USER MOD reduce.3.24.130724 H: found=0, std=0, add=1316, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1316 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: B 47 THR OG1 : rot -90:sc= 1.21 USER MOD Set 1.2: B 48 SER OG : rot 180:sc= 0.0396 USER MOD Set 2.1: A 79 HIS : no HD1:sc= -0.328 X(o=-0.39,f=-0.0087) USER MOD Set 2.2: A 80 HIS : no HD1:sc= -0.0621 X(o=-0.39,f=-0.0087) USER MOD Set 3.1: A 47 THR OG1 : rot -65:sc= 1.28 USER MOD Set 3.2: A 48 SER OG : rot 82:sc= 0 USER MOD Set 4.1: A 42 THR OG1 : rot 87:sc= 1.72 USER MOD Set 4.2: B 68 SER OG : rot -134:sc= 0.447 USER MOD Set 5.1: A 39 ASN : amide:sc=0.000633 K(o=-0.0015,f=-1.4) USER MOD Set 5.2: A 43 ASN : amide:sc=-0.00211 K(o=-0.0015,f=-0.86) USER MOD Set 6.1: A 26 HIS : no HD1:sc= 0.86 K(o=0.031,f=-5.3!) USER MOD Set 6.2: B 14 GLN : amide:sc= -0.828 X(o=0.031,f=0.14) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -104:sc= 0.0736 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -1.47! C(o=-1.5!,f=-6.3!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot -175:sc= -0.347 USER MOD Single : A 8 SER OG : rot 180:sc=-0.00564 USER MOD Single : A 11 GLN : amide:sc= -0.037 K(o=-0.037,f=-1.1) USER MOD Single : A 14 GLN : amide:sc= -0.207 K(o=-0.21,f=-0.98) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 25 LYS NZ :NH3+ 166:sc= -0.0191 (180deg=-0.202) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00429 USER MOD Single : A 33 SER OG : rot -9:sc= -1.22 USER MOD Single : A 35 MET CE :methyl -163:sc= -0.146 (180deg=-0.69) USER MOD Single : A 40 MET CE :methyl 144:sc= -0.0653 (180deg=-1.01) USER MOD Single : A 46 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.072) USER MOD Single : A 53 GLN :FLIP amide:sc= -0.331 F(o=-1.4!,f=-0.33) USER MOD Single : A 55 GLN : amide:sc= 1.13 K(o=1.1,f=-0.76) USER MOD Single : A 59 ASN : amide:sc= -0.028 K(o=-0.028,f=-1) USER MOD Single : A 60 SER OG : rot -79:sc= 0.738 USER MOD Single : A 66 GLN : amide:sc= -0.247 K(o=-0.25,f=-2.1) USER MOD Single : A 67 SER OG : rot 74:sc= 1.01 USER MOD Single : A 68 SER OG : rot 83:sc= 1.24 USER MOD Single : A 70 ASN : amide:sc= 0.747 K(o=0.75,f=-0.27) USER MOD Single : A 73 LYS NZ :NH3+ 160:sc= -0.114 (180deg=-0.554) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.128 X(o=-0.13,f=-0.0011) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 GLN : amide:sc= -1.86! C(o=-1.9!,f=-7.2!) USER MOD Single : B 5 SER OG : rot 85:sc= 0.36 USER MOD Single : B 7 TYR OH : rot 180:sc= -0.0202 USER MOD Single : B 8 SER OG : rot -110:sc= 1.29 USER MOD Single : B 11 GLN : amide:sc= -2.81! C(o=-2.8!,f=-6.6!) USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 25 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.124) USER MOD Single : B 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 THR OG1 : rot 180:sc= 0.0109 USER MOD Single : B 33 SER OG : rot 31:sc= 0.265 USER MOD Single : B 35 MET CE :methyl 162:sc= -0.0961 (180deg=-0.543) USER MOD Single : B 39 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : B 40 MET CE :methyl -130:sc= -0.147 (180deg=-1.43) USER MOD Single : B 42 THR OG1 : rot 77:sc= 1.27 USER MOD Single : B 43 ASN : amide:sc=-0.00256 X(o=-0.0026,f=0) USER MOD Single : B 46 ASN : amide:sc= 1.96 K(o=2,f=-4.5!) USER MOD Single : B 53 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : B 55 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 59 ASN : amide:sc= -0.0293 K(o=-0.029,f=-0.64) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : B 67 SER OG : rot 78:sc= 1.2 USER MOD Single : B 70 ASN : amide:sc= 0.424 K(o=0.42,f=-0.23) USER MOD Single : B 73 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.06) USER MOD Single : B 75 HIS : no HD1:sc= 1.03 K(o=1,f=-4.5!) USER MOD Single : B 78 HIS : no HD1:sc= -0.0502 X(o=-0.05,f=-0.05) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HE2:sc= 0.909 K(o=0.91,f=-5.2!) USER MOD Single : B 82 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=-0.037) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.680 -5.283 24.599 1.00 0.00 N ATOM 2 CA MET A 1 -13.960 -4.448 25.586 1.00 0.00 C ATOM 3 C MET A 1 -13.597 -3.112 24.963 1.00 0.00 C ATOM 4 O MET A 1 -13.450 -3.020 23.746 1.00 0.00 O ATOM 5 CB MET A 1 -12.695 -5.156 26.079 1.00 0.00 C ATOM 6 CG MET A 1 -12.965 -6.277 27.068 1.00 0.00 C ATOM 7 SD MET A 1 -11.449 -7.038 27.676 1.00 0.00 S ATOM 8 CE MET A 1 -12.108 -8.154 28.915 1.00 0.00 C ATOM 0 H1 MET A 1 -15.695 -5.289 24.824 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.539 -4.892 23.645 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.312 -6.255 24.632 1.00 0.00 H new ATOM 0 HA MET A 1 -14.615 -4.282 26.441 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.160 -5.562 25.221 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.038 -4.422 26.546 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.535 -5.885 27.911 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.584 -7.037 26.591 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.290 -8.701 29.384 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.644 -7.582 29.672 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.792 -8.859 28.443 1.00 0.00 H new ATOM 20 N PRO A 2 -13.460 -2.055 25.780 1.00 0.00 N ATOM 21 CA PRO A 2 -13.126 -0.721 25.284 1.00 0.00 C ATOM 22 C PRO A 2 -11.725 -0.658 24.681 1.00 0.00 C ATOM 23 O PRO A 2 -10.737 -0.428 25.384 1.00 0.00 O ATOM 24 CB PRO A 2 -13.223 0.174 26.523 1.00 0.00 C ATOM 25 CG PRO A 2 -13.067 -0.751 27.681 1.00 0.00 C ATOM 26 CD PRO A 2 -13.637 -2.071 27.244 1.00 0.00 C ATOM 0 HA PRO A 2 -13.795 -0.415 24.479 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -12.445 0.937 26.520 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -14.180 0.694 26.560 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -12.018 -0.853 27.959 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -13.593 -0.371 28.557 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -13.110 -2.907 27.703 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -14.687 -2.166 27.520 1.00 0.00 H new ATOM 34 N GLN A 3 -11.646 -0.906 23.383 1.00 0.00 N ATOM 35 CA GLN A 3 -10.396 -0.782 22.656 1.00 0.00 C ATOM 36 C GLN A 3 -10.195 0.667 22.249 1.00 0.00 C ATOM 37 O GLN A 3 -11.056 1.256 21.593 1.00 0.00 O ATOM 38 CB GLN A 3 -10.392 -1.692 21.425 1.00 0.00 C ATOM 39 CG GLN A 3 -10.438 -3.180 21.750 1.00 0.00 C ATOM 40 CD GLN A 3 -9.174 -3.683 22.427 1.00 0.00 C ATOM 41 OE1 GLN A 3 -8.499 -2.951 23.151 1.00 0.00 O ATOM 42 NE2 GLN A 3 -8.839 -4.941 22.191 1.00 0.00 N ATOM 0 H GLN A 3 -12.439 -1.196 22.810 1.00 0.00 H new ATOM 0 HA GLN A 3 -9.575 -1.092 23.302 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -11.248 -1.441 20.799 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -9.497 -1.487 20.838 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -11.293 -3.378 22.397 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -10.598 -3.742 20.830 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -9.422 -5.519 21.586 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -7.998 -5.333 22.614 1.00 0.00 H new ATOM 51 N ILE A 4 -9.072 1.237 22.660 1.00 0.00 N ATOM 52 CA ILE A 4 -8.805 2.649 22.435 1.00 0.00 C ATOM 53 C ILE A 4 -8.578 2.940 20.957 1.00 0.00 C ATOM 54 O ILE A 4 -9.441 3.520 20.299 1.00 0.00 O ATOM 55 CB ILE A 4 -7.575 3.128 23.238 1.00 0.00 C ATOM 56 CG1 ILE A 4 -7.765 2.841 24.729 1.00 0.00 C ATOM 57 CG2 ILE A 4 -7.335 4.616 23.007 1.00 0.00 C ATOM 58 CD1 ILE A 4 -6.573 3.226 25.577 1.00 0.00 C ATOM 0 H ILE A 4 -8.329 0.741 23.153 1.00 0.00 H new ATOM 0 HA ILE A 4 -9.686 3.192 22.777 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.700 2.579 22.890 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.643 3.380 25.085 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.967 1.778 24.863 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.465 4.937 23.580 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.158 4.796 21.947 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.210 5.180 23.329 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.780 2.994 26.622 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.697 2.668 25.248 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.383 4.294 25.473 1.00 0.00 H new ATOM 70 N SER A 5 -7.426 2.502 20.447 1.00 0.00 N ATOM 71 CA SER A 5 -6.995 2.832 19.092 1.00 0.00 C ATOM 72 C SER A 5 -6.928 4.350 18.920 1.00 0.00 C ATOM 73 O SER A 5 -7.930 5.001 18.630 1.00 0.00 O ATOM 74 CB SER A 5 -7.933 2.203 18.055 1.00 0.00 C ATOM 75 OG SER A 5 -7.993 0.792 18.213 1.00 0.00 O ATOM 0 H SER A 5 -6.770 1.912 20.960 1.00 0.00 H new ATOM 0 HA SER A 5 -5.999 2.421 18.931 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.932 2.627 18.158 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.586 2.446 17.051 1.00 0.00 H new ATOM 0 HG SER A 5 -8.598 0.413 17.542 1.00 0.00 H new ATOM 81 N ARG A 6 -5.736 4.910 19.094 1.00 0.00 N ATOM 82 CA ARG A 6 -5.555 6.363 19.123 1.00 0.00 C ATOM 83 C ARG A 6 -5.644 6.985 17.731 1.00 0.00 C ATOM 84 O ARG A 6 -5.140 8.083 17.492 1.00 0.00 O ATOM 85 CB ARG A 6 -4.216 6.701 19.774 1.00 0.00 C ATOM 86 CG ARG A 6 -4.154 6.297 21.235 1.00 0.00 C ATOM 87 CD ARG A 6 -2.796 6.581 21.848 1.00 0.00 C ATOM 88 NE ARG A 6 -2.767 6.226 23.263 1.00 0.00 N ATOM 89 CZ ARG A 6 -1.812 5.494 23.830 1.00 0.00 C ATOM 90 NH1 ARG A 6 -0.785 5.055 23.113 1.00 0.00 N ATOM 91 NH2 ARG A 6 -1.881 5.194 25.119 1.00 0.00 N ATOM 0 H ARG A 6 -4.874 4.379 19.218 1.00 0.00 H new ATOM 0 HA ARG A 6 -6.367 6.788 19.713 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.416 6.200 19.229 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -4.037 7.773 19.690 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.922 6.834 21.792 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -4.378 5.234 21.327 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -2.029 6.019 21.314 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -2.556 7.638 21.731 1.00 0.00 H new ATOM 0 HE ARG A 6 -3.527 6.560 23.855 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.724 5.278 22.120 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.057 4.494 23.555 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.667 5.525 25.678 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -1.148 4.633 25.552 1.00 0.00 H new ATOM 105 N TYR A 7 -6.307 6.285 16.829 1.00 0.00 N ATOM 106 CA TYR A 7 -6.558 6.778 15.491 1.00 0.00 C ATOM 107 C TYR A 7 -8.024 6.555 15.160 1.00 0.00 C ATOM 108 O TYR A 7 -8.406 5.512 14.619 1.00 0.00 O ATOM 109 CB TYR A 7 -5.646 6.080 14.480 1.00 0.00 C ATOM 110 CG TYR A 7 -4.179 6.245 14.806 1.00 0.00 C ATOM 111 CD1 TYR A 7 -3.542 7.460 14.613 1.00 0.00 C ATOM 112 CD2 TYR A 7 -3.437 5.190 15.323 1.00 0.00 C ATOM 113 CE1 TYR A 7 -2.208 7.625 14.925 1.00 0.00 C ATOM 114 CE2 TYR A 7 -2.100 5.346 15.636 1.00 0.00 C ATOM 115 CZ TYR A 7 -1.491 6.566 15.435 1.00 0.00 C ATOM 116 OH TYR A 7 -0.162 6.734 15.752 1.00 0.00 O ATOM 0 H TYR A 7 -6.687 5.355 17.006 1.00 0.00 H new ATOM 0 HA TYR A 7 -6.337 7.844 15.440 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -5.890 5.018 14.450 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.840 6.480 13.485 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -4.100 8.293 14.211 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.912 4.233 15.483 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.729 8.580 14.770 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -1.536 4.517 16.036 1.00 0.00 H new ATOM 0 HH TYR A 7 0.220 5.874 16.025 1.00 0.00 H new ATOM 126 N SER A 8 -8.844 7.523 15.546 1.00 0.00 N ATOM 127 CA SER A 8 -10.288 7.417 15.426 1.00 0.00 C ATOM 128 C SER A 8 -10.726 7.446 13.964 1.00 0.00 C ATOM 129 O SER A 8 -9.995 7.926 13.091 1.00 0.00 O ATOM 130 CB SER A 8 -10.958 8.554 16.206 1.00 0.00 C ATOM 131 OG SER A 8 -12.370 8.428 16.200 1.00 0.00 O ATOM 0 H SER A 8 -8.525 8.403 15.951 1.00 0.00 H new ATOM 0 HA SER A 8 -10.598 6.460 15.846 1.00 0.00 H new ATOM 0 HB2 SER A 8 -10.596 8.553 17.234 1.00 0.00 H new ATOM 0 HB3 SER A 8 -10.675 9.512 15.769 1.00 0.00 H new ATOM 0 HG SER A 8 -12.767 9.167 16.707 1.00 0.00 H new ATOM 137 N ASP A 9 -11.931 6.935 13.722 1.00 0.00 N ATOM 138 CA ASP A 9 -12.512 6.866 12.382 1.00 0.00 C ATOM 139 C ASP A 9 -12.442 8.213 11.679 1.00 0.00 C ATOM 140 O ASP A 9 -12.099 8.287 10.502 1.00 0.00 O ATOM 141 CB ASP A 9 -13.975 6.421 12.466 1.00 0.00 C ATOM 142 CG ASP A 9 -14.145 5.067 13.124 1.00 0.00 C ATOM 143 OD1 ASP A 9 -13.951 4.975 14.355 1.00 0.00 O ATOM 144 OD2 ASP A 9 -14.479 4.093 12.413 1.00 0.00 O ATOM 0 H ASP A 9 -12.534 6.556 14.452 1.00 0.00 H new ATOM 0 HA ASP A 9 -11.935 6.142 11.808 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.544 7.164 13.025 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.397 6.386 11.461 1.00 0.00 H new ATOM 149 N GLU A 10 -12.757 9.273 12.416 1.00 0.00 N ATOM 150 CA GLU A 10 -12.768 10.622 11.862 1.00 0.00 C ATOM 151 C GLU A 10 -11.399 11.008 11.317 1.00 0.00 C ATOM 152 O GLU A 10 -11.284 11.468 10.185 1.00 0.00 O ATOM 153 CB GLU A 10 -13.191 11.634 12.920 1.00 0.00 C ATOM 154 CG GLU A 10 -14.595 11.417 13.450 1.00 0.00 C ATOM 155 CD GLU A 10 -15.030 12.533 14.371 1.00 0.00 C ATOM 156 OE1 GLU A 10 -15.530 13.559 13.866 1.00 0.00 O ATOM 157 OE2 GLU A 10 -14.863 12.398 15.599 1.00 0.00 O ATOM 0 H GLU A 10 -13.009 9.223 13.403 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.487 10.631 11.043 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.488 11.591 13.752 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.123 12.637 12.498 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -15.291 11.344 12.614 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.638 10.468 13.984 1.00 0.00 H new ATOM 164 N GLN A 11 -10.368 10.802 12.127 1.00 0.00 N ATOM 165 CA GLN A 11 -9.010 11.180 11.750 1.00 0.00 C ATOM 166 C GLN A 11 -8.561 10.405 10.512 1.00 0.00 C ATOM 167 O GLN A 11 -7.929 10.961 9.613 1.00 0.00 O ATOM 168 CB GLN A 11 -8.053 10.930 12.918 1.00 0.00 C ATOM 169 CG GLN A 11 -6.638 11.434 12.678 1.00 0.00 C ATOM 170 CD GLN A 11 -5.724 11.164 13.857 1.00 0.00 C ATOM 171 OE1 GLN A 11 -5.908 10.193 14.589 1.00 0.00 O ATOM 172 NE2 GLN A 11 -4.730 12.018 14.053 1.00 0.00 N ATOM 0 H GLN A 11 -10.446 10.375 13.050 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.997 12.243 11.508 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.452 11.411 13.811 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -8.017 9.860 13.122 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.230 10.955 11.788 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.665 12.505 12.480 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.609 12.812 13.425 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -4.086 11.881 14.832 1.00 0.00 H new ATOM 181 N VAL A 12 -8.911 9.125 10.469 1.00 0.00 N ATOM 182 CA VAL A 12 -8.591 8.281 9.326 1.00 0.00 C ATOM 183 C VAL A 12 -9.356 8.744 8.087 1.00 0.00 C ATOM 184 O VAL A 12 -8.776 8.927 7.014 1.00 0.00 O ATOM 185 CB VAL A 12 -8.932 6.801 9.613 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.604 5.921 8.417 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.200 6.307 10.852 1.00 0.00 C ATOM 0 H VAL A 12 -9.418 8.649 11.215 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.520 8.366 9.144 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.004 6.738 9.798 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -8.854 4.885 8.648 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.182 6.250 7.554 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.540 5.996 8.191 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.456 5.263 11.034 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.124 6.396 10.699 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.495 6.908 11.712 1.00 0.00 H new ATOM 197 N GLU A 13 -10.658 8.952 8.256 1.00 0.00 N ATOM 198 CA GLU A 13 -11.532 9.363 7.166 1.00 0.00 C ATOM 199 C GLU A 13 -11.106 10.711 6.594 1.00 0.00 C ATOM 200 O GLU A 13 -11.005 10.871 5.380 1.00 0.00 O ATOM 201 CB GLU A 13 -12.980 9.434 7.655 1.00 0.00 C ATOM 202 CG GLU A 13 -13.977 9.833 6.581 1.00 0.00 C ATOM 203 CD GLU A 13 -15.401 9.855 7.099 1.00 0.00 C ATOM 204 OE1 GLU A 13 -15.818 10.886 7.671 1.00 0.00 O ATOM 205 OE2 GLU A 13 -16.112 8.841 6.938 1.00 0.00 O ATOM 0 H GLU A 13 -11.135 8.840 9.151 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.455 8.620 6.372 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.265 8.462 8.057 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.041 10.149 8.476 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -13.718 10.819 6.196 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.907 9.136 5.746 1.00 0.00 H new ATOM 212 N GLN A 14 -10.843 11.671 7.474 1.00 0.00 N ATOM 213 CA GLN A 14 -10.450 13.010 7.055 1.00 0.00 C ATOM 214 C GLN A 14 -9.155 12.986 6.253 1.00 0.00 C ATOM 215 O GLN A 14 -9.061 13.624 5.204 1.00 0.00 O ATOM 216 CB GLN A 14 -10.308 13.932 8.268 1.00 0.00 C ATOM 217 CG GLN A 14 -11.643 14.358 8.856 1.00 0.00 C ATOM 218 CD GLN A 14 -12.435 15.239 7.909 1.00 0.00 C ATOM 219 OE1 GLN A 14 -11.864 15.987 7.113 1.00 0.00 O ATOM 220 NE2 GLN A 14 -13.752 15.153 7.977 1.00 0.00 N ATOM 0 H GLN A 14 -10.895 11.545 8.485 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.237 13.398 6.408 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -9.726 13.424 9.036 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -9.746 14.820 7.978 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.229 13.472 9.100 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -11.472 14.894 9.790 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -14.188 14.522 8.649 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -14.333 15.718 7.357 1.00 0.00 H new ATOM 229 N LEU A 15 -8.164 12.245 6.735 1.00 0.00 N ATOM 230 CA LEU A 15 -6.890 12.146 6.036 1.00 0.00 C ATOM 231 C LEU A 15 -7.069 11.438 4.695 1.00 0.00 C ATOM 232 O LEU A 15 -6.527 11.871 3.676 1.00 0.00 O ATOM 233 CB LEU A 15 -5.857 11.406 6.890 1.00 0.00 C ATOM 234 CG LEU A 15 -4.453 11.327 6.282 1.00 0.00 C ATOM 235 CD1 LEU A 15 -3.874 12.721 6.082 1.00 0.00 C ATOM 236 CD2 LEU A 15 -3.539 10.491 7.164 1.00 0.00 C ATOM 0 H LEU A 15 -8.218 11.708 7.601 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.525 13.157 5.853 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.790 11.899 7.860 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.216 10.393 7.071 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.528 10.846 5.307 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.877 12.642 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.517 13.289 5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.813 13.231 7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.546 10.445 6.718 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.472 10.945 8.153 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.943 9.483 7.255 1.00 0.00 H new ATOM 248 N LEU A 16 -7.845 10.358 4.702 1.00 0.00 N ATOM 249 CA LEU A 16 -8.121 9.603 3.488 1.00 0.00 C ATOM 250 C LEU A 16 -8.862 10.470 2.474 1.00 0.00 C ATOM 251 O LEU A 16 -8.535 10.464 1.287 1.00 0.00 O ATOM 252 CB LEU A 16 -8.946 8.353 3.815 1.00 0.00 C ATOM 253 CG LEU A 16 -9.256 7.441 2.625 1.00 0.00 C ATOM 254 CD1 LEU A 16 -7.973 6.890 2.021 1.00 0.00 C ATOM 255 CD2 LEU A 16 -10.179 6.309 3.050 1.00 0.00 C ATOM 0 H LEU A 16 -8.294 9.987 5.539 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.171 9.294 3.052 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.412 7.772 4.567 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.888 8.667 4.265 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.764 8.031 1.862 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.216 6.245 1.177 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.348 7.715 1.679 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.434 6.315 2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.390 5.670 2.193 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.698 5.721 3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.112 6.724 3.431 1.00 0.00 H new ATOM 267 N ALA A 17 -9.848 11.219 2.955 1.00 0.00 N ATOM 268 CA ALA A 17 -10.628 12.106 2.102 1.00 0.00 C ATOM 269 C ALA A 17 -9.731 13.128 1.416 1.00 0.00 C ATOM 270 O ALA A 17 -9.862 13.364 0.217 1.00 0.00 O ATOM 271 CB ALA A 17 -11.711 12.808 2.908 1.00 0.00 C ATOM 0 H ALA A 17 -10.127 11.229 3.936 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.106 11.500 1.332 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.283 13.466 2.254 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.377 12.065 3.347 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.250 13.396 3.701 1.00 0.00 H new ATOM 277 N GLU A 18 -8.818 13.723 2.181 1.00 0.00 N ATOM 278 CA GLU A 18 -7.868 14.686 1.636 1.00 0.00 C ATOM 279 C GLU A 18 -7.030 14.050 0.530 1.00 0.00 C ATOM 280 O GLU A 18 -6.932 14.587 -0.574 1.00 0.00 O ATOM 281 CB GLU A 18 -6.949 15.216 2.741 1.00 0.00 C ATOM 282 CG GLU A 18 -7.660 16.063 3.784 1.00 0.00 C ATOM 283 CD GLU A 18 -8.162 17.379 3.229 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.383 18.354 3.207 1.00 0.00 O ATOM 285 OE2 GLU A 18 -9.340 17.454 2.832 1.00 0.00 O ATOM 0 H GLU A 18 -8.717 13.554 3.182 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.434 15.517 1.215 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.471 14.372 3.238 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.155 15.809 2.286 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.501 15.501 4.190 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -6.979 16.259 4.612 1.00 0.00 H new ATOM 292 N LEU A 19 -6.447 12.893 0.830 1.00 0.00 N ATOM 293 CA LEU A 19 -5.593 12.190 -0.123 1.00 0.00 C ATOM 294 C LEU A 19 -6.364 11.837 -1.392 1.00 0.00 C ATOM 295 O LEU A 19 -5.888 12.074 -2.504 1.00 0.00 O ATOM 296 CB LEU A 19 -5.011 10.921 0.507 1.00 0.00 C ATOM 297 CG LEU A 19 -4.109 11.148 1.722 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.640 9.819 2.293 1.00 0.00 C ATOM 299 CD2 LEU A 19 -2.916 12.019 1.348 1.00 0.00 C ATOM 0 H LEU A 19 -6.551 12.421 1.728 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.774 12.857 -0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.835 10.272 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.441 10.386 -0.253 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.687 11.667 2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.000 10.000 3.156 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.504 9.229 2.599 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.080 9.274 1.533 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.286 12.169 2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.338 11.527 0.566 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.270 12.984 0.986 1.00 0.00 H new ATOM 311 N LEU A 20 -7.560 11.284 -1.221 1.00 0.00 N ATOM 312 CA LEU A 20 -8.396 10.902 -2.354 1.00 0.00 C ATOM 313 C LEU A 20 -8.819 12.127 -3.155 1.00 0.00 C ATOM 314 O LEU A 20 -8.795 12.110 -4.386 1.00 0.00 O ATOM 315 CB LEU A 20 -9.636 10.141 -1.878 1.00 0.00 C ATOM 316 CG LEU A 20 -9.362 8.785 -1.227 1.00 0.00 C ATOM 317 CD1 LEU A 20 -10.664 8.151 -0.761 1.00 0.00 C ATOM 318 CD2 LEU A 20 -8.637 7.861 -2.196 1.00 0.00 C ATOM 0 H LEU A 20 -7.973 11.090 -0.309 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.806 10.250 -2.998 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.174 10.766 -1.165 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.298 9.989 -2.731 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.721 8.942 -0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -10.454 7.186 -0.299 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.147 8.804 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -11.325 8.008 -1.616 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -8.451 6.901 -1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -9.252 7.708 -3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.688 8.311 -2.486 1.00 0.00 H new ATOM 330 N ASN A 21 -9.196 13.187 -2.451 1.00 0.00 N ATOM 331 CA ASN A 21 -9.649 14.414 -3.096 1.00 0.00 C ATOM 332 C ASN A 21 -8.552 15.002 -3.973 1.00 0.00 C ATOM 333 O ASN A 21 -8.787 15.313 -5.137 1.00 0.00 O ATOM 334 CB ASN A 21 -10.096 15.446 -2.055 1.00 0.00 C ATOM 335 CG ASN A 21 -10.542 16.751 -2.687 1.00 0.00 C ATOM 336 OD1 ASN A 21 -9.741 17.668 -2.882 1.00 0.00 O ATOM 337 ND2 ASN A 21 -11.822 16.848 -3.013 1.00 0.00 N ATOM 0 H ASN A 21 -9.197 13.222 -1.432 1.00 0.00 H new ATOM 0 HA ASN A 21 -10.502 14.162 -3.726 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.915 15.032 -1.466 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -9.275 15.642 -1.366 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -12.176 17.703 -3.441 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -12.454 16.067 -2.836 1.00 0.00 H new ATOM 344 N VAL A 22 -7.351 15.126 -3.420 1.00 0.00 N ATOM 345 CA VAL A 22 -6.227 15.701 -4.153 1.00 0.00 C ATOM 346 C VAL A 22 -5.857 14.837 -5.361 1.00 0.00 C ATOM 347 O VAL A 22 -5.519 15.358 -6.429 1.00 0.00 O ATOM 348 CB VAL A 22 -4.995 15.883 -3.239 1.00 0.00 C ATOM 349 CG1 VAL A 22 -3.807 16.420 -4.022 1.00 0.00 C ATOM 350 CG2 VAL A 22 -5.326 16.811 -2.080 1.00 0.00 C ATOM 0 H VAL A 22 -7.130 14.837 -2.467 1.00 0.00 H new ATOM 0 HA VAL A 22 -6.541 16.682 -4.508 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.724 14.905 -2.840 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.954 16.538 -3.354 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.550 15.721 -4.818 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -4.064 17.386 -4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -4.447 16.929 -1.446 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.627 17.784 -2.468 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -6.142 16.386 -1.495 1.00 0.00 H new ATOM 360 N LEU A 23 -5.942 13.521 -5.193 1.00 0.00 N ATOM 361 CA LEU A 23 -5.658 12.585 -6.278 1.00 0.00 C ATOM 362 C LEU A 23 -6.624 12.820 -7.439 1.00 0.00 C ATOM 363 O LEU A 23 -6.208 13.001 -8.584 1.00 0.00 O ATOM 364 CB LEU A 23 -5.762 11.140 -5.756 1.00 0.00 C ATOM 365 CG LEU A 23 -5.300 10.033 -6.716 1.00 0.00 C ATOM 366 CD1 LEU A 23 -4.907 8.791 -5.929 1.00 0.00 C ATOM 367 CD2 LEU A 23 -6.393 9.679 -7.718 1.00 0.00 C ATOM 0 H LEU A 23 -6.206 13.077 -4.314 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.644 12.748 -6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.176 11.064 -4.840 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.801 10.948 -5.487 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.437 10.406 -7.267 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.581 8.012 -6.618 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.093 9.035 -5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.765 8.435 -5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.036 8.893 -8.383 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.276 9.329 -7.184 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.649 10.562 -8.304 1.00 0.00 H new ATOM 379 N GLU A 24 -7.913 12.848 -7.125 1.00 0.00 N ATOM 380 CA GLU A 24 -8.952 13.056 -8.129 1.00 0.00 C ATOM 381 C GLU A 24 -8.907 14.482 -8.674 1.00 0.00 C ATOM 382 O GLU A 24 -9.311 14.737 -9.808 1.00 0.00 O ATOM 383 CB GLU A 24 -10.323 12.776 -7.515 1.00 0.00 C ATOM 384 CG GLU A 24 -10.477 11.356 -6.994 1.00 0.00 C ATOM 385 CD GLU A 24 -10.779 10.352 -8.088 1.00 0.00 C ATOM 386 OE1 GLU A 24 -10.085 10.353 -9.125 1.00 0.00 O ATOM 387 OE2 GLU A 24 -11.736 9.565 -7.919 1.00 0.00 O ATOM 0 H GLU A 24 -8.267 12.728 -6.176 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.776 12.369 -8.957 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.495 13.475 -6.697 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.093 12.965 -8.263 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -9.561 11.062 -6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.278 11.331 -6.255 1.00 0.00 H new ATOM 394 N LYS A 25 -8.405 15.393 -7.849 1.00 0.00 N ATOM 395 CA LYS A 25 -8.307 16.808 -8.192 1.00 0.00 C ATOM 396 C LYS A 25 -7.302 17.034 -9.321 1.00 0.00 C ATOM 397 O LYS A 25 -7.501 17.893 -10.179 1.00 0.00 O ATOM 398 CB LYS A 25 -7.886 17.599 -6.949 1.00 0.00 C ATOM 399 CG LYS A 25 -7.962 19.106 -7.098 1.00 0.00 C ATOM 400 CD LYS A 25 -7.398 19.796 -5.867 1.00 0.00 C ATOM 401 CE LYS A 25 -7.611 21.299 -5.910 1.00 0.00 C ATOM 402 NZ LYS A 25 -9.051 21.663 -5.829 1.00 0.00 N ATOM 0 H LYS A 25 -8.052 15.170 -6.918 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.282 17.152 -8.538 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.518 17.298 -6.113 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.863 17.325 -6.690 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.406 19.418 -7.982 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.998 19.410 -7.249 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.871 19.388 -4.974 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.332 19.583 -5.788 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.073 21.765 -5.084 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.188 21.698 -6.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.141 22.679 -5.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.514 21.450 -6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.506 21.115 -5.071 1.00 0.00 H new ATOM 416 N HIS A 26 -6.218 16.266 -9.312 1.00 0.00 N ATOM 417 CA HIS A 26 -5.194 16.390 -10.348 1.00 0.00 C ATOM 418 C HIS A 26 -5.404 15.353 -11.442 1.00 0.00 C ATOM 419 O HIS A 26 -4.755 15.411 -12.485 1.00 0.00 O ATOM 420 CB HIS A 26 -3.787 16.248 -9.763 1.00 0.00 C ATOM 421 CG HIS A 26 -3.344 17.421 -8.946 1.00 0.00 C ATOM 422 ND1 HIS A 26 -2.571 18.448 -9.450 1.00 0.00 N ATOM 423 CD2 HIS A 26 -3.556 17.720 -7.644 1.00 0.00 C ATOM 424 CE1 HIS A 26 -2.327 19.320 -8.492 1.00 0.00 C ATOM 425 NE2 HIS A 26 -2.913 18.903 -7.385 1.00 0.00 N ATOM 0 H HIS A 26 -6.025 15.556 -8.606 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.288 17.386 -10.780 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.752 15.353 -9.143 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.079 16.099 -10.579 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -4.127 17.135 -6.938 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.745 20.224 -8.595 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.891 19.382 -6.485 1.00 0.00 H new ATOM 434 N LYS A 27 -6.313 14.413 -11.184 1.00 0.00 N ATOM 435 CA LYS A 27 -6.664 13.355 -12.134 1.00 0.00 C ATOM 436 C LYS A 27 -5.514 12.372 -12.320 1.00 0.00 C ATOM 437 O LYS A 27 -4.641 12.565 -13.167 1.00 0.00 O ATOM 438 CB LYS A 27 -7.087 13.940 -13.485 1.00 0.00 C ATOM 439 CG LYS A 27 -8.320 14.822 -13.406 1.00 0.00 C ATOM 440 CD LYS A 27 -8.631 15.464 -14.744 1.00 0.00 C ATOM 441 CE LYS A 27 -7.571 16.480 -15.137 1.00 0.00 C ATOM 442 NZ LYS A 27 -7.807 17.021 -16.501 1.00 0.00 N ATOM 0 H LYS A 27 -6.830 14.363 -10.306 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.511 12.813 -11.715 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.261 14.521 -13.895 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.279 13.123 -14.181 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.173 14.228 -13.079 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.166 15.598 -12.656 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.699 14.693 -15.511 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.604 15.953 -14.696 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.566 17.298 -14.417 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.587 16.013 -15.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.064 17.711 -16.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -7.787 16.243 -17.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.736 17.488 -16.533 1.00 0.00 H new ATOM 456 N ALA A 28 -5.525 11.312 -11.528 1.00 0.00 N ATOM 457 CA ALA A 28 -4.479 10.307 -11.587 1.00 0.00 C ATOM 458 C ALA A 28 -5.069 8.923 -11.814 1.00 0.00 C ATOM 459 O ALA A 28 -5.882 8.446 -11.019 1.00 0.00 O ATOM 460 CB ALA A 28 -3.656 10.325 -10.309 1.00 0.00 C ATOM 0 H ALA A 28 -6.250 11.126 -10.835 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.828 10.543 -12.428 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.876 9.566 -10.368 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.199 11.307 -10.184 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.303 10.115 -9.457 1.00 0.00 H new ATOM 466 N PRO A 29 -4.693 8.272 -12.924 1.00 0.00 N ATOM 467 CA PRO A 29 -5.113 6.900 -13.220 1.00 0.00 C ATOM 468 C PRO A 29 -4.547 5.908 -12.206 1.00 0.00 C ATOM 469 O PRO A 29 -3.533 6.184 -11.559 1.00 0.00 O ATOM 470 CB PRO A 29 -4.543 6.634 -14.618 1.00 0.00 C ATOM 471 CG PRO A 29 -4.214 7.980 -15.171 1.00 0.00 C ATOM 472 CD PRO A 29 -3.845 8.825 -13.989 1.00 0.00 C ATOM 0 HA PRO A 29 -6.195 6.781 -13.172 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.656 6.002 -14.568 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -5.268 6.117 -15.247 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.390 7.920 -15.882 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -5.065 8.403 -15.704 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.785 8.743 -13.747 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.051 9.881 -14.165 1.00 0.00 H new ATOM 480 N THR A 30 -5.194 4.755 -12.086 1.00 0.00 N ATOM 481 CA THR A 30 -4.833 3.768 -11.074 1.00 0.00 C ATOM 482 C THR A 30 -3.390 3.287 -11.250 1.00 0.00 C ATOM 483 O THR A 30 -2.698 3.006 -10.271 1.00 0.00 O ATOM 484 CB THR A 30 -5.795 2.562 -11.110 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.141 3.025 -11.300 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.713 1.762 -9.815 1.00 0.00 C ATOM 0 H THR A 30 -5.976 4.479 -12.680 1.00 0.00 H new ATOM 0 HA THR A 30 -4.916 4.257 -10.103 1.00 0.00 H new ATOM 0 HB THR A 30 -5.504 1.915 -11.938 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.750 2.258 -11.324 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.400 0.917 -9.865 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.696 1.395 -9.678 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.984 2.401 -8.975 1.00 0.00 H new ATOM 494 N ASP A 31 -2.938 3.211 -12.500 1.00 0.00 N ATOM 495 CA ASP A 31 -1.558 2.827 -12.798 1.00 0.00 C ATOM 496 C ASP A 31 -0.580 3.785 -12.122 1.00 0.00 C ATOM 497 O ASP A 31 0.391 3.365 -11.488 1.00 0.00 O ATOM 498 CB ASP A 31 -1.298 2.840 -14.310 1.00 0.00 C ATOM 499 CG ASP A 31 -2.116 1.816 -15.073 1.00 0.00 C ATOM 500 OD1 ASP A 31 -3.284 2.108 -15.401 1.00 0.00 O ATOM 501 OD2 ASP A 31 -1.584 0.725 -15.377 1.00 0.00 O ATOM 0 H ASP A 31 -3.506 3.410 -13.323 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.408 1.817 -12.417 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.519 3.834 -14.700 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.239 2.655 -14.490 1.00 0.00 H new ATOM 506 N LEU A 32 -0.863 5.075 -12.243 1.00 0.00 N ATOM 507 CA LEU A 32 0.033 6.106 -11.746 1.00 0.00 C ATOM 508 C LEU A 32 -0.100 6.261 -10.236 1.00 0.00 C ATOM 509 O LEU A 32 0.895 6.471 -9.540 1.00 0.00 O ATOM 510 CB LEU A 32 -0.254 7.437 -12.448 1.00 0.00 C ATOM 511 CG LEU A 32 0.715 8.578 -12.126 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.146 8.181 -12.459 1.00 0.00 C ATOM 513 CD2 LEU A 32 0.322 9.834 -12.889 1.00 0.00 C ATOM 0 H LEU A 32 -1.711 5.432 -12.684 1.00 0.00 H new ATOM 0 HA LEU A 32 1.058 5.806 -11.965 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.244 7.269 -13.525 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.263 7.756 -12.185 1.00 0.00 H new ATOM 0 HG LEU A 32 0.659 8.785 -11.057 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.817 9.007 -12.222 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.427 7.306 -11.873 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.221 7.946 -13.521 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.019 10.637 -12.651 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.352 9.633 -13.960 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.687 10.132 -12.604 1.00 0.00 H new ATOM 525 N SER A 33 -1.320 6.141 -9.726 1.00 0.00 N ATOM 526 CA SER A 33 -1.552 6.279 -8.298 1.00 0.00 C ATOM 527 C SER A 33 -0.837 5.170 -7.529 1.00 0.00 C ATOM 528 O SER A 33 -0.204 5.427 -6.506 1.00 0.00 O ATOM 529 CB SER A 33 -3.052 6.272 -7.993 1.00 0.00 C ATOM 530 OG SER A 33 -3.686 5.128 -8.539 1.00 0.00 O ATOM 0 H SER A 33 -2.157 5.950 -10.277 1.00 0.00 H new ATOM 0 HA SER A 33 -1.144 7.236 -7.974 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.205 6.295 -6.914 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.512 7.173 -8.399 1.00 0.00 H new ATOM 0 HG SER A 33 -3.058 4.654 -9.123 1.00 0.00 H new ATOM 536 N LEU A 34 -0.921 3.944 -8.039 1.00 0.00 N ATOM 537 CA LEU A 34 -0.243 2.811 -7.419 1.00 0.00 C ATOM 538 C LEU A 34 1.269 2.991 -7.482 1.00 0.00 C ATOM 539 O LEU A 34 1.982 2.650 -6.538 1.00 0.00 O ATOM 540 CB LEU A 34 -0.643 1.499 -8.100 1.00 0.00 C ATOM 541 CG LEU A 34 -2.098 1.074 -7.893 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.393 -0.207 -8.660 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.394 0.885 -6.412 1.00 0.00 C ATOM 0 H LEU A 34 -1.451 3.711 -8.879 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.548 2.767 -6.374 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.457 1.593 -9.170 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.006 0.705 -7.732 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.744 1.864 -8.276 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.432 -0.495 -8.501 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.220 -0.042 -9.724 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.738 -1.003 -8.305 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.433 0.583 -6.284 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.739 0.114 -6.006 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.221 1.823 -5.884 1.00 0.00 H new ATOM 555 N MET A 35 1.745 3.539 -8.592 1.00 0.00 N ATOM 556 CA MET A 35 3.166 3.808 -8.768 1.00 0.00 C ATOM 557 C MET A 35 3.676 4.757 -7.684 1.00 0.00 C ATOM 558 O MET A 35 4.697 4.494 -7.044 1.00 0.00 O ATOM 559 CB MET A 35 3.423 4.411 -10.151 1.00 0.00 C ATOM 560 CG MET A 35 4.892 4.702 -10.437 1.00 0.00 C ATOM 561 SD MET A 35 5.152 5.469 -12.050 1.00 0.00 S ATOM 562 CE MET A 35 4.498 4.206 -13.138 1.00 0.00 C ATOM 0 H MET A 35 1.165 3.807 -9.387 1.00 0.00 H new ATOM 0 HA MET A 35 3.705 2.864 -8.684 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.044 3.727 -10.910 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.855 5.337 -10.244 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.286 5.358 -9.660 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.458 3.772 -10.386 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.851 4.383 -14.154 1.00 0.00 H new ATOM 0 HE2 MET A 35 4.836 3.226 -12.802 1.00 0.00 H new ATOM 0 HE3 MET A 35 3.409 4.240 -13.121 1.00 0.00 H new ATOM 572 N VAL A 36 2.957 5.853 -7.475 1.00 0.00 N ATOM 573 CA VAL A 36 3.348 6.844 -6.483 1.00 0.00 C ATOM 574 C VAL A 36 3.220 6.284 -5.069 1.00 0.00 C ATOM 575 O VAL A 36 4.137 6.419 -4.258 1.00 0.00 O ATOM 576 CB VAL A 36 2.508 8.133 -6.607 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.926 9.158 -5.563 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.634 8.717 -8.006 1.00 0.00 C ATOM 0 H VAL A 36 2.100 6.077 -7.980 1.00 0.00 H new ATOM 0 HA VAL A 36 4.392 7.092 -6.675 1.00 0.00 H new ATOM 0 HB VAL A 36 1.464 7.875 -6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.319 10.057 -5.672 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.782 8.741 -4.566 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.977 9.411 -5.702 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.036 9.625 -8.076 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.678 8.954 -8.209 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.278 7.991 -8.737 1.00 0.00 H new ATOM 588 N LEU A 37 2.089 5.645 -4.782 1.00 0.00 N ATOM 589 CA LEU A 37 1.848 5.072 -3.459 1.00 0.00 C ATOM 590 C LEU A 37 2.912 4.036 -3.113 1.00 0.00 C ATOM 591 O LEU A 37 3.437 4.022 -1.999 1.00 0.00 O ATOM 592 CB LEU A 37 0.456 4.438 -3.385 1.00 0.00 C ATOM 593 CG LEU A 37 -0.715 5.414 -3.508 1.00 0.00 C ATOM 594 CD1 LEU A 37 -2.038 4.662 -3.483 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.671 6.451 -2.396 1.00 0.00 C ATOM 0 H LEU A 37 1.326 5.511 -5.445 1.00 0.00 H new ATOM 0 HA LEU A 37 1.902 5.882 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.372 3.694 -4.177 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.367 3.907 -2.437 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.629 5.933 -4.462 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.861 5.371 -3.571 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.073 3.960 -4.316 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.129 4.116 -2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.513 7.135 -2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.730 5.951 -1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.262 7.011 -2.458 1.00 0.00 H new ATOM 607 N GLY A 38 3.237 3.181 -4.077 1.00 0.00 N ATOM 608 CA GLY A 38 4.264 2.178 -3.870 1.00 0.00 C ATOM 609 C GLY A 38 5.607 2.803 -3.547 1.00 0.00 C ATOM 610 O GLY A 38 6.321 2.339 -2.654 1.00 0.00 O ATOM 0 H GLY A 38 2.805 3.165 -5.001 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.966 1.516 -3.057 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.356 1.562 -4.765 1.00 0.00 H new ATOM 614 N ASN A 39 5.938 3.868 -4.267 1.00 0.00 N ATOM 615 CA ASN A 39 7.175 4.609 -4.035 1.00 0.00 C ATOM 616 C ASN A 39 7.181 5.200 -2.627 1.00 0.00 C ATOM 617 O ASN A 39 8.173 5.105 -1.901 1.00 0.00 O ATOM 618 CB ASN A 39 7.321 5.722 -5.080 1.00 0.00 C ATOM 619 CG ASN A 39 8.622 6.495 -4.957 1.00 0.00 C ATOM 620 OD1 ASN A 39 9.643 5.959 -4.534 1.00 0.00 O ATOM 621 ND2 ASN A 39 8.590 7.765 -5.335 1.00 0.00 N ATOM 0 H ASN A 39 5.363 4.241 -5.022 1.00 0.00 H new ATOM 0 HA ASN A 39 8.019 3.926 -4.127 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.259 5.285 -6.077 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.485 6.414 -4.983 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.434 8.335 -5.280 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.721 8.172 -5.681 1.00 0.00 H new ATOM 628 N MET A 40 6.050 5.790 -2.244 1.00 0.00 N ATOM 629 CA MET A 40 5.895 6.384 -0.918 1.00 0.00 C ATOM 630 C MET A 40 6.124 5.348 0.177 1.00 0.00 C ATOM 631 O MET A 40 6.929 5.566 1.081 1.00 0.00 O ATOM 632 CB MET A 40 4.502 7.002 -0.762 1.00 0.00 C ATOM 633 CG MET A 40 4.287 8.247 -1.604 1.00 0.00 C ATOM 634 SD MET A 40 2.584 8.837 -1.563 1.00 0.00 S ATOM 635 CE MET A 40 2.364 9.144 0.188 1.00 0.00 C ATOM 0 H MET A 40 5.224 5.869 -2.837 1.00 0.00 H new ATOM 0 HA MET A 40 6.645 7.168 -0.818 1.00 0.00 H new ATOM 0 HB2 MET A 40 3.752 6.258 -1.032 1.00 0.00 H new ATOM 0 HB3 MET A 40 4.341 7.251 0.287 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.949 9.038 -1.250 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.568 8.035 -2.636 1.00 0.00 H new ATOM 0 HE1 MET A 40 1.734 10.022 0.327 1.00 0.00 H new ATOM 0 HE2 MET A 40 1.889 8.279 0.652 1.00 0.00 H new ATOM 0 HE3 MET A 40 3.335 9.317 0.652 1.00 0.00 H new ATOM 645 N VAL A 41 5.424 4.221 0.082 1.00 0.00 N ATOM 646 CA VAL A 41 5.535 3.161 1.082 1.00 0.00 C ATOM 647 C VAL A 41 6.966 2.627 1.155 1.00 0.00 C ATOM 648 O VAL A 41 7.508 2.433 2.245 1.00 0.00 O ATOM 649 CB VAL A 41 4.564 1.994 0.787 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.695 0.896 1.835 1.00 0.00 C ATOM 651 CG2 VAL A 41 3.128 2.495 0.722 1.00 0.00 C ATOM 0 H VAL A 41 4.774 4.017 -0.677 1.00 0.00 H new ATOM 0 HA VAL A 41 5.266 3.600 2.042 1.00 0.00 H new ATOM 0 HB VAL A 41 4.830 1.573 -0.183 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.001 0.088 1.604 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.715 0.511 1.833 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.463 1.303 2.819 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.460 1.659 0.514 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.857 2.947 1.676 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.037 3.238 -0.070 1.00 0.00 H new ATOM 661 N THR A 42 7.576 2.418 -0.008 1.00 0.00 N ATOM 662 CA THR A 42 8.944 1.921 -0.082 1.00 0.00 C ATOM 663 C THR A 42 9.905 2.826 0.688 1.00 0.00 C ATOM 664 O THR A 42 10.611 2.376 1.593 1.00 0.00 O ATOM 665 CB THR A 42 9.421 1.811 -1.545 1.00 0.00 C ATOM 666 OG1 THR A 42 8.569 0.921 -2.281 1.00 0.00 O ATOM 667 CG2 THR A 42 10.859 1.316 -1.612 1.00 0.00 C ATOM 0 H THR A 42 7.141 2.586 -0.915 1.00 0.00 H new ATOM 0 HA THR A 42 8.945 0.930 0.371 1.00 0.00 H new ATOM 0 HB THR A 42 9.373 2.805 -1.990 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.806 1.421 -2.640 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.172 1.247 -2.654 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.509 2.013 -1.083 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.927 0.333 -1.147 1.00 0.00 H new ATOM 675 N ASN A 43 9.910 4.107 0.339 1.00 0.00 N ATOM 676 CA ASN A 43 10.835 5.058 0.944 1.00 0.00 C ATOM 677 C ASN A 43 10.515 5.284 2.417 1.00 0.00 C ATOM 678 O ASN A 43 11.416 5.494 3.227 1.00 0.00 O ATOM 679 CB ASN A 43 10.813 6.393 0.191 1.00 0.00 C ATOM 680 CG ASN A 43 11.340 6.268 -1.226 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.194 5.428 -1.517 1.00 0.00 O ATOM 682 ND2 ASN A 43 10.842 7.110 -2.117 1.00 0.00 N ATOM 0 H ASN A 43 9.285 4.511 -0.359 1.00 0.00 H new ATOM 0 HA ASN A 43 11.835 4.631 0.874 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.792 6.774 0.164 1.00 0.00 H new ATOM 0 HB3 ASN A 43 11.412 7.124 0.735 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.164 7.078 -3.084 1.00 0.00 H new ATOM 0 HD22 ASN A 43 10.136 7.791 -1.836 1.00 0.00 H new ATOM 689 N LEU A 44 9.233 5.223 2.761 1.00 0.00 N ATOM 690 CA LEU A 44 8.799 5.417 4.140 1.00 0.00 C ATOM 691 C LEU A 44 9.405 4.351 5.051 1.00 0.00 C ATOM 692 O LEU A 44 10.067 4.671 6.037 1.00 0.00 O ATOM 693 CB LEU A 44 7.270 5.379 4.227 1.00 0.00 C ATOM 694 CG LEU A 44 6.683 5.705 5.603 1.00 0.00 C ATOM 695 CD1 LEU A 44 7.029 7.130 6.009 1.00 0.00 C ATOM 696 CD2 LEU A 44 5.176 5.500 5.599 1.00 0.00 C ATOM 0 H LEU A 44 8.475 5.041 2.103 1.00 0.00 H new ATOM 0 HA LEU A 44 9.146 6.395 4.474 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.864 6.084 3.501 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.931 4.386 3.932 1.00 0.00 H new ATOM 0 HG LEU A 44 7.121 5.026 6.335 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.603 7.343 6.990 1.00 0.00 H new ATOM 0 HD12 LEU A 44 8.112 7.243 6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.620 7.826 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.774 5.736 6.584 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.722 6.155 4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.951 4.462 5.354 1.00 0.00 H new ATOM 708 N ILE A 45 9.200 3.088 4.696 1.00 0.00 N ATOM 709 CA ILE A 45 9.711 1.976 5.496 1.00 0.00 C ATOM 710 C ILE A 45 11.240 1.952 5.480 1.00 0.00 C ATOM 711 O ILE A 45 11.882 1.610 6.476 1.00 0.00 O ATOM 712 CB ILE A 45 9.164 0.621 4.985 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.633 0.622 5.022 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.715 -0.534 5.813 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.006 -0.647 4.483 1.00 0.00 C ATOM 0 H ILE A 45 8.685 2.806 3.862 1.00 0.00 H new ATOM 0 HA ILE A 45 9.369 2.126 6.520 1.00 0.00 H new ATOM 0 HB ILE A 45 9.491 0.485 3.954 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.304 0.770 6.051 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.266 1.471 4.445 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.316 -1.475 5.435 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.803 -0.546 5.742 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.421 -0.408 6.855 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.920 -0.570 4.543 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.303 -0.787 3.444 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.342 -1.499 5.074 1.00 0.00 H new ATOM 727 N ASN A 46 11.810 2.351 4.353 1.00 0.00 N ATOM 728 CA ASN A 46 13.256 2.327 4.161 1.00 0.00 C ATOM 729 C ASN A 46 13.962 3.378 5.019 1.00 0.00 C ATOM 730 O ASN A 46 15.124 3.210 5.384 1.00 0.00 O ATOM 731 CB ASN A 46 13.584 2.544 2.678 1.00 0.00 C ATOM 732 CG ASN A 46 15.073 2.548 2.385 1.00 0.00 C ATOM 733 OD1 ASN A 46 15.717 3.596 2.396 1.00 0.00 O ATOM 734 ND2 ASN A 46 15.628 1.377 2.112 1.00 0.00 N ATOM 0 H ASN A 46 11.288 2.699 3.549 1.00 0.00 H new ATOM 0 HA ASN A 46 13.621 1.350 4.478 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.107 1.760 2.090 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.155 3.492 2.353 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.624 1.322 1.901 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.059 0.530 2.113 1.00 0.00 H new ATOM 741 N THR A 47 13.263 4.457 5.354 1.00 0.00 N ATOM 742 CA THR A 47 13.897 5.562 6.063 1.00 0.00 C ATOM 743 C THR A 47 13.381 5.729 7.494 1.00 0.00 C ATOM 744 O THR A 47 14.164 5.966 8.414 1.00 0.00 O ATOM 745 CB THR A 47 13.697 6.888 5.305 1.00 0.00 C ATOM 746 OG1 THR A 47 12.297 7.140 5.113 1.00 0.00 O ATOM 747 CG2 THR A 47 14.403 6.859 3.956 1.00 0.00 C ATOM 0 H THR A 47 12.272 4.590 5.150 1.00 0.00 H new ATOM 0 HA THR A 47 14.957 5.313 6.114 1.00 0.00 H new ATOM 0 HB THR A 47 14.131 7.688 5.904 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.918 6.452 4.527 1.00 0.00 H new ATOM 0 HG21 THR A 47 14.245 7.807 3.442 1.00 0.00 H new ATOM 0 HG22 THR A 47 15.471 6.702 4.108 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.999 6.047 3.351 1.00 0.00 H new ATOM 755 N SER A 48 12.073 5.608 7.682 1.00 0.00 N ATOM 756 CA SER A 48 11.454 5.955 8.958 1.00 0.00 C ATOM 757 C SER A 48 11.375 4.763 9.912 1.00 0.00 C ATOM 758 O SER A 48 11.088 4.933 11.095 1.00 0.00 O ATOM 759 CB SER A 48 10.058 6.524 8.709 1.00 0.00 C ATOM 760 OG SER A 48 10.107 7.576 7.758 1.00 0.00 O ATOM 0 H SER A 48 11.422 5.274 6.972 1.00 0.00 H new ATOM 0 HA SER A 48 12.083 6.705 9.438 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.397 5.735 8.352 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.638 6.892 9.645 1.00 0.00 H new ATOM 0 HG SER A 48 10.119 7.199 6.853 1.00 0.00 H new ATOM 766 N ILE A 49 11.620 3.562 9.404 1.00 0.00 N ATOM 767 CA ILE A 49 11.568 2.370 10.240 1.00 0.00 C ATOM 768 C ILE A 49 12.980 1.842 10.498 1.00 0.00 C ATOM 769 O ILE A 49 13.824 1.850 9.598 1.00 0.00 O ATOM 770 CB ILE A 49 10.677 1.252 9.617 1.00 0.00 C ATOM 771 CG1 ILE A 49 9.187 1.630 9.669 1.00 0.00 C ATOM 772 CG2 ILE A 49 10.889 -0.076 10.328 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.774 2.720 8.703 1.00 0.00 C ATOM 0 H ILE A 49 11.855 3.388 8.427 1.00 0.00 H new ATOM 0 HA ILE A 49 11.112 2.657 11.187 1.00 0.00 H new ATOM 0 HB ILE A 49 10.976 1.148 8.574 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.593 0.739 9.465 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.943 1.950 10.682 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.255 -0.837 9.873 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.934 -0.373 10.240 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.630 0.030 11.381 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.708 2.918 8.812 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.336 3.629 8.918 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.981 2.399 7.682 1.00 0.00 H new ATOM 785 N ALA A 50 13.224 1.411 11.739 1.00 0.00 N ATOM 786 CA ALA A 50 14.530 0.910 12.178 1.00 0.00 C ATOM 787 C ALA A 50 15.151 -0.065 11.178 1.00 0.00 C ATOM 788 O ALA A 50 14.458 -0.910 10.601 1.00 0.00 O ATOM 789 CB ALA A 50 14.399 0.248 13.541 1.00 0.00 C ATOM 0 H ALA A 50 12.516 1.400 12.473 1.00 0.00 H new ATOM 0 HA ALA A 50 15.199 1.768 12.245 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.373 -0.122 13.861 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.031 0.975 14.265 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.698 -0.584 13.475 1.00 0.00 H new ATOM 795 N PRO A 51 16.480 0.037 10.981 1.00 0.00 N ATOM 796 CA PRO A 51 17.233 -0.760 9.996 1.00 0.00 C ATOM 797 C PRO A 51 17.391 -2.229 10.390 1.00 0.00 C ATOM 798 O PRO A 51 18.486 -2.787 10.328 1.00 0.00 O ATOM 799 CB PRO A 51 18.612 -0.079 9.953 1.00 0.00 C ATOM 800 CG PRO A 51 18.460 1.200 10.708 1.00 0.00 C ATOM 801 CD PRO A 51 17.365 0.961 11.701 1.00 0.00 C ATOM 0 HA PRO A 51 16.712 -0.784 9.039 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.375 -0.712 10.407 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.923 0.109 8.925 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.389 1.471 11.209 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.207 2.022 10.038 1.00 0.00 H new ATOM 0 HD2 PRO A 51 17.743 0.524 12.625 1.00 0.00 H new ATOM 0 HD3 PRO A 51 16.854 1.885 11.972 1.00 0.00 H new ATOM 809 N ALA A 52 16.293 -2.854 10.777 1.00 0.00 N ATOM 810 CA ALA A 52 16.291 -4.270 11.108 1.00 0.00 C ATOM 811 C ALA A 52 14.911 -4.862 10.876 1.00 0.00 C ATOM 812 O ALA A 52 14.724 -5.717 10.016 1.00 0.00 O ATOM 813 CB ALA A 52 16.726 -4.487 12.550 1.00 0.00 C ATOM 0 H ALA A 52 15.384 -2.400 10.871 1.00 0.00 H new ATOM 0 HA ALA A 52 17.004 -4.777 10.457 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.717 -5.553 12.776 1.00 0.00 H new ATOM 0 HB2 ALA A 52 17.733 -4.095 12.689 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.039 -3.969 13.219 1.00 0.00 H new ATOM 819 N GLN A 53 13.932 -4.359 11.620 1.00 0.00 N ATOM 820 CA GLN A 53 12.573 -4.883 11.551 1.00 0.00 C ATOM 821 C GLN A 53 11.806 -4.297 10.369 1.00 0.00 C ATOM 822 O GLN A 53 10.648 -4.637 10.149 1.00 0.00 O ATOM 823 CB GLN A 53 11.826 -4.596 12.856 1.00 0.00 C ATOM 824 CG GLN A 53 11.817 -3.126 13.241 1.00 0.00 C ATOM 825 CD GLN A 53 12.528 -2.855 14.555 1.00 0.00 C ATOM 826 OE1 GLN A 53 13.500 -3.689 14.899 1.00 0.00 O flip ATOM 827 NE2 GLN A 53 12.197 -1.909 15.264 1.00 0.00 N flip ATOM 0 H GLN A 53 14.054 -3.589 12.278 1.00 0.00 H new ATOM 0 HA GLN A 53 12.641 -5.961 11.406 1.00 0.00 H new ATOM 0 HB2 GLN A 53 10.798 -4.944 12.760 1.00 0.00 H new ATOM 0 HB3 GLN A 53 12.284 -5.171 13.661 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.292 -2.546 12.450 1.00 0.00 H new ATOM 0 HG3 GLN A 53 10.786 -2.781 13.314 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.444 -1.288 14.967 1.00 0.00 H new ATOM 0 HE22 GLN A 53 12.675 -1.744 16.150 1.00 0.00 H new ATOM 836 N ARG A 54 12.458 -3.428 9.604 1.00 0.00 N ATOM 837 CA ARG A 54 11.826 -2.805 8.443 1.00 0.00 C ATOM 838 C ARG A 54 11.367 -3.856 7.436 1.00 0.00 C ATOM 839 O ARG A 54 10.304 -3.724 6.834 1.00 0.00 O ATOM 840 CB ARG A 54 12.771 -1.795 7.780 1.00 0.00 C ATOM 841 CG ARG A 54 14.171 -2.326 7.530 1.00 0.00 C ATOM 842 CD ARG A 54 15.037 -1.300 6.819 1.00 0.00 C ATOM 843 NE ARG A 54 15.102 -0.028 7.539 1.00 0.00 N ATOM 844 CZ ARG A 54 16.026 0.909 7.316 1.00 0.00 C ATOM 845 NH1 ARG A 54 17.016 0.684 6.460 1.00 0.00 N ATOM 846 NH2 ARG A 54 15.969 2.063 7.972 1.00 0.00 N ATOM 0 H ARG A 54 13.423 -3.138 9.765 1.00 0.00 H new ATOM 0 HA ARG A 54 10.945 -2.267 8.794 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.339 -1.479 6.830 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.838 -0.908 8.410 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.633 -2.598 8.479 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.115 -3.235 6.930 1.00 0.00 H new ATOM 0 HD2 ARG A 54 16.044 -1.699 6.701 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.643 -1.128 5.818 1.00 0.00 H new ATOM 0 HE ARG A 54 14.398 0.154 8.255 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.073 -0.208 5.969 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.719 1.404 6.293 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.220 2.231 8.644 1.00 0.00 H new ATOM 0 HH22 ARG A 54 16.674 2.781 7.804 1.00 0.00 H new ATOM 860 N GLN A 55 12.153 -4.913 7.282 1.00 0.00 N ATOM 861 CA GLN A 55 11.792 -5.999 6.381 1.00 0.00 C ATOM 862 C GLN A 55 10.661 -6.829 6.983 1.00 0.00 C ATOM 863 O GLN A 55 9.757 -7.272 6.274 1.00 0.00 O ATOM 864 CB GLN A 55 13.006 -6.881 6.095 1.00 0.00 C ATOM 865 CG GLN A 55 14.124 -6.163 5.353 1.00 0.00 C ATOM 866 CD GLN A 55 13.705 -5.667 3.983 1.00 0.00 C ATOM 867 OE1 GLN A 55 12.823 -6.239 3.344 1.00 0.00 O ATOM 868 NE2 GLN A 55 14.346 -4.610 3.511 1.00 0.00 N ATOM 0 H GLN A 55 13.041 -5.041 7.767 1.00 0.00 H new ATOM 0 HA GLN A 55 11.448 -5.571 5.439 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.396 -7.264 7.038 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.688 -7.743 5.508 1.00 0.00 H new ATOM 0 HG2 GLN A 55 14.464 -5.317 5.951 1.00 0.00 H new ATOM 0 HG3 GLN A 55 14.973 -6.839 5.245 1.00 0.00 H new ATOM 0 HE21 GLN A 55 15.072 -4.162 4.070 1.00 0.00 H new ATOM 0 HE22 GLN A 55 14.114 -4.243 2.588 1.00 0.00 H new ATOM 877 N ALA A 56 10.706 -7.015 8.299 1.00 0.00 N ATOM 878 CA ALA A 56 9.671 -7.759 9.008 1.00 0.00 C ATOM 879 C ALA A 56 8.327 -7.044 8.915 1.00 0.00 C ATOM 880 O ALA A 56 7.283 -7.681 8.786 1.00 0.00 O ATOM 881 CB ALA A 56 10.064 -7.963 10.464 1.00 0.00 C ATOM 0 H ALA A 56 11.451 -6.659 8.897 1.00 0.00 H new ATOM 0 HA ALA A 56 9.571 -8.736 8.534 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.280 -8.520 10.978 1.00 0.00 H new ATOM 0 HB2 ALA A 56 10.998 -8.522 10.514 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.195 -6.994 10.945 1.00 0.00 H new ATOM 887 N ILE A 57 8.361 -5.716 8.980 1.00 0.00 N ATOM 888 CA ILE A 57 7.158 -4.909 8.820 1.00 0.00 C ATOM 889 C ILE A 57 6.589 -5.077 7.412 1.00 0.00 C ATOM 890 O ILE A 57 5.380 -5.218 7.240 1.00 0.00 O ATOM 891 CB ILE A 57 7.428 -3.409 9.128 1.00 0.00 C ATOM 892 CG1 ILE A 57 7.171 -3.102 10.610 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.578 -2.490 8.256 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.032 -3.891 11.575 1.00 0.00 C ATOM 0 H ILE A 57 9.211 -5.176 9.143 1.00 0.00 H new ATOM 0 HA ILE A 57 6.421 -5.263 9.541 1.00 0.00 H new ATOM 0 HB ILE A 57 8.477 -3.219 8.899 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.337 -2.038 10.781 1.00 0.00 H new ATOM 0 HG13 ILE A 57 6.123 -3.301 10.832 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.796 -1.451 8.502 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.807 -2.670 7.206 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.522 -2.691 8.436 1.00 0.00 H new ATOM 0 HD11 ILE A 57 7.783 -3.610 12.598 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.850 -4.957 11.437 1.00 0.00 H new ATOM 0 HD13 ILE A 57 9.083 -3.675 11.385 1.00 0.00 H new ATOM 906 N ALA A 58 7.467 -5.093 6.415 1.00 0.00 N ATOM 907 CA ALA A 58 7.048 -5.297 5.035 1.00 0.00 C ATOM 908 C ALA A 58 6.415 -6.675 4.866 1.00 0.00 C ATOM 909 O ALA A 58 5.382 -6.824 4.210 1.00 0.00 O ATOM 910 CB ALA A 58 8.231 -5.136 4.092 1.00 0.00 C ATOM 0 H ALA A 58 8.472 -4.967 6.537 1.00 0.00 H new ATOM 0 HA ALA A 58 6.302 -4.543 4.786 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.901 -5.292 3.065 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.643 -4.132 4.193 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.998 -5.869 4.342 1.00 0.00 H new ATOM 916 N ASN A 59 7.038 -7.677 5.475 1.00 0.00 N ATOM 917 CA ASN A 59 6.531 -9.045 5.434 1.00 0.00 C ATOM 918 C ASN A 59 5.179 -9.154 6.130 1.00 0.00 C ATOM 919 O ASN A 59 4.220 -9.668 5.558 1.00 0.00 O ATOM 920 CB ASN A 59 7.528 -10.011 6.084 1.00 0.00 C ATOM 921 CG ASN A 59 8.728 -10.297 5.200 1.00 0.00 C ATOM 922 OD1 ASN A 59 8.617 -10.333 3.976 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.884 -10.497 5.813 1.00 0.00 N ATOM 0 H ASN A 59 7.901 -7.567 6.007 1.00 0.00 H new ATOM 0 HA ASN A 59 6.403 -9.317 4.386 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.871 -9.591 7.030 1.00 0.00 H new ATOM 0 HB3 ASN A 59 7.021 -10.948 6.316 1.00 0.00 H new ATOM 0 HD21 ASN A 59 10.724 -10.689 5.267 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.935 -10.459 6.831 1.00 0.00 H new ATOM 930 N SER A 60 5.103 -8.656 7.360 1.00 0.00 N ATOM 931 CA SER A 60 3.877 -8.748 8.145 1.00 0.00 C ATOM 932 C SER A 60 2.738 -7.965 7.493 1.00 0.00 C ATOM 933 O SER A 60 1.596 -8.425 7.476 1.00 0.00 O ATOM 934 CB SER A 60 4.121 -8.258 9.575 1.00 0.00 C ATOM 935 OG SER A 60 4.763 -6.993 9.588 1.00 0.00 O ATOM 0 H SER A 60 5.874 -8.186 7.834 1.00 0.00 H new ATOM 0 HA SER A 60 3.579 -9.796 8.181 1.00 0.00 H new ATOM 0 HB2 SER A 60 3.171 -8.191 10.105 1.00 0.00 H new ATOM 0 HB3 SER A 60 4.734 -8.984 10.110 1.00 0.00 H new ATOM 0 HG SER A 60 5.722 -7.111 9.424 1.00 0.00 H new ATOM 941 N PHE A 61 3.053 -6.793 6.945 1.00 0.00 N ATOM 942 CA PHE A 61 2.058 -5.978 6.255 1.00 0.00 C ATOM 943 C PHE A 61 1.490 -6.738 5.062 1.00 0.00 C ATOM 944 O PHE A 61 0.281 -6.731 4.827 1.00 0.00 O ATOM 945 CB PHE A 61 2.670 -4.651 5.794 1.00 0.00 C ATOM 946 CG PHE A 61 1.692 -3.731 5.116 1.00 0.00 C ATOM 947 CD1 PHE A 61 0.839 -2.936 5.866 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.622 -3.661 3.731 1.00 0.00 C ATOM 949 CE1 PHE A 61 -0.063 -2.090 5.250 1.00 0.00 C ATOM 950 CE2 PHE A 61 0.720 -2.817 3.112 1.00 0.00 C ATOM 951 CZ PHE A 61 -0.123 -2.030 3.871 1.00 0.00 C ATOM 0 H PHE A 61 3.989 -6.388 6.966 1.00 0.00 H new ATOM 0 HA PHE A 61 1.249 -5.760 6.952 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.096 -4.140 6.657 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.492 -4.860 5.109 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.880 -2.979 6.944 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.280 -4.273 3.131 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.721 -1.476 5.846 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.674 -2.773 2.034 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.828 -1.369 3.388 1.00 0.00 H new ATOM 961 N ALA A 62 2.367 -7.405 4.321 1.00 0.00 N ATOM 962 CA ALA A 62 1.954 -8.200 3.175 1.00 0.00 C ATOM 963 C ALA A 62 1.043 -9.340 3.615 1.00 0.00 C ATOM 964 O ALA A 62 0.027 -9.618 2.979 1.00 0.00 O ATOM 965 CB ALA A 62 3.169 -8.744 2.438 1.00 0.00 C ATOM 0 H ALA A 62 3.372 -7.410 4.496 1.00 0.00 H new ATOM 0 HA ALA A 62 1.396 -7.557 2.494 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.841 -9.336 1.584 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.785 -7.915 2.090 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.753 -9.371 3.112 1.00 0.00 H new ATOM 971 N ARG A 63 1.403 -9.985 4.720 1.00 0.00 N ATOM 972 CA ARG A 63 0.609 -11.085 5.256 1.00 0.00 C ATOM 973 C ARG A 63 -0.732 -10.577 5.774 1.00 0.00 C ATOM 974 O ARG A 63 -1.753 -11.258 5.660 1.00 0.00 O ATOM 975 CB ARG A 63 1.364 -11.805 6.373 1.00 0.00 C ATOM 976 CG ARG A 63 2.721 -12.339 5.947 1.00 0.00 C ATOM 977 CD ARG A 63 3.300 -13.275 6.989 1.00 0.00 C ATOM 978 NE ARG A 63 2.523 -14.509 7.095 1.00 0.00 N ATOM 979 CZ ARG A 63 2.817 -15.508 7.920 1.00 0.00 C ATOM 980 NH1 ARG A 63 3.844 -15.402 8.757 1.00 0.00 N ATOM 981 NH2 ARG A 63 2.078 -16.611 7.924 1.00 0.00 N ATOM 0 H ARG A 63 2.239 -9.765 5.262 1.00 0.00 H new ATOM 0 HA ARG A 63 0.427 -11.793 4.448 1.00 0.00 H new ATOM 0 HB2 ARG A 63 1.500 -11.119 7.209 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.755 -12.633 6.736 1.00 0.00 H new ATOM 0 HG2 ARG A 63 2.625 -12.865 4.997 1.00 0.00 H new ATOM 0 HG3 ARG A 63 3.406 -11.507 5.783 1.00 0.00 H new ATOM 0 HD2 ARG A 63 4.331 -13.515 6.731 1.00 0.00 H new ATOM 0 HD3 ARG A 63 3.322 -12.774 7.957 1.00 0.00 H new ATOM 0 HE ARG A 63 1.703 -14.609 6.497 1.00 0.00 H new ATOM 0 HH11 ARG A 63 4.408 -14.552 8.767 1.00 0.00 H new ATOM 0 HH12 ARG A 63 4.068 -16.170 9.390 1.00 0.00 H new ATOM 0 HH21 ARG A 63 1.281 -16.694 7.292 1.00 0.00 H new ATOM 0 HH22 ARG A 63 2.307 -17.376 8.559 1.00 0.00 H new ATOM 995 N ALA A 64 -0.725 -9.378 6.345 1.00 0.00 N ATOM 996 CA ALA A 64 -1.951 -8.739 6.799 1.00 0.00 C ATOM 997 C ALA A 64 -2.859 -8.446 5.612 1.00 0.00 C ATOM 998 O ALA A 64 -4.073 -8.632 5.686 1.00 0.00 O ATOM 999 CB ALA A 64 -1.638 -7.459 7.561 1.00 0.00 C ATOM 0 H ALA A 64 0.120 -8.829 6.504 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.468 -9.419 7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.568 -6.996 7.892 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.020 -7.693 8.428 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.101 -6.770 6.909 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.255 -8.002 4.515 1.00 0.00 N ATOM 1006 CA LEU A 65 -2.981 -7.749 3.278 1.00 0.00 C ATOM 1007 C LEU A 65 -3.636 -9.037 2.780 1.00 0.00 C ATOM 1008 O LEU A 65 -4.823 -9.057 2.451 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.026 -7.188 2.218 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.675 -6.754 0.905 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.644 -5.606 1.144 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.609 -6.353 -0.103 1.00 0.00 C ATOM 0 H LEU A 65 -1.255 -7.809 4.459 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.764 -7.014 3.468 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.503 -6.332 2.644 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.273 -7.944 1.997 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.236 -7.596 0.499 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.097 -5.309 0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.424 -5.926 1.835 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.106 -4.759 1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.086 -6.046 -1.034 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.024 -5.524 0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.952 -7.201 -0.294 1.00 0.00 H new ATOM 1024 N GLN A 66 -2.856 -10.116 2.759 1.00 0.00 N ATOM 1025 CA GLN A 66 -3.350 -11.428 2.347 1.00 0.00 C ATOM 1026 C GLN A 66 -4.512 -11.880 3.233 1.00 0.00 C ATOM 1027 O GLN A 66 -5.489 -12.457 2.750 1.00 0.00 O ATOM 1028 CB GLN A 66 -2.218 -12.460 2.406 1.00 0.00 C ATOM 1029 CG GLN A 66 -1.071 -12.165 1.452 1.00 0.00 C ATOM 1030 CD GLN A 66 0.122 -13.078 1.671 1.00 0.00 C ATOM 1031 OE1 GLN A 66 0.376 -13.530 2.787 1.00 0.00 O ATOM 1032 NE2 GLN A 66 0.863 -13.352 0.609 1.00 0.00 N ATOM 0 H GLN A 66 -1.871 -10.106 3.025 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.711 -11.347 1.322 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.830 -12.503 3.424 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -2.624 -13.445 2.178 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.421 -12.271 0.425 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.758 -11.128 1.576 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.618 -12.957 -0.299 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.678 -13.958 0.699 1.00 0.00 H new ATOM 1041 N SER A 67 -4.407 -11.592 4.525 1.00 0.00 N ATOM 1042 CA SER A 67 -5.429 -11.983 5.487 1.00 0.00 C ATOM 1043 C SER A 67 -6.665 -11.089 5.382 1.00 0.00 C ATOM 1044 O SER A 67 -7.758 -11.478 5.797 1.00 0.00 O ATOM 1045 CB SER A 67 -4.855 -11.931 6.903 1.00 0.00 C ATOM 1046 OG SER A 67 -3.705 -12.755 7.015 1.00 0.00 O ATOM 0 H SER A 67 -3.620 -11.086 4.932 1.00 0.00 H new ATOM 0 HA SER A 67 -5.738 -13.003 5.260 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.597 -10.903 7.157 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.611 -12.256 7.618 1.00 0.00 H new ATOM 0 HG SER A 67 -2.948 -12.323 6.567 1.00 0.00 H new ATOM 1052 N SER A 68 -6.492 -9.895 4.826 1.00 0.00 N ATOM 1053 CA SER A 68 -7.600 -8.968 4.643 1.00 0.00 C ATOM 1054 C SER A 68 -8.430 -9.362 3.423 1.00 0.00 C ATOM 1055 O SER A 68 -9.623 -9.060 3.343 1.00 0.00 O ATOM 1056 CB SER A 68 -7.077 -7.538 4.507 1.00 0.00 C ATOM 1057 OG SER A 68 -6.333 -7.164 5.659 1.00 0.00 O ATOM 0 H SER A 68 -5.593 -9.547 4.494 1.00 0.00 H new ATOM 0 HA SER A 68 -8.244 -9.015 5.521 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.448 -7.458 3.620 1.00 0.00 H new ATOM 0 HB3 SER A 68 -7.912 -6.851 4.369 1.00 0.00 H new ATOM 0 HG SER A 68 -5.414 -7.495 5.577 1.00 0.00 H new ATOM 1063 N ILE A 69 -7.791 -10.046 2.482 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.480 -10.565 1.310 1.00 0.00 C ATOM 1065 C ILE A 69 -9.337 -11.771 1.697 1.00 0.00 C ATOM 1066 O ILE A 69 -8.813 -12.834 2.030 1.00 0.00 O ATOM 1067 CB ILE A 69 -7.477 -10.977 0.205 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -6.604 -9.784 -0.206 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -8.206 -11.543 -1.006 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -7.383 -8.615 -0.775 1.00 0.00 C ATOM 0 H ILE A 69 -6.793 -10.254 2.509 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.117 -9.772 0.918 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.831 -11.756 0.610 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.041 -9.443 0.663 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.877 -10.117 -0.947 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -7.480 -11.825 -1.769 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -8.779 -12.421 -0.708 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.881 -10.789 -1.410 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -6.694 -7.813 -1.041 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.925 -8.937 -1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.091 -8.253 -0.030 1.00 0.00 H new ATOM 1082 N ASN A 70 -10.653 -11.590 1.675 1.00 0.00 N ATOM 1083 CA ASN A 70 -11.590 -12.649 2.039 1.00 0.00 C ATOM 1084 C ASN A 70 -12.709 -12.731 1.011 1.00 0.00 C ATOM 1085 O ASN A 70 -13.462 -11.776 0.831 1.00 0.00 O ATOM 1086 CB ASN A 70 -12.180 -12.398 3.432 1.00 0.00 C ATOM 1087 CG ASN A 70 -11.152 -12.528 4.542 1.00 0.00 C ATOM 1088 OD1 ASN A 70 -10.971 -13.600 5.119 1.00 0.00 O ATOM 1089 ND2 ASN A 70 -10.473 -11.435 4.853 1.00 0.00 N ATOM 0 H ASN A 70 -11.099 -10.713 1.407 1.00 0.00 H new ATOM 0 HA ASN A 70 -11.048 -13.595 2.058 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -12.615 -11.399 3.462 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -12.991 -13.104 3.610 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -9.772 -11.463 5.593 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -10.651 -10.564 4.352 1.00 0.00 H new ATOM 1096 N GLU A 71 -12.818 -13.874 0.349 1.00 0.00 N ATOM 1097 CA GLU A 71 -13.739 -14.029 -0.772 1.00 0.00 C ATOM 1098 C GLU A 71 -15.185 -14.237 -0.318 1.00 0.00 C ATOM 1099 O GLU A 71 -15.995 -13.309 -0.356 1.00 0.00 O ATOM 1100 CB GLU A 71 -13.296 -15.186 -1.676 1.00 0.00 C ATOM 1101 CG GLU A 71 -12.186 -14.829 -2.659 1.00 0.00 C ATOM 1102 CD GLU A 71 -10.995 -14.157 -2.006 1.00 0.00 C ATOM 1103 OE1 GLU A 71 -10.192 -14.857 -1.351 1.00 0.00 O ATOM 1104 OE2 GLU A 71 -10.873 -12.920 -2.136 1.00 0.00 O ATOM 0 H GLU A 71 -12.279 -14.711 0.569 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.709 -13.097 -1.337 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.958 -16.011 -1.049 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -14.160 -15.544 -2.236 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.851 -15.736 -3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.590 -14.169 -3.427 1.00 0.00 H new ATOM 1111 N ASP A 72 -15.501 -15.445 0.128 1.00 0.00 N ATOM 1112 CA ASP A 72 -16.885 -15.816 0.428 1.00 0.00 C ATOM 1113 C ASP A 72 -17.190 -15.644 1.908 1.00 0.00 C ATOM 1114 O ASP A 72 -18.132 -16.241 2.430 1.00 0.00 O ATOM 1115 CB ASP A 72 -17.150 -17.272 0.026 1.00 0.00 C ATOM 1116 CG ASP A 72 -16.788 -17.566 -1.414 1.00 0.00 C ATOM 1117 OD1 ASP A 72 -17.579 -17.222 -2.317 1.00 0.00 O ATOM 1118 OD2 ASP A 72 -15.708 -18.151 -1.648 1.00 0.00 O ATOM 0 H ASP A 72 -14.821 -16.187 0.291 1.00 0.00 H new ATOM 0 HA ASP A 72 -17.534 -15.155 -0.146 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -16.580 -17.933 0.680 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -18.204 -17.500 0.183 1.00 0.00 H new ATOM 1123 N LYS A 73 -16.390 -14.828 2.579 1.00 0.00 N ATOM 1124 CA LYS A 73 -16.542 -14.617 4.012 1.00 0.00 C ATOM 1125 C LYS A 73 -17.838 -13.873 4.326 1.00 0.00 C ATOM 1126 O LYS A 73 -18.628 -14.308 5.166 1.00 0.00 O ATOM 1127 CB LYS A 73 -15.349 -13.835 4.565 1.00 0.00 C ATOM 1128 CG LYS A 73 -15.382 -13.668 6.073 1.00 0.00 C ATOM 1129 CD LYS A 73 -14.211 -12.841 6.572 1.00 0.00 C ATOM 1130 CE LYS A 73 -14.177 -12.796 8.091 1.00 0.00 C ATOM 1131 NZ LYS A 73 -14.067 -14.157 8.680 1.00 0.00 N ATOM 0 H LYS A 73 -15.628 -14.300 2.154 1.00 0.00 H new ATOM 0 HA LYS A 73 -16.583 -15.596 4.490 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -14.428 -14.346 4.284 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -15.322 -12.850 4.099 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -16.317 -13.189 6.366 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -15.364 -14.649 6.548 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -13.279 -13.263 6.197 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -14.284 -11.828 6.177 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -13.333 -12.189 8.418 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -15.081 -12.311 8.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.712 -14.086 9.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -15.003 -14.610 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -13.409 -14.729 8.113 1.00 0.00 H new ATOM 1145 N ALA A 74 -18.053 -12.759 3.644 1.00 0.00 N ATOM 1146 CA ALA A 74 -19.214 -11.925 3.903 1.00 0.00 C ATOM 1147 C ALA A 74 -20.275 -12.122 2.831 1.00 0.00 C ATOM 1148 O ALA A 74 -19.962 -12.248 1.646 1.00 0.00 O ATOM 1149 CB ALA A 74 -18.806 -10.463 3.987 1.00 0.00 C ATOM 0 H ALA A 74 -17.439 -12.412 2.907 1.00 0.00 H new ATOM 0 HA ALA A 74 -19.642 -12.223 4.860 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -19.686 -9.850 4.181 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -18.087 -10.332 4.795 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -18.352 -10.157 3.044 1.00 0.00 H new ATOM 1155 N HIS A 75 -21.527 -12.169 3.253 1.00 0.00 N ATOM 1156 CA HIS A 75 -22.643 -12.312 2.331 1.00 0.00 C ATOM 1157 C HIS A 75 -23.461 -11.027 2.305 1.00 0.00 C ATOM 1158 O HIS A 75 -24.220 -10.739 3.230 1.00 0.00 O ATOM 1159 CB HIS A 75 -23.528 -13.498 2.727 1.00 0.00 C ATOM 1160 CG HIS A 75 -22.793 -14.804 2.785 1.00 0.00 C ATOM 1161 ND1 HIS A 75 -22.595 -15.503 3.957 1.00 0.00 N ATOM 1162 CD2 HIS A 75 -22.209 -15.540 1.809 1.00 0.00 C ATOM 1163 CE1 HIS A 75 -21.922 -16.608 3.700 1.00 0.00 C ATOM 1164 NE2 HIS A 75 -21.677 -16.654 2.406 1.00 0.00 N ATOM 0 H HIS A 75 -21.798 -12.110 4.235 1.00 0.00 H new ATOM 0 HA HIS A 75 -22.247 -12.503 1.334 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -23.974 -13.298 3.701 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -24.347 -13.583 2.013 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -22.170 -15.295 0.758 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -21.623 -17.349 4.426 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -21.172 -17.399 1.925 1.00 0.00 H new ATOM 1173 N LEU A 76 -23.280 -10.248 1.250 1.00 0.00 N ATOM 1174 CA LEU A 76 -23.948 -8.959 1.128 1.00 0.00 C ATOM 1175 C LEU A 76 -25.349 -9.119 0.545 1.00 0.00 C ATOM 1176 O LEU A 76 -25.505 -9.367 -0.654 1.00 0.00 O ATOM 1177 CB LEU A 76 -23.120 -8.016 0.248 1.00 0.00 C ATOM 1178 CG LEU A 76 -21.692 -7.755 0.734 1.00 0.00 C ATOM 1179 CD1 LEU A 76 -20.959 -6.843 -0.237 1.00 0.00 C ATOM 1180 CD2 LEU A 76 -21.702 -7.149 2.128 1.00 0.00 C ATOM 0 H LEU A 76 -22.675 -10.485 0.464 1.00 0.00 H new ATOM 0 HA LEU A 76 -24.040 -8.531 2.126 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -23.074 -8.432 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -23.642 -7.062 0.175 1.00 0.00 H new ATOM 0 HG LEU A 76 -21.165 -8.708 0.779 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -19.945 -6.667 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -20.919 -7.314 -1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -21.487 -5.892 -0.312 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -20.677 -6.971 2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -22.246 -6.205 2.110 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -22.190 -7.836 2.820 1.00 0.00 H new ATOM 1192 N GLU A 77 -26.356 -9.006 1.404 1.00 0.00 N ATOM 1193 CA GLU A 77 -27.755 -9.041 0.984 1.00 0.00 C ATOM 1194 C GLU A 77 -28.651 -8.786 2.190 1.00 0.00 C ATOM 1195 O GLU A 77 -28.788 -9.643 3.065 1.00 0.00 O ATOM 1196 CB GLU A 77 -28.099 -10.390 0.334 1.00 0.00 C ATOM 1197 CG GLU A 77 -29.283 -10.336 -0.626 1.00 0.00 C ATOM 1198 CD GLU A 77 -30.624 -10.183 0.069 1.00 0.00 C ATOM 1199 OE1 GLU A 77 -31.059 -9.036 0.300 1.00 0.00 O ATOM 1200 OE2 GLU A 77 -31.253 -11.217 0.369 1.00 0.00 O ATOM 0 H GLU A 77 -26.228 -8.888 2.409 1.00 0.00 H new ATOM 0 HA GLU A 77 -27.920 -8.262 0.240 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -27.225 -10.755 -0.205 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -28.315 -11.115 1.119 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -29.143 -9.503 -1.315 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -29.296 -11.246 -1.225 1.00 0.00 H new ATOM 1207 N HIS A 78 -29.234 -7.597 2.247 1.00 0.00 N ATOM 1208 CA HIS A 78 -30.096 -7.225 3.363 1.00 0.00 C ATOM 1209 C HIS A 78 -31.379 -6.560 2.881 1.00 0.00 C ATOM 1210 O HIS A 78 -32.020 -5.822 3.627 1.00 0.00 O ATOM 1211 CB HIS A 78 -29.363 -6.284 4.323 1.00 0.00 C ATOM 1212 CG HIS A 78 -28.338 -6.961 5.184 1.00 0.00 C ATOM 1213 ND1 HIS A 78 -26.991 -6.962 4.895 1.00 0.00 N ATOM 1214 CD2 HIS A 78 -28.469 -7.643 6.344 1.00 0.00 C ATOM 1215 CE1 HIS A 78 -26.342 -7.614 5.838 1.00 0.00 C ATOM 1216 NE2 HIS A 78 -27.212 -8.037 6.734 1.00 0.00 N ATOM 0 H HIS A 78 -29.127 -6.874 1.536 1.00 0.00 H new ATOM 0 HA HIS A 78 -30.359 -8.144 3.888 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -28.874 -5.501 3.744 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -30.096 -5.796 4.965 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -29.392 -7.842 6.868 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -25.275 -7.775 5.872 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -26.989 -8.568 7.576 1.00 0.00 H new ATOM 1225 N HIS A 79 -31.778 -6.835 1.645 1.00 0.00 N ATOM 1226 CA HIS A 79 -33.004 -6.245 1.121 1.00 0.00 C ATOM 1227 C HIS A 79 -34.127 -7.275 1.108 1.00 0.00 C ATOM 1228 O HIS A 79 -35.283 -6.944 0.843 1.00 0.00 O ATOM 1229 CB HIS A 79 -32.805 -5.608 -0.268 1.00 0.00 C ATOM 1230 CG HIS A 79 -32.381 -6.545 -1.362 1.00 0.00 C ATOM 1231 ND1 HIS A 79 -33.269 -7.155 -2.223 1.00 0.00 N ATOM 1232 CD2 HIS A 79 -31.148 -6.936 -1.762 1.00 0.00 C ATOM 1233 CE1 HIS A 79 -32.602 -7.877 -3.103 1.00 0.00 C ATOM 1234 NE2 HIS A 79 -31.316 -7.761 -2.844 1.00 0.00 N ATOM 0 H HIS A 79 -31.283 -7.449 0.998 1.00 0.00 H new ATOM 0 HA HIS A 79 -33.288 -5.433 1.791 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -33.739 -5.131 -0.565 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -32.058 -4.819 -0.181 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -30.208 -6.651 -1.313 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -33.036 -8.463 -3.900 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -30.565 -8.213 -3.365 1.00 0.00 H new ATOM 1243 N HIS A 80 -33.779 -8.523 1.401 1.00 0.00 N ATOM 1244 CA HIS A 80 -34.778 -9.566 1.611 1.00 0.00 C ATOM 1245 C HIS A 80 -35.181 -9.615 3.075 1.00 0.00 C ATOM 1246 O HIS A 80 -34.338 -9.790 3.958 1.00 0.00 O ATOM 1247 CB HIS A 80 -34.256 -10.937 1.177 1.00 0.00 C ATOM 1248 CG HIS A 80 -34.476 -11.233 -0.272 1.00 0.00 C ATOM 1249 ND1 HIS A 80 -35.105 -12.373 -0.716 1.00 0.00 N ATOM 1250 CD2 HIS A 80 -34.144 -10.533 -1.379 1.00 0.00 C ATOM 1251 CE1 HIS A 80 -35.154 -12.360 -2.034 1.00 0.00 C ATOM 1252 NE2 HIS A 80 -34.577 -11.253 -2.465 1.00 0.00 N ATOM 0 H HIS A 80 -32.814 -8.838 1.499 1.00 0.00 H new ATOM 0 HA HIS A 80 -35.646 -9.322 0.999 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -33.189 -10.995 1.393 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -34.744 -11.707 1.774 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -33.632 -9.582 -1.405 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -35.592 -13.126 -2.656 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -34.471 -10.979 -3.442 1.00 0.00 H new ATOM 1261 N HIS A 81 -36.466 -9.458 3.332 1.00 0.00 N ATOM 1262 CA HIS A 81 -36.972 -9.451 4.694 1.00 0.00 C ATOM 1263 C HIS A 81 -37.743 -10.731 4.964 1.00 0.00 C ATOM 1264 O HIS A 81 -38.126 -11.444 4.035 1.00 0.00 O ATOM 1265 CB HIS A 81 -37.899 -8.253 4.928 1.00 0.00 C ATOM 1266 CG HIS A 81 -37.354 -6.940 4.453 1.00 0.00 C ATOM 1267 ND1 HIS A 81 -38.056 -6.106 3.617 1.00 0.00 N ATOM 1268 CD2 HIS A 81 -36.180 -6.313 4.706 1.00 0.00 C ATOM 1269 CE1 HIS A 81 -37.343 -5.025 3.373 1.00 0.00 C ATOM 1270 NE2 HIS A 81 -36.198 -5.122 4.023 1.00 0.00 N ATOM 0 H HIS A 81 -37.181 -9.333 2.615 1.00 0.00 H new ATOM 0 HA HIS A 81 -36.120 -9.377 5.370 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -38.848 -8.441 4.425 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -38.113 -8.178 5.994 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -35.379 -6.682 5.329 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -37.645 -4.199 2.747 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -35.451 -4.428 4.019 1.00 0.00 H new ATOM 1279 N HIS A 82 -37.953 -11.033 6.233 1.00 0.00 N ATOM 1280 CA HIS A 82 -38.828 -12.131 6.612 1.00 0.00 C ATOM 1281 C HIS A 82 -40.260 -11.614 6.668 1.00 0.00 C ATOM 1282 O HIS A 82 -41.172 -12.180 6.064 1.00 0.00 O ATOM 1283 CB HIS A 82 -38.413 -12.722 7.963 1.00 0.00 C ATOM 1284 CG HIS A 82 -37.009 -13.257 7.982 1.00 0.00 C ATOM 1285 ND1 HIS A 82 -36.670 -14.511 7.520 1.00 0.00 N ATOM 1286 CD2 HIS A 82 -35.854 -12.690 8.400 1.00 0.00 C ATOM 1287 CE1 HIS A 82 -35.369 -14.687 7.654 1.00 0.00 C ATOM 1288 NE2 HIS A 82 -34.848 -13.596 8.180 1.00 0.00 N ATOM 0 H HIS A 82 -37.531 -10.536 7.017 1.00 0.00 H new ATOM 0 HA HIS A 82 -38.752 -12.928 5.872 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -38.510 -11.954 8.731 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -39.102 -13.525 8.226 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -35.744 -11.705 8.828 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -34.822 -15.577 7.379 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -33.860 -13.450 8.389 1.00 0.00 H new ATOM 1297 N HIS A 83 -40.431 -10.519 7.391 1.00 0.00 N ATOM 1298 CA HIS A 83 -41.680 -9.774 7.427 1.00 0.00 C ATOM 1299 C HIS A 83 -41.371 -8.322 7.738 1.00 0.00 C ATOM 1300 O HIS A 83 -41.124 -7.549 6.798 1.00 0.00 O ATOM 1301 CB HIS A 83 -42.649 -10.326 8.480 1.00 0.00 C ATOM 1302 CG HIS A 83 -43.520 -11.437 7.990 1.00 0.00 C ATOM 1303 ND1 HIS A 83 -43.719 -12.605 8.692 1.00 0.00 N ATOM 1304 CD2 HIS A 83 -44.272 -11.543 6.869 1.00 0.00 C ATOM 1305 CE1 HIS A 83 -44.552 -13.379 8.025 1.00 0.00 C ATOM 1306 NE2 HIS A 83 -44.903 -12.760 6.916 1.00 0.00 N ATOM 1307 OXT HIS A 83 -41.317 -7.975 8.937 1.00 0.00 O ATOM 0 H HIS A 83 -39.698 -10.118 7.976 1.00 0.00 H new ATOM 0 HA HIS A 83 -42.163 -9.870 6.455 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -42.074 -10.681 9.336 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -43.282 -9.513 8.836 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -44.359 -10.806 6.084 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -44.890 -14.357 8.335 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -45.540 -13.126 6.208 1.00 0.00 H new TER 1316 HIS A 83 ATOM 1317 N MET B 1 16.947 3.016 -23.824 1.00 0.00 N ATOM 1318 CA MET B 1 15.580 2.538 -24.128 1.00 0.00 C ATOM 1319 C MET B 1 14.569 3.658 -23.933 1.00 0.00 C ATOM 1320 O MET B 1 14.563 4.322 -22.898 1.00 0.00 O ATOM 1321 CB MET B 1 15.219 1.350 -23.227 1.00 0.00 C ATOM 1322 CG MET B 1 13.814 0.813 -23.458 1.00 0.00 C ATOM 1323 SD MET B 1 13.386 -0.535 -22.339 1.00 0.00 S ATOM 1324 CE MET B 1 11.711 -0.890 -22.868 1.00 0.00 C ATOM 0 H1 MET B 1 17.625 2.240 -23.962 1.00 0.00 H new ATOM 0 H2 MET B 1 17.189 3.804 -24.459 1.00 0.00 H new ATOM 0 H3 MET B 1 16.990 3.341 -22.837 1.00 0.00 H new ATOM 0 HA MET B 1 15.553 2.216 -25.169 1.00 0.00 H new ATOM 0 HB2 MET B 1 15.937 0.547 -23.394 1.00 0.00 H new ATOM 0 HB3 MET B 1 15.316 1.653 -22.185 1.00 0.00 H new ATOM 0 HG2 MET B 1 13.096 1.623 -23.334 1.00 0.00 H new ATOM 0 HG3 MET B 1 13.728 0.465 -24.487 1.00 0.00 H new ATOM 0 HE1 MET B 1 11.305 -1.705 -22.269 1.00 0.00 H new ATOM 0 HE2 MET B 1 11.093 -0.002 -22.739 1.00 0.00 H new ATOM 0 HE3 MET B 1 11.715 -1.179 -23.919 1.00 0.00 H new ATOM 1336 N PRO B 2 13.714 3.901 -24.934 1.00 0.00 N ATOM 1337 CA PRO B 2 12.653 4.894 -24.837 1.00 0.00 C ATOM 1338 C PRO B 2 11.484 4.371 -24.015 1.00 0.00 C ATOM 1339 O PRO B 2 10.842 3.389 -24.392 1.00 0.00 O ATOM 1340 CB PRO B 2 12.220 5.126 -26.293 1.00 0.00 C ATOM 1341 CG PRO B 2 13.140 4.301 -27.138 1.00 0.00 C ATOM 1342 CD PRO B 2 13.708 3.240 -26.243 1.00 0.00 C ATOM 0 HA PRO B 2 12.988 5.806 -24.343 1.00 0.00 H new ATOM 0 HB2 PRO B 2 11.182 4.829 -26.443 1.00 0.00 H new ATOM 0 HB3 PRO B 2 12.290 6.181 -26.557 1.00 0.00 H new ATOM 0 HG2 PRO B 2 12.602 3.855 -27.975 1.00 0.00 H new ATOM 0 HG3 PRO B 2 13.934 4.917 -27.561 1.00 0.00 H new ATOM 0 HD2 PRO B 2 13.094 2.339 -26.240 1.00 0.00 H new ATOM 0 HD3 PRO B 2 14.710 2.942 -26.552 1.00 0.00 H new ATOM 1350 N GLN B 3 11.225 5.004 -22.882 1.00 0.00 N ATOM 1351 CA GLN B 3 10.129 4.587 -22.024 1.00 0.00 C ATOM 1352 C GLN B 3 8.800 5.066 -22.593 1.00 0.00 C ATOM 1353 O GLN B 3 8.413 6.226 -22.430 1.00 0.00 O ATOM 1354 CB GLN B 3 10.327 5.103 -20.594 1.00 0.00 C ATOM 1355 CG GLN B 3 9.236 4.670 -19.617 1.00 0.00 C ATOM 1356 CD GLN B 3 9.134 3.160 -19.443 1.00 0.00 C ATOM 1357 OE1 GLN B 3 9.406 2.385 -20.361 1.00 0.00 O ATOM 1358 NE2 GLN B 3 8.737 2.730 -18.256 1.00 0.00 N ATOM 0 H GLN B 3 11.756 5.804 -22.537 1.00 0.00 H new ATOM 0 HA GLN B 3 10.116 3.498 -21.988 1.00 0.00 H new ATOM 0 HB2 GLN B 3 11.291 4.754 -20.224 1.00 0.00 H new ATOM 0 HB3 GLN B 3 10.369 6.192 -20.615 1.00 0.00 H new ATOM 0 HG2 GLN B 3 9.428 5.127 -18.646 1.00 0.00 H new ATOM 0 HG3 GLN B 3 8.276 5.052 -19.965 1.00 0.00 H new ATOM 0 HE21 GLN B 3 8.520 3.399 -17.518 1.00 0.00 H new ATOM 0 HE22 GLN B 3 8.648 1.729 -18.080 1.00 0.00 H new ATOM 1367 N ILE B 4 8.124 4.169 -23.290 1.00 0.00 N ATOM 1368 CA ILE B 4 6.844 4.478 -23.895 1.00 0.00 C ATOM 1369 C ILE B 4 5.720 4.263 -22.895 1.00 0.00 C ATOM 1370 O ILE B 4 5.259 3.138 -22.690 1.00 0.00 O ATOM 1371 CB ILE B 4 6.590 3.619 -25.151 1.00 0.00 C ATOM 1372 CG1 ILE B 4 7.717 3.823 -26.166 1.00 0.00 C ATOM 1373 CG2 ILE B 4 5.242 3.969 -25.771 1.00 0.00 C ATOM 1374 CD1 ILE B 4 7.607 2.939 -27.390 1.00 0.00 C ATOM 0 H ILE B 4 8.445 3.214 -23.451 1.00 0.00 H new ATOM 0 HA ILE B 4 6.868 5.526 -24.195 1.00 0.00 H new ATOM 0 HB ILE B 4 6.571 2.569 -24.859 1.00 0.00 H new ATOM 0 HG12 ILE B 4 7.723 4.866 -26.482 1.00 0.00 H new ATOM 0 HG13 ILE B 4 8.672 3.632 -25.677 1.00 0.00 H new ATOM 0 HG21 ILE B 4 5.078 3.354 -26.656 1.00 0.00 H new ATOM 0 HG22 ILE B 4 4.449 3.782 -25.047 1.00 0.00 H new ATOM 0 HG23 ILE B 4 5.234 5.022 -26.054 1.00 0.00 H new ATOM 0 HD11 ILE B 4 8.441 3.142 -28.062 1.00 0.00 H new ATOM 0 HD12 ILE B 4 7.632 1.892 -27.086 1.00 0.00 H new ATOM 0 HD13 ILE B 4 6.668 3.145 -27.905 1.00 0.00 H new ATOM 1386 N SER B 5 5.310 5.339 -22.249 1.00 0.00 N ATOM 1387 CA SER B 5 4.229 5.284 -21.288 1.00 0.00 C ATOM 1388 C SER B 5 3.540 6.637 -21.178 1.00 0.00 C ATOM 1389 O SER B 5 4.153 7.677 -21.428 1.00 0.00 O ATOM 1390 CB SER B 5 4.763 4.842 -19.921 1.00 0.00 C ATOM 1391 OG SER B 5 5.918 5.582 -19.550 1.00 0.00 O ATOM 0 H SER B 5 5.714 6.267 -22.375 1.00 0.00 H new ATOM 0 HA SER B 5 3.495 4.555 -21.631 1.00 0.00 H new ATOM 0 HB2 SER B 5 3.987 4.973 -19.166 1.00 0.00 H new ATOM 0 HB3 SER B 5 5.004 3.779 -19.949 1.00 0.00 H new ATOM 0 HG SER B 5 5.646 6.418 -19.117 1.00 0.00 H new ATOM 1397 N ARG B 6 2.260 6.611 -20.825 1.00 0.00 N ATOM 1398 CA ARG B 6 1.490 7.828 -20.571 1.00 0.00 C ATOM 1399 C ARG B 6 2.133 8.658 -19.466 1.00 0.00 C ATOM 1400 O ARG B 6 1.983 9.877 -19.415 1.00 0.00 O ATOM 1401 CB ARG B 6 0.069 7.474 -20.129 1.00 0.00 C ATOM 1402 CG ARG B 6 -0.767 6.761 -21.176 1.00 0.00 C ATOM 1403 CD ARG B 6 -2.058 6.247 -20.564 1.00 0.00 C ATOM 1404 NE ARG B 6 -3.004 5.767 -21.568 1.00 0.00 N ATOM 1405 CZ ARG B 6 -4.066 5.013 -21.280 1.00 0.00 C ATOM 1406 NH1 ARG B 6 -4.238 4.544 -20.049 1.00 0.00 N ATOM 1407 NH2 ARG B 6 -4.940 4.710 -22.231 1.00 0.00 N ATOM 0 H ARG B 6 1.726 5.750 -20.706 1.00 0.00 H new ATOM 0 HA ARG B 6 1.469 8.401 -21.498 1.00 0.00 H new ATOM 0 HB2 ARG B 6 0.127 6.845 -19.241 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -0.444 8.390 -19.838 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -0.992 7.443 -21.996 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -0.201 5.930 -21.598 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -1.830 5.438 -19.870 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -2.523 7.044 -19.984 1.00 0.00 H new ATOM 0 HE ARG B 6 -2.844 6.022 -22.542 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -3.557 4.760 -19.321 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -5.051 3.968 -19.832 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -4.799 5.054 -23.181 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -5.752 4.134 -22.012 1.00 0.00 H new ATOM 1421 N TYR B 7 2.845 7.977 -18.586 1.00 0.00 N ATOM 1422 CA TYR B 7 3.335 8.578 -17.361 1.00 0.00 C ATOM 1423 C TYR B 7 4.819 8.889 -17.463 1.00 0.00 C ATOM 1424 O TYR B 7 5.566 8.186 -18.150 1.00 0.00 O ATOM 1425 CB TYR B 7 3.046 7.629 -16.198 1.00 0.00 C ATOM 1426 CG TYR B 7 1.643 7.072 -16.271 1.00 0.00 C ATOM 1427 CD1 TYR B 7 0.553 7.833 -15.875 1.00 0.00 C ATOM 1428 CD2 TYR B 7 1.404 5.799 -16.780 1.00 0.00 C ATOM 1429 CE1 TYR B 7 -0.733 7.348 -15.985 1.00 0.00 C ATOM 1430 CE2 TYR B 7 0.119 5.303 -16.886 1.00 0.00 C ATOM 1431 CZ TYR B 7 -0.945 6.084 -16.485 1.00 0.00 C ATOM 1432 OH TYR B 7 -2.229 5.613 -16.614 1.00 0.00 O ATOM 0 H TYR B 7 3.098 6.996 -18.701 1.00 0.00 H new ATOM 0 HA TYR B 7 2.823 9.525 -17.189 1.00 0.00 H new ATOM 0 HB2 TYR B 7 3.765 6.810 -16.209 1.00 0.00 H new ATOM 0 HB3 TYR B 7 3.180 8.158 -15.254 1.00 0.00 H new ATOM 0 HD1 TYR B 7 0.714 8.823 -15.474 1.00 0.00 H new ATOM 0 HD2 TYR B 7 2.237 5.189 -17.097 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -1.570 7.958 -15.680 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -0.051 4.312 -17.280 1.00 0.00 H new ATOM 0 HH TYR B 7 -2.209 4.705 -16.982 1.00 0.00 H new ATOM 1442 N SER B 8 5.231 9.956 -16.797 1.00 0.00 N ATOM 1443 CA SER B 8 6.616 10.390 -16.816 1.00 0.00 C ATOM 1444 C SER B 8 7.058 10.772 -15.403 1.00 0.00 C ATOM 1445 O SER B 8 6.220 10.967 -14.519 1.00 0.00 O ATOM 1446 CB SER B 8 6.773 11.575 -17.777 1.00 0.00 C ATOM 1447 OG SER B 8 8.135 11.922 -17.963 1.00 0.00 O ATOM 0 H SER B 8 4.617 10.542 -16.231 1.00 0.00 H new ATOM 0 HA SER B 8 7.250 9.575 -17.166 1.00 0.00 H new ATOM 0 HB2 SER B 8 6.326 11.325 -18.739 1.00 0.00 H new ATOM 0 HB3 SER B 8 6.228 12.435 -17.387 1.00 0.00 H new ATOM 0 HG SER B 8 8.316 12.782 -17.530 1.00 0.00 H new ATOM 1453 N ASP B 9 8.372 10.886 -15.208 1.00 0.00 N ATOM 1454 CA ASP B 9 8.962 11.190 -13.898 1.00 0.00 C ATOM 1455 C ASP B 9 8.311 12.408 -13.246 1.00 0.00 C ATOM 1456 O ASP B 9 7.945 12.373 -12.072 1.00 0.00 O ATOM 1457 CB ASP B 9 10.467 11.439 -14.058 1.00 0.00 C ATOM 1458 CG ASP B 9 11.186 11.613 -12.733 1.00 0.00 C ATOM 1459 OD1 ASP B 9 11.255 12.755 -12.226 1.00 0.00 O ATOM 1460 OD2 ASP B 9 11.710 10.606 -12.206 1.00 0.00 O ATOM 0 H ASP B 9 9.060 10.771 -15.952 1.00 0.00 H new ATOM 0 HA ASP B 9 8.787 10.332 -13.249 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.912 10.604 -14.599 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.619 12.330 -14.667 1.00 0.00 H new ATOM 1465 N GLU B 10 8.148 13.470 -14.024 1.00 0.00 N ATOM 1466 CA GLU B 10 7.598 14.725 -13.520 1.00 0.00 C ATOM 1467 C GLU B 10 6.172 14.544 -13.014 1.00 0.00 C ATOM 1468 O GLU B 10 5.749 15.205 -12.069 1.00 0.00 O ATOM 1469 CB GLU B 10 7.619 15.798 -14.610 1.00 0.00 C ATOM 1470 CG GLU B 10 8.961 15.938 -15.307 1.00 0.00 C ATOM 1471 CD GLU B 10 9.052 15.112 -16.574 1.00 0.00 C ATOM 1472 OE1 GLU B 10 9.014 13.866 -16.492 1.00 0.00 O ATOM 1473 OE2 GLU B 10 9.149 15.710 -17.664 1.00 0.00 O ATOM 0 H GLU B 10 8.391 13.488 -15.015 1.00 0.00 H new ATOM 0 HA GLU B 10 8.224 15.043 -12.686 1.00 0.00 H new ATOM 0 HB2 GLU B 10 6.857 15.563 -15.353 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.348 16.757 -14.168 1.00 0.00 H new ATOM 0 HG2 GLU B 10 9.132 16.987 -15.549 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.754 15.635 -14.623 1.00 0.00 H new ATOM 1480 N GLN B 11 5.435 13.640 -13.642 1.00 0.00 N ATOM 1481 CA GLN B 11 4.053 13.395 -13.261 1.00 0.00 C ATOM 1482 C GLN B 11 3.999 12.600 -11.964 1.00 0.00 C ATOM 1483 O GLN B 11 3.079 12.759 -11.161 1.00 0.00 O ATOM 1484 CB GLN B 11 3.317 12.664 -14.380 1.00 0.00 C ATOM 1485 CG GLN B 11 3.299 13.442 -15.687 1.00 0.00 C ATOM 1486 CD GLN B 11 2.621 12.685 -16.808 1.00 0.00 C ATOM 1487 OE1 GLN B 11 2.633 11.458 -16.834 1.00 0.00 O ATOM 1488 NE2 GLN B 11 2.031 13.414 -17.741 1.00 0.00 N ATOM 0 H GLN B 11 5.770 13.066 -14.415 1.00 0.00 H new ATOM 0 HA GLN B 11 3.556 14.351 -13.096 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.790 11.696 -14.546 1.00 0.00 H new ATOM 0 HB3 GLN B 11 2.292 12.468 -14.066 1.00 0.00 H new ATOM 0 HG2 GLN B 11 2.786 14.391 -15.533 1.00 0.00 H new ATOM 0 HG3 GLN B 11 4.322 13.677 -15.980 1.00 0.00 H new ATOM 0 HE21 GLN B 11 2.046 14.432 -17.678 1.00 0.00 H new ATOM 0 HE22 GLN B 11 1.561 12.958 -18.523 1.00 0.00 H new ATOM 1497 N VAL B 12 5.001 11.756 -11.760 1.00 0.00 N ATOM 1498 CA VAL B 12 5.150 11.045 -10.503 1.00 0.00 C ATOM 1499 C VAL B 12 5.497 12.039 -9.403 1.00 0.00 C ATOM 1500 O VAL B 12 4.941 11.991 -8.306 1.00 0.00 O ATOM 1501 CB VAL B 12 6.251 9.964 -10.584 1.00 0.00 C ATOM 1502 CG1 VAL B 12 6.346 9.187 -9.279 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.994 9.023 -11.752 1.00 0.00 C ATOM 0 H VAL B 12 5.722 11.549 -12.451 1.00 0.00 H new ATOM 0 HA VAL B 12 4.206 10.546 -10.282 1.00 0.00 H new ATOM 0 HB VAL B 12 7.205 10.464 -10.750 1.00 0.00 H new ATOM 0 HG11 VAL B 12 7.128 8.432 -9.361 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.586 9.871 -8.465 1.00 0.00 H new ATOM 0 HG13 VAL B 12 5.392 8.701 -9.075 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.780 8.269 -11.792 1.00 0.00 H new ATOM 0 HG22 VAL B 12 5.029 8.534 -11.620 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.988 9.591 -12.682 1.00 0.00 H new ATOM 1513 N GLU B 13 6.407 12.955 -9.726 1.00 0.00 N ATOM 1514 CA GLU B 13 6.805 14.022 -8.815 1.00 0.00 C ATOM 1515 C GLU B 13 5.595 14.869 -8.428 1.00 0.00 C ATOM 1516 O GLU B 13 5.395 15.173 -7.255 1.00 0.00 O ATOM 1517 CB GLU B 13 7.894 14.878 -9.482 1.00 0.00 C ATOM 1518 CG GLU B 13 8.460 16.000 -8.618 1.00 0.00 C ATOM 1519 CD GLU B 13 7.634 17.272 -8.667 1.00 0.00 C ATOM 1520 OE1 GLU B 13 7.495 17.851 -9.764 1.00 0.00 O ATOM 1521 OE2 GLU B 13 7.125 17.701 -7.611 1.00 0.00 O ATOM 0 H GLU B 13 6.888 12.977 -10.625 1.00 0.00 H new ATOM 0 HA GLU B 13 7.211 13.590 -7.900 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.713 14.225 -9.783 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.483 15.314 -10.392 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.524 15.657 -7.586 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.476 16.222 -8.944 1.00 0.00 H new ATOM 1528 N GLN B 14 4.788 15.221 -9.424 1.00 0.00 N ATOM 1529 CA GLN B 14 3.580 16.014 -9.210 1.00 0.00 C ATOM 1530 C GLN B 14 2.682 15.385 -8.143 1.00 0.00 C ATOM 1531 O GLN B 14 2.247 16.060 -7.209 1.00 0.00 O ATOM 1532 CB GLN B 14 2.815 16.156 -10.531 1.00 0.00 C ATOM 1533 CG GLN B 14 1.490 16.898 -10.411 1.00 0.00 C ATOM 1534 CD GLN B 14 1.643 18.339 -9.958 1.00 0.00 C ATOM 1535 OE1 GLN B 14 0.760 18.888 -9.303 1.00 0.00 O ATOM 1536 NE2 GLN B 14 2.756 18.964 -10.310 1.00 0.00 N ATOM 0 H GLN B 14 4.951 14.967 -10.398 1.00 0.00 H new ATOM 0 HA GLN B 14 3.877 17.001 -8.854 1.00 0.00 H new ATOM 0 HB2 GLN B 14 3.447 16.679 -11.249 1.00 0.00 H new ATOM 0 HB3 GLN B 14 2.626 15.162 -10.937 1.00 0.00 H new ATOM 0 HG2 GLN B 14 0.984 16.880 -11.376 1.00 0.00 H new ATOM 0 HG3 GLN B 14 0.849 16.369 -9.705 1.00 0.00 H new ATOM 0 HE21 GLN B 14 3.466 18.474 -10.854 1.00 0.00 H new ATOM 0 HE22 GLN B 14 2.903 19.936 -10.037 1.00 0.00 H new ATOM 1545 N LEU B 15 2.415 14.092 -8.278 1.00 0.00 N ATOM 1546 CA LEU B 15 1.561 13.395 -7.324 1.00 0.00 C ATOM 1547 C LEU B 15 2.283 13.180 -6.003 1.00 0.00 C ATOM 1548 O LEU B 15 1.687 13.325 -4.937 1.00 0.00 O ATOM 1549 CB LEU B 15 1.099 12.052 -7.884 1.00 0.00 C ATOM 1550 CG LEU B 15 0.186 12.133 -9.107 1.00 0.00 C ATOM 1551 CD1 LEU B 15 -0.229 10.741 -9.539 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -1.038 12.988 -8.810 1.00 0.00 C ATOM 0 H LEU B 15 2.774 13.508 -9.033 1.00 0.00 H new ATOM 0 HA LEU B 15 0.687 14.021 -7.148 1.00 0.00 H new ATOM 0 HB2 LEU B 15 1.979 11.464 -8.146 1.00 0.00 H new ATOM 0 HB3 LEU B 15 0.576 11.509 -7.096 1.00 0.00 H new ATOM 0 HG LEU B 15 0.737 12.603 -9.922 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -0.879 10.809 -10.411 1.00 0.00 H new ATOM 0 HD12 LEU B 15 0.657 10.159 -9.792 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.764 10.252 -8.725 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -1.674 13.032 -9.694 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -1.596 12.549 -7.983 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -0.721 13.995 -8.540 1.00 0.00 H new ATOM 1564 N LEU B 16 3.563 12.838 -6.081 1.00 0.00 N ATOM 1565 CA LEU B 16 4.375 12.624 -4.890 1.00 0.00 C ATOM 1566 C LEU B 16 4.374 13.873 -4.021 1.00 0.00 C ATOM 1567 O LEU B 16 4.156 13.796 -2.813 1.00 0.00 O ATOM 1568 CB LEU B 16 5.810 12.258 -5.280 1.00 0.00 C ATOM 1569 CG LEU B 16 6.760 11.985 -4.113 1.00 0.00 C ATOM 1570 CD1 LEU B 16 6.305 10.768 -3.322 1.00 0.00 C ATOM 1571 CD2 LEU B 16 8.178 11.793 -4.620 1.00 0.00 C ATOM 0 H LEU B 16 4.062 12.703 -6.960 1.00 0.00 H new ATOM 0 HA LEU B 16 3.945 11.798 -4.323 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.781 11.374 -5.916 1.00 0.00 H new ATOM 0 HB3 LEU B 16 6.223 13.069 -5.880 1.00 0.00 H new ATOM 0 HG LEU B 16 6.744 12.848 -3.447 1.00 0.00 H new ATOM 0 HD11 LEU B 16 6.995 10.592 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU B 16 5.304 10.944 -2.927 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.289 9.895 -3.974 1.00 0.00 H new ATOM 0 HD21 LEU B 16 8.842 11.600 -3.778 1.00 0.00 H new ATOM 0 HD22 LEU B 16 8.207 10.947 -5.307 1.00 0.00 H new ATOM 0 HD23 LEU B 16 8.504 12.694 -5.140 1.00 0.00 H new ATOM 1583 N ALA B 17 4.597 15.019 -4.652 1.00 0.00 N ATOM 1584 CA ALA B 17 4.599 16.294 -3.954 1.00 0.00 C ATOM 1585 C ALA B 17 3.261 16.537 -3.269 1.00 0.00 C ATOM 1586 O ALA B 17 3.216 16.796 -2.072 1.00 0.00 O ATOM 1587 CB ALA B 17 4.911 17.428 -4.918 1.00 0.00 C ATOM 0 H ALA B 17 4.780 15.089 -5.653 1.00 0.00 H new ATOM 0 HA ALA B 17 5.376 16.262 -3.190 1.00 0.00 H new ATOM 0 HB1 ALA B 17 4.908 18.375 -4.379 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.893 17.267 -5.364 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.156 17.456 -5.704 1.00 0.00 H new ATOM 1593 N GLU B 18 2.179 16.426 -4.030 1.00 0.00 N ATOM 1594 CA GLU B 18 0.840 16.675 -3.504 1.00 0.00 C ATOM 1595 C GLU B 18 0.479 15.713 -2.373 1.00 0.00 C ATOM 1596 O GLU B 18 0.150 16.150 -1.270 1.00 0.00 O ATOM 1597 CB GLU B 18 -0.196 16.588 -4.626 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.251 17.836 -5.491 1.00 0.00 C ATOM 1599 CD GLU B 18 -0.794 19.035 -4.738 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -0.079 19.574 -3.871 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -1.953 19.434 -4.996 1.00 0.00 O ATOM 0 H GLU B 18 2.202 16.165 -5.016 1.00 0.00 H new ATOM 0 HA GLU B 18 0.836 17.683 -3.088 1.00 0.00 H new ATOM 0 HB2 GLU B 18 0.032 15.728 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.180 16.413 -4.190 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.749 18.064 -5.860 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.876 17.644 -6.363 1.00 0.00 H new ATOM 1608 N LEU B 19 0.564 14.416 -2.639 1.00 0.00 N ATOM 1609 CA LEU B 19 0.158 13.407 -1.664 1.00 0.00 C ATOM 1610 C LEU B 19 0.982 13.509 -0.383 1.00 0.00 C ATOM 1611 O LEU B 19 0.440 13.435 0.723 1.00 0.00 O ATOM 1612 CB LEU B 19 0.280 12.001 -2.258 1.00 0.00 C ATOM 1613 CG LEU B 19 -0.639 11.718 -3.450 1.00 0.00 C ATOM 1614 CD1 LEU B 19 -0.411 10.310 -3.975 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -2.097 11.910 -3.057 1.00 0.00 C ATOM 0 H LEU B 19 0.910 14.036 -3.520 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.886 13.594 -1.412 1.00 0.00 H new ATOM 0 HB2 LEU B 19 1.313 11.843 -2.570 1.00 0.00 H new ATOM 0 HB3 LEU B 19 0.069 11.273 -1.475 1.00 0.00 H new ATOM 0 HG LEU B 19 -0.400 12.425 -4.244 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -1.072 10.126 -4.822 1.00 0.00 H new ATOM 0 HD12 LEU B 19 0.626 10.204 -4.294 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -0.623 9.589 -3.186 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -2.736 11.705 -3.916 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -2.348 11.226 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -2.253 12.937 -2.727 1.00 0.00 H new ATOM 1627 N LEU B 20 2.287 13.696 -0.534 1.00 0.00 N ATOM 1628 CA LEU B 20 3.175 13.803 0.615 1.00 0.00 C ATOM 1629 C LEU B 20 2.917 15.113 1.353 1.00 0.00 C ATOM 1630 O LEU B 20 2.859 15.138 2.583 1.00 0.00 O ATOM 1631 CB LEU B 20 4.640 13.726 0.165 1.00 0.00 C ATOM 1632 CG LEU B 20 5.583 12.934 1.084 1.00 0.00 C ATOM 1633 CD1 LEU B 20 5.652 13.551 2.471 1.00 0.00 C ATOM 1634 CD2 LEU B 20 5.144 11.480 1.170 1.00 0.00 C ATOM 0 H LEU B 20 2.752 13.776 -1.438 1.00 0.00 H new ATOM 0 HA LEU B 20 2.976 12.972 1.292 1.00 0.00 H new ATOM 0 HB2 LEU B 20 4.672 13.279 -0.829 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.025 14.741 0.070 1.00 0.00 H new ATOM 0 HG LEU B 20 6.583 12.974 0.651 1.00 0.00 H new ATOM 0 HD11 LEU B 20 6.327 12.967 3.096 1.00 0.00 H new ATOM 0 HD12 LEU B 20 6.021 14.574 2.396 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.657 13.555 2.917 1.00 0.00 H new ATOM 0 HD21 LEU B 20 5.823 10.933 1.825 1.00 0.00 H new ATOM 0 HD22 LEU B 20 4.132 11.429 1.572 1.00 0.00 H new ATOM 0 HD23 LEU B 20 5.162 11.035 0.175 1.00 0.00 H new ATOM 1646 N ASN B 21 2.739 16.194 0.598 1.00 0.00 N ATOM 1647 CA ASN B 21 2.524 17.509 1.189 1.00 0.00 C ATOM 1648 C ASN B 21 1.246 17.541 2.011 1.00 0.00 C ATOM 1649 O ASN B 21 1.245 18.054 3.121 1.00 0.00 O ATOM 1650 CB ASN B 21 2.489 18.603 0.114 1.00 0.00 C ATOM 1651 CG ASN B 21 2.199 19.978 0.689 1.00 0.00 C ATOM 1652 OD1 ASN B 21 3.097 20.654 1.194 1.00 0.00 O ATOM 1653 ND2 ASN B 21 0.957 20.426 0.574 1.00 0.00 N ATOM 0 H ASN B 21 2.740 16.184 -0.422 1.00 0.00 H new ATOM 0 HA ASN B 21 3.365 17.706 1.853 1.00 0.00 H new ATOM 0 HB2 ASN B 21 3.446 18.626 -0.407 1.00 0.00 H new ATOM 0 HB3 ASN B 21 1.729 18.355 -0.627 1.00 0.00 H new ATOM 0 HD21 ASN B 21 0.718 21.359 0.909 1.00 0.00 H new ATOM 0 HD22 ASN B 21 0.240 19.838 0.150 1.00 0.00 H new ATOM 1660 N VAL B 22 0.167 16.979 1.477 1.00 0.00 N ATOM 1661 CA VAL B 22 -1.102 16.932 2.201 1.00 0.00 C ATOM 1662 C VAL B 22 -0.946 16.182 3.523 1.00 0.00 C ATOM 1663 O VAL B 22 -1.399 16.645 4.574 1.00 0.00 O ATOM 1664 CB VAL B 22 -2.217 16.263 1.363 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -3.501 16.130 2.172 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.475 17.053 0.092 1.00 0.00 C ATOM 0 H VAL B 22 0.143 16.552 0.551 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.391 17.964 2.400 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.880 15.263 1.091 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.269 15.657 1.560 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.313 15.519 3.055 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.841 17.119 2.480 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.262 16.567 -0.485 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.786 18.065 0.350 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.562 17.094 -0.503 1.00 0.00 H new ATOM 1676 N LEU B 23 -0.283 15.034 3.462 1.00 0.00 N ATOM 1677 CA LEU B 23 -0.076 14.199 4.637 1.00 0.00 C ATOM 1678 C LEU B 23 0.823 14.912 5.649 1.00 0.00 C ATOM 1679 O LEU B 23 0.517 14.950 6.842 1.00 0.00 O ATOM 1680 CB LEU B 23 0.527 12.850 4.210 1.00 0.00 C ATOM 1681 CG LEU B 23 0.477 11.721 5.250 1.00 0.00 C ATOM 1682 CD1 LEU B 23 0.628 10.372 4.564 1.00 0.00 C ATOM 1683 CD2 LEU B 23 1.567 11.889 6.302 1.00 0.00 C ATOM 0 H LEU B 23 0.123 14.659 2.605 1.00 0.00 H new ATOM 0 HA LEU B 23 -1.035 14.013 5.121 1.00 0.00 H new ATOM 0 HB2 LEU B 23 0.008 12.512 3.313 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.568 13.013 3.933 1.00 0.00 H new ATOM 0 HG LEU B 23 -0.490 11.769 5.750 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.591 9.578 5.310 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.183 10.235 3.848 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.584 10.335 4.041 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.505 11.074 7.024 1.00 0.00 H new ATOM 0 HD22 LEU B 23 2.544 11.873 5.819 1.00 0.00 H new ATOM 0 HD23 LEU B 23 1.432 12.840 6.817 1.00 0.00 H new ATOM 1695 N GLU B 24 1.915 15.489 5.166 1.00 0.00 N ATOM 1696 CA GLU B 24 2.881 16.153 6.036 1.00 0.00 C ATOM 1697 C GLU B 24 2.317 17.461 6.593 1.00 0.00 C ATOM 1698 O GLU B 24 2.609 17.836 7.725 1.00 0.00 O ATOM 1699 CB GLU B 24 4.182 16.417 5.273 1.00 0.00 C ATOM 1700 CG GLU B 24 5.308 16.965 6.137 1.00 0.00 C ATOM 1701 CD GLU B 24 6.595 17.156 5.364 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.733 18.187 4.673 1.00 0.00 O ATOM 1703 OE2 GLU B 24 7.479 16.277 5.440 1.00 0.00 O ATOM 0 H GLU B 24 2.156 15.512 4.175 1.00 0.00 H new ATOM 0 HA GLU B 24 3.089 15.493 6.878 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.514 15.488 4.809 1.00 0.00 H new ATOM 0 HB3 GLU B 24 3.981 17.122 4.466 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.001 17.919 6.565 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.486 16.284 6.970 1.00 0.00 H new ATOM 1710 N LYS B 25 1.505 18.141 5.793 1.00 0.00 N ATOM 1711 CA LYS B 25 0.894 19.402 6.203 1.00 0.00 C ATOM 1712 C LYS B 25 -0.131 19.183 7.310 1.00 0.00 C ATOM 1713 O LYS B 25 -0.144 19.908 8.307 1.00 0.00 O ATOM 1714 CB LYS B 25 0.232 20.081 5.002 1.00 0.00 C ATOM 1715 CG LYS B 25 -0.609 21.290 5.361 1.00 0.00 C ATOM 1716 CD LYS B 25 -1.210 21.929 4.123 1.00 0.00 C ATOM 1717 CE LYS B 25 -2.230 22.989 4.488 1.00 0.00 C ATOM 1718 NZ LYS B 25 -1.647 24.048 5.353 1.00 0.00 N ATOM 0 H LYS B 25 1.253 17.840 4.852 1.00 0.00 H new ATOM 0 HA LYS B 25 1.681 20.048 6.592 1.00 0.00 H new ATOM 0 HB2 LYS B 25 1.006 20.386 4.298 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -0.397 19.354 4.488 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -1.406 20.992 6.043 1.00 0.00 H new ATOM 0 HG3 LYS B 25 0.005 22.020 5.888 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -0.418 22.375 3.521 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -1.683 21.163 3.509 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -2.625 23.441 3.578 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.070 22.522 5.003 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -2.328 24.827 5.454 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -1.433 23.652 6.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -0.772 24.407 4.920 1.00 0.00 H new ATOM 1732 N HIS B 26 -0.989 18.184 7.131 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.997 17.860 8.135 1.00 0.00 C ATOM 1734 C HIS B 26 -1.355 17.125 9.305 1.00 0.00 C ATOM 1735 O HIS B 26 -1.931 17.039 10.390 1.00 0.00 O ATOM 1736 CB HIS B 26 -3.130 17.025 7.528 1.00 0.00 C ATOM 1737 CG HIS B 26 -4.047 17.812 6.636 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -5.390 17.979 6.895 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -3.807 18.480 5.480 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -5.932 18.713 5.943 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -4.996 19.031 5.071 1.00 0.00 N ATOM 0 H HIS B 26 -1.007 17.587 6.304 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.429 18.792 8.501 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.698 16.203 6.957 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.714 16.581 8.334 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -2.856 18.563 4.975 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -6.970 19.005 5.887 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.133 19.594 4.231 1.00 0.00 H new ATOM 1750 N LYS B 27 -0.157 16.603 9.054 1.00 0.00 N ATOM 1751 CA LYS B 27 0.686 15.984 10.074 1.00 0.00 C ATOM 1752 C LYS B 27 0.042 14.738 10.664 1.00 0.00 C ATOM 1753 O LYS B 27 -0.681 14.794 11.662 1.00 0.00 O ATOM 1754 CB LYS B 27 1.052 16.998 11.164 1.00 0.00 C ATOM 1755 CG LYS B 27 1.692 18.248 10.590 1.00 0.00 C ATOM 1756 CD LYS B 27 2.234 19.174 11.659 1.00 0.00 C ATOM 1757 CE LYS B 27 2.842 20.415 11.028 1.00 0.00 C ATOM 1758 NZ LYS B 27 3.604 21.227 12.008 1.00 0.00 N ATOM 0 H LYS B 27 0.261 16.598 8.124 1.00 0.00 H new ATOM 0 HA LYS B 27 1.608 15.662 9.589 1.00 0.00 H new ATOM 0 HB2 LYS B 27 0.155 17.273 11.719 1.00 0.00 H new ATOM 0 HB3 LYS B 27 1.736 16.534 11.874 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.502 17.961 9.920 1.00 0.00 H new ATOM 0 HG3 LYS B 27 0.957 18.784 9.990 1.00 0.00 H new ATOM 0 HD2 LYS B 27 1.433 19.460 12.341 1.00 0.00 H new ATOM 0 HD3 LYS B 27 2.987 18.654 12.252 1.00 0.00 H new ATOM 0 HE2 LYS B 27 3.502 20.119 10.213 1.00 0.00 H new ATOM 0 HE3 LYS B 27 2.050 21.024 10.592 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 4.000 22.063 11.533 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 2.970 21.532 12.774 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.377 20.656 12.406 1.00 0.00 H new ATOM 1772 N ALA B 28 0.302 13.615 10.017 1.00 0.00 N ATOM 1773 CA ALA B 28 -0.206 12.333 10.461 1.00 0.00 C ATOM 1774 C ALA B 28 0.945 11.427 10.878 1.00 0.00 C ATOM 1775 O ALA B 28 1.943 11.320 10.164 1.00 0.00 O ATOM 1776 CB ALA B 28 -1.018 11.684 9.352 1.00 0.00 C ATOM 0 H ALA B 28 0.870 13.568 9.171 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.854 12.488 11.324 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -1.396 10.721 9.694 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.856 12.330 9.089 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -0.385 11.535 8.477 1.00 0.00 H new ATOM 1782 N PRO B 29 0.829 10.782 12.050 1.00 0.00 N ATOM 1783 CA PRO B 29 1.849 9.855 12.558 1.00 0.00 C ATOM 1784 C PRO B 29 2.133 8.705 11.591 1.00 0.00 C ATOM 1785 O PRO B 29 1.307 8.378 10.732 1.00 0.00 O ATOM 1786 CB PRO B 29 1.231 9.320 13.855 1.00 0.00 C ATOM 1787 CG PRO B 29 0.249 10.362 14.263 1.00 0.00 C ATOM 1788 CD PRO B 29 -0.301 10.921 12.983 1.00 0.00 C ATOM 0 HA PRO B 29 2.810 10.350 12.697 1.00 0.00 H new ATOM 0 HB2 PRO B 29 0.744 8.358 13.694 1.00 0.00 H new ATOM 0 HB3 PRO B 29 1.990 9.169 14.623 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -0.544 9.935 14.877 1.00 0.00 H new ATOM 0 HG3 PRO B 29 0.728 11.141 14.857 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -1.176 10.367 12.643 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -0.607 11.961 13.095 1.00 0.00 H new ATOM 1796 N THR B 30 3.299 8.093 11.748 1.00 0.00 N ATOM 1797 CA THR B 30 3.730 7.002 10.881 1.00 0.00 C ATOM 1798 C THR B 30 2.737 5.838 10.923 1.00 0.00 C ATOM 1799 O THR B 30 2.484 5.187 9.910 1.00 0.00 O ATOM 1800 CB THR B 30 5.126 6.499 11.294 1.00 0.00 C ATOM 1801 OG1 THR B 30 5.987 7.621 11.549 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.738 5.629 10.204 1.00 0.00 C ATOM 0 H THR B 30 3.971 8.336 12.476 1.00 0.00 H new ATOM 0 HA THR B 30 3.773 7.390 9.863 1.00 0.00 H new ATOM 0 HB THR B 30 5.020 5.898 12.197 1.00 0.00 H new ATOM 0 HG1 THR B 30 6.874 7.299 11.813 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.723 5.287 10.521 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.096 4.767 10.023 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.834 6.209 9.286 1.00 0.00 H new ATOM 1810 N ASP B 31 2.165 5.595 12.096 1.00 0.00 N ATOM 1811 CA ASP B 31 1.185 4.525 12.259 1.00 0.00 C ATOM 1812 C ASP B 31 -0.070 4.836 11.456 1.00 0.00 C ATOM 1813 O ASP B 31 -0.578 3.989 10.722 1.00 0.00 O ATOM 1814 CB ASP B 31 0.802 4.350 13.730 1.00 0.00 C ATOM 1815 CG ASP B 31 1.999 4.267 14.651 1.00 0.00 C ATOM 1816 OD1 ASP B 31 2.586 3.178 14.775 1.00 0.00 O ATOM 1817 OD2 ASP B 31 2.345 5.300 15.263 1.00 0.00 O ATOM 0 H ASP B 31 2.361 6.122 12.947 1.00 0.00 H new ATOM 0 HA ASP B 31 1.638 3.602 11.898 1.00 0.00 H new ATOM 0 HB2 ASP B 31 0.173 5.185 14.037 1.00 0.00 H new ATOM 0 HB3 ASP B 31 0.205 3.445 13.838 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.550 6.067 11.590 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.782 6.495 10.939 1.00 0.00 C ATOM 1824 C LEU B 32 -1.650 6.434 9.425 1.00 0.00 C ATOM 1825 O LEU B 32 -2.537 5.928 8.740 1.00 0.00 O ATOM 1826 CB LEU B 32 -2.150 7.915 11.369 1.00 0.00 C ATOM 1827 CG LEU B 32 -3.428 8.477 10.737 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -4.632 7.623 11.102 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -3.644 9.915 11.170 1.00 0.00 C ATOM 0 H LEU B 32 -0.100 6.792 12.149 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.575 5.813 11.246 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -2.262 7.932 12.453 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -1.320 8.578 11.124 1.00 0.00 H new ATOM 0 HG LEU B 32 -3.312 8.455 9.653 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -5.527 8.041 10.642 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.480 6.606 10.741 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.753 7.609 12.185 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -4.556 10.300 10.713 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.736 9.958 12.255 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.795 10.522 10.854 1.00 0.00 H new ATOM 1841 N SER B 33 -0.540 6.940 8.908 1.00 0.00 N ATOM 1842 CA SER B 33 -0.311 6.955 7.473 1.00 0.00 C ATOM 1843 C SER B 33 -0.297 5.535 6.909 1.00 0.00 C ATOM 1844 O SER B 33 -0.900 5.271 5.870 1.00 0.00 O ATOM 1845 CB SER B 33 0.992 7.689 7.156 1.00 0.00 C ATOM 1846 OG SER B 33 2.003 7.358 8.088 1.00 0.00 O ATOM 0 H SER B 33 0.215 7.345 9.461 1.00 0.00 H new ATOM 0 HA SER B 33 -1.131 7.490 6.994 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.322 7.432 6.150 1.00 0.00 H new ATOM 0 HB3 SER B 33 0.819 8.765 7.169 1.00 0.00 H new ATOM 0 HG SER B 33 1.870 6.439 8.402 1.00 0.00 H new ATOM 1852 N LEU B 34 0.363 4.620 7.615 1.00 0.00 N ATOM 1853 CA LEU B 34 0.390 3.218 7.210 1.00 0.00 C ATOM 1854 C LEU B 34 -1.009 2.610 7.242 1.00 0.00 C ATOM 1855 O LEU B 34 -1.391 1.866 6.340 1.00 0.00 O ATOM 1856 CB LEU B 34 1.335 2.413 8.108 1.00 0.00 C ATOM 1857 CG LEU B 34 2.823 2.729 7.937 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.652 1.929 8.929 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.270 2.436 6.512 1.00 0.00 C ATOM 0 H LEU B 34 0.885 4.824 8.468 1.00 0.00 H new ATOM 0 HA LEU B 34 0.759 3.176 6.185 1.00 0.00 H new ATOM 0 HB2 LEU B 34 1.060 2.589 9.148 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.180 1.352 7.912 1.00 0.00 H new ATOM 0 HG LEU B 34 2.976 3.790 8.134 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.708 2.165 8.795 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.350 2.184 9.945 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.494 0.864 8.760 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.330 2.666 6.409 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.104 1.382 6.288 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.696 3.049 5.817 1.00 0.00 H new ATOM 1871 N MET B 35 -1.776 2.939 8.278 1.00 0.00 N ATOM 1872 CA MET B 35 -3.144 2.442 8.405 1.00 0.00 C ATOM 1873 C MET B 35 -4.016 2.941 7.257 1.00 0.00 C ATOM 1874 O MET B 35 -4.766 2.170 6.652 1.00 0.00 O ATOM 1875 CB MET B 35 -3.755 2.869 9.742 1.00 0.00 C ATOM 1876 CG MET B 35 -3.116 2.202 10.950 1.00 0.00 C ATOM 1877 SD MET B 35 -3.812 2.776 12.514 1.00 0.00 S ATOM 1878 CE MET B 35 -5.531 2.303 12.325 1.00 0.00 C ATOM 0 H MET B 35 -1.475 3.546 9.040 1.00 0.00 H new ATOM 0 HA MET B 35 -3.104 1.353 8.366 1.00 0.00 H new ATOM 0 HB2 MET B 35 -3.662 3.950 9.844 1.00 0.00 H new ATOM 0 HB3 MET B 35 -4.821 2.640 9.734 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.245 1.122 10.874 1.00 0.00 H new ATOM 0 HG3 MET B 35 -2.043 2.396 10.942 1.00 0.00 H new ATOM 0 HE1 MET B 35 -6.015 2.293 13.302 1.00 0.00 H new ATOM 0 HE2 MET B 35 -6.036 3.019 11.677 1.00 0.00 H new ATOM 0 HE3 MET B 35 -5.588 1.309 11.881 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.911 4.230 6.959 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.686 4.832 5.883 1.00 0.00 C ATOM 1890 C VAL B 36 -4.270 4.265 4.531 1.00 0.00 C ATOM 1891 O VAL B 36 -5.116 3.813 3.760 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.546 6.371 5.872 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.264 6.979 4.675 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -5.088 6.956 7.166 1.00 0.00 C ATOM 0 H VAL B 36 -3.295 4.879 7.449 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.732 4.586 6.065 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.487 6.615 5.789 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -5.149 8.063 4.693 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.835 6.584 3.754 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.323 6.726 4.719 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -4.984 8.041 7.147 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -6.141 6.694 7.271 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.528 6.553 8.010 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.967 4.264 4.257 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.454 3.753 2.988 1.00 0.00 C ATOM 1906 C LEU B 37 -2.807 2.282 2.814 1.00 0.00 C ATOM 1907 O LEU B 37 -3.165 1.848 1.719 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.937 3.943 2.894 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.462 5.397 2.840 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.055 5.460 2.789 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -1.064 6.115 1.641 1.00 0.00 C ATOM 0 H LEU B 37 -2.250 4.610 4.894 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.925 4.322 2.187 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.473 3.458 3.753 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.577 3.427 2.004 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.799 5.900 3.746 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.375 6.501 2.751 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.469 4.986 3.679 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.411 4.938 1.901 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -0.714 7.147 1.621 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.759 5.611 0.724 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.151 6.102 1.718 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.721 1.526 3.903 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.074 0.120 3.867 1.00 0.00 C ATOM 1925 C GLY B 38 -4.499 -0.100 3.399 1.00 0.00 C ATOM 1926 O GLY B 38 -4.741 -0.863 2.462 1.00 0.00 O ATOM 0 H GLY B 38 -2.411 1.865 4.814 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.390 -0.408 3.203 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.949 -0.310 4.861 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.441 0.584 4.034 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.846 0.469 3.660 1.00 0.00 C ATOM 1932 C ASN B 39 -7.084 1.054 2.271 1.00 0.00 C ATOM 1933 O ASN B 39 -7.888 0.535 1.499 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.752 1.164 4.683 1.00 0.00 C ATOM 1935 CG ASN B 39 -7.925 0.364 5.964 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -8.809 -0.487 6.060 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -7.096 0.639 6.962 1.00 0.00 N ATOM 0 H ASN B 39 -5.260 1.223 4.808 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.097 -0.592 3.644 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.334 2.141 4.925 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.730 1.338 4.235 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -7.179 0.138 7.847 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -6.375 1.351 6.845 1.00 0.00 H new ATOM 1944 N MET B 40 -6.368 2.129 1.959 1.00 0.00 N ATOM 1945 CA MET B 40 -6.487 2.795 0.665 1.00 0.00 C ATOM 1946 C MET B 40 -6.128 1.842 -0.475 1.00 0.00 C ATOM 1947 O MET B 40 -6.902 1.673 -1.419 1.00 0.00 O ATOM 1948 CB MET B 40 -5.582 4.030 0.620 1.00 0.00 C ATOM 1949 CG MET B 40 -5.677 4.825 -0.673 1.00 0.00 C ATOM 1950 SD MET B 40 -4.598 6.269 -0.674 1.00 0.00 S ATOM 1951 CE MET B 40 -4.946 6.953 -2.292 1.00 0.00 C ATOM 0 H MET B 40 -5.693 2.561 2.590 1.00 0.00 H new ATOM 0 HA MET B 40 -7.524 3.107 0.538 1.00 0.00 H new ATOM 0 HB2 MET B 40 -5.836 4.683 1.455 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.549 3.715 0.765 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.417 4.180 -1.512 1.00 0.00 H new ATOM 0 HG3 MET B 40 -6.708 5.145 -0.824 1.00 0.00 H new ATOM 0 HE1 MET B 40 -4.009 7.148 -2.814 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.540 6.243 -2.867 1.00 0.00 H new ATOM 0 HE3 MET B 40 -5.501 7.885 -2.181 1.00 0.00 H new ATOM 1961 N VAL B 41 -4.958 1.214 -0.372 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.504 0.269 -1.389 1.00 0.00 C ATOM 1963 C VAL B 41 -5.448 -0.925 -1.473 1.00 0.00 C ATOM 1964 O VAL B 41 -5.841 -1.340 -2.565 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.064 -0.225 -1.108 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -2.634 -1.261 -2.138 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.089 0.942 -1.096 1.00 0.00 C ATOM 0 H VAL B 41 -4.309 1.343 0.404 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.504 0.797 -2.343 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.056 -0.695 -0.125 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -1.619 -1.592 -1.919 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.311 -2.115 -2.100 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -2.664 -0.818 -3.134 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.083 0.573 -0.897 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.107 1.441 -2.065 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.377 1.649 -0.318 1.00 0.00 H new ATOM 1977 N THR B 42 -5.828 -1.457 -0.315 1.00 0.00 N ATOM 1978 CA THR B 42 -6.746 -2.586 -0.254 1.00 0.00 C ATOM 1979 C THR B 42 -8.061 -2.253 -0.961 1.00 0.00 C ATOM 1980 O THR B 42 -8.602 -3.070 -1.707 1.00 0.00 O ATOM 1981 CB THR B 42 -7.029 -2.997 1.210 1.00 0.00 C ATOM 1982 OG1 THR B 42 -5.792 -3.224 1.895 1.00 0.00 O ATOM 1983 CG2 THR B 42 -7.876 -4.261 1.276 1.00 0.00 C ATOM 0 H THR B 42 -5.512 -1.122 0.595 1.00 0.00 H new ATOM 0 HA THR B 42 -6.271 -3.424 -0.764 1.00 0.00 H new ATOM 0 HB THR B 42 -7.580 -2.186 1.687 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.386 -2.364 2.131 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.057 -4.523 2.318 1.00 0.00 H new ATOM 0 HG22 THR B 42 -8.828 -4.088 0.775 1.00 0.00 H new ATOM 0 HG23 THR B 42 -7.350 -5.078 0.782 1.00 0.00 H new ATOM 1991 N ASN B 43 -8.555 -1.038 -0.746 1.00 0.00 N ATOM 1992 CA ASN B 43 -9.791 -0.593 -1.379 1.00 0.00 C ATOM 1993 C ASN B 43 -9.633 -0.525 -2.894 1.00 0.00 C ATOM 1994 O ASN B 43 -10.516 -0.957 -3.633 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.220 0.770 -0.825 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.477 1.306 -1.488 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.596 0.961 -1.104 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -11.306 2.177 -2.475 1.00 0.00 N ATOM 0 H ASN B 43 -8.119 -0.344 -0.139 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.569 -1.321 -1.150 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -10.389 0.684 0.248 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -9.409 1.485 -0.963 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.116 2.584 -2.942 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -10.364 2.439 -2.766 1.00 0.00 H new ATOM 2005 N LEU B 44 -8.499 -0.002 -3.359 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.231 0.099 -4.793 1.00 0.00 C ATOM 2007 C LEU B 44 -8.311 -1.273 -5.456 1.00 0.00 C ATOM 2008 O LEU B 44 -8.955 -1.436 -6.492 1.00 0.00 O ATOM 2009 CB LEU B 44 -6.852 0.715 -5.047 1.00 0.00 C ATOM 2010 CG LEU B 44 -6.691 2.170 -4.603 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -5.268 2.645 -4.838 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -7.677 3.066 -5.336 1.00 0.00 C ATOM 0 H LEU B 44 -7.752 0.358 -2.765 1.00 0.00 H new ATOM 0 HA LEU B 44 -8.992 0.747 -5.228 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -6.103 0.111 -4.534 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.636 0.652 -6.114 1.00 0.00 H new ATOM 0 HG LEU B 44 -6.902 2.227 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -5.173 3.682 -4.516 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -4.578 2.023 -4.268 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.030 2.571 -5.899 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.547 4.097 -5.006 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.498 3.003 -6.409 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.695 2.742 -5.119 1.00 0.00 H new ATOM 2024 N ILE B 45 -7.681 -2.256 -4.829 1.00 0.00 N ATOM 2025 CA ILE B 45 -7.663 -3.619 -5.352 1.00 0.00 C ATOM 2026 C ILE B 45 -9.066 -4.238 -5.326 1.00 0.00 C ATOM 2027 O ILE B 45 -9.377 -5.132 -6.107 1.00 0.00 O ATOM 2028 CB ILE B 45 -6.683 -4.506 -4.548 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.301 -3.846 -4.476 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -6.569 -5.891 -5.172 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.303 -4.611 -3.631 1.00 0.00 C ATOM 0 H ILE B 45 -7.173 -2.136 -3.953 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.323 -3.569 -6.387 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.076 -4.614 -3.537 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -4.905 -3.743 -5.486 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.410 -2.840 -4.072 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.875 -6.496 -4.589 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -7.549 -6.369 -5.179 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.202 -5.800 -6.194 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.349 -4.083 -3.627 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.677 -4.692 -2.610 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.164 -5.609 -4.047 1.00 0.00 H new ATOM 2043 N ASN B 46 -9.907 -3.750 -4.427 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.264 -4.270 -4.291 1.00 0.00 C ATOM 2045 C ASN B 46 -12.290 -3.434 -5.051 1.00 0.00 C ATOM 2046 O ASN B 46 -13.480 -3.757 -5.045 1.00 0.00 O ATOM 2047 CB ASN B 46 -11.663 -4.359 -2.815 1.00 0.00 C ATOM 2048 CG ASN B 46 -11.082 -5.576 -2.129 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -11.690 -6.643 -2.125 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -9.903 -5.434 -1.548 1.00 0.00 N ATOM 0 H ASN B 46 -9.677 -2.996 -3.780 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.260 -5.268 -4.730 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.329 -3.460 -2.297 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -12.750 -4.386 -2.737 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -9.468 -6.227 -1.076 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -9.428 -4.532 -1.572 1.00 0.00 H new ATOM 2057 N THR B 47 -11.850 -2.353 -5.683 1.00 0.00 N ATOM 2058 CA THR B 47 -12.767 -1.493 -6.425 1.00 0.00 C ATOM 2059 C THR B 47 -12.475 -1.495 -7.927 1.00 0.00 C ATOM 2060 O THR B 47 -13.300 -1.943 -8.724 1.00 0.00 O ATOM 2061 CB THR B 47 -12.743 -0.046 -5.891 1.00 0.00 C ATOM 2062 OG1 THR B 47 -11.391 0.399 -5.720 1.00 0.00 O ATOM 2063 CG2 THR B 47 -13.485 0.054 -4.568 1.00 0.00 C ATOM 0 H THR B 47 -10.875 -2.052 -5.698 1.00 0.00 H new ATOM 0 HA THR B 47 -13.763 -1.908 -6.273 1.00 0.00 H new ATOM 0 HB THR B 47 -13.242 0.592 -6.621 1.00 0.00 H new ATOM 0 HG1 THR B 47 -11.090 0.188 -4.812 1.00 0.00 H new ATOM 0 HG21 THR B 47 -13.455 1.083 -4.211 1.00 0.00 H new ATOM 0 HG22 THR B 47 -14.522 -0.251 -4.708 1.00 0.00 H new ATOM 0 HG23 THR B 47 -13.011 -0.599 -3.835 1.00 0.00 H new ATOM 2071 N SER B 48 -11.310 -0.994 -8.311 1.00 0.00 N ATOM 2072 CA SER B 48 -10.956 -0.886 -9.720 1.00 0.00 C ATOM 2073 C SER B 48 -10.368 -2.195 -10.236 1.00 0.00 C ATOM 2074 O SER B 48 -10.607 -2.589 -11.380 1.00 0.00 O ATOM 2075 CB SER B 48 -9.977 0.271 -9.924 1.00 0.00 C ATOM 2076 OG SER B 48 -9.055 0.351 -8.848 1.00 0.00 O ATOM 0 H SER B 48 -10.594 -0.656 -7.668 1.00 0.00 H new ATOM 0 HA SER B 48 -11.861 -0.683 -10.293 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.437 0.135 -10.861 1.00 0.00 H new ATOM 0 HB3 SER B 48 -10.528 1.208 -10.007 1.00 0.00 H new ATOM 0 HG SER B 48 -8.438 1.097 -9.001 1.00 0.00 H new ATOM 2082 N ILE B 49 -9.610 -2.870 -9.385 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.050 -4.166 -9.730 1.00 0.00 C ATOM 2084 C ILE B 49 -10.137 -5.235 -9.636 1.00 0.00 C ATOM 2085 O ILE B 49 -11.022 -5.150 -8.784 1.00 0.00 O ATOM 2086 CB ILE B 49 -7.865 -4.532 -8.805 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -6.783 -3.445 -8.862 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -7.277 -5.888 -9.177 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -6.195 -3.233 -10.243 1.00 0.00 C ATOM 0 H ILE B 49 -9.369 -2.541 -8.450 1.00 0.00 H new ATOM 0 HA ILE B 49 -8.673 -4.115 -10.751 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.242 -4.596 -7.784 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.208 -2.505 -8.511 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -5.981 -3.709 -8.173 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.446 -6.119 -8.511 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.044 -6.656 -9.081 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -6.919 -5.860 -10.206 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -5.438 -2.450 -10.200 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -5.738 -4.160 -10.590 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -6.985 -2.937 -10.933 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.088 -6.213 -10.535 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.068 -7.289 -10.551 1.00 0.00 C ATOM 2103 C ALA B 50 -11.005 -8.099 -9.259 1.00 0.00 C ATOM 2104 O ALA B 50 -9.966 -8.673 -8.929 1.00 0.00 O ATOM 2105 CB ALA B 50 -10.846 -8.187 -11.759 1.00 0.00 C ATOM 0 H ALA B 50 -9.377 -6.281 -11.263 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.062 -6.848 -10.624 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.586 -8.987 -11.758 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.947 -7.600 -12.672 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.846 -8.618 -11.713 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.126 -8.165 -8.521 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.195 -8.838 -7.215 1.00 0.00 C ATOM 2113 C PRO B 51 -11.838 -10.322 -7.291 1.00 0.00 C ATOM 2114 O PRO B 51 -11.488 -10.934 -6.287 1.00 0.00 O ATOM 2115 CB PRO B 51 -13.658 -8.665 -6.791 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.159 -7.513 -7.593 1.00 0.00 C ATOM 2117 CD PRO B 51 -13.423 -7.577 -8.899 1.00 0.00 C ATOM 0 HA PRO B 51 -11.479 -8.412 -6.512 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -14.236 -9.567 -6.992 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -13.738 -8.466 -5.722 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -15.236 -7.582 -7.747 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -13.970 -6.569 -7.083 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -13.948 -8.194 -9.628 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -13.304 -6.589 -9.344 1.00 0.00 H new ATOM 2125 N ALA B 52 -11.918 -10.893 -8.483 1.00 0.00 N ATOM 2126 CA ALA B 52 -11.591 -12.297 -8.676 1.00 0.00 C ATOM 2127 C ALA B 52 -10.084 -12.527 -8.575 1.00 0.00 C ATOM 2128 O ALA B 52 -9.632 -13.580 -8.127 1.00 0.00 O ATOM 2129 CB ALA B 52 -12.113 -12.780 -10.021 1.00 0.00 C ATOM 0 H ALA B 52 -12.207 -10.406 -9.331 1.00 0.00 H new ATOM 0 HA ALA B 52 -12.074 -12.871 -7.885 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -11.861 -13.832 -10.152 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -13.196 -12.659 -10.056 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -11.657 -12.195 -10.820 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.308 -11.525 -8.970 1.00 0.00 N ATOM 2136 CA GLN B 53 -7.858 -11.656 -8.996 1.00 0.00 C ATOM 2137 C GLN B 53 -7.203 -10.757 -7.952 1.00 0.00 C ATOM 2138 O GLN B 53 -5.985 -10.582 -7.954 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.317 -11.327 -10.389 1.00 0.00 C ATOM 2140 CG GLN B 53 -7.614 -9.907 -10.841 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.129 -9.633 -12.249 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -5.997 -9.201 -12.458 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -7.984 -9.887 -13.223 1.00 0.00 N ATOM 0 H GLN B 53 -9.657 -10.617 -9.275 1.00 0.00 H new ATOM 0 HA GLN B 53 -7.612 -12.690 -8.755 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.238 -11.483 -10.396 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.744 -12.025 -11.109 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -8.688 -9.730 -10.789 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.142 -9.204 -10.154 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -8.914 -10.245 -13.005 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -7.714 -9.725 -14.193 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.012 -10.212 -7.047 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.506 -9.320 -6.005 1.00 0.00 C ATOM 2154 C ARG B 54 -6.471 -10.032 -5.134 1.00 0.00 C ATOM 2155 O ARG B 54 -5.524 -9.413 -4.651 1.00 0.00 O ATOM 2156 CB ARG B 54 -8.651 -8.790 -5.132 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.378 -9.867 -4.347 1.00 0.00 C ATOM 2158 CD ARG B 54 -10.482 -9.283 -3.482 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.291 -10.330 -2.865 1.00 0.00 N ATOM 2160 CZ ARG B 54 -12.529 -10.156 -2.412 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -13.078 -8.950 -2.371 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -13.204 -11.193 -1.959 1.00 0.00 N ATOM 0 H ARG B 54 -9.019 -10.371 -7.013 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.025 -8.475 -6.498 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.252 -8.054 -4.435 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -9.369 -8.271 -5.767 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.803 -10.596 -5.037 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.667 -10.401 -3.717 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.044 -8.656 -2.706 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.119 -8.640 -4.089 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.878 -11.258 -2.775 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.550 -8.138 -2.690 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.029 -8.834 -2.021 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.776 -12.119 -1.958 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.154 -11.070 -1.609 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.650 -11.336 -4.960 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.748 -12.135 -4.144 1.00 0.00 C ATOM 2178 C GLN B 55 -4.382 -12.234 -4.816 1.00 0.00 C ATOM 2179 O GLN B 55 -3.347 -11.990 -4.189 1.00 0.00 O ATOM 2180 CB GLN B 55 -6.339 -13.529 -3.934 1.00 0.00 C ATOM 2181 CG GLN B 55 -5.553 -14.394 -2.965 1.00 0.00 C ATOM 2182 CD GLN B 55 -6.136 -15.785 -2.829 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -6.702 -16.333 -3.776 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -6.015 -16.361 -1.646 1.00 0.00 N ATOM 0 H GLN B 55 -7.417 -11.864 -5.377 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.623 -11.654 -3.174 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -7.361 -13.428 -3.568 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -6.394 -14.038 -4.896 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -4.520 -14.468 -3.304 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -5.534 -13.914 -1.987 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -5.539 -15.873 -0.887 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -6.398 -17.294 -1.491 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.395 -12.575 -6.099 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.171 -12.684 -6.883 1.00 0.00 C ATOM 2195 C ALA B 56 -2.469 -11.333 -6.998 1.00 0.00 C ATOM 2196 O ALA B 56 -1.248 -11.245 -6.867 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.481 -13.239 -8.266 1.00 0.00 C ATOM 0 H ALA B 56 -5.246 -12.782 -6.621 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.498 -13.370 -6.369 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.559 -13.316 -8.842 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.932 -14.227 -8.169 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.175 -12.572 -8.778 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.250 -10.284 -7.235 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.709 -8.935 -7.378 1.00 0.00 C ATOM 2205 C ILE B 57 -2.040 -8.468 -6.087 1.00 0.00 C ATOM 2206 O ILE B 57 -0.938 -7.920 -6.118 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.806 -7.925 -7.791 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -4.355 -8.276 -9.179 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -3.271 -6.498 -7.774 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -3.303 -8.286 -10.269 1.00 0.00 C ATOM 0 H ILE B 57 -4.264 -10.342 -7.333 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.959 -8.976 -8.168 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.617 -7.988 -7.066 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -4.828 -9.257 -9.135 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -5.132 -7.559 -9.444 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.063 -5.809 -8.068 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.929 -6.250 -6.769 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -2.438 -6.413 -8.472 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -3.768 -8.543 -11.221 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -2.846 -7.299 -10.343 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -2.537 -9.023 -10.029 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.703 -8.700 -4.960 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.163 -8.313 -3.658 1.00 0.00 C ATOM 2224 C ALA B 58 -0.826 -9.002 -3.398 1.00 0.00 C ATOM 2225 O ALA B 58 0.126 -8.380 -2.925 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.153 -8.645 -2.552 1.00 0.00 C ATOM 0 H ALA B 58 -3.615 -9.154 -4.919 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.997 -7.236 -3.666 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.735 -8.350 -1.589 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.085 -8.106 -2.724 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.350 -9.717 -2.549 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.759 -10.284 -3.727 1.00 0.00 N ATOM 2233 CA ASN B 59 0.459 -11.062 -3.543 1.00 0.00 C ATOM 2234 C ASN B 59 1.549 -10.584 -4.503 1.00 0.00 C ATOM 2235 O ASN B 59 2.720 -10.482 -4.133 1.00 0.00 O ATOM 2236 CB ASN B 59 0.158 -12.550 -3.752 1.00 0.00 C ATOM 2237 CG ASN B 59 1.340 -13.451 -3.442 1.00 0.00 C ATOM 2238 OD1 ASN B 59 2.212 -13.113 -2.642 1.00 0.00 O ATOM 2239 ND2 ASN B 59 1.359 -14.623 -4.058 1.00 0.00 N ATOM 0 H ASN B 59 -1.537 -10.810 -4.125 1.00 0.00 H new ATOM 0 HA ASN B 59 0.824 -10.920 -2.526 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.683 -12.836 -3.120 1.00 0.00 H new ATOM 0 HB3 ASN B 59 -0.151 -12.710 -4.785 1.00 0.00 H new ATOM 0 HD21 ASN B 59 2.115 -15.283 -3.876 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.617 -14.866 -4.715 1.00 0.00 H new ATOM 2246 N SER B 60 1.153 -10.263 -5.730 1.00 0.00 N ATOM 2247 CA SER B 60 2.081 -9.728 -6.718 1.00 0.00 C ATOM 2248 C SER B 60 2.644 -8.388 -6.248 1.00 0.00 C ATOM 2249 O SER B 60 3.842 -8.124 -6.387 1.00 0.00 O ATOM 2250 CB SER B 60 1.381 -9.565 -8.071 1.00 0.00 C ATOM 2251 OG SER B 60 2.277 -9.092 -9.064 1.00 0.00 O ATOM 0 H SER B 60 0.194 -10.364 -6.064 1.00 0.00 H new ATOM 0 HA SER B 60 2.907 -10.430 -6.835 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.962 -10.522 -8.383 1.00 0.00 H new ATOM 0 HB3 SER B 60 0.548 -8.870 -7.970 1.00 0.00 H new ATOM 0 HG SER B 60 1.802 -9.000 -9.916 1.00 0.00 H new ATOM 2257 N PHE B 61 1.777 -7.559 -5.674 1.00 0.00 N ATOM 2258 CA PHE B 61 2.181 -6.265 -5.141 1.00 0.00 C ATOM 2259 C PHE B 61 3.209 -6.448 -4.030 1.00 0.00 C ATOM 2260 O PHE B 61 4.130 -5.644 -3.885 1.00 0.00 O ATOM 2261 CB PHE B 61 0.960 -5.499 -4.617 1.00 0.00 C ATOM 2262 CG PHE B 61 1.275 -4.112 -4.125 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.429 -3.065 -5.019 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.408 -3.855 -2.769 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.718 -1.790 -4.572 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.699 -2.582 -2.316 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.850 -1.547 -3.219 1.00 0.00 C ATOM 0 H PHE B 61 0.784 -7.764 -5.566 1.00 0.00 H new ATOM 0 HA PHE B 61 2.636 -5.685 -5.944 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.217 -5.432 -5.412 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.508 -6.068 -3.805 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.322 -3.248 -6.078 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.283 -4.659 -2.059 1.00 0.00 H new ATOM 0 HE1 PHE B 61 1.841 -0.984 -5.280 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.808 -2.396 -1.258 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.071 -0.550 -2.867 1.00 0.00 H new ATOM 2277 N ALA B 62 3.053 -7.519 -3.259 1.00 0.00 N ATOM 2278 CA ALA B 62 3.993 -7.840 -2.196 1.00 0.00 C ATOM 2279 C ALA B 62 5.393 -8.060 -2.759 1.00 0.00 C ATOM 2280 O ALA B 62 6.370 -7.537 -2.220 1.00 0.00 O ATOM 2281 CB ALA B 62 3.529 -9.062 -1.419 1.00 0.00 C ATOM 0 H ALA B 62 2.282 -8.180 -3.352 1.00 0.00 H new ATOM 0 HA ALA B 62 4.032 -6.993 -1.510 1.00 0.00 H new ATOM 0 HB1 ALA B 62 4.246 -9.285 -0.629 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.553 -8.863 -0.977 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.455 -9.915 -2.093 1.00 0.00 H new ATOM 2287 N ARG B 63 5.490 -8.818 -3.851 1.00 0.00 N ATOM 2288 CA ARG B 63 6.780 -9.018 -4.510 1.00 0.00 C ATOM 2289 C ARG B 63 7.323 -7.697 -5.033 1.00 0.00 C ATOM 2290 O ARG B 63 8.500 -7.389 -4.851 1.00 0.00 O ATOM 2291 CB ARG B 63 6.695 -10.021 -5.666 1.00 0.00 C ATOM 2292 CG ARG B 63 6.619 -11.476 -5.229 1.00 0.00 C ATOM 2293 CD ARG B 63 5.191 -11.979 -5.197 1.00 0.00 C ATOM 2294 NE ARG B 63 4.583 -11.988 -6.527 1.00 0.00 N ATOM 2295 CZ ARG B 63 3.732 -12.923 -6.948 1.00 0.00 C ATOM 2296 NH1 ARG B 63 3.449 -13.965 -6.175 1.00 0.00 N ATOM 2297 NH2 ARG B 63 3.186 -12.826 -8.153 1.00 0.00 N ATOM 0 H ARG B 63 4.705 -9.297 -4.292 1.00 0.00 H new ATOM 0 HA ARG B 63 7.455 -9.426 -3.758 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.817 -9.789 -6.269 1.00 0.00 H new ATOM 0 HB3 ARG B 63 7.566 -9.892 -6.308 1.00 0.00 H new ATOM 0 HG2 ARG B 63 7.206 -12.091 -5.911 1.00 0.00 H new ATOM 0 HG3 ARG B 63 7.064 -11.582 -4.240 1.00 0.00 H new ATOM 0 HD2 ARG B 63 5.171 -12.987 -4.782 1.00 0.00 H new ATOM 0 HD3 ARG B 63 4.600 -11.349 -4.532 1.00 0.00 H new ATOM 0 HE ARG B 63 4.825 -11.234 -7.170 1.00 0.00 H new ATOM 0 HH11 ARG B 63 3.883 -14.051 -5.256 1.00 0.00 H new ATOM 0 HH12 ARG B 63 2.797 -14.679 -6.500 1.00 0.00 H new ATOM 0 HH21 ARG B 63 3.418 -12.037 -8.756 1.00 0.00 H new ATOM 0 HH22 ARG B 63 2.534 -13.541 -8.477 1.00 0.00 H new ATOM 2311 N ALA B 64 6.457 -6.920 -5.672 1.00 0.00 N ATOM 2312 CA ALA B 64 6.841 -5.625 -6.221 1.00 0.00 C ATOM 2313 C ALA B 64 7.393 -4.710 -5.132 1.00 0.00 C ATOM 2314 O ALA B 64 8.434 -4.081 -5.310 1.00 0.00 O ATOM 2315 CB ALA B 64 5.653 -4.973 -6.912 1.00 0.00 C ATOM 0 H ALA B 64 5.479 -7.166 -5.823 1.00 0.00 H new ATOM 0 HA ALA B 64 7.630 -5.787 -6.956 1.00 0.00 H new ATOM 0 HB1 ALA B 64 5.953 -4.007 -7.317 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.306 -5.615 -7.722 1.00 0.00 H new ATOM 0 HB3 ALA B 64 4.847 -4.830 -6.192 1.00 0.00 H new ATOM 2321 N LEU B 65 6.698 -4.660 -4.002 1.00 0.00 N ATOM 2322 CA LEU B 65 7.110 -3.833 -2.877 1.00 0.00 C ATOM 2323 C LEU B 65 8.474 -4.270 -2.349 1.00 0.00 C ATOM 2324 O LEU B 65 9.373 -3.451 -2.170 1.00 0.00 O ATOM 2325 CB LEU B 65 6.070 -3.903 -1.757 1.00 0.00 C ATOM 2326 CG LEU B 65 6.374 -3.039 -0.531 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.387 -1.565 -0.906 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.360 -3.301 0.570 1.00 0.00 C ATOM 0 H LEU B 65 5.840 -5.187 -3.841 1.00 0.00 H new ATOM 0 HA LEU B 65 7.189 -2.803 -3.226 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.103 -3.604 -2.162 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.974 -4.940 -1.436 1.00 0.00 H new ATOM 0 HG LEU B 65 7.363 -3.307 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.605 -0.966 -0.021 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.153 -1.388 -1.661 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.413 -1.282 -1.304 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.592 -2.678 1.434 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.360 -3.062 0.208 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.400 -4.351 0.859 1.00 0.00 H new ATOM 2340 N GLN B 66 8.626 -5.568 -2.121 1.00 0.00 N ATOM 2341 CA GLN B 66 9.864 -6.107 -1.569 1.00 0.00 C ATOM 2342 C GLN B 66 11.029 -5.958 -2.547 1.00 0.00 C ATOM 2343 O GLN B 66 12.180 -5.832 -2.134 1.00 0.00 O ATOM 2344 CB GLN B 66 9.675 -7.572 -1.178 1.00 0.00 C ATOM 2345 CG GLN B 66 8.753 -7.759 0.016 1.00 0.00 C ATOM 2346 CD GLN B 66 8.491 -9.218 0.333 1.00 0.00 C ATOM 2347 OE1 GLN B 66 9.317 -10.086 0.057 1.00 0.00 O ATOM 2348 NE2 GLN B 66 7.339 -9.494 0.921 1.00 0.00 N ATOM 0 H GLN B 66 7.908 -6.268 -2.309 1.00 0.00 H new ATOM 0 HA GLN B 66 10.110 -5.531 -0.677 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.271 -8.119 -2.030 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.647 -8.009 -0.950 1.00 0.00 H new ATOM 0 HG2 GLN B 66 9.193 -7.276 0.888 1.00 0.00 H new ATOM 0 HG3 GLN B 66 7.805 -7.259 -0.181 1.00 0.00 H new ATOM 0 HE21 GLN B 66 6.682 -8.743 1.133 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.108 -10.458 1.163 1.00 0.00 H new ATOM 2357 N SER B 67 10.726 -5.958 -3.838 1.00 0.00 N ATOM 2358 CA SER B 67 11.749 -5.765 -4.858 1.00 0.00 C ATOM 2359 C SER B 67 12.102 -4.284 -4.982 1.00 0.00 C ATOM 2360 O SER B 67 13.174 -3.923 -5.471 1.00 0.00 O ATOM 2361 CB SER B 67 11.260 -6.306 -6.202 1.00 0.00 C ATOM 2362 OG SER B 67 10.883 -7.671 -6.097 1.00 0.00 O ATOM 0 H SER B 67 9.783 -6.089 -4.204 1.00 0.00 H new ATOM 0 HA SER B 67 12.644 -6.312 -4.563 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.411 -5.717 -6.548 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.047 -6.199 -6.949 1.00 0.00 H new ATOM 0 HG SER B 67 9.998 -7.735 -5.680 1.00 0.00 H new ATOM 2368 N SER B 68 11.187 -3.434 -4.534 1.00 0.00 N ATOM 2369 CA SER B 68 11.390 -1.997 -4.558 1.00 0.00 C ATOM 2370 C SER B 68 12.265 -1.567 -3.381 1.00 0.00 C ATOM 2371 O SER B 68 13.064 -0.633 -3.492 1.00 0.00 O ATOM 2372 CB SER B 68 10.032 -1.285 -4.513 1.00 0.00 C ATOM 2373 OG SER B 68 10.172 0.120 -4.616 1.00 0.00 O ATOM 0 H SER B 68 10.289 -3.722 -4.146 1.00 0.00 H new ATOM 0 HA SER B 68 11.901 -1.721 -5.480 1.00 0.00 H new ATOM 0 HB2 SER B 68 9.404 -1.648 -5.326 1.00 0.00 H new ATOM 0 HB3 SER B 68 9.522 -1.532 -3.582 1.00 0.00 H new ATOM 0 HG SER B 68 9.615 0.555 -3.937 1.00 0.00 H new ATOM 2379 N ILE B 69 12.123 -2.263 -2.256 1.00 0.00 N ATOM 2380 CA ILE B 69 12.906 -1.953 -1.069 1.00 0.00 C ATOM 2381 C ILE B 69 14.313 -2.536 -1.183 1.00 0.00 C ATOM 2382 O ILE B 69 14.605 -3.602 -0.634 1.00 0.00 O ATOM 2383 CB ILE B 69 12.249 -2.482 0.229 1.00 0.00 C ATOM 2384 CG1 ILE B 69 10.787 -2.040 0.324 1.00 0.00 C ATOM 2385 CG2 ILE B 69 13.021 -1.989 1.448 1.00 0.00 C ATOM 2386 CD1 ILE B 69 10.067 -2.595 1.536 1.00 0.00 C ATOM 0 H ILE B 69 11.475 -3.042 -2.144 1.00 0.00 H new ATOM 0 HA ILE B 69 12.954 -0.866 -1.009 1.00 0.00 H new ATOM 0 HB ILE B 69 12.277 -3.571 0.203 1.00 0.00 H new ATOM 0 HG12 ILE B 69 10.746 -0.951 0.353 1.00 0.00 H new ATOM 0 HG13 ILE B 69 10.261 -2.355 -0.577 1.00 0.00 H new ATOM 0 HG21 ILE B 69 12.549 -2.368 2.355 1.00 0.00 H new ATOM 0 HG22 ILE B 69 14.049 -2.347 1.397 1.00 0.00 H new ATOM 0 HG23 ILE B 69 13.017 -0.899 1.465 1.00 0.00 H new ATOM 0 HD11 ILE B 69 9.036 -2.242 1.540 1.00 0.00 H new ATOM 0 HD12 ILE B 69 10.077 -3.684 1.498 1.00 0.00 H new ATOM 0 HD13 ILE B 69 10.569 -2.259 2.443 1.00 0.00 H new ATOM 2398 N ASN B 70 15.169 -1.863 -1.930 1.00 0.00 N ATOM 2399 CA ASN B 70 16.563 -2.256 -2.008 1.00 0.00 C ATOM 2400 C ASN B 70 17.397 -1.351 -1.110 1.00 0.00 C ATOM 2401 O ASN B 70 17.496 -0.144 -1.330 1.00 0.00 O ATOM 2402 CB ASN B 70 17.072 -2.248 -3.464 1.00 0.00 C ATOM 2403 CG ASN B 70 17.106 -0.870 -4.104 1.00 0.00 C ATOM 2404 OD1 ASN B 70 16.094 -0.381 -4.607 1.00 0.00 O ATOM 2405 ND2 ASN B 70 18.280 -0.253 -4.121 1.00 0.00 N ATOM 0 H ASN B 70 14.925 -1.045 -2.489 1.00 0.00 H new ATOM 0 HA ASN B 70 16.662 -3.282 -1.653 1.00 0.00 H new ATOM 0 HB2 ASN B 70 18.076 -2.673 -3.489 1.00 0.00 H new ATOM 0 HB3 ASN B 70 16.436 -2.899 -4.063 1.00 0.00 H new ATOM 0 HD21 ASN B 70 18.369 0.662 -4.563 1.00 0.00 H new ATOM 0 HD22 ASN B 70 19.094 -0.694 -3.692 1.00 0.00 H new ATOM 2412 N GLU B 71 17.940 -1.933 -0.054 1.00 0.00 N ATOM 2413 CA GLU B 71 18.746 -1.182 0.895 1.00 0.00 C ATOM 2414 C GLU B 71 20.202 -1.156 0.460 1.00 0.00 C ATOM 2415 O GLU B 71 21.000 -0.370 0.965 1.00 0.00 O ATOM 2416 CB GLU B 71 18.619 -1.779 2.293 1.00 0.00 C ATOM 2417 CG GLU B 71 17.209 -1.705 2.850 1.00 0.00 C ATOM 2418 CD GLU B 71 17.133 -2.179 4.282 1.00 0.00 C ATOM 2419 OE1 GLU B 71 17.721 -1.510 5.160 1.00 0.00 O ATOM 2420 OE2 GLU B 71 16.491 -3.217 4.535 1.00 0.00 O ATOM 0 H GLU B 71 17.838 -2.923 0.168 1.00 0.00 H new ATOM 0 HA GLU B 71 18.377 -0.157 0.921 1.00 0.00 H new ATOM 0 HB2 GLU B 71 18.938 -2.821 2.266 1.00 0.00 H new ATOM 0 HB3 GLU B 71 19.297 -1.256 2.967 1.00 0.00 H new ATOM 0 HG2 GLU B 71 16.851 -0.677 2.790 1.00 0.00 H new ATOM 0 HG3 GLU B 71 16.545 -2.311 2.233 1.00 0.00 H new ATOM 2427 N ASP B 72 20.534 -2.024 -0.481 1.00 0.00 N ATOM 2428 CA ASP B 72 21.871 -2.069 -1.045 1.00 0.00 C ATOM 2429 C ASP B 72 21.756 -2.016 -2.565 1.00 0.00 C ATOM 2430 O ASP B 72 20.703 -1.630 -3.081 1.00 0.00 O ATOM 2431 CB ASP B 72 22.610 -3.332 -0.579 1.00 0.00 C ATOM 2432 CG ASP B 72 24.119 -3.197 -0.686 1.00 0.00 C ATOM 2433 OD1 ASP B 72 24.679 -3.536 -1.749 1.00 0.00 O ATOM 2434 OD2 ASP B 72 24.753 -2.744 0.289 1.00 0.00 O ATOM 0 H ASP B 72 19.890 -2.711 -0.872 1.00 0.00 H new ATOM 0 HA ASP B 72 22.453 -1.214 -0.701 1.00 0.00 H new ATOM 0 HB2 ASP B 72 22.340 -3.546 0.455 1.00 0.00 H new ATOM 0 HB3 ASP B 72 22.281 -4.182 -1.177 1.00 0.00 H new ATOM 2439 N LYS B 73 22.829 -2.385 -3.269 1.00 0.00 N ATOM 2440 CA LYS B 73 22.887 -2.321 -4.734 1.00 0.00 C ATOM 2441 C LYS B 73 22.987 -0.863 -5.196 1.00 0.00 C ATOM 2442 O LYS B 73 23.068 -0.566 -6.389 1.00 0.00 O ATOM 2443 CB LYS B 73 21.674 -3.035 -5.361 1.00 0.00 C ATOM 2444 CG LYS B 73 21.727 -3.153 -6.873 1.00 0.00 C ATOM 2445 CD LYS B 73 20.564 -3.972 -7.405 1.00 0.00 C ATOM 2446 CE LYS B 73 20.559 -4.006 -8.923 1.00 0.00 C ATOM 2447 NZ LYS B 73 20.181 -2.694 -9.513 1.00 0.00 N ATOM 0 H LYS B 73 23.684 -2.737 -2.840 1.00 0.00 H new ATOM 0 HA LYS B 73 23.781 -2.843 -5.075 1.00 0.00 H new ATOM 0 HB2 LYS B 73 21.596 -4.035 -4.934 1.00 0.00 H new ATOM 0 HB3 LYS B 73 20.768 -2.497 -5.082 1.00 0.00 H new ATOM 0 HG2 LYS B 73 21.707 -2.158 -7.318 1.00 0.00 H new ATOM 0 HG3 LYS B 73 22.667 -3.617 -7.171 1.00 0.00 H new ATOM 0 HD2 LYS B 73 20.625 -4.989 -7.017 1.00 0.00 H new ATOM 0 HD3 LYS B 73 19.625 -3.550 -7.046 1.00 0.00 H new ATOM 0 HE2 LYS B 73 21.548 -4.292 -9.282 1.00 0.00 H new ATOM 0 HE3 LYS B 73 19.862 -4.771 -9.265 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 20.042 -2.801 -10.538 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 19.298 -2.359 -9.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 20.938 -2.003 -9.337 1.00 0.00 H new ATOM 2461 N ALA B 74 23.004 0.040 -4.224 1.00 0.00 N ATOM 2462 CA ALA B 74 23.169 1.459 -4.477 1.00 0.00 C ATOM 2463 C ALA B 74 23.886 2.113 -3.304 1.00 0.00 C ATOM 2464 O ALA B 74 23.269 2.453 -2.297 1.00 0.00 O ATOM 2465 CB ALA B 74 21.822 2.125 -4.719 1.00 0.00 C ATOM 0 H ALA B 74 22.903 -0.195 -3.237 1.00 0.00 H new ATOM 0 HA ALA B 74 23.773 1.586 -5.376 1.00 0.00 H new ATOM 0 HB1 ALA B 74 21.970 3.188 -4.906 1.00 0.00 H new ATOM 0 HB2 ALA B 74 21.340 1.668 -5.583 1.00 0.00 H new ATOM 0 HB3 ALA B 74 21.189 1.996 -3.841 1.00 0.00 H new ATOM 2471 N HIS B 75 25.197 2.240 -3.420 1.00 0.00 N ATOM 2472 CA HIS B 75 25.996 2.855 -2.372 1.00 0.00 C ATOM 2473 C HIS B 75 26.244 4.322 -2.680 1.00 0.00 C ATOM 2474 O HIS B 75 26.649 4.676 -3.790 1.00 0.00 O ATOM 2475 CB HIS B 75 27.322 2.113 -2.190 1.00 0.00 C ATOM 2476 CG HIS B 75 27.200 0.855 -1.381 1.00 0.00 C ATOM 2477 ND1 HIS B 75 28.003 0.578 -0.296 1.00 0.00 N ATOM 2478 CD2 HIS B 75 26.356 -0.197 -1.500 1.00 0.00 C ATOM 2479 CE1 HIS B 75 27.655 -0.588 0.218 1.00 0.00 C ATOM 2480 NE2 HIS B 75 26.657 -1.080 -0.493 1.00 0.00 N ATOM 0 H HIS B 75 25.732 1.925 -4.230 1.00 0.00 H new ATOM 0 HA HIS B 75 25.438 2.788 -1.438 1.00 0.00 H new ATOM 0 HB2 HIS B 75 27.728 1.866 -3.171 1.00 0.00 H new ATOM 0 HB3 HIS B 75 28.038 2.778 -1.707 1.00 0.00 H new ATOM 0 HD2 HIS B 75 25.588 -0.319 -2.249 1.00 0.00 H new ATOM 0 HE1 HIS B 75 28.110 -1.060 1.076 1.00 0.00 H new ATOM 0 HE2 HIS B 75 26.187 -1.969 -0.322 1.00 0.00 H new ATOM 2489 N LEU B 76 26.005 5.169 -1.690 1.00 0.00 N ATOM 2490 CA LEU B 76 26.089 6.611 -1.874 1.00 0.00 C ATOM 2491 C LEU B 76 27.477 7.129 -1.499 1.00 0.00 C ATOM 2492 O LEU B 76 27.762 8.321 -1.618 1.00 0.00 O ATOM 2493 CB LEU B 76 25.014 7.306 -1.031 1.00 0.00 C ATOM 2494 CG LEU B 76 24.842 8.806 -1.287 1.00 0.00 C ATOM 2495 CD1 LEU B 76 24.398 9.057 -2.720 1.00 0.00 C ATOM 2496 CD2 LEU B 76 23.845 9.404 -0.306 1.00 0.00 C ATOM 0 H LEU B 76 25.750 4.881 -0.745 1.00 0.00 H new ATOM 0 HA LEU B 76 25.919 6.837 -2.927 1.00 0.00 H new ATOM 0 HB2 LEU B 76 24.059 6.812 -1.213 1.00 0.00 H new ATOM 0 HB3 LEU B 76 25.253 7.160 0.022 1.00 0.00 H new ATOM 0 HG LEU B 76 25.806 9.292 -1.137 1.00 0.00 H new ATOM 0 HD11 LEU B 76 24.281 10.128 -2.882 1.00 0.00 H new ATOM 0 HD12 LEU B 76 25.148 8.665 -3.407 1.00 0.00 H new ATOM 0 HD13 LEU B 76 23.446 8.557 -2.899 1.00 0.00 H new ATOM 0 HD21 LEU B 76 23.736 10.470 -0.503 1.00 0.00 H new ATOM 0 HD22 LEU B 76 22.879 8.912 -0.424 1.00 0.00 H new ATOM 0 HD23 LEU B 76 24.205 9.258 0.713 1.00 0.00 H new ATOM 2508 N GLU B 77 28.348 6.229 -1.059 1.00 0.00 N ATOM 2509 CA GLU B 77 29.703 6.607 -0.682 1.00 0.00 C ATOM 2510 C GLU B 77 30.571 6.795 -1.922 1.00 0.00 C ATOM 2511 O GLU B 77 31.508 6.036 -2.173 1.00 0.00 O ATOM 2512 CB GLU B 77 30.318 5.569 0.256 1.00 0.00 C ATOM 2513 CG GLU B 77 29.557 5.416 1.561 1.00 0.00 C ATOM 2514 CD GLU B 77 30.254 4.498 2.539 1.00 0.00 C ATOM 2515 OE1 GLU B 77 31.098 4.986 3.320 1.00 0.00 O ATOM 2516 OE2 GLU B 77 29.952 3.290 2.549 1.00 0.00 O ATOM 0 H GLU B 77 28.141 5.236 -0.955 1.00 0.00 H new ATOM 0 HA GLU B 77 29.655 7.556 -0.149 1.00 0.00 H new ATOM 0 HB2 GLU B 77 30.353 4.605 -0.252 1.00 0.00 H new ATOM 0 HB3 GLU B 77 31.348 5.851 0.475 1.00 0.00 H new ATOM 0 HG2 GLU B 77 29.428 6.397 2.019 1.00 0.00 H new ATOM 0 HG3 GLU B 77 28.560 5.028 1.352 1.00 0.00 H new ATOM 2523 N HIS B 78 30.226 7.806 -2.708 1.00 0.00 N ATOM 2524 CA HIS B 78 30.976 8.146 -3.905 1.00 0.00 C ATOM 2525 C HIS B 78 31.930 9.296 -3.597 1.00 0.00 C ATOM 2526 O HIS B 78 32.703 9.736 -4.452 1.00 0.00 O ATOM 2527 CB HIS B 78 30.011 8.523 -5.039 1.00 0.00 C ATOM 2528 CG HIS B 78 30.661 8.625 -6.386 1.00 0.00 C ATOM 2529 ND1 HIS B 78 31.018 7.525 -7.129 1.00 0.00 N ATOM 2530 CD2 HIS B 78 31.019 9.703 -7.120 1.00 0.00 C ATOM 2531 CE1 HIS B 78 31.568 7.919 -8.261 1.00 0.00 C ATOM 2532 NE2 HIS B 78 31.584 9.239 -8.282 1.00 0.00 N ATOM 0 H HIS B 78 29.422 8.409 -2.533 1.00 0.00 H new ATOM 0 HA HIS B 78 31.560 7.285 -4.229 1.00 0.00 H new ATOM 0 HB2 HIS B 78 29.215 7.780 -5.087 1.00 0.00 H new ATOM 0 HB3 HIS B 78 29.542 9.478 -4.800 1.00 0.00 H new ATOM 0 HD2 HIS B 78 30.885 10.738 -6.843 1.00 0.00 H new ATOM 0 HE1 HIS B 78 31.942 7.271 -9.040 1.00 0.00 H new ATOM 0 HE2 HIS B 78 31.954 9.818 -9.036 1.00 0.00 H new ATOM 2541 N HIS B 79 31.866 9.774 -2.359 1.00 0.00 N ATOM 2542 CA HIS B 79 32.738 10.846 -1.903 1.00 0.00 C ATOM 2543 C HIS B 79 34.172 10.334 -1.855 1.00 0.00 C ATOM 2544 O HIS B 79 34.390 9.144 -1.628 1.00 0.00 O ATOM 2545 CB HIS B 79 32.296 11.347 -0.522 1.00 0.00 C ATOM 2546 CG HIS B 79 32.912 12.656 -0.121 1.00 0.00 C ATOM 2547 ND1 HIS B 79 34.029 12.754 0.679 1.00 0.00 N ATOM 2548 CD2 HIS B 79 32.551 13.928 -0.413 1.00 0.00 C ATOM 2549 CE1 HIS B 79 34.330 14.024 0.860 1.00 0.00 C ATOM 2550 NE2 HIS B 79 33.450 14.759 0.207 1.00 0.00 N ATOM 0 H HIS B 79 31.215 9.433 -1.652 1.00 0.00 H new ATOM 0 HA HIS B 79 32.677 11.684 -2.597 1.00 0.00 H new ATOM 0 HB2 HIS B 79 31.211 11.451 -0.515 1.00 0.00 H new ATOM 0 HB3 HIS B 79 32.549 10.594 0.224 1.00 0.00 H new ATOM 0 HD2 HIS B 79 31.712 14.232 -1.021 1.00 0.00 H new ATOM 0 HE1 HIS B 79 35.157 14.400 1.444 1.00 0.00 H new ATOM 0 HE2 HIS B 79 33.440 15.778 0.169 1.00 0.00 H new ATOM 2559 N HIS B 80 35.128 11.234 -2.081 1.00 0.00 N ATOM 2560 CA HIS B 80 36.543 10.877 -2.187 1.00 0.00 C ATOM 2561 C HIS B 80 36.810 10.160 -3.508 1.00 0.00 C ATOM 2562 O HIS B 80 36.490 8.981 -3.671 1.00 0.00 O ATOM 2563 CB HIS B 80 37.007 10.030 -0.986 1.00 0.00 C ATOM 2564 CG HIS B 80 38.392 9.464 -1.127 1.00 0.00 C ATOM 2565 ND1 HIS B 80 39.534 10.159 -0.791 1.00 0.00 N ATOM 2566 CD2 HIS B 80 38.810 8.253 -1.567 1.00 0.00 C ATOM 2567 CE1 HIS B 80 40.591 9.401 -1.023 1.00 0.00 C ATOM 2568 NE2 HIS B 80 40.180 8.241 -1.492 1.00 0.00 N ATOM 0 H HIS B 80 34.944 12.231 -2.196 1.00 0.00 H new ATOM 0 HA HIS B 80 37.126 11.798 -2.171 1.00 0.00 H new ATOM 0 HB2 HIS B 80 36.968 10.644 -0.086 1.00 0.00 H new ATOM 0 HB3 HIS B 80 36.304 9.209 -0.842 1.00 0.00 H new ATOM 0 HD2 HIS B 80 38.181 7.446 -1.913 1.00 0.00 H new ATOM 0 HE1 HIS B 80 41.620 9.685 -0.856 1.00 0.00 H new ATOM 0 HE2 HIS B 80 40.782 7.461 -1.756 1.00 0.00 H new ATOM 2577 N HIS B 81 37.380 10.890 -4.460 1.00 0.00 N ATOM 2578 CA HIS B 81 37.776 10.303 -5.737 1.00 0.00 C ATOM 2579 C HIS B 81 39.091 9.560 -5.536 1.00 0.00 C ATOM 2580 O HIS B 81 39.550 9.403 -4.405 1.00 0.00 O ATOM 2581 CB HIS B 81 37.984 11.372 -6.829 1.00 0.00 C ATOM 2582 CG HIS B 81 37.199 12.639 -6.659 1.00 0.00 C ATOM 2583 ND1 HIS B 81 37.776 13.813 -6.227 1.00 0.00 N ATOM 2584 CD2 HIS B 81 35.897 12.925 -6.894 1.00 0.00 C ATOM 2585 CE1 HIS B 81 36.866 14.767 -6.203 1.00 0.00 C ATOM 2586 NE2 HIS B 81 35.717 14.257 -6.604 1.00 0.00 N ATOM 0 H HIS B 81 37.578 11.887 -4.373 1.00 0.00 H new ATOM 0 HA HIS B 81 36.978 9.636 -6.065 1.00 0.00 H new ATOM 0 HB2 HIS B 81 39.044 11.625 -6.866 1.00 0.00 H new ATOM 0 HB3 HIS B 81 37.727 10.934 -7.794 1.00 0.00 H new ATOM 0 HD1 HIS B 81 38.755 13.927 -5.966 1.00 0.00 H new ATOM 0 HD2 HIS B 81 35.142 12.237 -7.243 1.00 0.00 H new ATOM 0 HE1 HIS B 81 37.033 15.792 -5.906 1.00 0.00 H new ATOM 2595 N HIS B 82 39.702 9.103 -6.620 1.00 0.00 N ATOM 2596 CA HIS B 82 41.071 8.604 -6.541 1.00 0.00 C ATOM 2597 C HIS B 82 42.001 9.757 -6.162 1.00 0.00 C ATOM 2598 O HIS B 82 43.078 9.553 -5.601 1.00 0.00 O ATOM 2599 CB HIS B 82 41.511 7.927 -7.852 1.00 0.00 C ATOM 2600 CG HIS B 82 41.358 8.765 -9.089 1.00 0.00 C ATOM 2601 ND1 HIS B 82 40.388 8.530 -10.040 1.00 0.00 N ATOM 2602 CD2 HIS B 82 42.077 9.817 -9.544 1.00 0.00 C ATOM 2603 CE1 HIS B 82 40.519 9.403 -11.023 1.00 0.00 C ATOM 2604 NE2 HIS B 82 41.537 10.195 -10.747 1.00 0.00 N ATOM 0 H HIS B 82 39.283 9.066 -7.549 1.00 0.00 H new ATOM 0 HA HIS B 82 41.123 7.835 -5.770 1.00 0.00 H new ATOM 0 HB2 HIS B 82 42.557 7.635 -7.758 1.00 0.00 H new ATOM 0 HB3 HIS B 82 40.935 7.011 -7.980 1.00 0.00 H new ATOM 0 HD2 HIS B 82 42.921 10.275 -9.050 1.00 0.00 H new ATOM 0 HE1 HIS B 82 39.897 9.459 -11.904 1.00 0.00 H new ATOM 0 HE2 HIS B 82 41.868 10.962 -11.332 1.00 0.00 H new ATOM 2613 N HIS B 83 41.547 10.970 -6.470 1.00 0.00 N ATOM 2614 CA HIS B 83 42.182 12.198 -6.021 1.00 0.00 C ATOM 2615 C HIS B 83 41.235 13.360 -6.294 1.00 0.00 C ATOM 2616 O HIS B 83 40.312 13.575 -5.485 1.00 0.00 O ATOM 2617 CB HIS B 83 43.528 12.432 -6.720 1.00 0.00 C ATOM 2618 CG HIS B 83 44.284 13.608 -6.172 1.00 0.00 C ATOM 2619 ND1 HIS B 83 45.186 13.504 -5.135 1.00 0.00 N ATOM 2620 CD2 HIS B 83 44.263 14.918 -6.517 1.00 0.00 C ATOM 2621 CE1 HIS B 83 45.683 14.695 -4.865 1.00 0.00 C ATOM 2622 NE2 HIS B 83 45.138 15.572 -5.686 1.00 0.00 N ATOM 2623 OXT HIS B 83 41.396 14.024 -7.334 1.00 0.00 O ATOM 0 H HIS B 83 40.719 11.125 -7.045 1.00 0.00 H new ATOM 0 HA HIS B 83 42.387 12.118 -4.953 1.00 0.00 H new ATOM 0 HB2 HIS B 83 44.141 11.536 -6.622 1.00 0.00 H new ATOM 0 HB3 HIS B 83 43.355 12.584 -7.785 1.00 0.00 H new ATOM 0 HD2 HIS B 83 43.668 15.365 -7.300 1.00 0.00 H new ATOM 0 HE1 HIS B 83 46.413 14.915 -4.100 1.00 0.00 H new ATOM 0 HE2 HIS B 83 45.335 16.573 -5.701 1.00 0.00 H new TER 2632 HIS B 83