 CZ TYR A 47 16.597 25.006 -5.198 1.00 0.00 C ATOM 794 OH TYR A 47 16.838 26.226 -5.786 1.00 0.00 O ATOM 0 H TYR A 47 17.255 20.445 -5.242 1.00 0.00 H new ATOM 0 HA TYR A 47 17.779 20.885 -2.480 1.00 0.00 H new ATOM 0 HB2 TYR A 47 15.139 20.642 -3.974 1.00 0.00 H new ATOM 0 HB3 TYR A 47 15.363 21.363 -2.393 1.00 0.00 H new ATOM 0 HD1 TYR A 47 16.545 23.545 -2.168 1.00 0.00 H new ATOM 0 HD2 TYR A 47 15.737 21.855 -5.996 1.00 0.00 H new ATOM 0 HE1 TYR A 47 16.975 25.722 -3.220 1.00 0.00 H new ATOM 0 HE2 TYR A 47 16.168 24.031 -7.049 1.00 0.00 H new ATOM 0 HH TYR A 47 16.722 26.150 -6.756 1.00 0.00 H new ATOM 804 N ASN A 48 16.953 18.910 -1.212 1.00 0.00 N ATOM 805 CA ASN A 48 16.645 17.684 -0.487 1.00 0.00 C ATOM 806 C ASN A 48 15.439 17.880 0.427 1.00 0.00 C ATOM 807 O ASN A 48 15.348 18.877 1.144 1.00 0.00 O ATOM 808 CB ASN A 48 17.854 17.235 0.335 1.00 0.00 C ATOM 809 CG ASN A 48 18.755 16.288 -0.432 1.00 0.00 C ATOM 810 OD1 ASN A 48 19.088 16.531 -1.592 1.00 0.00 O ATOM 811 ND2 ASN A 48 19.155 15.199 0.214 1.00 0.00 N ATOM 0 H ASN A 48 17.341 19.656 -0.634 1.00 0.00 H new ATOM 0 HA ASN A 48 16.403 16.911 -1.217 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.427 18.110 0.640 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.509 16.746 1.246 1.00 0.00 H new ATOM 0 HD21 ASN A 48 19.762 14.524 -0.251 1.00 0.00 H new ATOM 0 HD22 ASN A 48 18.855 15.037 1.175 1.00 0.00 H new ATOM 818 N GLU A 49 14.516 16.924 0.395 1.00 0.00 N ATOM 819 CA GLU A 49 13.316 16.993 1.220 1.00 0.00 C ATOM 820 C GLU A 49 13.373 15.971 2.351 1.00 0.00 C ATOM 821 O GLU A 49 14.156 15.022 2.305 1.00 0.00 O ATOM 822 CB GLU A 49 12.070 16.754 0.365 1.00 0.00 C ATOM 823 CG GLU A 49 11.491 18.025 -0.235 1.00 0.00 C ATOM 824 CD GLU A 49 11.827 18.179 -1.707 1.00 0.00 C ATOM 825 OE1 GLU A 49 12.982 17.895 -2.085 1.00 0.00 O ATOM 826 OE2 GLU A 49 10.933 18.584 -2.479 1.00 0.00 O ATOM 0 H GLU A 49 14.576 16.093 -0.193 1.00 0.00 H new ATOM 0 HA GLU A 49 13.263 17.990 1.657 1.00 0.00 H new ATOM 0 HB2 GLU A 49 12.319 16.063 -0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.308 16.270 0.976 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.408 18.020 -0.112 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.871 18.887 0.313 1.00 0.00 H new ATOM 834 N ARG A 50 12.539 16.172 3.366 1.00 0.00 N ATOM 835 CA ARG A 50 12.495 15.268 4.509 1.00 0.00 C ATOM 836 C ARG A 50 11.097 14.675 4.680 1.00 0.00 C ATOM 837 O ARG A 50 10.370 15.031 5.608 1.00 0.00 O ATOM 838 CB ARG A 50 12.910 16.006 5.784 1.00 0.00 C ATOM 839 CG ARG A 50 13.650 15.129 6.781 1.00 0.00 C ATOM 840 CD ARG A 50 15.157 15.298 6.664 1.00 0.00 C ATOM 841 NE ARG A 50 15.780 14.178 5.961 1.00 0.00 N ATOM 842 CZ ARG A 50 16.040 13.002 6.528 1.00 0.00 C ATOM 843 NH1 ARG A 50 15.732 12.786 7.800 1.00 0.00 N ATOM 844 NH2 ARG A 50 16.609 12.037 5.818 1.00 0.00 N ATOM 0 H ARG A 50 11.885 16.953 3.420 1.00 0.00 H new ATOM 0 HA ARG A 50 13.195 14.453 4.325 1.00 0.00 H new ATOM 0 HB2 ARG A 50 13.544 16.851 5.515 1.00 0.00 H new ATOM 0 HB3 ARG A 50 12.020 16.415 6.263 1.00 0.00 H new ATOM 0 HG2 ARG A 50 13.333 15.380 7.793 1.00 0.00 H new ATOM 0 HG3 ARG A 50 13.386 14.085 6.614 1.00 0.00 H new ATOM 0 HD2 ARG A 50 15.378 16.226 6.136 1.00 0.00 H new ATOM 0 HD3 ARG A 50 15.590 15.387 7.660 1.00 0.00 H new ATOM 0 HE ARG A 50 16.030 14.305 4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 50 15.293 13.524 8.351 1.00 0.00 H new ATOM 0 HH12 ARG A 50 15.934 11.882 8.227 1.00 0.00 H new ATOM 0 HH21 ARG A 50 16.847 12.197 4.839 1.00 0.00 H new ATOM 0 HH22 ARG A 50 16.809 11.135 6.251 1.00 0.00 H new ATOM 858 N PRO A 51 10.702 13.757 3.781 1.00 0.00 N ATOM 859 CA PRO A 51 9.386 13.114 3.835 1.00 0.00 C ATOM 860 C PRO A 51 9.269 12.130 4.995 1.00 0.00 C ATOM 861 O PRO A 51 9.726 10.991 4.903 1.00 0.00 O ATOM 862 CB PRO A 51 9.296 12.378 2.498 1.00 0.00 C ATOM 863 CG PRO A 51 10.710 12.111 2.119 1.00 0.00 C ATOM 864 CD PRO A 51 11.507 13.274 2.642 1.00 0.00 C ATOM 0 HA PRO A 51 8.585 13.836 3.994 1.00 0.00 H new ATOM 0 HB2 PRO A 51 8.730 11.452 2.593 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.792 12.984 1.745 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.059 11.173 2.551 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.814 12.022 1.038 1.00 0.00 H new ATOM 0 HD2 PRO A 51 12.505 12.968 2.956 1.00 0.00 H new ATOM 0 HD3 PRO A 51 11.635 14.047 1.884 1.00 0.00 H new ATOM 872 N TRP A 52 8.654 12.578 6.084 1.00 0.00 N ATOM 873 CA TRP A 52 8.477 11.735 7.262 1.00 0.00 C ATOM 874 C TRP A 52 7.132 11.017 7.220 1.00 0.00 C ATOM 875 O TRP A 52 6.203 11.458 6.544 1.00 0.00 O ATOM 876 CB TRP A 52 8.580 12.575 8.536 1.00 0.00 C ATOM 877 CG TRP A 52 9.989 12.759 9.013 1.00 0.00 C ATOM 878 CD1 TRP A 52 10.813 13.816 8.749 1.00 0.00 C ATOM 879 CD2 TRP A 52 10.740 11.861 9.838 1.00 0.00 C ATOM 880 NE1 TRP A 52 12.030 13.629 9.359 1.00 0.00 N ATOM 881 CE2 TRP A 52 12.010 12.437 10.032 1.00 0.00 C ATOM 882 CE3 TRP A 52 10.462 10.625 10.430 1.00 0.00 C ATOM 883 CZ2 TRP A 52 12.998 11.818 10.795 1.00 0.00 C ATOM 884 CZ3 TRP A 52 11.445 10.014 11.186 1.00 0.00 C ATOM 885 CH2 TRP A 52 12.699 10.611 11.363 1.00 0.00 C ATOM 0 H TRP A 52 8.270 13.518 6.176 1.00 0.00 H new ATOM 0 HA TRP A 52 9.269 10.986 7.264 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.135 13.553 8.355 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.996 12.100 9.324 1.00 0.00 H new ATOM 0 HD1 TRP A 52 10.547 14.673 8.149 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.820 14.273 9.317 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.498 10.157 10.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 13.966 12.276 10.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 11.242 9.059 11.648 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.445 10.108 11.960 1.00 0.00 H new ATOM 896 N GLY A 53 7.036 9.908 7.945 1.00 0.00 N ATOM 897 CA GLY A 53 5.802 9.147 7.977 1.00 0.00 C ATOM 898 C GLY A 53 6.039 7.665 8.189 1.00 0.00 C ATOM 899 O GLY A 53 6.243 6.919 7.230 1.00 0.00 O ATOM 0 H GLY A 53 7.792 9.523 8.511 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.165 9.528 8.775 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.263 9.295 7.041 1.00 0.00 H new ATOM 903 N GLY A 54 6.013 7.237 9.447 1.00 0.00 N ATOM 904 CA GLY A 54 6.228 5.836 9.758 1.00 0.00 C ATOM 905 C GLY A 54 5.142 5.267 10.650 1.00 0.00 C ATOM 906 O GLY A 54 4.300 6.004 11.162 1.00 0.00 O ATOM 0 H GLY A 54 5.847 7.835 10.256 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.270 5.264 8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.195 5.720 10.248 1.00 0.00 H new ATOM 910 N GLY A 55 5.162 3.951 10.838 1.00 0.00 N ATOM 911 CA GLY A 55 4.167 3.305 11.673 1.00 0.00 C ATOM 912 C GLY A 55 4.198 1.795 11.550 1.00 0.00 C ATOM 913 O GLY A 55 5.195 1.220 11.115 1.00 0.00 O ATOM 0 H GLY A 55 5.850 3.321 10.426 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.333 3.585 12.713 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.176 3.668 11.399 1.00 0.00 H new ATOM 917 N PHE A 56 3.101 1.150 11.935 1.00 0.00 N ATOM 918 CA PHE A 56 3.005 -0.305 11.866 1.00 0.00 C ATOM 919 C PHE A 56 1.930 -0.732 10.872 1.00 0.00 C ATOM 920 O PHE A 56 1.200 0.102 10.335 1.00 0.00 O ATOM 921 CB PHE A 56 2.698 -0.883 13.249 1.00 0.00 C ATOM 922 CG PHE A 56 1.605 -0.151 13.977 1.00 0.00 C ATOM 923 CD1 PHE A 56 1.895 0.963 14.746 1.00 0.00 C ATOM 924 CD2 PHE A 56 0.290 -0.580 13.890 1.00 0.00 C ATOM 925 CE1 PHE A 56 0.892 1.638 15.417 1.00 0.00 C ATOM 926 CE2 PHE A 56 -0.716 0.090 14.560 1.00 0.00 C ATOM 927 CZ PHE A 56 -0.415 1.201 15.324 1.00 0.00 C ATOM 0 H PHE A 56 2.267 1.611 12.298 1.00 0.00 H new ATOM 0 HA PHE A 56 3.965 -0.692 11.524 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.414 -1.930 13.141 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.605 -0.859 13.853 1.00 0.00 H new ATOM 0 HD1 PHE A 56 2.915 1.308 14.823 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.049 -1.447 13.292 1.00 0.00 H new ATOM 0 HE1 PHE A 56 1.130 2.506 16.013 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.737 -0.255 14.486 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.200 1.727 15.847 1.00 0.00 H new ATOM 937 N GLY A 57 1.838 -2.036 10.633 1.00 0.00 N ATOM 938 CA GLY A 57 0.848 -2.550 9.704 1.00 0.00 C ATOM 939 C GLY A 57 0.180 -3.814 10.208 1.00 0.00 C ATOM 940 O GLY A 57 0.737 -4.529 11.042 1.00 0.00 O ATOM 0 H GLY A 57 2.430 -2.745 11.065 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.089 -1.787 9.528 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.325 -2.753 8.745 1.00 0.00 H new ATOM 944 N LEU A 58 -1.018 -4.090 9.701 1.00 0.00 N ATOM 945 CA LEU A 58 -1.763 -5.276 10.105 1.00 0.00 C ATOM 946 C LEU A 58 -2.569 -5.834 8.936 1.00 0.00 C ATOM 947 O LEU A 58 -2.565 -5.270 7.841 1.00 0.00 O ATOM 948 CB LEU A 58 -2.695 -4.945 11.274 1.00 0.00 C ATOM 949 CG LEU A 58 -2.719 -5.985 12.396 1.00 0.00 C ATOM 950 CD1 LEU A 58 -1.687 -5.647 13.459 1.00 0.00 C ATOM 951 CD2 LEU A 58 -4.109 -6.075 13.008 1.00 0.00 C ATOM 0 H LEU A 58 -1.493 -3.508 9.010 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.048 -6.034 10.425 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.398 -3.985 11.695 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.708 -4.824 10.889 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.467 -6.957 11.971 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.719 -6.398 14.249 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.694 -5.634 13.011 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.907 -4.667 13.881 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.108 -6.819 13.804 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.389 -5.105 13.418 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.826 -6.365 12.240 1.00 0.00 H new ATOM 963 N SER A 59 -3.259 -6.944 9.174 1.00 0.00 N ATOM 964 CA SER A 59 -4.069 -7.577 8.140 1.00 0.00 C ATOM 965 C SER A 59 -4.902 -8.717 8.720 1.00 0.00 C ATOM 966 O SER A 59 -4.533 -9.316 9.730 1.00 0.00 O ATOM 967 CB SER A 59 -3.177 -8.104 7.014 1.00 0.00 C ATOM 968 OG SER A 59 -2.288 -9.099 7.491 1.00 0.00 O ATOM 0 H SER A 59 -3.274 -7.424 10.074 1.00 0.00 H new ATOM 0 HA SER A 59 -4.747 -6.825 7.736 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.797 -8.517 6.218 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.608 -7.281 6.581 1.00 0.00 H new ATOM 0 HG SER A 59 -1.730 -9.421 6.752 1.00 0.00 H new ATOM 974 N ARG A 60 -6.023 -9.012 8.072 1.00 0.00 N ATOM 975 CA ARG A 60 -6.908 -10.081 8.522 1.00 0.00 C ATOM 976 C ARG A 60 -7.286 -10.998 7.363 1.00 0.00 C ATOM 977 O ARG A 60 -6.869 -10.780 6.225 1.00 0.00 O ATOM 978 CB ARG A 60 -8.171 -9.494 9.156 1.00 0.00 C ATOM 979 CG ARG A 60 -7.976 -9.039 10.593 1.00 0.00 C ATOM 980 CD ARG A 60 -8.970 -7.954 10.975 1.00 0.00 C ATOM 981 NE ARG A 60 -8.368 -6.939 11.834 1.00 0.00 N ATOM 982 CZ ARG A 60 -8.088 -7.128 13.122 1.00 0.00 C ATOM 983 NH1 ARG A 60 -8.354 -8.293 13.701 1.00 0.00 N ATOM 984 NH2 ARG A 60 -7.542 -6.151 13.832 1.00 0.00 N ATOM 0 H ARG A 60 -6.341 -8.526 7.233 1.00 0.00 H new ATOM 0 HA ARG A 60 -6.375 -10.669 9.269 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -8.507 -8.647 8.558 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.964 -10.241 9.125 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.090 -9.891 11.264 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -6.960 -8.665 10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -9.356 -7.482 10.072 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.820 -8.405 11.487 1.00 0.00 H new ATOM 0 HE ARG A 60 -8.149 -6.031 11.423 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.775 -9.048 13.159 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.138 -8.433 14.688 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -7.336 -5.254 13.392 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.328 -6.296 14.819 1.00 0.00 H new ATOM 998 N TRP A 61 -8.078 -12.023 7.659 1.00 0.00 N ATOM 999 CA TRP A 61 -8.511 -12.974 6.641 1.00 0.00 C ATOM 1000 C TRP A 61 -9.993 -12.794 6.324 1.00 0.00 C ATOM 1001 O TRP A 61 -10.824 -12.703 7.227 1.00 0.00 O ATOM 1002 CB TRP A 61 -8.243 -14.407 7.106 1.00 0.00 C ATOM 1003 CG TRP A 61 -7.499 -15.229 6.099 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -6.212 -15.674 6.193 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -7.998 -15.702 4.842 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -5.879 -16.396 5.073 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -6.958 -16.428 4.228 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -9.220 -15.585 4.177 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -7.107 -17.032 2.982 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -9.367 -16.185 2.939 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -8.315 -16.901 2.355 1.00 0.00 C ATOM 0 H TRP A 61 -8.433 -12.217 8.595 1.00 0.00 H new ATOM 0 HA TRP A 61 -7.940 -12.783 5.732 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.673 -14.379 8.034 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -9.193 -14.892 7.330 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -5.552 -15.486 7.027 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.976 -16.837 4.898 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -10.037 -15.035 4.621 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -6.298 -17.584 2.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -10.308 -16.100 2.415 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -8.461 -17.360 1.388 1.00 0.00 H new ATOM 1022 N ASP A 62 -10.315 -12.746 5.036 1.00 0.00 N ATOM 1023 CA ASP A 62 -11.697 -12.580 4.599 1.00 0.00 C ATOM 1024 C ASP A 62 -12.261 -13.893 4.068 1.00 0.00 C ATOM 1025 O ASP A 62 -11.713 -14.485 3.137 1.00 0.00 O ATOM 1026 CB ASP A 62 -11.787 -11.495 3.523 1.00 0.00 C ATOM 1027 CG ASP A 62 -12.955 -10.555 3.747 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -14.104 -11.040 3.815 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.720 -9.332 3.856 1.00 0.00 O ATOM 0 H ASP A 62 -9.638 -12.820 4.276 1.00 0.00 H new ATOM 0 HA ASP A 62 -12.291 -12.275 5.460 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.860 -10.922 3.510 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -11.885 -11.965 2.544 1.00 0.00 H new ATOM 1035 N GLU A 63 -13.360 -14.341 4.668 1.00 0.00 N ATOM 1036 CA GLU A 63 -14.006 -15.587 4.263 1.00 0.00 C ATOM 1037 C GLU A 63 -14.400 -15.561 2.787 1.00 0.00 C ATOM 1038 O GLU A 63 -14.635 -16.607 2.183 1.00 0.00 O ATOM 1039 CB GLU A 63 -15.244 -15.844 5.125 1.00 0.00 C ATOM 1040 CG GLU A 63 -15.485 -17.316 5.420 1.00 0.00 C ATOM 1041 CD GLU A 63 -16.949 -17.698 5.321 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -17.332 -18.320 4.308 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -17.712 -17.376 6.256 1.00 0.00 O ATOM 0 H GLU A 63 -13.823 -13.859 5.438 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.288 -16.394 4.407 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -15.139 -15.306 6.067 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -16.119 -15.435 4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.907 -17.922 4.722 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.120 -17.547 6.421 1.00 0.00 H new ATOM 1051 N LYS A 64 -14.472 -14.363 2.210 1.00 0.00 N ATOM 1052 CA LYS A 64 -14.841 -14.215 0.805 1.00 0.00 C ATOM 1053 C LYS A 64 -13.610 -14.255 -0.099 1.00 0.00 C ATOM 1054 O LYS A 64 -13.619 -13.696 -1.196 1.00 0.00 O ATOM 1055 CB LYS A 64 -15.602 -12.904 0.595 1.00 0.00 C ATOM 1056 CG LYS A 64 -16.866 -13.061 -0.235 1.00 0.00 C ATOM 1057 CD LYS A 64 -16.645 -12.630 -1.676 1.00 0.00 C ATOM 1058 CE LYS A 64 -17.180 -11.231 -1.928 1.00 0.00 C ATOM 1059 NZ LYS A 64 -16.123 -10.194 -1.767 1.00 0.00 N ATOM 0 H LYS A 64 -14.280 -13.485 2.692 1.00 0.00 H new ATOM 0 HA LYS A 64 -15.485 -15.052 0.537 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -15.865 -12.486 1.567 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -14.944 -12.185 0.107 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.191 -14.101 -0.211 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.667 -12.467 0.205 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.580 -12.660 -1.906 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -17.136 -13.335 -2.347 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -17.592 -11.176 -2.936 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -17.998 -11.026 -1.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -16.529 -9.254 -1.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -15.747 -10.229 -0.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -15.354 -10.375 -2.443 1.00 0.00 H new ATOM 1073 N GLY A 65 -12.552 -14.918 0.362 1.00 0.00 N ATOM 1074 CA GLY A 65 -11.336 -15.013 -0.424 1.00 0.00 C ATOM 1075 C GLY A 65 -10.663 -13.669 -0.616 1.00 0.00 C ATOM 1076 O GLY A 65 -10.198 -13.350 -1.710 1.00 0.00 O ATOM 0 H GLY A 65 -12.516 -15.390 1.265 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.643 -15.696 0.066 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.570 -15.441 -1.399 1.00 0.00 H new ATOM 1080 N ASN A 66 -10.611 -12.879 0.452 1.00 0.00 N ATOM 1081 CA ASN A 66 -9.988 -11.560 0.395 1.00 0.00 C ATOM 1082 C ASN A 66 -9.033 -11.356 1.566 1.00 0.00 C ATOM 1083 O ASN A 66 -9.157 -12.009 2.602 1.00 0.00 O ATOM 1084 CB ASN A 66 -11.060 -10.468 0.398 1.00 0.00 C ATOM 1085 CG ASN A 66 -11.374 -9.962 -0.997 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -10.630 -10.218 -1.944 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -12.481 -9.240 -1.131 1.00 0.00 N ATOM 0 H ASN A 66 -10.991 -13.128 1.365 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.415 -11.496 -0.530 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.970 -10.858 0.854 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -10.725 -9.635 1.017 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.743 -8.874 -2.046 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.069 -9.052 -0.319 1.00 0.00 H new ATOM 1094 N TRP A 67 -8.080 -10.446 1.394 1.00 0.00 N ATOM 1095 CA TRP A 67 -7.104 -10.154 2.437 1.00 0.00 C ATOM 1096 C TRP A 67 -7.313 -8.752 2.999 1.00 0.00 C ATOM 1097 O TRP A 67 -6.901 -7.763 2.396 1.00 0.00 O ATOM 1098 CB TRP A 67 -5.682 -10.289 1.886 1.00 0.00 C ATOM 1099 CG TRP A 67 -4.705 -10.817 2.891 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -4.168 -10.139 3.947 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -4.145 -12.134 2.932 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -3.309 -10.954 4.644 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -3.278 -12.185 4.040 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -4.295 -13.277 2.141 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -2.564 -13.332 4.375 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -3.584 -14.415 2.474 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -2.729 -14.436 3.583 1.00 0.00 C ATOM 0 H TRP A 67 -7.963 -9.898 0.542 1.00 0.00 H new ATOM 0 HA TRP A 67 -7.244 -10.874 3.243 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.696 -10.952 1.021 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.341 -9.315 1.536 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -4.386 -9.112 4.198 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -2.781 -10.687 5.475 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.954 -13.271 1.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.903 -13.350 5.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.690 -15.303 1.869 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -2.189 -15.341 3.818 1.00 0.00 H new ATOM 1118 N HIS A 68 -7.960 -8.676 4.158 1.00 0.00 N ATOM 1119 CA HIS A 68 -8.226 -7.395 4.800 1.00 0.00 C ATOM 1120 C HIS A 68 -6.932 -6.748 5.284 1.00 0.00 C ATOM 1121 O HIS A 68 -6.023 -7.431 5.757 1.00 0.00 O ATOM 1122 CB HIS A 68 -9.189 -7.579 5.975 1.00 0.00 C ATOM 1123 CG HIS A 68 -10.238 -6.515 6.061 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -11.580 -6.791 6.221 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -10.138 -5.164 6.009 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -12.259 -5.657 6.261 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -11.408 -4.657 6.136 1.00 0.00 N ATOM 0 H HIS A 68 -8.309 -9.486 4.671 1.00 0.00 H new ATOM 0 HA HIS A 68 -8.685 -6.737 4.062 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.675 -8.551 5.887 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.618 -7.591 6.904 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.229 -4.593 5.890 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -13.329 -5.565 6.376 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -11.654 -3.667 6.134 1.00 0.00 H new ATOM 1136 N GLY A 69 -6.855 -5.427 5.161 1.00 0.00 N ATOM 1137 CA GLY A 69 -5.669 -4.708 5.589 1.00 0.00 C ATOM 1138 C GLY A 69 -5.994 -3.554 6.515 1.00 0.00 C ATOM 1139 O GLY A 69 -6.989 -2.855 6.323 1.00 0.00 O ATOM 0 H GLY A 69 -7.594 -4.841 4.772 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.993 -5.397 6.095 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -5.141 -4.330 4.713 1.00 0.00 H new ATOM 1143 N LEU A 70 -5.151 -3.352 7.523 1.00 0.00 N ATOM 1144 CA LEU A 70 -5.353 -2.273 8.483 1.00 0.00 C ATOM 1145 C LEU A 70 -4.026 -1.844 9.102 1.00 0.00 C ATOM 1146 O LEU A 70 -3.391 -2.611 9.826 1.00 0.00 O ATOM 1147 CB LEU A 70 -6.323 -2.714 9.582 1.00 0.00 C ATOM 1148 CG LEU A 70 -7.129 -1.584 10.225 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -8.504 -2.082 10.643 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -6.381 -1.011 11.420 1.00 0.00 C ATOM 0 H LEU A 70 -4.322 -3.921 7.696 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.780 -1.422 7.953 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.017 -3.442 9.162 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.758 -3.225 10.361 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.261 -0.791 9.489 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.064 -1.265 11.099 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.041 -2.446 9.767 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.394 -2.893 11.363 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -6.968 -0.208 11.866 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.220 -1.796 12.159 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.419 -0.618 11.092 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.614 -0.615 8.813 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.362 -0.085 9.341 1.00 0.00 C ATOM 1164 C TYR A 71 -2.540 1.349 9.829 1.00 0.00 C ATOM 1165 O TYR A 71 -3.510 2.020 9.479 1.00 0.00 O ATOM 1166 CB TYR A 71 -1.269 -0.139 8.272 1.00 0.00 C ATOM 1167 CG TYR A 71 -1.643 0.563 6.986 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -2.298 -0.116 5.967 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -1.339 1.905 6.792 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -2.642 0.522 4.790 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -1.679 2.550 5.617 1.00 0.00 C ATOM 1172 CZ TYR A 71 -2.329 1.855 4.621 1.00 0.00 C ATOM 1173 OH TYR A 71 -2.669 2.494 3.450 1.00 0.00 O ATOM 0 H TYR A 71 -4.128 0.033 8.216 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.064 -0.704 10.187 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.360 0.312 8.671 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.038 -1.182 8.053 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -2.543 -1.160 6.096 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.829 2.453 7.571 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -3.153 -0.020 4.008 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -1.436 3.593 5.481 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.379 3.429 3.491 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.595 1.813 10.642 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.646 3.166 11.179 1.00 0.00 C ATOM 1185 C ALA A 72 -0.255 3.791 11.222 1.00 0.00 C ATOM 1186 O ALA A 72 0.692 3.187 11.726 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.267 3.160 12.568 1.00 0.00 C ATOM 0 H ALA A 72 -0.785 1.270 10.942 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.268 3.770 10.518 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.299 4.178 12.957 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.280 2.761 12.512 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.668 2.537 13.232 1.00 0.00 H new ATOM 1193 N MET A 73 -0.140 5.003 10.690 1.00 0.00 N ATOM 1194 CA MET A 73 1.137 5.709 10.668 1.00 0.00 C ATOM 1195 C MET A 73 0.995 7.113 11.248 1.00 0.00 C ATOM 1196 O MET A 73 -0.103 7.537 11.609 1.00 0.00 O ATOM 1197 CB MET A 73 1.674 5.789 9.238 1.00 0.00 C ATOM 1198 CG MET A 73 1.874 4.430 8.586 1.00 0.00 C ATOM 1199 SD MET A 73 3.273 4.404 7.449 1.00 0.00 S ATOM 1200 CE MET A 73 2.462 3.935 5.923 1.00 0.00 C ATOM 0 H MET A 73 -0.914 5.517 10.269 1.00 0.00 H new ATOM 0 HA MET A 73 1.842 5.151 11.284 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.984 6.375 8.632 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.624 6.323 9.245 1.00 0.00 H new ATOM 0 HG2 MET A 73 2.027 3.679 9.361 1.00 0.00 H new ATOM 0 HG3 MET A 73 0.968 4.153 8.047 1.00 0.00 H new ATOM 0 HE1 MET A 73 3.199 3.877 5.122 1.00 0.00 H new ATOM 0 HE2 MET A 73 1.985 2.963 6.048 1.00 0.00 H new ATOM 0 HE3 MET A 73 1.708 4.679 5.668 1.00 0.00 H new ATOM 1210 N ALA A 74 2.112 7.828 11.334 1.00 0.00 N ATOM 1211 CA ALA A 74 2.113 9.184 11.869 1.00 0.00 C ATOM 1212 C ALA A 74 3.097 10.070 11.115 1.00 0.00 C ATOM 1213 O ALA A 74 4.209 9.650 10.797 1.00 0.00 O ATOM 1214 CB ALA A 74 2.447 9.163 13.353 1.00 0.00 C ATOM 0 H ALA A 74 3.028 7.490 11.040 1.00 0.00 H new ATOM 0 HA ALA A 74 1.115 9.602 11.738 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.445 10.182 13.741 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.703 8.570 13.885 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.433 8.722 13.498 1.00 0.00 H new ATOM 1220 N PHE A 75 2.679 11.300 10.829 1.00 0.00 N ATOM 1221 CA PHE A 75 3.524 12.247 10.112 1.00 0.00 C ATOM 1222 C PHE A 75 4.059 13.321 11.054 1.00 0.00 C ATOM 1223 O PHE A 75 3.350 13.788 11.945 1.00 0.00 O ATOM 1224 CB PHE A 75 2.740 12.897 8.970 1.00 0.00 C ATOM 1225 CG PHE A 75 2.332 11.932 7.895 1.00 0.00 C ATOM 1226 CD1 PHE A 75 3.261 11.076 7.324 1.00 0.00 C ATOM 1227 CD2 PHE A 75 1.019 11.878 7.456 1.00 0.00 C ATOM 1228 CE1 PHE A 75 2.888 10.187 6.335 1.00 0.00 C ATOM 1229 CE2 PHE A 75 0.640 10.990 6.467 1.00 0.00 C ATOM 1230 CZ PHE A 75 1.576 10.144 5.905 1.00 0.00 C ATOM 0 H PHE A 75 1.760 11.663 11.083 1.00 0.00 H new ATOM 0 HA PHE A 75 4.371 11.700 9.697 1.00 0.00 H new ATOM 0 HB2 PHE A 75 1.848 13.372 9.378 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.347 13.686 8.527 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.288 11.105 7.656 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.283 12.538 7.892 1.00 0.00 H new ATOM 0 HE1 PHE A 75 3.622 9.526 5.898 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.387 10.958 6.134 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.283 9.450 5.131 1.00 0.00 H new ATOM 1240 N LYS A 76 5.315 13.707 10.850 1.00 0.00 N ATOM 1241 CA LYS A 76 5.945 14.726 11.681 1.00 0.00 C ATOM 1242 C LYS A 76 5.620 16.125 11.167 1.00 0.00 C ATOM 1243 O LYS A 76 5.500 16.342 9.962 1.00 0.00 O ATOM 1244 CB LYS A 76 7.461 14.522 11.714 1.00 0.00 C ATOM 1245 CG LYS A 76 7.929 13.616 12.841 1.00 0.00 C ATOM 1246 CD LYS A 76 8.410 14.421 14.038 1.00 0.00 C ATOM 1247 CE LYS A 76 9.384 13.623 14.890 1.00 0.00 C ATOM 1248 NZ LYS A 76 10.728 13.527 14.254 1.00 0.00 N ATOM 0 H LYS A 76 5.916 13.330 10.117 1.00 0.00 H new ATOM 0 HA LYS A 76 5.550 14.629 12.692 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.783 14.100 10.762 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.948 15.492 11.813 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.113 12.961 13.146 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.735 12.976 12.484 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.892 15.336 13.693 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.555 14.720 14.644 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.478 14.092 15.869 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.987 12.621 15.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 11.409 13.142 14.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.676 12.899 13.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.037 14.473 13.952 1.00 0.00 H new ATOM 1262 N ASP A 77 5.479 17.071 12.090 1.00 0.00 N ATOM 1263 CA ASP A 77 5.167 18.450 11.731 1.00 0.00 C ATOM 1264 C ASP A 77 6.431 19.208 11.340 1.00 0.00 C ATOM 1265 O ASP A 77 7.512 18.627 11.242 1.00 0.00 O ATOM 1266 CB ASP A 77 4.473 19.157 12.894 1.00 0.00 C ATOM 1267 CG ASP A 77 3.376 20.095 12.429 1.00 0.00 C ATOM 1268 OD1 ASP A 77 3.440 20.554 11.269 1.00 0.00 O ATOM 1269 OD2 ASP A 77 2.453 20.371 13.224 1.00 0.00 O ATOM 0 H ASP A 77 5.576 16.908 13.092 1.00 0.00 H new ATOM 0 HA ASP A 77 4.495 18.433 10.873 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.049 18.412 13.567 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.211 19.720 13.466 1.00 0.00 H new ATOM 1275 N SER A 78 6.288 20.511 11.117 1.00 0.00 N ATOM 1276 CA SER A 78 7.418 21.350 10.737 1.00 0.00 C ATOM 1277 C SER A 78 8.320 21.624 11.935 1.00 0.00 C ATOM 1278 O SER A 78 9.534 21.771 11.790 1.00 0.00 O ATOM 1279 CB SER A 78 6.923 22.671 10.145 1.00 0.00 C ATOM 1280 OG SER A 78 7.846 23.184 9.199 1.00 0.00 O ATOM 0 H SER A 78 5.401 21.008 11.193 1.00 0.00 H new ATOM 0 HA SER A 78 7.997 20.816 9.984 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.955 22.519 9.668 1.00 0.00 H new ATOM 0 HB3 SER A 78 6.774 23.398 10.944 1.00 0.00 H new ATOM 0 HG SER A 78 7.506 24.027 8.834 1.00 0.00 H new ATOM 1286 N TRP A 79 7.720 21.691 13.120 1.00 0.00 N ATOM 1287 CA TRP A 79 8.471 21.947 14.343 1.00 0.00 C ATOM 1288 C TRP A 79 8.519 20.703 15.224 1.00 0.00 C ATOM 1289 O TRP A 79 9.572 20.086 15.389 1.00 0.00 O ATOM 1290 CB TRP A 79 7.844 23.111 15.116 1.00 0.00 C ATOM 1291 CG TRP A 79 8.855 24.053 15.692 1.00 0.00 C ATOM 1292 CD1 TRP A 79 9.924 23.730 16.477 1.00 0.00 C ATOM 1293 CD2 TRP A 79 8.893 25.476 15.529 1.00 0.00 C ATOM 1294 NE1 TRP A 79 10.624 24.864 16.812 1.00 0.00 N ATOM 1295 CE2 TRP A 79 10.011 25.949 16.242 1.00 0.00 C ATOM 1296 CE3 TRP A 79 8.090 26.395 14.848 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 10.345 27.300 16.293 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 8.423 27.736 14.899 1.00 0.00 C ATOM 1299 CH2 TRP A 79 9.541 28.178 15.617 1.00 0.00 C ATOM 0 H TRP A 79 6.717 21.572 13.258 1.00 0.00 H new ATOM 0 HA TRP A 79 9.491 22.211 14.065 1.00 0.00 H new ATOM 0 HB2 TRP A 79 7.180 23.664 14.451 1.00 0.00 H new ATOM 0 HB3 TRP A 79 7.228 22.713 15.922 1.00 0.00 H new ATOM 0 HD1 TRP A 79 10.182 22.729 16.789 1.00 0.00 H new ATOM 0 HE1 TRP A 79 11.463 24.893 17.391 1.00 0.00 H new ATOM 0 HE3 TRP A 79 7.225 26.064 14.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 11.207 27.643 16.846 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 7.810 28.455 14.376 1.00 0.00 H new ATOM 0 HH2 TRP A 79 9.774 29.232 15.638 1.00 0.00 H new ATOM 1310 N ASN A 80 7.373 20.338 15.789 1.00 0.00 N ATOM 1311 CA ASN A 80 7.285 19.167 16.653 1.00 0.00 C ATOM 1312 C ASN A 80 5.830 18.783 16.905 1.00 0.00 C ATOM 1313 O ASN A 80 5.194 19.292 17.826 1.00 0.00 O ATOM 1314 CB ASN A 80 7.991 19.435 17.984 1.00 0.00 C ATOM 1315 CG ASN A 80 8.716 18.212 18.511 1.00 0.00 C ATOM 1316 OD1 ASN A 80 8.926 17.241 17.785 1.00 0.00 O ATOM 1317 ND2 ASN A 80 9.101 18.254 19.780 1.00 0.00 N ATOM 0 H ASN A 80 6.492 20.837 15.664 1.00 0.00 H new ATOM 0 HA ASN A 80 7.778 18.337 16.148 1.00 0.00 H new ATOM 0 HB2 ASN A 80 8.704 20.250 17.856 1.00 0.00 H new ATOM 0 HB3 ASN A 80 7.258 19.765 18.721 1.00 0.00 H new ATOM 0 HD21 ASN A 80 9.592 17.460 20.190 1.00 0.00 H new ATOM 0 HD22 ASN A 80 8.906 19.080 20.345 1.00 0.00 H new ATOM 1324 N LYS A 81 5.311 17.881 16.078 1.00 0.00 N ATOM 1325 CA LYS A 81 3.932 17.427 16.211 1.00 0.00 C ATOM 1326 C LYS A 81 3.669 16.215 15.322 1.00 0.00 C ATOM 1327 O LYS A 81 3.900 16.258 14.113 1.00 0.00 O ATOM 1328 CB LYS A 81 2.964 18.558 15.854 1.00 0.00 C ATOM 1329 CG LYS A 81 2.383 19.268 17.066 1.00 0.00 C ATOM 1330 CD LYS A 81 1.089 19.988 16.723 1.00 0.00 C ATOM 1331 CE LYS A 81 0.119 19.975 17.893 1.00 0.00 C ATOM 1332 NZ LYS A 81 0.677 20.669 19.086 1.00 0.00 N ATOM 0 H LYS A 81 5.825 17.450 15.309 1.00 0.00 H new ATOM 0 HA LYS A 81 3.770 17.134 17.248 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.483 19.286 15.231 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.148 18.151 15.256 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.198 18.544 17.859 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.108 19.985 17.451 1.00 0.00 H new ATOM 0 HD2 LYS A 81 1.308 21.018 16.442 1.00 0.00 H new ATOM 0 HD3 LYS A 81 0.625 19.513 15.859 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -0.813 20.456 17.597 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -0.122 18.944 18.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.051 20.727 19.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 1.495 20.137 19.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 0.978 21.628 18.820 1.00 0.00 H new ATOM 1346 N TRP A 82 3.188 15.135 15.928 1.00 0.00 N ATOM 1347 CA TRP A 82 2.894 13.912 15.191 1.00 0.00 C ATOM 1348 C TRP A 82 1.400 13.607 15.211 1.00 0.00 C ATOM 1349 O TRP A 82 0.766 13.630 16.267 1.00 0.00 O ATOM 1350 CB TRP A 82 3.674 12.735 15.783 1.00 0.00 C ATOM 1351 CG TRP A 82 3.312 12.439 17.206 1.00 0.00 C ATOM 1352 CD1 TRP A 82 3.706 13.132 18.313 1.00 0.00 C ATOM 1353 CD2 TRP A 82 2.485 11.368 17.675 1.00 0.00 C ATOM 1354 NE1 TRP A 82 3.174 12.559 19.443 1.00 0.00 N ATOM 1355 CE2 TRP A 82 2.420 11.475 19.077 1.00 0.00 C ATOM 1356 CE3 TRP A 82 1.791 10.330 17.046 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 1.690 10.582 19.858 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 1.067 9.445 17.822 1.00 0.00 C ATOM 1359 CH2 TRP A 82 1.021 9.577 19.216 1.00 0.00 C ATOM 0 H TRP A 82 2.993 15.082 16.928 1.00 0.00 H new ATOM 0 HA TRP A 82 3.201 14.060 14.156 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.493 11.847 15.177 1.00 0.00 H new ATOM 0 HB3 TRP A 82 4.741 12.949 15.724 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.343 14.004 18.303 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.317 12.887 20.398 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.820 10.222 15.972 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.654 10.680 20.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 0.528 8.639 17.346 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.445 8.870 19.795 1.00 0.00 H new ATOM 1370 N GLU A 83 0.843 13.322 14.039 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.577 13.013 13.922 1.00 0.00 C ATOM 1372 C GLU A 83 -0.784 11.618 13.330 1.00 0.00 C ATOM 1373 O GLU A 83 -0.273 11.315 12.252 1.00 0.00 O ATOM 1374 CB GLU A 83 -1.276 14.057 13.049 1.00 0.00 C ATOM 1375 CG GLU A 83 -1.363 15.430 13.696 1.00 0.00 C ATOM 1376 CD GLU A 83 -2.724 16.076 13.513 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -3.160 16.810 14.425 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -3.352 15.848 12.459 1.00 0.00 O ATOM 0 H GLU A 83 1.354 13.299 13.156 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.012 13.033 14.921 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.742 14.143 12.103 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.283 13.709 12.817 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.148 15.340 14.761 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.597 16.078 13.270 1.00 0.00 H new ATOM 1386 N PRO A 84 -1.536 10.747 14.027 1.00 0.00 N ATOM 1387 CA PRO A 84 -1.799 9.384 13.556 1.00 0.00 C ATOM 1388 C PRO A 84 -2.816 9.348 12.419 1.00 0.00 C ATOM 1389 O PRO A 84 -3.589 10.288 12.235 1.00 0.00 O ATOM 1390 CB PRO A 84 -2.361 8.690 14.797 1.00 0.00 C ATOM 1391 CG PRO A 84 -3.008 9.781 15.576 1.00 0.00 C ATOM 1392 CD PRO A 84 -2.187 11.017 15.324 1.00 0.00 C ATOM 0 HA PRO A 84 -0.905 8.911 13.150 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.079 7.916 14.527 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.572 8.206 15.372 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.040 9.927 15.258 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.033 9.539 16.639 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -2.811 11.910 15.281 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.454 11.178 16.114 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.809 8.256 11.662 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.730 8.095 10.544 1.00 0.00 C ATOM 1402 C ILE A 85 -4.172 6.642 10.404 1.00 0.00 C ATOM 1403 O ILE A 85 -3.356 5.724 10.480 1.00 0.00 O ATOM 1404 CB ILE A 85 -3.093 8.556 9.218 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -1.749 7.858 9.002 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.920 10.067 9.211 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -1.199 8.027 7.603 1.00 0.00 C ATOM 0 H ILE A 85 -2.175 7.469 11.803 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.598 8.719 10.756 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.757 8.283 8.398 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.026 8.250 9.718 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.863 6.795 9.213 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.469 10.377 8.268 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.893 10.545 9.322 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.274 10.363 10.037 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.245 7.506 7.522 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.903 7.610 6.883 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.053 9.087 7.395 1.00 0.00 H new ATOM 1419 N ALA A 86 -5.470 6.441 10.199 1.00 0.00 N ATOM 1420 CA ALA A 86 -6.021 5.098 10.050 1.00 0.00 C ATOM 1421 C ALA A 86 -6.241 4.754 8.581 1.00 0.00 C ATOM 1422 O ALA A 86 -6.560 5.623 7.770 1.00 0.00 O ATOM 1423 CB ALA A 86 -7.324 4.974 10.825 1.00 0.00 C ATOM 0 H ALA A 86 -6.159 7.190 10.132 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.300 4.389 10.457 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.724 3.967 10.705 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.139 5.167 11.882 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -8.044 5.698 10.444 1.00 0.00 H new ATOM 1429 N GLY A 87 -6.068 3.479 8.247 1.00 0.00 N ATOM 1430 CA GLY A 87 -6.254 3.041 6.876 1.00 0.00 C ATOM 1431 C GLY A 87 -6.730 1.605 6.785 1.00 0.00 C ATOM 1432 O GLY A 87 -6.224 0.730 7.488 1.00 0.00 O ATOM 0 H GLY A 87 -5.803 2.742 8.901 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.977 3.692 6.385 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.314 3.144 6.334 1.00 0.00 H new ATOM 1436 N TYR A 88 -7.708 1.362 5.919 1.00 0.00 N ATOM 1437 CA TYR A 88 -8.254 0.021 5.739 1.00 0.00 C ATOM 1438 C TYR A 88 -8.654 -0.214 4.286 1.00 0.00 C ATOM 1439 O TYR A 88 -9.186 0.678 3.627 1.00 0.00 O ATOM 1440 CB TYR A 88 -9.463 -0.187 6.653 1.00 0.00 C ATOM 1441 CG TYR A 88 -10.599 0.775 6.383 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -10.571 2.071 6.883 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -11.699 0.386 5.627 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -11.607 2.951 6.638 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -12.738 1.262 5.378 1.00 0.00 C ATOM 1446 CZ TYR A 88 -12.688 2.542 5.886 1.00 0.00 C ATOM 1447 OH TYR A 88 -13.721 3.417 5.640 1.00 0.00 O ATOM 0 H TYR A 88 -8.139 2.075 5.331 1.00 0.00 H new ATOM 0 HA TYR A 88 -7.479 -0.698 6.004 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.826 -1.208 6.534 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.146 -0.080 7.690 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.726 2.395 7.472 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -11.742 -0.617 5.228 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -11.571 3.955 7.034 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -13.585 0.945 4.788 1.00 0.00 H new ATOM 0 HH TYR A 88 -14.403 2.973 5.094 1.00 0.00 H new ATOM 1457 N GLY A 89 -8.392 -1.420 3.793 1.00 0.00 N ATOM 1458 CA GLY A 89 -8.732 -1.750 2.421 1.00 0.00 C ATOM 1459 C GLY A 89 -8.695 -3.242 2.157 1.00 0.00 C ATOM 1460 O GLY A 89 -8.668 -4.045 3.090 1.00 0.00 O ATOM 0 H GLY A 89 -7.951 -2.174 4.319 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.728 -1.369 2.195 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -8.038 -1.248 1.747 1.00 0.00 H new ATOM 1464 N TRP A 90 -8.695 -3.615 0.881 1.00 0.00 N ATOM 1465 CA TRP A 90 -8.660 -5.021 0.496 1.00 0.00 C ATOM 1466 C TRP A 90 -7.569 -5.278 -0.537 1.00 0.00 C ATOM 1467 O TRP A 90 -7.307 -4.439 -1.399 1.00 0.00 O ATOM 1468 CB TRP A 90 -10.018 -5.451 -0.061 1.00 0.00 C ATOM 1469 CG TRP A 90 -11.035 -5.734 1.002 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -10.833 -6.414 2.168 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -12.413 -5.344 0.997 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -12.001 -6.471 2.889 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -12.986 -5.821 2.191 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -13.218 -4.637 0.100 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -14.326 -5.614 2.510 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -14.549 -4.432 0.416 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -15.090 -4.919 1.613 1.00 0.00 C ATOM 0 H TRP A 90 -8.719 -2.963 0.097 1.00 0.00 H new ATOM 0 HA TRP A 90 -8.436 -5.609 1.386 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -10.398 -4.668 -0.717 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.885 -6.343 -0.673 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.892 -6.844 2.478 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.117 -6.923 3.796 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -12.808 -4.257 -0.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -14.746 -5.988 3.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -15.181 -3.888 -0.271 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -16.133 -4.742 1.832 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.933 -6.442 -0.443 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.870 -6.809 -1.370 1.00 0.00 C ATOM 1490 C GLU A 91 -5.959 -8.285 -1.745 1.00 0.00 C ATOM 1491 O GLU A 91 -6.386 -9.115 -0.942 1.00 0.00 O ATOM 1492 CB GLU A 91 -4.502 -6.509 -0.754 1.00 0.00 C ATOM 1493 CG GLU A 91 -4.245 -7.252 0.548 1.00 0.00 C ATOM 1494 CD GLU A 91 -2.997 -6.768 1.258 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -2.801 -5.536 1.343 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -2.215 -7.619 1.731 1.00 0.00 O ATOM 0 H GLU A 91 -7.136 -7.147 0.266 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.992 -6.215 -2.276 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.724 -6.771 -1.472 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -4.421 -5.437 -0.573 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.104 -7.130 1.207 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.151 -8.318 0.341 1.00 0.00 H new ATOM 1504 N SER A 92 -5.554 -8.605 -2.970 1.00 0.00 N ATOM 1505 CA SER A 92 -5.589 -9.981 -3.451 1.00 0.00 C ATOM 1506 C SER A 92 -4.209 -10.625 -3.360 1.00 0.00 C ATOM 1507 O SER A 92 -3.194 -9.984 -3.633 1.00 0.00 O ATOM 1508 CB SER A 92 -6.091 -10.026 -4.895 1.00 0.00 C ATOM 1509 OG SER A 92 -7.507 -10.067 -4.942 1.00 0.00 O ATOM 0 H SER A 92 -5.198 -7.930 -3.647 1.00 0.00 H new ATOM 0 HA SER A 92 -6.275 -10.543 -2.817 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.731 -9.151 -5.436 1.00 0.00 H new ATOM 0 HB3 SER A 92 -5.682 -10.902 -5.398 1.00 0.00 H new ATOM 0 HG SER A 92 -7.803 -10.094 -5.876 1.00 0.00 H new ATOM 1515 N THR A 93 -4.180 -11.897 -2.975 1.00 0.00 N ATOM 1516 CA THR A 93 -2.925 -12.628 -2.847 1.00 0.00 C ATOM 1517 C THR A 93 -2.584 -13.354 -4.145 1.00 0.00 C ATOM 1518 O THR A 93 -3.473 -13.786 -4.877 1.00 0.00 O ATOM 1519 CB THR A 93 -3.008 -13.630 -1.695 1.00 0.00 C ATOM 1520 OG1 THR A 93 -3.996 -13.237 -0.759 1.00 0.00 O ATOM 1521 CG2 THR A 93 -1.703 -13.790 -0.946 1.00 0.00 C ATOM 0 H THR A 93 -5.011 -12.442 -2.746 1.00 0.00 H new ATOM 0 HA THR A 93 -2.134 -11.908 -2.635 1.00 0.00 H new ATOM 0 HB THR A 93 -3.261 -14.583 -2.159 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.608 -13.224 0.141 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.831 -14.515 -0.142 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.931 -14.141 -1.631 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.405 -12.830 -0.525 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.291 -13.483 -4.422 1.00 0.00 N ATOM 1530 CA TRP A 94 -0.832 -14.157 -5.631 1.00 0.00 C ATOM 1531 C TRP A 94 0.518 -14.832 -5.400 1.00 0.00 C ATOM 1532 O TRP A 94 1.514 -14.166 -5.118 1.00 0.00 O ATOM 1533 CB TRP A 94 -0.730 -13.160 -6.787 1.00 0.00 C ATOM 1534 CG TRP A 94 -1.692 -13.442 -7.901 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -2.547 -12.556 -8.490 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -1.899 -14.698 -8.558 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -3.272 -13.183 -9.473 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -2.893 -14.499 -9.535 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -1.340 -15.971 -8.417 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -3.338 -15.525 -10.364 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -1.783 -16.989 -9.240 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -2.773 -16.761 -10.204 1.00 0.00 C ATOM 0 H TRP A 94 -0.542 -13.130 -3.826 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.560 -14.926 -5.888 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.910 -12.154 -6.407 1.00 0.00 H new ATOM 0 HB3 TRP A 94 0.286 -13.175 -7.181 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -2.640 -11.514 -8.222 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -3.978 -12.741 -10.062 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -0.575 -16.156 -7.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -4.102 -15.352 -11.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -1.359 -17.977 -9.138 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -3.097 -17.577 -10.833 1.00 0.00 H new ATOM 1553 N ARG A 95 0.541 -16.155 -5.523 1.00 0.00 N ATOM 1554 CA ARG A 95 1.769 -16.919 -5.329 1.00 0.00 C ATOM 1555 C ARG A 95 2.067 -17.789 -6.548 1.00 0.00 C ATOM 1556 O ARG A 95 1.152 -18.246 -7.233 1.00 0.00 O ATOM 1557 CB ARG A 95 1.656 -17.794 -4.079 1.00 0.00 C ATOM 1558 CG ARG A 95 1.162 -17.044 -2.853 1.00 0.00 C ATOM 1559 CD ARG A 95 0.289 -17.925 -1.975 1.00 0.00 C ATOM 1560 NE ARG A 95 -0.852 -17.195 -1.427 1.00 0.00 N ATOM 1561 CZ ARG A 95 -1.571 -17.613 -0.389 1.00 0.00 C ATOM 1562 NH1 ARG A 95 -1.271 -18.755 0.218 1.00 0.00 N ATOM 1563 NH2 ARG A 95 -2.593 -16.887 0.046 1.00 0.00 N ATOM 0 H ARG A 95 -0.275 -16.720 -5.756 1.00 0.00 H new ATOM 0 HA ARG A 95 2.590 -16.214 -5.199 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.978 -18.622 -4.286 1.00 0.00 H new ATOM 0 HB3 ARG A 95 2.632 -18.228 -3.860 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.015 -16.685 -2.277 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.597 -16.166 -3.166 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.070 -18.774 -2.557 1.00 0.00 H new ATOM 0 HD3 ARG A 95 0.887 -18.328 -1.158 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.113 -16.312 -1.867 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -0.486 -19.317 -0.111 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.826 -19.071 1.014 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -2.827 -16.008 -0.416 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -3.144 -17.208 0.842 1.00 0.00 H new ATOM 1577 N PRO A 96 3.358 -18.031 -6.835 1.00 0.00 N ATOM 1578 CA PRO A 96 3.772 -18.851 -7.977 1.00 0.00 C ATOM 1579 C PRO A 96 3.447 -20.327 -7.778 1.00 0.00 C ATOM 1580 O PRO A 96 3.212 -21.057 -8.741 1.00 0.00 O ATOM 1581 CB PRO A 96 5.287 -18.640 -8.036 1.00 0.00 C ATOM 1582 CG PRO A 96 5.674 -18.290 -6.641 1.00 0.00 C ATOM 1583 CD PRO A 96 4.513 -17.524 -6.069 1.00 0.00 C ATOM 0 HA PRO A 96 3.253 -18.566 -8.892 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.799 -19.540 -8.375 1.00 0.00 H new ATOM 0 HB3 PRO A 96 5.549 -17.843 -8.732 1.00 0.00 H new ATOM 0 HG2 PRO A 96 5.876 -19.187 -6.055 1.00 0.00 H new ATOM 0 HG3 PRO A 96 6.583 -17.689 -6.627 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.398 -17.707 -5.001 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.639 -16.449 -6.197 1.00 0.00 H new ATOM 1591 N LEU A 97 3.433 -20.761 -6.521 1.00 0.00 N ATOM 1592 CA LEU A 97 3.136 -22.150 -6.195 1.00 0.00 C ATOM 1593 C LEU A 97 2.754 -22.294 -4.725 1.00 0.00 C ATOM 1594 O LEU A 97 3.098 -23.282 -4.078 1.00 0.00 O ATOM 1595 CB LEU A 97 4.340 -23.040 -6.510 1.00 0.00 C ATOM 1596 CG LEU A 97 3.998 -24.481 -6.891 1.00 0.00 C ATOM 1597 CD1 LEU A 97 3.765 -24.596 -8.389 1.00 0.00 C ATOM 1598 CD2 LEU A 97 5.106 -25.425 -6.446 1.00 0.00 C ATOM 0 H LEU A 97 3.624 -20.170 -5.712 1.00 0.00 H new ATOM 0 HA LEU A 97 2.290 -22.467 -6.805 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.903 -22.588 -7.327 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.998 -23.056 -5.641 1.00 0.00 H new ATOM 0 HG LEU A 97 3.078 -24.765 -6.380 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.523 -25.628 -8.641 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.938 -23.948 -8.679 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.667 -24.294 -8.922 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.847 -26.447 -6.725 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.041 -25.143 -6.930 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.224 -25.363 -5.364 1.00 0.00 H new ATOM 1610 N ALA A 98 2.039 -21.301 -4.205 1.00 0.00 N ATOM 1611 CA ALA A 98 1.611 -21.316 -2.813 1.00 0.00 C ATOM 1612 C ALA A 98 2.809 -21.357 -1.871 1.00 0.00 C ATOM 1613 O ALA A 98 3.066 -22.371 -1.220 1.00 0.00 O ATOM 1614 CB ALA A 98 0.692 -22.502 -2.557 1.00 0.00 C ATOM 0 H ALA A 98 1.744 -20.476 -4.728 1.00 0.00 H new ATOM 0 HA ALA A 98 1.061 -20.396 -2.617 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.379 -22.501 -1.513 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.186 -22.427 -3.199 1.00 0.00 H new ATOM 0 HB3 ALA A 98 1.224 -23.428 -2.776 1.00 0.00 H new ATOM 1620 N ASP A 99 3.540 -20.250 -1.802 1.00 0.00 N ATOM 1621 CA ASP A 99 4.712 -20.158 -0.940 1.00 0.00 C ATOM 1622 C ASP A 99 4.527 -19.077 0.119 1.00 0.00 C ATOM 1623 O ASP A 99 3.656 -18.214 -0.006 1.00 0.00 O ATOM 1624 CB ASP A 99 5.962 -19.864 -1.772 1.00 0.00 C ATOM 1625 CG ASP A 99 7.224 -20.406 -1.131 1.00 0.00 C ATOM 1626 OD1 ASP A 99 7.238 -20.572 0.106 1.00 0.00 O ATOM 1627 OD2 ASP A 99 8.199 -20.666 -1.868 1.00 0.00 O ATOM 0 H ASP A 99 3.341 -19.403 -2.334 1.00 0.00 H new ATOM 0 HA ASP A 99 4.836 -21.117 -0.436 1.00 0.00 H new ATOM 0 HB2 ASP A 99 5.846 -20.300 -2.764 1.00 0.00 H new ATOM 0 HB3 ASP A 99 6.060 -18.787 -1.907 1.00 0.00 H new ATOM 1633 N GLU A 100 5.348 -19.128 1.162 1.00 0.00 N ATOM 1634 CA GLU A 100 5.275 -18.153 2.243 1.00 0.00 C ATOM 1635 C GLU A 100 6.476 -17.213 2.212 1.00 0.00 C ATOM 1636 O GLU A 100 6.387 -16.061 2.638 1.00 0.00 O ATOM 1637 CB GLU A 100 5.205 -18.864 3.596 1.00 0.00 C ATOM 1638 CG GLU A 100 4.526 -18.044 4.679 1.00 0.00 C ATOM 1639 CD GLU A 100 3.071 -18.425 4.873 1.00 0.00 C ATOM 1640 OE1 GLU A 100 2.801 -19.375 5.637 1.00 0.00 O ATOM 1641 OE2 GLU A 100 2.200 -17.771 4.260 1.00 0.00 O ATOM 0 H GLU A 100 6.073 -19.836 1.282 1.00 0.00 H new ATOM 0 HA GLU A 100 4.370 -17.562 2.103 1.00 0.00 H new ATOM 0 HB2 GLU A 100 4.669 -19.805 3.475 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.216 -19.112 3.920 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.061 -18.177 5.619 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.590 -16.986 4.423 1.00 0.00 H new ATOM 1649 N ASN A 101 7.600 -17.711 1.705 1.00 0.00 N ATOM 1650 CA ASN A 101 8.819 -16.914 1.619 1.00 0.00 C ATOM 1651 C ASN A 101 8.594 -15.660 0.778 1.00 0.00 C ATOM 1652 O ASN A 101 8.725 -14.540 1.271 1.00 0.00 O ATOM 1653 CB ASN A 101 9.955 -17.747 1.019 1.00 0.00 C ATOM 1654 CG ASN A 101 11.285 -17.480 1.697 1.00 0.00 C ATOM 1655 OD1 ASN A 101 11.459 -17.758 2.883 1.00 0.00 O ATOM 1656 ND2 ASN A 101 12.234 -16.938 0.942 1.00 0.00 N ATOM 0 H ASN A 101 7.692 -18.662 1.348 1.00 0.00 H new ATOM 0 HA ASN A 101 9.094 -16.607 2.628 1.00 0.00 H new ATOM 0 HB2 ASN A 101 9.711 -18.806 1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 101 10.041 -17.526 -0.045 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.151 -16.736 1.342 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.046 -16.724 -0.037 1.00 0.00 H new ATOM 1663 N PHE A 102 8.258 -15.858 -0.493 1.00 0.00 N ATOM 1664 CA PHE A 102 8.015 -14.744 -1.402 1.00 0.00 C ATOM 1665 C PHE A 102 6.557 -14.711 -1.848 1.00 0.00 C ATOM 1666 O PHE A 102 5.993 -15.734 -2.236 1.00 0.00 O ATOM 1667 CB PHE A 102 8.932 -14.842 -2.623 1.00 0.00 C ATOM 1668 CG PHE A 102 9.099 -16.243 -3.143 1.00 0.00 C ATOM 1669 CD1 PHE A 102 8.086 -16.852 -3.866 1.00 0.00 C ATOM 1670 CD2 PHE A 102 10.266 -16.949 -2.905 1.00 0.00 C ATOM 1671 CE1 PHE A 102 8.237 -18.140 -4.346 1.00 0.00 C ATOM 1672 CE2 PHE A 102 10.422 -18.238 -3.380 1.00 0.00 C ATOM 1673 CZ PHE A 102 9.406 -18.834 -4.102 1.00 0.00 C ATOM 0 H PHE A 102 8.148 -16.779 -0.916 1.00 0.00 H new ATOM 0 HA PHE A 102 8.233 -13.820 -0.867 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.531 -14.214 -3.419 1.00 0.00 H new ATOM 0 HB3 PHE A 102 9.912 -14.441 -2.364 1.00 0.00 H new ATOM 0 HD1 PHE A 102 7.169 -16.315 -4.057 1.00 0.00 H new ATOM 0 HD2 PHE A 102 11.064 -16.487 -2.342 1.00 0.00 H new ATOM 0 HE1 PHE A 102 7.442 -18.603 -4.911 1.00 0.00 H new ATOM 0 HE2 PHE A 102 11.337 -18.778 -3.187 1.00 0.00 H new ATOM 0 HZ PHE A 102 9.526 -19.841 -4.475 1.00 0.00 H new ATOM 1683 N HIS A 103 5.952 -13.529 -1.787 1.00 0.00 N ATOM 1684 CA HIS A 103 4.558 -13.361 -2.184 1.00 0.00 C ATOM 1685 C HIS A 103 4.344 -12.011 -2.860 1.00 0.00 C ATOM 1686 O HIS A 103 5.164 -11.102 -2.727 1.00 0.00 O ATOM 1687 CB HIS A 103 3.641 -13.486 -0.967 1.00 0.00 C ATOM 1688 CG HIS A 103 3.969 -12.522 0.131 1.00 0.00 C ATOM 1689 ND1 HIS A 103 3.407 -11.266 0.224 1.00 0.00 N ATOM 1690 CD2 HIS A 103 4.810 -12.636 1.187 1.00 0.00 C ATOM 1691 CE1 HIS A 103 3.887 -10.649 1.290 1.00 0.00 C ATOM 1692 NE2 HIS A 103 4.740 -11.459 1.890 1.00 0.00 N ATOM 0 H HIS A 103 6.405 -12.673 -1.466 1.00 0.00 H new ATOM 0 HA HIS A 103 4.312 -14.147 -2.898 1.00 0.00 H new ATOM 0 HB2 HIS A 103 2.609 -13.328 -1.282 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.704 -14.502 -0.578 1.00 0.00 H new ATOM 0 HD2 HIS A 103 5.421 -13.493 1.430 1.00 0.00 H new ATOM 0 HE1 HIS A 103 3.626 -9.653 1.615 1.00 0.00 H new ATOM 0 HE2 HIS A 103 5.263 -11.245 2.739 1.00 0.00 H new ATOM 1701 N LEU A 104 3.235 -11.886 -3.584 1.00 0.00 N ATOM 1702 CA LEU A 104 2.912 -10.646 -4.279 1.00 0.00 C ATOM 1703 C LEU A 104 1.404 -10.486 -4.435 1.00 0.00 C ATOM 1704 O LEU A 104 0.683 -11.466 -4.627 1.00 0.00 O ATOM 1705 CB LEU A 104 3.586 -10.617 -5.652 1.00 0.00 C ATOM 1706 CG LEU A 104 3.055 -11.645 -6.654 1.00 0.00 C ATOM 1707 CD1 LEU A 104 1.982 -11.025 -7.537 1.00 0.00 C ATOM 1708 CD2 LEU A 104 4.190 -12.198 -7.502 1.00 0.00 C ATOM 0 H LEU A 104 2.546 -12.629 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 104 3.286 -9.815 -3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.466 -9.621 -6.078 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.655 -10.780 -5.519 1.00 0.00 H new ATOM 0 HG LEU A 104 2.608 -12.469 -6.098 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.616 -11.771 -8.243 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.156 -10.677 -6.916 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.404 -10.183 -8.085 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.794 -12.927 -8.209 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.666 -11.384 -8.049 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.925 -12.680 -6.857 1.00 0.00 H new ATOM 1720 N GLY A 105 0.933 -9.247 -4.352 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.488 -8.983 -4.485 1.00 0.00 C ATOM 1722 C GLY A 105 -0.781 -7.540 -4.847 1.00 0.00 C ATOM 1723 O GLY A 105 0.138 -6.739 -5.022 1.00 0.00 O ATOM 0 H GLY A 105 1.510 -8.420 -4.195 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.905 -9.638 -5.250 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.989 -9.228 -3.548 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.062 -7.209 -4.958 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.475 -5.852 -5.300 1.00 0.00 C ATOM 1729 C LEU A 106 -3.924 -5.606 -4.893 1.00 0.00 C ATOM 1730 O LEU A 106 -4.706 -6.546 -4.751 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.307 -5.609 -6.801 1.00 0.00 C ATOM 1732 CG LEU A 106 -3.133 -6.529 -7.703 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -3.539 -5.804 -8.975 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -2.352 -7.792 -8.033 1.00 0.00 C ATOM 0 H LEU A 106 -2.833 -7.861 -4.816 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.839 -5.156 -4.752 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.576 -4.575 -7.018 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.254 -5.725 -7.057 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.038 -6.815 -7.168 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.126 -6.474 -9.604 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -4.137 -4.929 -8.720 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.646 -5.488 -9.515 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -2.954 -8.435 -8.675 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.430 -7.525 -8.549 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.112 -8.322 -7.112 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.276 -4.338 -4.707 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.631 -3.995 -4.318 1.00 0.00 C ATOM 1748 C GLY A 107 -5.795 -2.515 -4.033 1.00 0.00 C ATOM 1749 O GLY A 107 -4.947 -1.706 -4.406 1.00 0.00 O ATOM 0 H GLY A 107 -3.647 -3.542 -4.819 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.319 -4.287 -5.112 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.907 -4.565 -3.431 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.893 -2.161 -3.372 1.00 0.00 N ATOM 1754 CA PHE A 108 -7.169 -0.769 -3.038 1.00 0.00 C ATOM 1755 C PHE A 108 -7.060 -0.537 -1.535 1.00 0.00 C ATOM 1756 O PHE A 108 -7.176 -1.473 -0.742 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.563 -0.372 -3.526 1.00 0.00 C ATOM 1758 CG PHE A 108 -8.667 -0.261 -5.020 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -8.566 -1.388 -5.821 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.867 0.970 -5.625 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -8.661 -1.289 -7.196 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -8.962 1.075 -6.999 1.00 0.00 C ATOM 1763 CZ PHE A 108 -8.859 -0.055 -7.786 1.00 0.00 C ATOM 0 H PHE A 108 -7.606 -2.819 -3.057 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.425 -0.148 -3.538 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.286 -1.108 -3.173 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.837 0.584 -3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -8.411 -2.355 -5.365 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.950 1.857 -5.015 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.581 -2.175 -7.809 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.117 2.040 -7.458 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.933 0.025 -8.860 1.00 0.00 H new ATOM 1773 N THR A 109 -6.836 0.713 -1.148 1.00 0.00 N ATOM 1774 CA THR A 109 -6.711 1.067 0.262 1.00 0.00 C ATOM 1775 C THR A 109 -7.431 2.379 0.560 1.00 0.00 C ATOM 1776 O THR A 109 -7.263 3.366 -0.156 1.00 0.00 O ATOM 1777 CB THR A 109 -5.237 1.182 0.651 1.00 0.00 C ATOM 1778 OG1 THR A 109 -4.514 0.043 0.219 1.00 0.00 O ATOM 1779 CG2 THR A 109 -5.020 1.324 2.142 1.00 0.00 C ATOM 0 H THR A 109 -6.737 1.499 -1.790 1.00 0.00 H new ATOM 0 HA THR A 109 -7.175 0.277 0.852 1.00 0.00 H new ATOM 0 HB THR A 109 -4.879 2.087 0.160 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.573 0.136 0.476 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.953 1.401 2.349 1.00 0.00 H new ATOM 0 HG22 THR A 109 -5.524 2.222 2.499 1.00 0.00 H new ATOM 0 HG23 THR A 109 -5.427 0.452 2.654 1.00 0.00 H new ATOM 1787 N ALA A 110 -8.232 2.380 1.620 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.977 3.570 2.012 1.00 0.00 C ATOM 1789 C ALA A 110 -8.352 4.229 3.237 1.00 0.00 C ATOM 1790 O ALA A 110 -8.348 3.658 4.328 1.00 0.00 O ATOM 1791 CB ALA A 110 -10.430 3.216 2.285 1.00 0.00 C ATOM 0 H ALA A 110 -8.382 1.571 2.222 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.937 4.282 1.188 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.975 4.114 2.577 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.878 2.797 1.384 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.481 2.483 3.090 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.823 5.434 3.050 1.00 0.00 N ATOM 1798 CA GLY A 111 -7.203 6.150 4.149 1.00 0.00 C ATOM 1799 C GLY A 111 -8.136 7.162 4.784 1.00 0.00 C ATOM 1800 O GLY A 111 -8.749 7.972 4.088 1.00 0.00 O ATOM 0 H GLY A 111 -7.813 5.927 2.157 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.878 5.436 4.906 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.310 6.661 3.788 1.00 0.00 H new ATOM 1804 N VAL A 112 -8.246 7.116 6.107 1.00 0.00 N ATOM 1805 CA VAL A 112 -9.112 8.035 6.835 1.00 0.00 C ATOM 1806 C VAL A 112 -8.301 8.941 7.756 1.00 0.00 C ATOM 1807 O VAL A 112 -7.512 8.466 8.574 1.00 0.00 O ATOM 1808 CB VAL A 112 -10.158 7.277 7.672 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -11.190 6.619 6.769 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -9.484 6.245 8.563 1.00 0.00 C ATOM 0 H VAL A 112 -7.746 6.451 6.697 1.00 0.00 H new ATOM 0 HA VAL A 112 -9.625 8.643 6.090 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.673 7.994 8.311 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.921 6.088 7.379 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.696 7.383 6.178 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.693 5.914 6.102 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -10.240 5.719 9.147 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -8.941 5.530 7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.788 6.745 9.236 1.00 0.00 H new ATOM 1820 N THR A 113 -8.502 10.248 7.618 1.00 0.00 N ATOM 1821 CA THR A 113 -7.789 11.222 8.438 1.00 0.00 C ATOM 1822 C THR A 113 -8.757 12.232 9.046 1.00 0.00 C ATOM 1823 O THR A 113 -9.565 12.835 8.340 1.00 0.00 O ATOM 1824 CB THR A 113 -6.733 11.948 7.603 1.00 0.00 C ATOM 1825 OG1 THR A 113 -7.318 12.529 6.451 1.00 0.00 O ATOM 1826 CG2 THR A 113 -5.610 11.045 7.141 1.00 0.00 C ATOM 0 H THR A 113 -9.152 10.657 6.947 1.00 0.00 H new ATOM 0 HA THR A 113 -7.295 10.686 9.248 1.00 0.00 H new ATOM 0 HB THR A 113 -6.317 12.710 8.262 1.00 0.00 H new ATOM 0 HG1 THR A 113 -6.627 12.990 5.931 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.896 11.623 6.554 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.106 10.619 8.008 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.018 10.242 6.527 1.00 0.00 H new ATOM 1834 N ALA A 114 -8.668 12.412 10.360 1.00 0.00 N ATOM 1835 CA ALA A 114 -9.535 13.350 11.064 1.00 0.00 C ATOM 1836 C ALA A 114 -8.767 14.598 11.484 1.00 0.00 C ATOM 1837 O ALA A 114 -7.650 14.510 11.992 1.00 0.00 O ATOM 1838 CB ALA A 114 -10.161 12.680 12.276 1.00 0.00 C ATOM 0 H ALA A 114 -8.004 11.921 10.959 1.00 0.00 H new ATOM 0 HA ALA A 114 -10.328 13.657 10.382 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.806 13.391 12.792 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.752 11.823 11.953 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -9.375 12.345 12.953 1.00 0.00 H new ATOM 1844 N ARG A 115 -9.374 15.761 11.266 1.00 0.00 N ATOM 1845 CA ARG A 115 -8.747 17.029 11.624 1.00 0.00 C ATOM 1846 C ARG A 115 -9.497 17.702 12.768 1.00 0.00 C ATOM 1847 O ARG A 115 -10.483 18.407 12.548 1.00 0.00 O ATOM 1848 CB ARG A 115 -8.702 17.959 10.410 1.00 0.00 C ATOM 1849 CG ARG A 115 -7.434 17.819 9.583 1.00 0.00 C ATOM 1850 CD ARG A 115 -7.310 18.938 8.562 1.00 0.00 C ATOM 1851 NE ARG A 115 -6.566 18.518 7.377 1.00 0.00 N ATOM 1852 CZ ARG A 115 -5.238 18.437 7.324 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -4.505 18.746 8.386 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -4.642 18.047 6.206 1.00 0.00 N ATOM 0 H ARG A 115 -10.298 15.851 10.844 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.729 16.823 11.953 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.564 17.756 9.775 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -8.792 18.991 10.750 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -6.566 17.828 10.242 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -7.436 16.857 9.071 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -8.305 19.271 8.266 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.811 19.792 9.019 1.00 0.00 H new ATOM 0 HE ARG A 115 -7.095 18.272 6.540 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -4.958 19.047 9.249 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -3.488 18.682 8.340 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.201 17.809 5.386 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -3.625 17.985 6.165 1.00 0.00 H new ATOM 1868 N ASP A 116 -9.024 17.482 13.990 1.00 0.00 N ATOM 1869 CA ASP A 116 -9.650 18.068 15.169 1.00 0.00 C ATOM 1870 C ASP A 116 -9.605 19.591 15.110 1.00 0.00 C ATOM 1871 O ASP A 116 -8.633 20.211 15.542 1.00 0.00 O ATOM 1872 CB ASP A 116 -8.955 17.575 16.440 1.00 0.00 C ATOM 1873 CG ASP A 116 -9.366 16.163 16.813 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -8.699 15.211 16.356 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -10.355 16.011 17.561 1.00 0.00 O ATOM 0 H ASP A 116 -8.209 16.902 14.190 1.00 0.00 H new ATOM 0 HA ASP A 116 -10.694 17.754 15.188 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.875 17.610 16.297 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.190 18.249 17.264 1.00 0.00 H new ATOM 1881 N ASN A 117 -10.663 20.189 14.571 1.00 0.00 N ATOM 1882 CA ASN A 117 -10.743 21.640 14.454 1.00 0.00 C ATOM 1883 C ASN A 117 -12.109 22.147 14.907 1.00 0.00 C ATOM 1884 O ASN A 117 -12.203 23.054 15.733 1.00 0.00 O ATOM 1885 CB ASN A 117 -10.478 22.073 13.012 1.00 0.00 C ATOM 1886 CG ASN A 117 -9.005 22.026 12.656 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -8.150 21.856 13.524 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -8.702 22.177 11.372 1.00 0.00 N ATOM 0 H ASN A 117 -11.476 19.691 14.209 1.00 0.00 H new ATOM 0 HA ASN A 117 -9.981 22.074 15.101 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -11.034 21.426 12.333 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -10.852 23.086 12.865 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -7.727 22.154 11.072 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -9.444 22.316 10.686 1.00 0.00 H new ATOM 1895 N TRP A 118 -13.165 21.554 14.360 1.00 0.00 N ATOM 1896 CA TRP A 118 -14.526 21.945 14.708 1.00 0.00 C ATOM 1897 C TRP A 118 -15.372 20.722 15.049 1.00 0.00 C ATOM 1898 O TRP A 118 -15.864 20.589 16.170 1.00 0.00 O ATOM 1899 CB TRP A 118 -15.168 22.716 13.553 1.00 0.00 C ATOM 1900 CG TRP A 118 -14.926 24.194 13.619 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -13.821 24.865 13.182 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -15.811 25.184 14.155 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -13.964 26.211 13.413 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -15.177 26.433 14.010 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -17.078 25.137 14.744 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -15.767 27.622 14.431 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -17.663 26.318 15.163 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -17.007 27.546 15.004 1.00 0.00 C ATOM 0 H TRP A 118 -13.104 20.801 13.674 1.00 0.00 H new ATOM 0 HA TRP A 118 -14.480 22.590 15.586 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -14.779 22.333 12.609 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -16.242 22.530 13.554 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -12.959 24.404 12.722 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -13.279 26.929 13.178 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -17.591 24.195 14.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -15.264 28.570 14.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -18.641 26.293 15.620 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -17.490 28.451 15.341 1.00 0.00 H new ATOM 1919 N ASN A 119 -15.539 19.833 14.077 1.00 0.00 N ATOM 1920 CA ASN A 119 -16.326 18.621 14.274 1.00 0.00 C ATOM 1921 C ASN A 119 -15.530 17.384 13.873 1.00 0.00 C ATOM 1922 O ASN A 119 -14.368 17.482 13.477 1.00 0.00 O ATOM 1923 CB ASN A 119 -17.622 18.692 13.463 1.00 0.00 C ATOM 1924 CG ASN A 119 -18.673 19.556 14.130 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -18.479 20.756 14.320 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -19.798 18.947 14.490 1.00 0.00 N ATOM 0 H ASN A 119 -15.140 19.929 13.143 1.00 0.00 H new ATOM 0 HA ASN A 119 -16.571 18.546 15.333 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -17.406 19.088 12.471 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -18.017 17.685 13.325 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -20.542 19.477 14.943 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -19.917 17.950 14.313 1.00 0.00 H new ATOM 1933 N TYR A 120 -16.161 16.219 13.979 1.00 0.00 N ATOM 1934 CA TYR A 120 -15.512 14.962 13.627 1.00 0.00 C ATOM 1935 C TYR A 120 -15.946 14.493 12.243 1.00 0.00 C ATOM 1936 O TYR A 120 -16.978 13.838 12.094 1.00 0.00 O ATOM 1937 CB TYR A 120 -15.835 13.888 14.667 1.00 0.00 C ATOM 1938 CG TYR A 120 -14.968 12.655 14.555 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -15.228 11.684 13.597 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -13.889 12.461 15.408 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -14.439 10.555 13.491 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -13.093 11.335 15.309 1.00 0.00 C ATOM 1943 CZ TYR A 120 -13.373 10.386 14.349 1.00 0.00 C ATOM 1944 OH TYR A 120 -12.584 9.262 14.247 1.00 0.00 O ATOM 0 H TYR A 120 -17.122 16.120 14.306 1.00 0.00 H new ATOM 0 HA TYR A 120 -14.435 15.131 13.612 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -15.720 14.313 15.664 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -16.880 13.597 14.564 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.062 11.814 12.923 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.668 13.203 16.161 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -14.656 9.809 12.741 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -12.257 11.200 15.979 1.00 0.00 H new ATOM 0 HH TYR A 120 -11.876 9.297 14.924 1.00 0.00 H new ATOM 1954 N ILE A 121 -15.152 14.833 11.233 1.00 0.00 N ATOM 1955 CA ILE A 121 -15.455 14.447 9.860 1.00 0.00 C ATOM 1956 C ILE A 121 -14.250 13.784 9.197 1.00 0.00 C ATOM 1957 O ILE A 121 -13.391 14.463 8.631 1.00 0.00 O ATOM 1958 CB ILE A 121 -15.884 15.663 9.017 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -14.900 16.819 9.208 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -17.295 16.095 9.390 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -14.632 17.601 7.941 1.00 0.00 C ATOM 0 H ILE A 121 -14.294 15.375 11.340 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.280 13.736 9.906 1.00 0.00 H new ATOM 0 HB ILE A 121 -15.878 15.376 7.965 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.291 17.496 9.967 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -13.958 16.424 9.588 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -17.584 16.955 8.786 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.988 15.274 9.206 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.326 16.366 10.445 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -13.926 18.404 8.152 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -14.211 16.937 7.186 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.565 18.026 7.571 1.00 0.00 H new ATOM 1973 N PRO A 122 -14.168 12.443 9.257 1.00 0.00 N ATOM 1974 CA PRO A 122 -13.058 11.693 8.659 1.00 0.00 C ATOM 1975 C PRO A 122 -12.851 12.041 7.189 1.00 0.00 C ATOM 1976 O PRO A 122 -13.783 12.461 6.502 1.00 0.00 O ATOM 1977 CB PRO A 122 -13.491 10.232 8.806 1.00 0.00 C ATOM 1978 CG PRO A 122 -14.435 10.230 9.958 1.00 0.00 C ATOM 1979 CD PRO A 122 -15.145 11.554 9.912 1.00 0.00 C ATOM 0 HA PRO A 122 -12.108 11.919 9.143 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -13.973 9.869 7.898 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.636 9.583 8.994 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -15.143 9.405 9.881 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.901 10.106 10.900 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -16.074 11.492 9.346 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -15.403 11.907 10.911 1.00 0.00 H new ATOM 1987 N LEU A 123 -11.623 11.862 6.711 1.00 0.00 N ATOM 1988 CA LEU A 123 -11.292 12.157 5.322 1.00 0.00 C ATOM 1989 C LEU A 123 -10.865 10.889 4.584 1.00 0.00 C ATOM 1990 O LEU A 123 -9.681 10.553 4.547 1.00 0.00 O ATOM 1991 CB LEU A 123 -10.177 13.202 5.252 1.00 0.00 C ATOM 1992 CG LEU A 123 -10.653 14.656 5.241 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -11.198 15.050 6.605 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -9.518 15.583 4.830 1.00 0.00 C ATOM 0 H LEU A 123 -10.841 11.514 7.266 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.184 12.555 4.838 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.512 13.060 6.104 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -9.587 13.022 4.354 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.457 14.751 4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -11.532 16.087 6.578 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -12.039 14.405 6.861 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.415 14.940 7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.873 16.614 4.827 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.694 15.485 5.537 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -9.173 15.315 3.831 1.00 0.00 H new ATOM 2006 N PRO A 124 -11.828 10.167 3.985 1.00 0.00 N ATOM 2007 CA PRO A 124 -11.545 8.932 3.247 1.00 0.00 C ATOM 2008 C PRO A 124 -10.841 9.197 1.920 1.00 0.00 C ATOM 2009 O PRO A 124 -11.104 10.198 1.255 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.934 8.340 3.005 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.850 9.513 3.004 1.00 0.00 C ATOM 2012 CD PRO A 124 -13.266 10.497 3.981 1.00 0.00 C ATOM 0 HA PRO A 124 -10.874 8.273 3.797 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.976 7.804 2.057 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -13.203 7.628 3.786 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.924 9.949 2.008 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.858 9.221 3.300 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.441 11.526 3.667 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.706 10.387 4.972 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.946 8.290 1.542 1.00 0.00 N ATOM 2021 CA VAL A 125 -9.204 8.422 0.293 1.00 0.00 C ATOM 2022 C VAL A 125 -8.909 7.056 -0.315 1.00 0.00 C ATOM 2023 O VAL A 125 -8.265 6.213 0.309 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.878 9.176 0.504 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -8.141 10.612 0.932 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -7.012 8.457 1.529 1.00 0.00 C ATOM 0 H VAL A 125 -9.717 7.456 2.082 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.832 8.994 -0.390 1.00 0.00 H new ATOM 0 HB VAL A 125 -7.339 9.197 -0.443 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -7.192 11.128 1.076 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.718 11.122 0.160 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -8.702 10.616 1.867 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.079 9.004 1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.543 8.402 2.480 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.793 7.449 1.177 1.00 0.00 H new ATOM 2036 N LEU A 126 -9.387 6.842 -1.537 1.00 0.00 N ATOM 2037 CA LEU A 126 -9.176 5.575 -2.229 1.00 0.00 C ATOM 2038 C LEU A 126 -8.005 5.673 -3.202 1.00 0.00 C ATOM 2039 O LEU A 126 -7.995 6.522 -4.094 1.00 0.00 O ATOM 2040 CB LEU A 126 -10.448 5.160 -2.973 1.00 0.00 C ATOM 2041 CG LEU A 126 -11.064 3.839 -2.514 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -12.275 3.489 -3.365 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -10.032 2.722 -2.569 1.00 0.00 C ATOM 0 H LEU A 126 -9.923 7.529 -2.068 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.937 4.816 -1.484 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.191 5.949 -2.859 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.221 5.087 -4.037 1.00 0.00 H new ATOM 0 HG LEU A 126 -11.393 3.954 -1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.700 2.545 -3.023 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -13.023 4.277 -3.275 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -11.972 3.394 -4.408 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -10.488 1.789 -2.239 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -9.673 2.608 -3.592 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -9.195 2.968 -1.916 1.00 0.00 H new ATOM 2055 N LEU A 127 -7.022 4.795 -3.026 1.00 0.00 N ATOM 2056 CA LEU A 127 -5.846 4.780 -3.889 1.00 0.00 C ATOM 2057 C LEU A 127 -5.334 3.353 -4.081 1.00 0.00 C ATOM 2058 O LEU A 127 -5.337 2.555 -3.144 1.00 0.00 O ATOM 2059 CB LEU A 127 -4.741 5.655 -3.296 1.00 0.00 C ATOM 2060 CG LEU A 127 -5.201 7.019 -2.778 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -5.639 6.919 -1.326 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -4.091 8.047 -2.933 1.00 0.00 C ATOM 0 H LEU A 127 -7.017 4.085 -2.294 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.132 5.180 -4.862 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.270 5.112 -2.476 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -3.976 5.812 -4.056 1.00 0.00 H new ATOM 0 HG LEU A 127 -6.056 7.343 -3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -5.963 7.899 -0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -6.465 6.213 -1.243 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.804 6.573 -0.717 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.434 9.012 -2.560 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.218 7.728 -2.364 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.825 8.139 -3.986 1.00 0.00 H new ATOM 2074 N PRO A 128 -4.887 3.011 -5.303 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.375 1.676 -5.610 1.00 0.00 C ATOM 2076 C PRO A 128 -2.908 1.510 -5.223 1.00 0.00 C ATOM 2077 O PRO A 128 -2.137 2.469 -5.251 1.00 0.00 O ATOM 2078 CB PRO A 128 -4.540 1.598 -7.125 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.352 3.001 -7.593 1.00 0.00 C ATOM 2080 CD PRO A 128 -4.851 3.895 -6.485 1.00 0.00 C ATOM 0 HA PRO A 128 -4.898 0.893 -5.060 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -3.804 0.929 -7.571 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -5.524 1.217 -7.398 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -3.302 3.200 -7.809 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -4.906 3.180 -8.514 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -4.187 4.745 -6.328 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -5.838 4.299 -6.712 1.00 0.00 H new ATOM 2088 N LEU A 129 -2.530 0.286 -4.866 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.155 -0.005 -4.477 1.00 0.00 C ATOM 2090 C LEU A 129 -0.850 -1.492 -4.628 1.00 0.00 C ATOM 2091 O LEU A 129 -1.715 -2.276 -5.019 1.00 0.00 O ATOM 2092 CB LEU A 129 -0.901 0.435 -3.031 1.00 0.00 C ATOM 2093 CG LEU A 129 -2.043 0.163 -2.048 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -3.175 1.158 -2.255 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -2.552 -1.264 -2.195 1.00 0.00 C ATOM 0 H LEU A 129 -3.156 -0.519 -4.838 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.494 0.554 -5.139 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -0.005 -0.069 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.689 1.504 -3.027 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.658 0.285 -1.036 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -3.977 0.949 -1.547 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.804 2.170 -2.094 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.556 1.069 -3.272 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.363 -1.436 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.918 -1.417 -3.210 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.740 -1.963 -1.993 1.00 0.00 H new ATOM 2107 N ALA A 130 0.384 -1.873 -4.316 1.00 0.00 N ATOM 2108 CA ALA A 130 0.803 -3.266 -4.416 1.00 0.00 C ATOM 2109 C ALA A 130 1.860 -3.599 -3.368 1.00 0.00 C ATOM 2110 O ALA A 130 2.314 -2.723 -2.631 1.00 0.00 O ATOM 2111 CB ALA A 130 1.333 -3.558 -5.812 1.00 0.00 C ATOM 0 H ALA A 130 1.112 -1.236 -3.992 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.067 -3.895 -4.229 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.642 -4.601 -5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.549 -3.368 -6.546 1.00 0.00 H new ATOM 0 HB3 ALA A 130 2.187 -2.914 -6.019 1.00 0.00 H new ATOM 2117 N SER A 131 2.245 -4.868 -3.305 1.00 0.00 N ATOM 2118 CA SER A 131 3.248 -5.316 -2.346 1.00 0.00 C ATOM 2119 C SER A 131 3.863 -6.643 -2.779 1.00 0.00 C ATOM 2120 O SER A 131 3.169 -7.653 -2.889 1.00 0.00 O ATOM 2121 CB SER A 131 2.628 -5.458 -0.955 1.00 0.00 C ATOM 2122 OG SER A 131 3.623 -5.679 0.028 1.00 0.00 O ATOM 0 H SER A 131 1.878 -5.605 -3.907 1.00 0.00 H new ATOM 0 HA SER A 131 4.038 -4.566 -2.309 1.00 0.00 H new ATOM 0 HB2 SER A 131 2.065 -4.557 -0.711 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.920 -6.287 -0.952 1.00 0.00 H new ATOM 0 HG SER A 131 3.200 -5.764 0.908 1.00 0.00 H new ATOM 2128 N VAL A 132 5.169 -6.633 -3.025 1.00 0.00 N ATOM 2129 CA VAL A 132 5.878 -7.836 -3.446 1.00 0.00 C ATOM 2130 C VAL A 132 7.281 -7.884 -2.850 1.00 0.00 C ATOM 2131 O VAL A 132 8.014 -6.894 -2.879 1.00 0.00 O ATOM 2132 CB VAL A 132 5.976 -7.920 -4.983 1.00 0.00 C ATOM 2133 CG1 VAL A 132 6.733 -6.723 -5.538 1.00 0.00 C ATOM 2134 CG2 VAL A 132 6.637 -9.222 -5.410 1.00 0.00 C ATOM 0 H VAL A 132 5.758 -5.805 -2.940 1.00 0.00 H new ATOM 0 HA VAL A 132 5.305 -8.688 -3.080 1.00 0.00 H new ATOM 0 HB VAL A 132 4.965 -7.903 -5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.791 -6.801 -6.624 1.00 0.00 H new ATOM 0 HG12 VAL A 132 6.211 -5.805 -5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.740 -6.704 -5.121 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.696 -9.260 -6.498 1.00 0.00 H new ATOM 0 HG22 VAL A 132 7.641 -9.275 -4.990 1.00 0.00 H new ATOM 0 HG23 VAL A 132 6.048 -10.065 -5.049 1.00 0.00 H new ATOM 2144 N GLY A 133 7.650 -9.040 -2.309 1.00 0.00 N ATOM 2145 CA GLY A 133 8.965 -9.196 -1.714 1.00 0.00 C ATOM 2146 C GLY A 133 9.187 -10.585 -1.150 1.00 0.00 C ATOM 2147 O GLY A 133 8.426 -11.509 -1.440 1.00 0.00 O ATOM 0 H GLY A 133 7.062 -9.872 -2.272 1.00 0.00 H new ATOM 0 HA2 GLY A 133 9.727 -8.986 -2.465 1.00 0.00 H new ATOM 0 HA3 GLY A 133 9.090 -8.461 -0.919 1.00 0.00 H new ATOM 2151 N TYR A 134 10.233 -10.735 -0.343 1.00 0.00 N ATOM 2152 CA TYR A 134 10.553 -12.023 0.261 1.00 0.00 C ATOM 2153 C TYR A 134 11.144 -11.839 1.655 1.00 0.00 C ATOM 2154 O TYR A 134 11.841 -10.859 1.922 1.00 0.00 O ATOM 2155 CB TYR A 134 11.529 -12.799 -0.623 1.00 0.00 C ATOM 2156 CG TYR A 134 12.803 -12.044 -0.929 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.841 -11.084 -1.933 1.00 0.00 C ATOM 2158 CD2 TYR A 134 13.969 -12.292 -0.215 1.00 0.00 C ATOM 2159 CE1 TYR A 134 14.004 -10.392 -2.216 1.00 0.00 C ATOM 2160 CE2 TYR A 134 15.135 -11.603 -0.491 1.00 0.00 C ATOM 2161 CZ TYR A 134 15.148 -10.656 -1.492 1.00 0.00 C ATOM 2162 OH TYR A 134 16.307 -9.970 -1.771 1.00 0.00 O ATOM 0 H TYR A 134 10.873 -9.981 -0.093 1.00 0.00 H new ATOM 0 HA TYR A 134 9.628 -12.592 0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.783 -13.738 -0.132 1.00 0.00 H new ATOM 0 HB3 TYR A 134 11.034 -13.053 -1.560 1.00 0.00 H new ATOM 0 HD1 TYR A 134 11.947 -10.875 -2.502 1.00 0.00 H new ATOM 0 HD2 TYR A 134 13.964 -13.035 0.568 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.017 -9.649 -3.000 1.00 0.00 H new ATOM 0 HE2 TYR A 134 16.032 -11.806 0.075 1.00 0.00 H new ATOM 0 HH TYR A 134 17.019 -10.274 -1.170 1.00 0.00 H new ATOM 2172 N GLY A 135 10.863 -12.789 2.541 1.00 0.00 N ATOM 2173 CA GLY A 135 11.375 -12.714 3.897 1.00 0.00 C ATOM 2174 C GLY A 135 10.929 -11.456 4.618 1.00 0.00 C ATOM 2175 O GLY A 135 9.859 -10.919 4.329 1.00 0.00 O ATOM 0 H GLY A 135 10.290 -13.609 2.344 1.00 0.00 H new ATOM 0 HA2 GLY A 135 11.041 -13.587 4.457 1.00 0.00 H new ATOM 0 HA3 GLY A 135 12.464 -12.748 3.873 1.00 0.00 H new ATOM 2179 N PRO A 136 11.735 -10.957 5.570 1.00 0.00 N ATOM 2180 CA PRO A 136 11.404 -9.747 6.331 1.00 0.00 C ATOM 2181 C PRO A 136 11.525 -8.476 5.494 1.00 0.00 C ATOM 2182 O PRO A 136 11.150 -7.392 5.942 1.00 0.00 O ATOM 2183 CB PRO A 136 12.440 -9.744 7.456 1.00 0.00 C ATOM 2184 CG PRO A 136 13.604 -10.487 6.898 1.00 0.00 C ATOM 2185 CD PRO A 136 13.030 -11.533 5.982 1.00 0.00 C ATOM 0 HA PRO A 136 10.371 -9.757 6.679 1.00 0.00 H new ATOM 0 HB2 PRO A 136 12.716 -8.728 7.737 1.00 0.00 H new ATOM 0 HB3 PRO A 136 12.053 -10.229 8.352 1.00 0.00 H new ATOM 0 HG2 PRO A 136 14.270 -9.817 6.355 1.00 0.00 H new ATOM 0 HG3 PRO A 136 14.192 -10.945 7.693 1.00 0.00 H new ATOM 0 HD2 PRO A 136 13.679 -11.716 5.125 1.00 0.00 H new ATOM 0 HD3 PRO A 136 12.901 -12.487 6.493 1.00 0.00 H new ATOM 2193 N VAL A 137 12.048 -8.610 4.277 1.00 0.00 N ATOM 2194 CA VAL A 137 12.211 -7.466 3.389 1.00 0.00 C ATOM 2195 C VAL A 137 11.193 -7.502 2.253 1.00 0.00 C ATOM 2196 O VAL A 137 11.202 -8.416 1.427 1.00 0.00 O ATOM 2197 CB VAL A 137 13.634 -7.409 2.796 1.00 0.00 C ATOM 2198 CG1 VAL A 137 13.920 -8.644 1.953 1.00 0.00 C ATOM 2199 CG2 VAL A 137 13.823 -6.141 1.976 1.00 0.00 C ATOM 0 H VAL A 137 12.365 -9.497 3.886 1.00 0.00 H new ATOM 0 HA VAL A 137 12.045 -6.572 3.991 1.00 0.00 H new ATOM 0 HB VAL A 137 14.346 -7.392 3.622 1.00 0.00 H new ATOM 0 HG11 VAL A 137 14.929 -8.581 1.546 1.00 0.00 H new ATOM 0 HG12 VAL A 137 13.834 -9.536 2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 137 13.202 -8.701 1.135 1.00 0.00 H new ATOM 0 HG21 VAL A 137 14.833 -6.120 1.566 1.00 0.00 H new ATOM 0 HG22 VAL A 137 13.100 -6.124 1.160 1.00 0.00 H new ATOM 0 HG23 VAL A 137 13.671 -5.270 2.613 1.00 0.00 H new ATOM 2209 N THR A 138 10.317 -6.504 2.219 1.00 0.00 N ATOM 2210 CA THR A 138 9.292 -6.422 1.184 1.00 0.00 C ATOM 2211 C THR A 138 9.142 -4.991 0.679 1.00 0.00 C ATOM 2212 O THR A 138 9.319 -4.034 1.433 1.00 0.00 O ATOM 2213 CB THR A 138 7.953 -6.930 1.721 1.00 0.00 C ATOM 2214 OG1 THR A 138 6.898 -6.592 0.838 1.00 0.00 O ATOM 2215 CG2 THR A 138 7.605 -6.375 3.085 1.00 0.00 C ATOM 0 H THR A 138 10.296 -5.741 2.895 1.00 0.00 H new ATOM 0 HA THR A 138 9.602 -7.051 0.350 1.00 0.00 H new ATOM 0 HB THR A 138 8.067 -8.011 1.805 1.00 0.00 H new ATOM 0 HG1 THR A 138 6.050 -6.927 1.198 1.00 0.00 H new ATOM 0 HG21 THR A 138 6.644 -6.776 3.406 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.375 -6.661 3.801 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.545 -5.288 3.031 1.00 0.00 H new ATOM 2223 N PHE A 139 8.814 -4.852 -0.602 1.00 0.00 N ATOM 2224 CA PHE A 139 8.640 -3.537 -1.207 1.00 0.00 C ATOM 2225 C PHE A 139 7.169 -3.265 -1.505 1.00 0.00 C ATOM 2226 O PHE A 139 6.425 -4.168 -1.888 1.00 0.00 O ATOM 2227 CB PHE A 139 9.460 -3.432 -2.494 1.00 0.00 C ATOM 2228 CG PHE A 139 10.882 -3.006 -2.267 1.00 0.00 C ATOM 2229 CD1 PHE A 139 11.211 -1.663 -2.188 1.00 0.00 C ATOM 2230 CD2 PHE A 139 11.888 -3.949 -2.133 1.00 0.00 C ATOM 2231 CE1 PHE A 139 12.519 -1.268 -1.979 1.00 0.00 C ATOM 2232 CE2 PHE A 139 13.197 -3.559 -1.924 1.00 0.00 C ATOM 2233 CZ PHE A 139 13.513 -2.217 -1.847 1.00 0.00 C ATOM 0 H PHE A 139 8.664 -5.633 -1.240 1.00 0.00 H new ATOM 0 HA PHE A 139 8.993 -2.789 -0.497 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.455 -4.398 -2.998 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.979 -2.720 -3.165 1.00 0.00 H new ATOM 0 HD1 PHE A 139 10.437 -0.916 -2.291 1.00 0.00 H new ATOM 0 HD2 PHE A 139 11.647 -5.000 -2.193 1.00 0.00 H new ATOM 0 HE1 PHE A 139 12.763 -0.218 -1.919 1.00 0.00 H new ATOM 0 HE2 PHE A 139 13.973 -4.303 -1.821 1.00 0.00 H new ATOM 0 HZ PHE A 139 14.536 -1.910 -1.684 1.00 0.00 H new ATOM 2243 N GLN A 140 6.756 -2.014 -1.328 1.00 0.00 N ATOM 2244 CA GLN A 140 5.374 -1.622 -1.580 1.00 0.00 C ATOM 2245 C GLN A 140 5.305 -0.500 -2.610 1.00 0.00 C ATOM 2246 O GLN A 140 5.936 0.545 -2.448 1.00 0.00 O ATOM 2247 CB GLN A 140 4.703 -1.176 -0.279 1.00 0.00 C ATOM 2248 CG GLN A 140 3.231 -0.835 -0.440 1.00 0.00 C ATOM 2249 CD GLN A 140 2.654 -0.150 0.784 1.00 0.00 C ATOM 2250 OE1 GLN A 140 3.342 0.603 1.472 1.00 0.00 O ATOM 2251 NE2 GLN A 140 1.381 -0.412 1.062 1.00 0.00 N ATOM 0 H GLN A 140 7.359 -1.255 -1.011 1.00 0.00 H new ATOM 0 HA GLN A 140 4.844 -2.488 -1.977 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.805 -1.968 0.463 1.00 0.00 H new ATOM 0 HB3 GLN A 140 5.229 -0.305 0.111 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.105 -0.187 -1.308 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.670 -1.748 -0.639 1.00 0.00 H new ATOM 0 HE21 GLN A 140 0.848 -1.043 0.464 1.00 0.00 H new ATOM 0 HE22 GLN A 140 0.937 0.018 1.874 1.00 0.00 H new ATOM 2260 N MET A 141 4.536 -0.723 -3.671 1.00 0.00 N ATOM 2261 CA MET A 141 4.385 0.269 -4.728 1.00 0.00 C ATOM 2262 C MET A 141 3.013 0.931 -4.660 1.00 0.00 C ATOM 2263 O MET A 141 2.062 0.360 -4.126 1.00 0.00 O ATOM 2264 CB MET A 141 4.583 -0.382 -6.099 1.00 0.00 C ATOM 2265 CG MET A 141 6.033 -0.713 -6.410 1.00 0.00 C ATOM 2266 SD MET A 141 7.018 0.752 -6.777 1.00 0.00 S ATOM 2267 CE MET A 141 6.432 1.150 -8.422 1.00 0.00 C ATOM 0 H MET A 141 4.008 -1.583 -3.821 1.00 0.00 H new ATOM 0 HA MET A 141 5.146 1.036 -4.584 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.992 -1.296 -6.147 1.00 0.00 H new ATOM 0 HB3 MET A 141 4.198 0.287 -6.869 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.472 -1.237 -5.561 1.00 0.00 H new ATOM 0 HG3 MET A 141 6.072 -1.394 -7.260 1.00 0.00 H new ATOM 0 HE1 MET A 141 7.117 1.856 -8.892 1.00 0.00 H new ATOM 0 HE2 MET A 141 6.382 0.240 -9.020 1.00 0.00 H new ATOM 0 HE3 MET A 141 5.440 1.597 -8.357 1.00 0.00 H new ATOM 2277 N THR A 142 2.917 2.139 -5.207 1.00 0.00 N ATOM 2278 CA THR A 142 1.661 2.880 -5.208 1.00 0.00 C ATOM 2279 C THR A 142 1.468 3.618 -6.529 1.00 0.00 C ATOM 2280 O THR A 142 2.288 4.452 -6.910 1.00 0.00 O ATOM 2281 CB THR A 142 1.629 3.873 -4.045 1.00 0.00 C ATOM 2282 OG1 THR A 142 0.377 4.534 -3.987 1.00 0.00 O ATOM 2283 CG2 THR A 142 2.705 4.933 -4.133 1.00 0.00 C ATOM 0 H THR A 142 3.694 2.625 -5.655 1.00 0.00 H new ATOM 0 HA THR A 142 0.846 2.166 -5.088 1.00 0.00 H new ATOM 0 HB THR A 142 1.803 3.277 -3.150 1.00 0.00 H new ATOM 0 HG1 THR A 142 0.374 5.164 -3.236 1.00 0.00 H new ATOM 0 HG21 THR A 142 2.625 5.604 -3.278 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.686 4.457 -4.131 1.00 0.00 H new ATOM 0 HG23 THR A 142 2.580 5.503 -5.054 1.00 0.00 H new ATOM 2291 N TYR A 143 0.378 3.305 -7.222 1.00 0.00 N ATOM 2292 CA TYR A 143 0.077 3.939 -8.501 1.00 0.00 C ATOM 2293 C TYR A 143 -0.960 5.044 -8.330 1.00 0.00 C ATOM 2294 O TYR A 143 -1.742 5.033 -7.380 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.428 2.900 -9.503 1.00 0.00 C ATOM 2296 CG TYR A 143 0.556 1.782 -9.764 1.00 0.00 C ATOM 2297 CD1 TYR A 143 0.702 0.733 -8.864 1.00 0.00 C ATOM 2298 CD2 TYR A 143 1.340 1.774 -10.911 1.00 0.00 C ATOM 2299 CE1 TYR A 143 1.600 -0.290 -9.099 1.00 0.00 C ATOM 2300 CE2 TYR A 143 2.240 0.755 -11.154 1.00 0.00 C ATOM 2301 CZ TYR A 143 2.366 -0.275 -10.245 1.00 0.00 C ATOM 2302 OH TYR A 143 3.261 -1.292 -10.483 1.00 0.00 O ATOM 0 H TYR A 143 -0.311 2.617 -6.920 1.00 0.00 H new ATOM 0 HA TYR A 143 0.996 4.384 -8.882 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -1.360 2.473 -9.132 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -0.658 3.398 -10.445 1.00 0.00 H new ATOM 0 HD1 TYR A 143 0.103 0.717 -7.965 1.00 0.00 H new ATOM 0 HD2 TYR A 143 1.244 2.579 -11.625 1.00 0.00 H new ATOM 0 HE1 TYR A 143 1.701 -1.097 -8.389 1.00 0.00 H new ATOM 0 HE2 TYR A 143 2.842 0.764 -12.051 1.00 0.00 H new ATOM 0 HH TYR A 143 3.720 -1.131 -11.334 1.00 0.00 H new ATOM 2312 N ILE A 144 -0.959 5.997 -9.256 1.00 0.00 N ATOM 2313 CA ILE A 144 -1.901 7.109 -9.208 1.00 0.00 C ATOM 2314 C ILE A 144 -3.081 6.870 -10.149 1.00 0.00 C ATOM 2315 O ILE A 144 -2.894 6.469 -11.298 1.00 0.00 O ATOM 2316 CB ILE A 144 -1.214 8.439 -9.581 1.00 0.00 C ATOM 2317 CG1 ILE A 144 -2.179 9.612 -9.393 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -0.700 8.392 -11.013 1.00 0.00 C ATOM 2319 CD1 ILE A 144 -2.213 10.145 -7.977 1.00 0.00 C ATOM 0 H ILE A 144 -0.317 6.022 -10.048 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.268 7.174 -8.184 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.362 8.585 -8.916 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -1.895 10.418 -10.069 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -3.182 9.296 -9.678 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -0.219 9.339 -11.258 1.00 0.00 H new ATOM 0 HG22 ILE A 144 0.021 7.581 -11.114 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -1.534 8.222 -11.694 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -2.918 10.974 -7.917 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -2.527 9.353 -7.297 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -1.219 10.492 -7.695 1.00 0.00 H new ATOM 2331 N PRO A 145 -4.317 7.111 -9.676 1.00 0.00 N ATOM 2332 CA PRO A 145 -5.523 6.916 -10.488 1.00 0.00 C ATOM 2333 C PRO A 145 -5.643 7.950 -11.602 1.00 0.00 C ATOM 2334 O PRO A 145 -5.428 9.142 -11.383 1.00 0.00 O ATOM 2335 CB PRO A 145 -6.663 7.082 -9.481 1.00 0.00 C ATOM 2336 CG PRO A 145 -6.096 7.946 -8.407 1.00 0.00 C ATOM 2337 CD PRO A 145 -4.638 7.591 -8.317 1.00 0.00 C ATOM 0 HA PRO A 145 -5.521 5.950 -10.993 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -7.535 7.545 -9.943 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -6.985 6.119 -9.086 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -6.227 9.002 -8.646 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -6.600 7.769 -7.457 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -4.031 8.453 -8.042 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -4.458 6.822 -7.566 1.00 0.00 H new ATOM 2345 N GLY A 146 -5.987 7.486 -12.799 1.00 0.00 N ATOM 2346 CA GLY A 146 -6.130 8.384 -13.930 1.00 0.00 C ATOM 2347 C GLY A 146 -4.806 8.981 -14.366 1.00 0.00 C ATOM 2348 O GLY A 146 -4.062 9.522 -13.548 1.00 0.00 O ATOM 0 H GLY A 146 -6.169 6.504 -13.006 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -6.574 7.843 -14.766 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -6.819 9.187 -13.668 1.00 0.00 H new ATOM 2352 N THR A 147 -4.512 8.883 -15.658 1.00 0.00 N ATOM 2353 CA THR A 147 -3.270 9.418 -16.202 1.00 0.00 C ATOM 2354 C THR A 147 -3.491 9.999 -17.595 1.00 0.00 C ATOM 2355 O THR A 147 -3.179 9.364 -18.602 1.00 0.00 O ATOM 2356 CB THR A 147 -2.200 8.326 -16.258 1.00 0.00 C ATOM 2357 OG1 THR A 147 -1.011 8.818 -16.850 1.00 0.00 O ATOM 2358 CG2 THR A 147 -2.632 7.104 -17.040 1.00 0.00 C ATOM 0 H THR A 147 -5.117 8.438 -16.348 1.00 0.00 H new ATOM 0 HA THR A 147 -2.930 10.217 -15.543 1.00 0.00 H new ATOM 0 HB THR A 147 -2.032 8.033 -15.222 1.00 0.00 H new ATOM 0 HG1 THR A 147 -0.398 8.073 -17.021 1.00 0.00 H new ATOM 0 HG21 THR A 147 -1.827 6.369 -17.040 1.00 0.00 H new ATOM 0 HG22 THR A 147 -3.519 6.671 -16.577 1.00 0.00 H new ATOM 0 HG23 THR A 147 -2.862 7.391 -18.066 1.00 0.00 H new ATOM 2366 N TYR A 148 -4.034 11.212 -17.646 1.00 0.00 N ATOM 2367 CA TYR A 148 -4.297 11.879 -18.915 1.00 0.00 C ATOM 2368 C TYR A 148 -2.996 12.282 -19.600 1.00 0.00 C ATOM 2369 O TYR A 148 -2.182 13.008 -19.029 1.00 0.00 O ATOM 2370 CB TYR A 148 -5.175 13.113 -18.694 1.00 0.00 C ATOM 2371 CG TYR A 148 -4.606 14.089 -17.689 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -3.712 15.078 -18.082 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -4.964 14.023 -16.348 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -3.190 15.972 -17.166 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -4.446 14.914 -15.427 1.00 0.00 C ATOM 2376 CZ TYR A 148 -3.560 15.886 -15.841 1.00 0.00 C ATOM 2377 OH TYR A 148 -3.043 16.775 -14.927 1.00 0.00 O ATOM 0 H TYR A 148 -4.300 11.752 -16.823 1.00 0.00 H new ATOM 0 HA TYR A 148 -4.823 11.178 -19.562 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -5.314 13.625 -19.646 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -6.161 12.792 -18.358 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -3.421 15.149 -19.119 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -5.658 13.263 -16.020 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -2.496 16.734 -17.487 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -4.734 14.849 -14.388 1.00 0.00 H new ATOM 0 HH TYR A 148 -3.406 16.578 -14.038 1.00 0.00 H new ATOM 2387 N ASN A 149 -2.808 11.806 -20.828 1.00 0.00 N ATOM 2388 CA ASN A 149 -1.606 12.113 -21.599 1.00 0.00 C ATOM 2389 C ASN A 149 -0.376 11.452 -20.982 1.00 0.00 C ATOM 2390 O ASN A 149 0.203 10.534 -21.562 1.00 0.00 O ATOM 2391 CB ASN A 149 -1.397 13.627 -21.685 1.00 0.00 C ATOM 2392 CG ASN A 149 -2.655 14.361 -22.106 1.00 0.00 C ATOM 2393 OD1 ASN A 149 -3.048 15.350 -21.489 1.00 0.00 O ATOM 2394 ND2 ASN A 149 -3.296 13.877 -23.164 1.00 0.00 N ATOM 0 H ASN A 149 -3.475 11.204 -21.312 1.00 0.00 H new ATOM 0 HA ASN A 149 -1.743 11.716 -22.605 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -1.068 14.001 -20.715 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.599 13.841 -22.396 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -4.149 14.328 -23.494 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -2.935 13.054 -23.647 1.00 0.00 H new ATOM 2401 N ASN A 150 0.017 11.923 -19.803 1.00 0.00 N ATOM 2402 CA ASN A 150 1.178 11.375 -19.110 1.00 0.00 C ATOM 2403 C ASN A 150 1.284 11.942 -17.698 1.00 0.00 C ATOM 2404 O ASN A 150 0.414 12.689 -17.250 1.00 0.00 O ATOM 2405 CB ASN A 150 2.456 11.681 -19.893 1.00 0.00 C ATOM 2406 CG ASN A 150 2.846 10.553 -20.827 1.00 0.00 C ATOM 2407 OD1 ASN A 150 2.653 10.640 -22.040 1.00 0.00 O ATOM 2408 ND2 ASN A 150 3.398 9.483 -20.265 1.00 0.00 N ATOM 0 H ASN A 150 -0.451 12.682 -19.308 1.00 0.00 H new ATOM 0 HA ASN A 150 1.053 10.294 -19.040 1.00 0.00 H new ATOM 0 HB2 ASN A 150 2.315 12.595 -20.470 1.00 0.00 H new ATOM 0 HB3 ASN A 150 3.271 11.868 -19.194 1.00 0.00 H new ATOM 0 HD21 ASN A 150 3.680 8.692 -20.843 1.00 0.00 H new ATOM 0 HD22 ASN A 150 3.540 9.453 -19.255 1.00 0.00 H new ATOM 2415 N GLY A 151 2.358 11.583 -17.001 1.00 0.00 N ATOM 2416 CA GLY A 151 2.559 12.065 -15.647 1.00 0.00 C ATOM 2417 C GLY A 151 2.286 10.999 -14.604 1.00 0.00 C ATOM 2418 O GLY A 151 1.899 11.309 -13.477 1.00 0.00 O ATOM 0 H GLY A 151 3.092 10.967 -17.350 1.00 0.00 H new ATOM 0 HA2 GLY A 151 3.584 12.420 -15.540 1.00 0.00 H new ATOM 0 HA3 GLY A 151 1.906 12.919 -15.468 1.00 0.00 H new ATOM 2422 N ASN A 152 2.487 9.741 -14.980 1.00 0.00 N ATOM 2423 CA ASN A 152 2.260 8.625 -14.067 1.00 0.00 C ATOM 2424 C ASN A 152 3.263 8.651 -12.919 1.00 0.00 C ATOM 2425 O ASN A 152 4.428 8.291 -13.091 1.00 0.00 O ATOM 2426 CB ASN A 152 2.359 7.296 -14.818 1.00 0.00 C ATOM 2427 CG ASN A 152 1.445 6.235 -14.238 1.00 0.00 C ATOM 2428 OD1 ASN A 152 1.861 5.426 -13.408 1.00 0.00 O ATOM 2429 ND2 ASN A 152 0.190 6.233 -14.674 1.00 0.00 N ATOM 0 H ASN A 152 2.806 9.468 -15.909 1.00 0.00 H new ATOM 0 HA ASN A 152 1.257 8.725 -13.652 1.00 0.00 H new ATOM 0 HB2 ASN A 152 2.107 7.455 -15.867 1.00 0.00 H new ATOM 0 HB3 ASN A 152 3.389 6.941 -14.788 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -0.472 5.542 -14.320 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -0.112 6.922 -15.363 1.00 0.00 H new ATOM 2436 N VAL A 153 2.803 9.079 -11.747 1.00 0.00 N ATOM 2437 CA VAL A 153 3.660 9.151 -10.571 1.00 0.00 C ATOM 2438 C VAL A 153 3.531 7.894 -9.718 1.00 0.00 C ATOM 2439 O VAL A 153 2.424 7.460 -9.397 1.00 0.00 O ATOM 2440 CB VAL A 153 3.327 10.381 -9.707 1.00 0.00 C ATOM 2441 CG1 VAL A 153 3.797 11.657 -10.389 1.00 0.00 C ATOM 2442 CG2 VAL A 153 1.835 10.441 -9.416 1.00 0.00 C ATOM 0 H VAL A 153 1.842 9.381 -11.588 1.00 0.00 H new ATOM 0 HA VAL A 153 4.685 9.237 -10.932 1.00 0.00 H new ATOM 0 HB VAL A 153 3.855 10.289 -8.758 1.00 0.00 H new ATOM 0 HG11 VAL A 153 3.553 12.515 -9.763 1.00 0.00 H new ATOM 0 HG12 VAL A 153 4.876 11.613 -10.540 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.300 11.758 -11.354 1.00 0.00 H new ATOM 0 HG21 VAL A 153 1.619 11.317 -8.804 1.00 0.00 H new ATOM 0 HG22 VAL A 153 1.284 10.508 -10.354 1.00 0.00 H new ATOM 0 HG23 VAL A 153 1.532 9.541 -8.881 1.00 0.00 H new ATOM 2452 N TYR A 154 4.669 7.314 -9.352 1.00 0.00 N ATOM 2453 CA TYR A 154 4.684 6.106 -8.536 1.00 0.00 C ATOM 2454 C TYR A 154 5.642 6.256 -7.359 1.00 0.00 C ATOM 2455 O TYR A 154 6.756 6.757 -7.513 1.00 0.00 O ATOM 2456 CB TYR A 154 5.087 4.898 -9.383 1.00 0.00 C ATOM 2457 CG TYR A 154 6.285 5.153 -10.270 1.00 0.00 C ATOM 2458 CD1 TYR A 154 7.567 5.209 -9.739 1.00 0.00 C ATOM 2459 CD2 TYR A 154 6.133 5.340 -11.638 1.00 0.00 C ATOM 2460 CE1 TYR A 154 8.665 5.443 -10.546 1.00 0.00 C ATOM 2461 CE2 TYR A 154 7.226 5.574 -12.452 1.00 0.00 C ATOM 2462 CZ TYR A 154 8.488 5.625 -11.900 1.00 0.00 C ATOM 2463 OH TYR A 154 9.578 5.858 -12.707 1.00 0.00 O ATOM 0 H TYR A 154 5.593 7.661 -9.608 1.00 0.00 H new ATOM 0 HA TYR A 154 3.678 5.950 -8.146 1.00 0.00 H new ATOM 0 HB2 TYR A 154 5.306 4.059 -8.723 1.00 0.00 H new ATOM 0 HB3 TYR A 154 4.242 4.602 -10.004 1.00 0.00 H new ATOM 0 HD1 TYR A 154 7.709 5.067 -8.678 1.00 0.00 H new ATOM 0 HD2 TYR A 154 5.145 5.302 -12.073 1.00 0.00 H new ATOM 0 HE1 TYR A 154 9.656 5.483 -10.117 1.00 0.00 H new ATOM 0 HE2 TYR A 154 7.092 5.716 -13.514 1.00 0.00 H new ATOM 0 HH TYR A 154 9.281 5.963 -13.635 1.00 0.00 H new ATOM 2473 N PHE A 155 5.202 5.821 -6.184 1.00 0.00 N ATOM 2474 CA PHE A 155 6.020 5.907 -4.980 1.00 0.00 C ATOM 2475 C PHE A 155 6.337 4.517 -4.436 1.00 0.00 C ATOM 2476 O PHE A 155 5.663 3.542 -4.767 1.00 0.00 O ATOM 2477 CB PHE A 155 5.306 6.738 -3.910 1.00 0.00 C ATOM 2478 CG PHE A 155 6.117 7.901 -3.414 1.00 0.00 C ATOM 2479 CD1 PHE A 155 6.038 9.135 -4.041 1.00 0.00 C ATOM 2480 CD2 PHE A 155 6.957 7.761 -2.321 1.00 0.00 C ATOM 2481 CE1 PHE A 155 6.783 10.207 -3.586 1.00 0.00 C ATOM 2482 CE2 PHE A 155 7.704 8.830 -1.862 1.00 0.00 C ATOM 2483 CZ PHE A 155 7.616 10.054 -2.496 1.00 0.00 C ATOM 0 H PHE A 155 4.282 5.405 -6.039 1.00 0.00 H new ATOM 0 HA PHE A 155 6.958 6.396 -5.243 1.00 0.00 H new ATOM 0 HB2 PHE A 155 4.365 7.109 -4.317 1.00 0.00 H new ATOM 0 HB3 PHE A 155 5.057 6.093 -3.067 1.00 0.00 H new ATOM 0 HD1 PHE A 155 5.388 9.260 -4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 155 7.029 6.806 -1.822 1.00 0.00 H new ATOM 0 HE1 PHE A 155 6.713 11.163 -4.083 1.00 0.00 H new ATOM 0 HE2 PHE A 155 8.355 8.708 -1.009 1.00 0.00 H new ATOM 0 HZ PHE A 155 8.198 10.891 -2.139 1.00 0.00 H new ATOM 2493 N ALA A 156 7.368 4.434 -3.601 1.00 0.00 N ATOM 2494 CA ALA A 156 7.774 3.164 -3.012 1.00 0.00 C ATOM 2495 C ALA A 156 8.091 3.325 -1.529 1.00 0.00 C ATOM 2496 O ALA A 156 8.722 4.300 -1.121 1.00 0.00 O ATOM 2497 CB ALA A 156 8.978 2.601 -3.753 1.00 0.00 C ATOM 0 H ALA A 156 7.937 5.232 -3.317 1.00 0.00 H new ATOM 0 HA ALA A 156 6.943 2.464 -3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.271 1.652 -3.303 1.00 0.00 H new ATOM 0 HB2 ALA A 156 8.719 2.442 -4.800 1.00 0.00 H new ATOM 0 HB3 ALA A 156 9.807 3.305 -3.688 1.00 0.00 H new ATOM 2503 N TRP A 157 7.647 2.362 -0.728 1.00 0.00 N ATOM 2504 CA TRP A 157 7.882 2.398 0.712 1.00 0.00 C ATOM 2505 C TRP A 157 8.469 1.078 1.201 1.00 0.00 C ATOM 2506 O TRP A 157 8.226 0.023 0.612 1.00 0.00 O ATOM 2507 CB TRP A 157 6.580 2.698 1.456 1.00 0.00 C ATOM 2508 CG TRP A 157 5.805 3.835 0.863 1.00 0.00 C ATOM 2509 CD1 TRP A 157 4.862 3.760 -0.121 1.00 0.00 C ATOM 2510 CD2 TRP A 157 5.910 5.219 1.216 1.00 0.00 C ATOM 2511 NE1 TRP A 157 4.372 5.013 -0.401 1.00 0.00 N ATOM 2512 CE2 TRP A 157 4.999 5.926 0.407 1.00 0.00 C ATOM 2513 CE3 TRP A 157 6.684 5.930 2.138 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 4.844 7.307 0.492 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 6.527 7.301 2.222 1.00 0.00 C ATOM 2516 CH2 TRP A 157 5.614 7.977 1.404 1.00 0.00 C ATOM 0 H TRP A 157 7.123 1.548 -1.050 1.00 0.00 H new ATOM 0 HA TRP A 157 8.600 3.192 0.917 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.956 1.804 1.457 1.00 0.00 H new ATOM 0 HB3 TRP A 157 6.809 2.928 2.497 1.00 0.00 H new ATOM 0 HD1 TRP A 157 4.547 2.849 -0.608 1.00 0.00 H new ATOM 0 HE1 TRP A 157 3.658 5.229 -1.097 1.00 0.00 H new ATOM 0 HE3 TRP A 157 7.392 5.418 2.773 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 4.141 7.831 -0.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 7.119 7.860 2.931 1.00 0.00 H new ATOM 0 HH2 TRP A 157 5.515 9.049 1.494 1.00 0.00 H new ATOM 2527 N MET A 158 9.242 1.142 2.280 1.00 0.00 N ATOM 2528 CA MET A 158 9.863 -0.049 2.847 1.00 0.00 C ATOM 2529 C MET A 158 8.990 -0.648 3.945 1.00 0.00 C ATOM 2530 O MET A 158 8.465 0.071 4.795 1.00 0.00 O ATOM 2531 CB MET A 158 11.246 0.289 3.407 1.00 0.00 C ATOM 2532 CG MET A 158 12.348 0.270 2.359 1.00 0.00 C ATOM 2533 SD MET A 158 12.816 -1.402 1.875 1.00 0.00 S ATOM 2534 CE MET A 158 14.386 -1.093 1.070 1.00 0.00 C ATOM 0 H MET A 158 9.453 2.006 2.779 1.00 0.00 H new ATOM 0 HA MET A 158 9.971 -0.786 2.051 1.00 0.00 H new ATOM 0 HB2 MET A 158 11.211 1.276 3.868 1.00 0.00 H new ATOM 0 HB3 MET A 158 11.493 -0.422 4.195 1.00 0.00 H new ATOM 0 HG2 MET A 158 12.016 0.820 1.478 1.00 0.00 H new ATOM 0 HG3 MET A 158 13.223 0.790 2.748 1.00 0.00 H new ATOM 0 HE1 MET A 158 14.804 -2.035 0.714 1.00 0.00 H new ATOM 0 HE2 MET A 158 14.236 -0.420 0.225 1.00 0.00 H new ATOM 0 HE3 MET A 158 15.075 -0.636 1.780 1.00 0.00 H new ATOM 2544 N ARG A 159 8.839 -1.968 3.920 1.00 0.00 N ATOM 2545 CA ARG A 159 8.029 -2.664 4.913 1.00 0.00 C ATOM 2546 C ARG A 159 8.779 -3.862 5.485 1.00 0.00 C ATOM 2547 O ARG A 159 9.483 -4.567 4.762 1.00 0.00 O ATOM 2548 CB ARG A 159 6.707 -3.121 4.294 1.00 0.00 C ATOM 2549 CG ARG A 159 5.742 -3.728 5.299 1.00 0.00 C ATOM 2550 CD ARG A 159 4.928 -4.857 4.685 1.00 0.00 C ATOM 2551 NE ARG A 159 3.493 -4.669 4.884 1.00 0.00 N ATOM 2552 CZ ARG A 159 2.572 -5.566 4.542 1.00 0.00 C ATOM 2553 NH1 ARG A 159 2.931 -6.715 3.983 1.00 0.00 N ATOM 2554 NH2 ARG A 159 1.288 -5.314 4.758 1.00 0.00 N ATOM 0 H ARG A 159 9.267 -2.577 3.223 1.00 0.00 H new ATOM 0 HA ARG A 159 7.819 -1.969 5.726 1.00 0.00 H new ATOM 0 HB2 ARG A 159 6.228 -2.269 3.812 1.00 0.00 H new ATOM 0 HB3 ARG A 159 6.915 -3.854 3.514 1.00 0.00 H new ATOM 0 HG2 ARG A 159 6.299 -4.105 6.156 1.00 0.00 H new ATOM 0 HG3 ARG A 159 5.070 -2.955 5.671 1.00 0.00 H new ATOM 0 HD2 ARG A 159 5.141 -4.918 3.618 1.00 0.00 H new ATOM 0 HD3 ARG A 159 5.234 -5.806 5.126 1.00 0.00 H new ATOM 0 HE ARG A 159 3.178 -3.798 5.311 1.00 0.00 H new ATOM 0 HH11 ARG A 159 3.917 -6.914 3.814 1.00 0.00 H new ATOM 0 HH12 ARG A 159 2.221 -7.399 3.723 1.00 0.00 H new ATOM 0 HH21 ARG A 159 1.006 -4.432 5.186 1.00 0.00 H new ATOM 0 HH22 ARG A 159 0.582 -6.002 4.496 1.00 0.00 H new ATOM 2568 N PHE A 160 8.625 -4.086 6.785 1.00 0.00 N ATOM 2569 CA PHE A 160 9.288 -5.199 7.453 1.00 0.00 C ATOM 2570 C PHE A 160 8.267 -6.191 8.004 1.00 0.00 C ATOM 2571 O PHE A 160 7.277 -5.798 8.620 1.00 0.00 O ATOM 2572 CB PHE A 160 10.182 -4.683 8.584 1.00 0.00 C ATOM 2573 CG PHE A 160 11.640 -4.979 8.378 1.00 0.00 C ATOM 2574 CD1 PHE A 160 12.329 -4.426 7.311 1.00 0.00 C ATOM 2575 CD2 PHE A 160 12.320 -5.812 9.252 1.00 0.00 C ATOM 2576 CE1 PHE A 160 13.671 -4.698 7.119 1.00 0.00 C ATOM 2577 CE2 PHE A 160 13.662 -6.087 9.065 1.00 0.00 C ATOM 2578 CZ PHE A 160 14.339 -5.529 7.997 1.00 0.00 C ATOM 0 H PHE A 160 8.046 -3.511 7.397 1.00 0.00 H new ATOM 0 HA PHE A 160 9.906 -5.715 6.719 1.00 0.00 H new ATOM 0 HB2 PHE A 160 10.048 -3.605 8.679 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.858 -5.129 9.524 1.00 0.00 H new ATOM 0 HD1 PHE A 160 11.812 -3.775 6.621 1.00 0.00 H new ATOM 0 HD2 PHE A 160 11.796 -6.251 10.088 1.00 0.00 H new ATOM 0 HE1 PHE A 160 14.197 -4.261 6.283 1.00 0.00 H new ATOM 0 HE2 PHE A 160 14.181 -6.738 9.753 1.00 0.00 H new ATOM 0 HZ PHE A 160 15.387 -5.742 7.849 1.00 0.00 H new ATOM 2588 N GLN A 161 8.516 -7.476 7.775 1.00 0.00 N ATOM 2589 CA GLN A 161 7.619 -8.524 8.247 1.00 0.00 C ATOM 2590 C GLN A 161 8.236 -9.282 9.418 1.00 0.00 C ATOM 2591 O GLN A 161 9.302 -9.885 9.287 1.00 0.00 O ATOM 2592 CB GLN A 161 7.292 -9.495 7.110 1.00 0.00 C ATOM 2593 CG GLN A 161 5.849 -9.971 7.115 1.00 0.00 C ATOM 2594 CD GLN A 161 5.004 -9.280 6.062 1.00 0.00 C ATOM 2595 OE1 GLN A 161 5.475 -8.385 5.361 1.00 0.00 O ATOM 2596 NE2 GLN A 161 3.746 -9.693 5.947 1.00 0.00 N ATOM 0 H GLN A 161 9.331 -7.817 7.266 1.00 0.00 H new ATOM 0 HA GLN A 161 6.698 -8.052 8.589 1.00 0.00 H new ATOM 0 HB2 GLN A 161 7.503 -9.010 6.157 1.00 0.00 H new ATOM 0 HB3 GLN A 161 7.952 -10.360 7.180 1.00 0.00 H new ATOM 0 HG2 GLN A 161 5.825 -11.048 6.946 1.00 0.00 H new ATOM 0 HG3 GLN A 161 5.415 -9.793 8.099 1.00 0.00 H new ATOM 0 HE21 GLN A 161 3.397 -10.439 6.549 1.00 0.00 H new ATOM 0 HE22 GLN A 161 3.130 -9.264 5.257 1.00 0.00 H new ATOM 2605 N PHE A 162 7.559 -9.249 10.561 1.00 0.00 N ATOM 2606 CA PHE A 162 8.042 -9.934 11.755 1.00 0.00 C ATOM 2607 C PHE A 162 6.935 -10.778 12.381 1.00 0.00 C ATOM 2608 O PHE A 162 5.805 -10.797 11.894 1.00 0.00 O ATOM 2609 CB PHE A 162 8.567 -8.920 12.774 1.00 0.00 C ATOM 2610 CG PHE A 162 9.867 -9.326 13.407 1.00 0.00 C ATOM 2611 CD1 PHE A 162 11.051 -9.266 12.690 1.00 0.00 C ATOM 2612 CD2 PHE A 162 9.905 -9.767 14.721 1.00 0.00 C ATOM 2613 CE1 PHE A 162 12.249 -9.639 13.269 1.00 0.00 C ATOM 2614 CE2 PHE A 162 11.100 -10.142 15.305 1.00 0.00 C ATOM 2615 CZ PHE A 162 12.273 -10.077 14.579 1.00 0.00 C ATOM 0 H PHE A 162 6.675 -8.756 10.686 1.00 0.00 H new ATOM 0 HA PHE A 162 8.857 -10.596 11.461 1.00 0.00 H new ATOM 0 HB2 PHE A 162 8.697 -7.956 12.282 1.00 0.00 H new ATOM 0 HB3 PHE A 162 7.819 -8.781 13.555 1.00 0.00 H new ATOM 0 HD1 PHE A 162 11.037 -8.923 11.666 1.00 0.00 H new ATOM 0 HD2 PHE A 162 8.991 -9.818 15.294 1.00 0.00 H new ATOM 0 HE1 PHE A 162 13.165 -9.588 12.699 1.00 0.00 H new ATOM 0 HE2 PHE A 162 11.117 -10.486 16.329 1.00 0.00 H new ATOM 0 HZ PHE A 162 13.208 -10.368 15.035 1.00 0.00 H new ATOM 2625 N LEU A 163 7.268 -11.474 13.463 1.00 0.00 N ATOM 2626 CA LEU A 163 6.302 -12.319 14.154 1.00 0.00 C ATOM 2627 C LEU A 163 6.318 -12.049 15.656 1.00 0.00 C ATOM 2628 O LEU A 163 7.347 -11.679 16.220 1.00 0.00 O ATOM 2629 CB LEU A 163 6.603 -13.796 13.887 1.00 0.00 C ATOM 2630 CG LEU A 163 6.781 -14.162 12.413 1.00 0.00 C ATOM 2631 CD1 LEU A 163 7.787 -15.293 12.263 1.00 0.00 C ATOM 2632 CD2 LEU A 163 5.444 -14.549 11.796 1.00 0.00 C ATOM 0 H LEU A 163 8.199 -11.469 13.880 1.00 0.00 H new ATOM 0 HA LEU A 163 5.310 -12.081 13.771 1.00 0.00 H new ATOM 0 HB2 LEU A 163 7.510 -14.070 14.426 1.00 0.00 H new ATOM 0 HB3 LEU A 163 5.793 -14.397 14.300 1.00 0.00 H new ATOM 0 HG LEU A 163 7.164 -13.290 11.884 1.00 0.00 H new ATOM 0 HD11 LEU A 163 7.901 -15.541 11.208 1.00 0.00 H new ATOM 0 HD12 LEU A 163 8.749 -14.980 12.669 1.00 0.00 H new ATOM 0 HD13 LEU A 163 7.432 -16.170 12.805 1.00 0.00 H new ATOM 0 HD21 LEU A 163 5.588 -14.807 10.747 1.00 0.00 H new ATOM 0 HD22 LEU A 163 5.033 -15.408 12.327 1.00 0.00 H new ATOM 0 HD23 LEU A 163 4.752 -13.710 11.872 1.00 0.00 H new ATOM 2644 N GLU A 164 5.168 -12.237 16.297 1.00 0.00 N ATOM 2645 CA GLU A 164 5.048 -12.014 17.733 1.00 0.00 C ATOM 2646 C GLU A 164 4.912 -13.337 18.479 1.00 0.00 C ATOM 2647 O GLU A 164 3.826 -13.909 18.556 1.00 0.00 O ATOM 2648 CB GLU A 164 3.844 -11.120 18.033 1.00 0.00 C ATOM 2649 CG GLU A 164 4.071 -10.160 19.189 1.00 0.00 C ATOM 2650 CD GLU A 164 2.794 -9.479 19.641 1.00 0.00 C ATOM 2651 OE1 GLU A 164 2.359 -9.732 20.784 1.00 0.00 O ATOM 2652 OE2 GLU A 164 2.230 -8.691 18.852 1.00 0.00 O ATOM 0 H GLU A 164 4.307 -12.543 15.844 1.00 0.00 H new ATOM 0 HA GLU A 164 5.955 -11.516 18.075 1.00 0.00 H new ATOM 0 HB2 GLU A 164 3.596 -10.547 17.139 1.00 0.00 H new ATOM 0 HB3 GLU A 164 2.982 -11.749 18.258 1.00 0.00 H new ATOM 0 HG2 GLU A 164 4.505 -10.704 20.028 1.00 0.00 H new ATOM 0 HG3 GLU A 164 4.796 -9.403 18.891 1.00 0.00 H new ATOM 2660 N HIS A 165 6.022 -13.817 19.030 1.00 0.00 N ATOM 2661 CA HIS A 165 6.027 -15.072 19.771 1.00 0.00 C ATOM 2662 C HIS A 165 5.588 -14.852 21.215 1.00 0.00 C ATOM 2663 O HIS A 165 5.882 -13.818 21.814 1.00 0.00 O ATOM 2664 CB HIS A 165 7.422 -15.703 19.738 1.00 0.00 C ATOM 2665 CG HIS A 165 7.407 -17.173 19.461 1.00 0.00 C ATOM 2666 ND1 HIS A 165 8.521 -17.871 19.041 1.00 0.00 N ATOM 2667 CD2 HIS A 165 6.405 -18.081 19.543 1.00 0.00 C ATOM 2668 CE1 HIS A 165 8.204 -19.144 18.878 1.00 0.00 C ATOM 2669 NE2 HIS A 165 6.928 -19.297 19.177 1.00 0.00 N ATOM 0 H HIS A 165 6.930 -13.355 18.977 1.00 0.00 H new ATOM 0 HA HIS A 165 5.319 -15.750 19.295 1.00 0.00 H new ATOM 0 HB2 HIS A 165 8.020 -15.204 18.975 1.00 0.00 H new ATOM 0 HB3 HIS A 165 7.914 -15.527 20.694 1.00 0.00 H new ATOM 0 HD2 HIS A 165 5.385 -17.885 19.841 1.00 0.00 H new ATOM 0 HE1 HIS A 165 8.875 -19.926 18.555 1.00 0.00 H new ATOM 0 HE2 HIS A 165 6.413 -20.177 19.142 1.00 0.00 H new ATOM 2678 N HIS A 166 4.881 -15.832 21.770 1.00 0.00 N ATOM 2679 CA HIS A 166 4.402 -15.746 23.144 1.00 0.00 C ATOM 2680 C HIS A 166 3.867 -17.093 23.619 1.00 0.00 C ATOM 2681 O HIS A 166 4.138 -17.518 24.742 1.00 0.00 O ATOM 2682 CB HIS A 166 3.308 -14.682 23.258 1.00 0.00 C ATOM 2683 CG HIS A 166 2.211 -14.840 22.252 1.00 0.00 C ATOM 2684 ND1 HIS A 166 2.303 -14.373 20.957 1.00 0.00 N ATOM 2685 CD2 HIS A 166 0.991 -15.418 22.355 1.00 0.00 C ATOM 2686 CE1 HIS A 166 1.187 -14.657 20.309 1.00 0.00 C ATOM 2687 NE2 HIS A 166 0.375 -15.290 21.135 1.00 0.00 N ATOM 0 H HIS A 166 4.628 -16.695 21.288 1.00 0.00 H new ATOM 0 HA HIS A 166 5.242 -15.465 23.779 1.00 0.00 H new ATOM 0 HB2 HIS A 166 2.879 -14.720 24.259 1.00 0.00 H new ATOM 0 HB3 HIS A 166 3.758 -13.696 23.141 1.00 0.00 H new ATOM 0 HD1 HIS A 166 3.107 -13.885 20.562 1.00 0.00 H new ATOM 0 HD2 HIS A 166 0.579 -15.892 23.234 1.00 0.00 H new ATOM 0 HE1 HIS A 166 0.975 -14.413 19.279 1.00 0.00 H new ATOM 2696 N HIS A 167 3.108 -17.761 22.757 1.00 0.00 N ATOM 2697 CA HIS A 167 2.536 -19.060 23.089 1.00 0.00 C ATOM 2698 C HIS A 167 3.426 -20.190 22.581 1.00 0.00 C ATOM 2699 O HIS A 167 4.230 -20.000 21.670 1.00 0.00 O ATOM 2700 CB HIS A 167 1.134 -19.192 22.491 1.00 0.00 C ATOM 2701 CG HIS A 167 0.097 -18.390 23.215 1.00 0.00 C ATOM 2702 ND1 HIS A 167 0.184 -18.081 24.555 1.00 0.00 N ATOM 2703 CD2 HIS A 167 -1.056 -17.832 22.775 1.00 0.00 C ATOM 2704 CE1 HIS A 167 -0.870 -17.369 24.911 1.00 0.00 C ATOM 2705 NE2 HIS A 167 -1.637 -17.203 23.849 1.00 0.00 N ATOM 0 H HIS A 167 2.875 -17.424 21.823 1.00 0.00 H new ATOM 0 HA HIS A 167 2.468 -19.133 24.174 1.00 0.00 H new ATOM 0 HB2 HIS A 167 1.162 -18.878 21.448 1.00 0.00 H new ATOM 0 HB3 HIS A 167 0.841 -20.242 22.500 1.00 0.00 H new ATOM 0 HD2 HIS A 167 -1.445 -17.874 21.769 1.00 0.00 H new ATOM 0 HE1 HIS A 167 -1.070 -16.988 25.901 1.00 0.00 H new ATOM 0 HE2 HIS A 167 -2.519 -16.690 23.829 1.00 0.00 H new ATOM 2714 N HIS A 168 3.276 -21.368 23.179 1.00 0.00 N ATOM 2715 CA HIS A 168 4.065 -22.530 22.787 1.00 0.00 C ATOM 2716 C HIS A 168 3.424 -23.250 21.606 1.00 0.00 C ATOM 2717 O HIS A 168 4.117 -23.791 20.744 1.00 0.00 O ATOM 2718 CB HIS A 168 4.212 -23.493 23.967 1.00 0.00 C ATOM 2719 CG HIS A 168 5.037 -22.945 25.090 1.00 0.00 C ATOM 2720 ND1 HIS A 168 5.767 -23.740 25.947 1.00 0.00 N ATOM 2721 CD2 HIS A 168 5.245 -21.669 25.494 1.00 0.00 C ATOM 2722 CE1 HIS A 168 6.387 -22.979 26.830 1.00 0.00 C ATOM 2723 NE2 HIS A 168 6.087 -21.718 26.577 1.00 0.00 N ATOM 0 H HIS A 168 2.616 -21.543 23.936 1.00 0.00 H new ATOM 0 HA HIS A 168 5.053 -22.182 22.484 1.00 0.00 H new ATOM 0 HB2 HIS A 168 3.221 -23.745 24.345 1.00 0.00 H new ATOM 0 HB3 HIS A 168 4.664 -24.420 23.614 1.00 0.00 H new ATOM 0 HD2 HIS A 168 4.827 -20.779 25.047 1.00 0.00 H new ATOM 0 HE1 HIS A 168 7.030 -23.328 27.624 1.00 0.00 H new ATOM 0 HE2 HIS A 168 6.426 -20.911 27.101 1.00 0.00 H new ATOM 2732 N HIS A 169 2.095 -23.252 21.571 1.00 0.00 N ATOM 2733 CA HIS A 169 1.360 -23.905 20.494 1.00 0.00 C ATOM 2734 C HIS A 169 1.406 -23.070 19.218 1.00 0.00 C ATOM 2735 O HIS A 169 1.655 -21.865 19.262 1.00 0.00 O ATOM 2736 CB HIS A 169 -0.093 -24.139 20.911 1.00 0.00 C ATOM 2737 CG HIS A 169 -0.246 -25.151 22.004 1.00 0.00 C ATOM 2738 ND1 HIS A 169 -1.458 -25.448 22.591 1.00 0.00 N ATOM 2739 CD2 HIS A 169 0.670 -25.937 22.618 1.00 0.00 C ATOM 2740 CE1 HIS A 169 -1.280 -26.372 23.520 1.00 0.00 C ATOM 2741 NE2 HIS A 169 0.001 -26.686 23.554 1.00 0.00 N ATOM 0 H HIS A 169 1.506 -22.809 22.276 1.00 0.00 H new ATOM 0 HA HIS A 169 1.834 -24.866 20.295 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -0.525 -23.194 21.239 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -0.664 -24.466 20.042 1.00 0.00 H new ATOM 0 HD2 HIS A 169 1.729 -25.969 22.410 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -2.052 -26.797 24.145 1.00 0.00 H new ATOM 0 HE2 HIS A 169 0.426 -27.374 24.175 1.00 0.00 H new ATOM 2750 N HIS A 170 1.164 -23.719 18.084 1.00 0.00 N ATOM 2751 CA HIS A 170 1.178 -23.037 16.796 1.00 0.00 C ATOM 2752 C HIS A 170 -0.241 -22.787 16.296 1.00 0.00 C ATOM 2753 O HIS A 170 -0.554 -21.624 15.964 1.00 0.00 O ATOM 2754 CB HIS A 170 1.954 -23.861 15.767 1.00 0.00 C ATOM 2755 CG HIS A 170 3.437 -23.842 15.980 1.00 0.00 C ATOM 2756 ND1 HIS A 170 4.065 -22.948 16.820 1.00 0.00 N ATOM 2757 CD2 HIS A 170 4.417 -24.617 15.456 1.00 0.00 C ATOM 2758 CE1 HIS A 170 5.368 -23.171 16.803 1.00 0.00 C ATOM 2759 NE2 HIS A 170 5.606 -24.179 15.985 1.00 0.00 N ATOM 2760 OXT HIS A 170 -1.028 -23.756 16.242 1.00 0.00 O ATOM 0 H HIS A 170 0.956 -24.716 18.031 1.00 0.00 H new ATOM 0 HA HIS A 170 1.672 -22.075 16.929 1.00 0.00 H new ATOM 0 HB2 HIS A 170 1.604 -24.893 15.801 1.00 0.00 H new ATOM 0 HB3 HIS A 170 1.734 -23.482 14.769 1.00 0.00 H new ATOM 0 HD2 HIS A 170 4.287 -25.427 14.754 1.00 0.00 H new ATOM 0 HE1 HIS A 170 6.111 -22.622 17.363 1.00 0.00 H new ATOM 0 HE2 HIS A 170 6.525 -24.570 15.779 1.00 0.00 H new TER 2769 HIS A 170