USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1017 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 2 GLN : amide:sc= -1.07! C(o=-3.2!,f=-23!) USER MOD Set 1.2: B 63 LYS NZ :NH3+ 166:sc= -2.13! (180deg=-3.37!) USER MOD Set 2.1: B 31 GLN : amide:sc= -2.85! X(o=-5.4!,f=-5.6) USER MOD Set 2.2: B 41 GLN : amide:sc= -2.58! X(o=-5.4!,f=-5.3) USER MOD Set 3.1: B 27 LYS NZ :NH3+ 158:sc= -0.291 (180deg=-0.827) USER MOD Set 3.2: B 49 GLN :FLIP amide:sc= -0.41 F(o=-1.5!,f=-0.7) USER MOD Set 4.1: A 35 ASN : amide:sc= -0.124 X(o=0.64,f=0.75) USER MOD Set 4.2: A 42 THR OG1 : rot 115:sc= 0.761 USER MOD Set 5.1: A 27 LYS NZ :NH3+ -145:sc= 1.08 (180deg=-0.404) USER MOD Set 5.2: A 31 HIS : no HE2:sc= 0.629 K(o=1.7,f=-10!) USER MOD Set 6.1: A 19 MET CE :methyl 179:sc= -10.9! (180deg=-10.7!) USER MOD Set 6.2: B 68 HIS : no HD1:sc= -2.33 K(o=-13,f=-22!) USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -2.5 F(o=-3.3,f=-2.5) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 167:sc= -0.0612 (180deg=-0.308) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 146:sc= -1.98! (180deg=-2.75!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 36 ASN :FLIP amide:sc= -0.169 F(o=-2.3!,f=-0.17) USER MOD Single : A 37 ASN : amide:sc= -2.49! X(o=-2.5!,f=-2.4) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.0995 K(o=-0.099,f=-2.3!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -146:sc= -0.763 (180deg=-3.01!) USER MOD Single : B 1 MET N :NH3+ 137:sc= 0.0268 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 167:sc= -0.0268 (180deg=-0.23) USER MOD Single : B 7 THR OG1 : rot -67:sc= 0.395 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 47:sc= 0.726 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot -24:sc= 0.555 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 41:sc= 0.566 USER MOD Single : B 25 ASN : amide:sc= -0.612 K(o=-0.61,f=-2.6!) USER MOD Single : B 28 SER OG : rot 70:sc= 1.19 USER MOD Single : B 29 LYS NZ :NH3+ -135:sc= -6! (180deg=-7.66!) USER MOD Single : B 33 LYS NZ :NH3+ 171:sc= -0.0137 (180deg=-0.171) USER MOD Single : B 40 GLN : amide:sc= -1.53 K(o=-1.5,f=-2.2) USER MOD Single : B 48 LYS NZ :NH3+ 166:sc= -0.0294 (180deg=-0.259) USER MOD Single : B 55 THR OG1 : rot 180:sc= -0.41 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 180:sc= 0 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 65 SER OG : rot 160:sc= 0 USER MOD Single : B 66 THR OG1 : rot -8:sc= -0.674! USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 6 18.044 4.010 2.624 1.00 0.00 N ATOM 2 CA ASN A 6 17.741 4.239 1.217 1.00 0.00 C ATOM 3 C ASN A 6 18.316 3.118 0.358 1.00 0.00 C ATOM 4 O ASN A 6 19.467 2.717 0.534 1.00 0.00 O ATOM 5 CB ASN A 6 18.301 5.589 0.763 1.00 0.00 C ATOM 6 CG ASN A 6 17.952 5.903 -0.678 1.00 0.00 C ATOM 7 OD1 ASN A 6 16.778 5.990 -1.041 1.00 0.00 O ATOM 8 ND2 ASN A 6 18.973 6.073 -1.511 1.00 0.00 N ATOM 0 HA ASN A 6 16.658 4.251 1.097 1.00 0.00 H new ATOM 0 HB2 ASN A 6 17.912 6.376 1.408 1.00 0.00 H new ATOM 0 HB3 ASN A 6 19.385 5.588 0.880 1.00 0.00 H new ATOM 0 HD21 ASN A 6 18.800 6.285 -2.494 1.00 0.00 H new ATOM 0 HD22 ASN A 6 19.930 5.992 -1.168 1.00 0.00 H new ATOM 15 N ASP A 7 17.508 2.614 -0.568 1.00 0.00 N ATOM 16 CA ASP A 7 17.937 1.534 -1.452 1.00 0.00 C ATOM 17 C ASP A 7 16.925 1.305 -2.570 1.00 0.00 C ATOM 18 O ASP A 7 17.288 0.898 -3.673 1.00 0.00 O ATOM 19 CB ASP A 7 18.147 0.239 -0.658 1.00 0.00 C ATOM 20 CG ASP A 7 16.917 -0.187 0.123 1.00 0.00 C ATOM 21 OD1 ASP A 7 15.909 0.550 0.103 1.00 0.00 O ATOM 22 OD2 ASP A 7 16.966 -1.257 0.765 1.00 0.00 O ATOM 0 H ASP A 7 16.553 2.935 -0.727 1.00 0.00 H new ATOM 0 HA ASP A 7 18.885 1.829 -1.903 1.00 0.00 H new ATOM 0 HB2 ASP A 7 18.429 -0.559 -1.345 1.00 0.00 H new ATOM 0 HB3 ASP A 7 18.980 0.374 0.032 1.00 0.00 H new ATOM 27 N ASP A 8 15.656 1.566 -2.276 1.00 0.00 N ATOM 28 CA ASP A 8 14.593 1.383 -3.256 1.00 0.00 C ATOM 29 C ASP A 8 13.300 2.051 -2.802 1.00 0.00 C ATOM 30 O ASP A 8 12.217 1.482 -2.942 1.00 0.00 O ATOM 31 CB ASP A 8 14.357 -0.110 -3.503 1.00 0.00 C ATOM 32 CG ASP A 8 14.074 -0.874 -2.223 1.00 0.00 C ATOM 33 OD1 ASP A 8 13.074 -0.554 -1.547 1.00 0.00 O ATOM 34 OD2 ASP A 8 14.854 -1.793 -1.896 1.00 0.00 O ATOM 0 H ASP A 8 15.339 1.905 -1.368 1.00 0.00 H new ATOM 0 HA ASP A 8 14.907 1.856 -4.187 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.519 -0.233 -4.189 1.00 0.00 H new ATOM 0 HB3 ASP A 8 15.233 -0.537 -3.991 1.00 0.00 H new ATOM 39 N HIS A 9 13.414 3.267 -2.268 1.00 0.00 N ATOM 40 CA HIS A 9 12.239 3.997 -1.815 1.00 0.00 C ATOM 41 C HIS A 9 11.303 4.246 -2.990 1.00 0.00 C ATOM 42 O HIS A 9 10.097 4.414 -2.814 1.00 0.00 O ATOM 43 CB HIS A 9 12.615 5.321 -1.128 1.00 0.00 C ATOM 44 CG HIS A 9 12.828 6.485 -2.055 1.00 0.00 C ATOM 45 ND1 HIS A 9 13.372 6.563 -3.295 1.00 0.00 N flip ATOM 46 CD2 HIS A 9 12.463 7.773 -1.721 1.00 0.00 C flip ATOM 47 CE1 HIS A 9 13.319 7.880 -3.680 1.00 0.00 C flip ATOM 48 NE2 HIS A 9 12.765 8.589 -2.714 1.00 0.00 N flip ATOM 0 H HIS A 9 14.298 3.759 -2.141 1.00 0.00 H new ATOM 0 HA HIS A 9 11.728 3.386 -1.071 1.00 0.00 H new ATOM 0 HB2 HIS A 9 11.828 5.580 -0.420 1.00 0.00 H new ATOM 0 HB3 HIS A 9 13.526 5.166 -0.550 1.00 0.00 H new ATOM 0 HD2 HIS A 9 12.001 8.068 -0.790 1.00 0.00 H new ATOM 0 HE1 HIS A 9 13.673 8.273 -4.622 1.00 0.00 H new ATOM 0 HE2 HIS A 9 12.599 9.595 -2.732 1.00 0.00 H new ATOM 57 N GLU A 10 11.880 4.273 -4.190 1.00 0.00 N ATOM 58 CA GLU A 10 11.120 4.504 -5.412 1.00 0.00 C ATOM 59 C GLU A 10 9.940 3.547 -5.489 1.00 0.00 C ATOM 60 O GLU A 10 8.857 3.921 -5.936 1.00 0.00 O ATOM 61 CB GLU A 10 12.018 4.328 -6.638 1.00 0.00 C ATOM 62 CG GLU A 10 13.237 5.237 -6.635 1.00 0.00 C ATOM 63 CD GLU A 10 14.128 5.021 -7.843 1.00 0.00 C ATOM 64 OE1 GLU A 10 14.628 3.890 -8.017 1.00 0.00 O ATOM 65 OE2 GLU A 10 14.322 5.982 -8.615 1.00 0.00 O ATOM 0 H GLU A 10 12.880 4.136 -4.340 1.00 0.00 H new ATOM 0 HA GLU A 10 10.743 5.527 -5.397 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.349 3.291 -6.690 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.433 4.521 -7.537 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.910 6.277 -6.610 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.814 5.062 -5.727 1.00 0.00 H new ATOM 72 N SER A 11 10.152 2.316 -5.035 1.00 0.00 N ATOM 73 CA SER A 11 9.094 1.317 -5.034 1.00 0.00 C ATOM 74 C SER A 11 7.916 1.824 -4.210 1.00 0.00 C ATOM 75 O SER A 11 6.775 1.855 -4.682 1.00 0.00 O ATOM 76 CB SER A 11 9.616 -0.003 -4.465 1.00 0.00 C ATOM 77 OG SER A 11 10.655 -0.530 -5.272 1.00 0.00 O ATOM 0 H SER A 11 11.044 1.989 -4.665 1.00 0.00 H new ATOM 0 HA SER A 11 8.762 1.142 -6.057 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.983 0.154 -3.451 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.800 -0.723 -4.401 1.00 0.00 H new ATOM 0 HG SER A 11 10.973 -1.373 -4.886 1.00 0.00 H new ATOM 83 N LYS A 12 8.209 2.258 -2.987 1.00 0.00 N ATOM 84 CA LYS A 12 7.189 2.804 -2.104 1.00 0.00 C ATOM 85 C LYS A 12 6.548 4.015 -2.764 1.00 0.00 C ATOM 86 O LYS A 12 5.341 4.232 -2.666 1.00 0.00 O ATOM 87 CB LYS A 12 7.804 3.204 -0.762 1.00 0.00 C ATOM 88 CG LYS A 12 8.450 2.047 -0.019 1.00 0.00 C ATOM 89 CD LYS A 12 9.097 2.508 1.276 1.00 0.00 C ATOM 90 CE LYS A 12 9.729 1.346 2.024 1.00 0.00 C ATOM 91 NZ LYS A 12 10.751 0.645 1.198 1.00 0.00 N ATOM 0 H LYS A 12 9.147 2.241 -2.587 1.00 0.00 H new ATOM 0 HA LYS A 12 6.430 2.043 -1.922 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.552 3.979 -0.931 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.029 3.641 -0.133 1.00 0.00 H new ATOM 0 HG2 LYS A 12 7.698 1.288 0.199 1.00 0.00 H new ATOM 0 HG3 LYS A 12 9.201 1.579 -0.655 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.857 3.259 1.058 1.00 0.00 H new ATOM 0 HD3 LYS A 12 8.349 2.986 1.908 1.00 0.00 H new ATOM 0 HE2 LYS A 12 10.192 1.713 2.940 1.00 0.00 H new ATOM 0 HE3 LYS A 12 8.953 0.639 2.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 11.310 0.010 1.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.277 0.090 0.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.380 1.345 0.756 1.00 0.00 H new ATOM 105 N LEU A 13 7.381 4.788 -3.456 1.00 0.00 N ATOM 106 CA LEU A 13 6.927 5.971 -4.167 1.00 0.00 C ATOM 107 C LEU A 13 5.904 5.578 -5.223 1.00 0.00 C ATOM 108 O LEU A 13 4.900 6.261 -5.417 1.00 0.00 O ATOM 109 CB LEU A 13 8.120 6.683 -4.814 1.00 0.00 C ATOM 110 CG LEU A 13 7.782 7.934 -5.627 1.00 0.00 C ATOM 111 CD1 LEU A 13 7.097 8.973 -4.754 1.00 0.00 C ATOM 112 CD2 LEU A 13 9.043 8.511 -6.256 1.00 0.00 C ATOM 0 H LEU A 13 8.382 4.610 -3.537 1.00 0.00 H new ATOM 0 HA LEU A 13 6.456 6.655 -3.462 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.824 6.961 -4.029 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.633 5.975 -5.466 1.00 0.00 H new ATOM 0 HG LEU A 13 7.094 7.653 -6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.865 9.855 -5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.175 8.557 -4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.759 9.254 -3.935 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.788 9.401 -6.832 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.752 8.777 -5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.493 7.769 -6.915 1.00 0.00 H new ATOM 124 N SER A 14 6.162 4.455 -5.890 1.00 0.00 N ATOM 125 CA SER A 14 5.260 3.948 -6.912 1.00 0.00 C ATOM 126 C SER A 14 3.901 3.645 -6.296 1.00 0.00 C ATOM 127 O SER A 14 2.862 4.017 -6.844 1.00 0.00 O ATOM 128 CB SER A 14 5.838 2.689 -7.561 1.00 0.00 C ATOM 129 OG SER A 14 4.968 2.184 -8.558 1.00 0.00 O ATOM 0 H SER A 14 6.991 3.881 -5.738 1.00 0.00 H new ATOM 0 HA SER A 14 5.141 4.709 -7.684 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.809 2.916 -8.002 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.005 1.927 -6.799 1.00 0.00 H new ATOM 0 HG SER A 14 5.361 1.380 -8.958 1.00 0.00 H new ATOM 135 N ILE A 15 3.919 2.986 -5.138 1.00 0.00 N ATOM 136 CA ILE A 15 2.687 2.657 -4.434 1.00 0.00 C ATOM 137 C ILE A 15 1.891 3.920 -4.128 1.00 0.00 C ATOM 138 O ILE A 15 0.673 3.946 -4.281 1.00 0.00 O ATOM 139 CB ILE A 15 2.959 1.899 -3.110 1.00 0.00 C ATOM 140 CG1 ILE A 15 3.202 0.410 -3.366 1.00 0.00 C ATOM 141 CG2 ILE A 15 1.800 2.077 -2.141 1.00 0.00 C ATOM 142 CD1 ILE A 15 4.434 0.116 -4.194 1.00 0.00 C ATOM 0 H ILE A 15 4.770 2.672 -4.672 1.00 0.00 H new ATOM 0 HA ILE A 15 2.112 2.006 -5.093 1.00 0.00 H new ATOM 0 HB ILE A 15 3.859 2.323 -2.665 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.291 -0.102 -2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.331 -0.007 -3.871 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.011 1.537 -1.218 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.670 3.136 -1.920 1.00 0.00 H new ATOM 0 HG23 ILE A 15 0.887 1.685 -2.590 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.533 -0.961 -4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.341 0.597 -5.168 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.316 0.500 -3.682 1.00 0.00 H new ATOM 154 N LEU A 16 2.588 4.965 -3.687 1.00 0.00 N ATOM 155 CA LEU A 16 1.938 6.228 -3.353 1.00 0.00 C ATOM 156 C LEU A 16 1.260 6.850 -4.571 1.00 0.00 C ATOM 157 O LEU A 16 0.126 7.317 -4.482 1.00 0.00 O ATOM 158 CB LEU A 16 2.950 7.216 -2.764 1.00 0.00 C ATOM 159 CG LEU A 16 3.594 6.791 -1.442 1.00 0.00 C ATOM 160 CD1 LEU A 16 4.539 7.873 -0.943 1.00 0.00 C ATOM 161 CD2 LEU A 16 2.530 6.492 -0.395 1.00 0.00 C ATOM 0 H LEU A 16 3.599 4.961 -3.553 1.00 0.00 H new ATOM 0 HA LEU A 16 1.171 6.012 -2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.740 7.380 -3.497 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.451 8.174 -2.614 1.00 0.00 H new ATOM 0 HG LEU A 16 4.166 5.880 -1.617 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.990 7.557 -0.002 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.322 8.041 -1.682 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.983 8.798 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.010 6.192 0.536 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.929 7.385 -0.222 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.888 5.685 -0.749 1.00 0.00 H new ATOM 173 N MET A 17 1.959 6.866 -5.703 1.00 0.00 N ATOM 174 CA MET A 17 1.409 7.448 -6.925 1.00 0.00 C ATOM 175 C MET A 17 0.120 6.745 -7.340 1.00 0.00 C ATOM 176 O MET A 17 -0.891 7.394 -7.610 1.00 0.00 O ATOM 177 CB MET A 17 2.429 7.379 -8.064 1.00 0.00 C ATOM 178 CG MET A 17 3.736 8.089 -7.754 1.00 0.00 C ATOM 179 SD MET A 17 4.803 8.251 -9.200 1.00 0.00 S ATOM 180 CE MET A 17 5.056 6.538 -9.641 1.00 0.00 C ATOM 0 H MET A 17 2.900 6.486 -5.800 1.00 0.00 H new ATOM 0 HA MET A 17 1.180 8.493 -6.717 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.638 6.333 -8.290 1.00 0.00 H new ATOM 0 HB3 MET A 17 1.991 7.818 -8.960 1.00 0.00 H new ATOM 0 HG2 MET A 17 3.520 9.080 -7.354 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.267 7.540 -6.976 1.00 0.00 H new ATOM 0 HE1 MET A 17 5.134 6.449 -10.725 1.00 0.00 H new ATOM 0 HE2 MET A 17 5.975 6.175 -9.180 1.00 0.00 H new ATOM 0 HE3 MET A 17 4.214 5.943 -9.288 1.00 0.00 H new ATOM 190 N ASP A 18 0.162 5.418 -7.389 1.00 0.00 N ATOM 191 CA ASP A 18 -1.007 4.632 -7.769 1.00 0.00 C ATOM 192 C ASP A 18 -2.105 4.748 -6.716 1.00 0.00 C ATOM 193 O ASP A 18 -3.288 4.849 -7.043 1.00 0.00 O ATOM 194 CB ASP A 18 -0.621 3.163 -7.960 1.00 0.00 C ATOM 195 CG ASP A 18 -1.801 2.303 -8.374 1.00 0.00 C ATOM 196 OD1 ASP A 18 -2.372 2.560 -9.455 1.00 0.00 O ATOM 197 OD2 ASP A 18 -2.154 1.375 -7.616 1.00 0.00 O ATOM 0 H ASP A 18 0.991 4.865 -7.171 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.388 5.026 -8.711 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.160 3.091 -8.716 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.202 2.777 -7.031 1.00 0.00 H new ATOM 202 N MET A 19 -1.699 4.727 -5.452 1.00 0.00 N ATOM 203 CA MET A 19 -2.636 4.823 -4.338 1.00 0.00 C ATOM 204 C MET A 19 -3.360 6.171 -4.345 1.00 0.00 C ATOM 205 O MET A 19 -4.544 6.250 -4.019 1.00 0.00 O ATOM 206 CB MET A 19 -1.898 4.630 -3.008 1.00 0.00 C ATOM 207 CG MET A 19 -2.822 4.481 -1.810 1.00 0.00 C ATOM 208 SD MET A 19 -1.940 4.407 -0.243 1.00 0.00 S ATOM 209 CE MET A 19 -1.283 2.746 -0.314 1.00 0.00 C ATOM 0 H MET A 19 -0.722 4.644 -5.172 1.00 0.00 H new ATOM 0 HA MET A 19 -3.380 4.035 -4.452 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.265 3.745 -3.079 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.238 5.482 -2.842 1.00 0.00 H new ATOM 0 HG2 MET A 19 -3.518 5.320 -1.789 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.417 3.576 -1.928 1.00 0.00 H new ATOM 0 HE1 MET A 19 -0.693 2.550 0.581 1.00 0.00 H new ATOM 0 HE2 MET A 19 -2.105 2.032 -0.371 1.00 0.00 H new ATOM 0 HE3 MET A 19 -0.650 2.642 -1.196 1.00 0.00 H new ATOM 219 N PHE A 20 -2.639 7.227 -4.718 1.00 0.00 N ATOM 220 CA PHE A 20 -3.214 8.571 -4.765 1.00 0.00 C ATOM 221 C PHE A 20 -3.041 9.195 -6.151 1.00 0.00 C ATOM 222 O PHE A 20 -2.245 10.118 -6.325 1.00 0.00 O ATOM 223 CB PHE A 20 -2.562 9.479 -3.716 1.00 0.00 C ATOM 224 CG PHE A 20 -2.476 8.867 -2.349 1.00 0.00 C ATOM 225 CD1 PHE A 20 -3.544 8.945 -1.471 1.00 0.00 C ATOM 226 CD2 PHE A 20 -1.327 8.206 -1.946 1.00 0.00 C ATOM 227 CE1 PHE A 20 -3.467 8.376 -0.215 1.00 0.00 C ATOM 228 CE2 PHE A 20 -1.244 7.636 -0.692 1.00 0.00 C ATOM 229 CZ PHE A 20 -2.316 7.721 0.175 1.00 0.00 C ATOM 0 H PHE A 20 -1.658 7.179 -4.992 1.00 0.00 H new ATOM 0 HA PHE A 20 -4.278 8.478 -4.548 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.558 9.740 -4.050 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.128 10.408 -3.652 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.447 9.456 -1.772 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.487 8.136 -2.621 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -4.306 8.443 0.461 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -0.342 7.124 -0.389 1.00 0.00 H new ATOM 0 HZ PHE A 20 -2.254 7.276 1.157 1.00 0.00 H new ATOM 239 N PRO A 21 -3.784 8.701 -7.159 1.00 0.00 N ATOM 240 CA PRO A 21 -3.699 9.224 -8.528 1.00 0.00 C ATOM 241 C PRO A 21 -3.873 10.739 -8.585 1.00 0.00 C ATOM 242 O PRO A 21 -3.178 11.424 -9.334 1.00 0.00 O ATOM 243 CB PRO A 21 -4.857 8.528 -9.247 1.00 0.00 C ATOM 244 CG PRO A 21 -5.077 7.271 -8.481 1.00 0.00 C ATOM 245 CD PRO A 21 -4.760 7.600 -7.048 1.00 0.00 C ATOM 0 HA PRO A 21 -2.723 9.033 -8.975 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -5.752 9.151 -9.252 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -4.609 8.319 -10.288 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.106 6.926 -8.584 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -4.434 6.472 -8.850 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.651 7.906 -6.499 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -4.341 6.742 -6.522 1.00 0.00 H new ATOM 253 N ALA A 22 -4.807 11.252 -7.791 1.00 0.00 N ATOM 254 CA ALA A 22 -5.079 12.686 -7.753 1.00 0.00 C ATOM 255 C ALA A 22 -3.864 13.474 -7.267 1.00 0.00 C ATOM 256 O ALA A 22 -3.488 14.481 -7.868 1.00 0.00 O ATOM 257 CB ALA A 22 -6.281 12.970 -6.865 1.00 0.00 C ATOM 0 H ALA A 22 -5.389 10.696 -7.164 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.301 13.010 -8.770 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.473 14.043 -6.845 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.155 12.452 -7.259 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.077 12.619 -5.853 1.00 0.00 H new ATOM 263 N ILE A 23 -3.260 13.016 -6.175 1.00 0.00 N ATOM 264 CA ILE A 23 -2.094 13.687 -5.609 1.00 0.00 C ATOM 265 C ILE A 23 -0.863 13.505 -6.493 1.00 0.00 C ATOM 266 O ILE A 23 -0.562 12.397 -6.937 1.00 0.00 O ATOM 267 CB ILE A 23 -1.783 13.162 -4.193 1.00 0.00 C ATOM 268 CG1 ILE A 23 -2.992 13.366 -3.276 1.00 0.00 C ATOM 269 CG2 ILE A 23 -0.555 13.863 -3.627 1.00 0.00 C ATOM 270 CD1 ILE A 23 -2.801 12.799 -1.885 1.00 0.00 C ATOM 0 H ILE A 23 -3.558 12.184 -5.665 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.336 14.748 -5.553 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.571 12.094 -4.253 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.203 14.433 -3.199 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -3.866 12.901 -3.732 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.347 13.482 -2.627 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.302 13.673 -4.273 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.740 14.936 -3.576 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.697 12.980 -1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.621 11.726 -1.951 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.947 13.282 -1.409 1.00 0.00 H new ATOM 282 N SER A 24 -0.153 14.604 -6.738 1.00 0.00 N ATOM 283 CA SER A 24 1.051 14.571 -7.562 1.00 0.00 C ATOM 284 C SER A 24 2.155 13.771 -6.878 1.00 0.00 C ATOM 285 O SER A 24 2.333 13.857 -5.662 1.00 0.00 O ATOM 286 CB SER A 24 1.538 15.993 -7.849 1.00 0.00 C ATOM 287 OG SER A 24 1.865 16.674 -6.650 1.00 0.00 O ATOM 0 H SER A 24 -0.391 15.528 -6.377 1.00 0.00 H new ATOM 0 HA SER A 24 0.803 14.083 -8.505 1.00 0.00 H new ATOM 0 HB2 SER A 24 2.412 15.957 -8.500 1.00 0.00 H new ATOM 0 HB3 SER A 24 0.765 16.544 -8.384 1.00 0.00 H new ATOM 0 HG SER A 24 2.175 17.579 -6.862 1.00 0.00 H new ATOM 293 N LYS A 25 2.891 12.990 -7.664 1.00 0.00 N ATOM 294 CA LYS A 25 3.976 12.172 -7.132 1.00 0.00 C ATOM 295 C LYS A 25 5.022 13.028 -6.427 1.00 0.00 C ATOM 296 O LYS A 25 5.679 12.571 -5.492 1.00 0.00 O ATOM 297 CB LYS A 25 4.635 11.354 -8.243 1.00 0.00 C ATOM 298 CG LYS A 25 5.150 12.188 -9.406 1.00 0.00 C ATOM 299 CD LYS A 25 5.894 11.337 -10.426 1.00 0.00 C ATOM 300 CE LYS A 25 7.172 10.746 -9.848 1.00 0.00 C ATOM 301 NZ LYS A 25 7.915 9.940 -10.857 1.00 0.00 N ATOM 0 H LYS A 25 2.756 12.907 -8.672 1.00 0.00 H new ATOM 0 HA LYS A 25 3.542 11.490 -6.401 1.00 0.00 H new ATOM 0 HB2 LYS A 25 5.465 10.789 -7.820 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.915 10.628 -8.621 1.00 0.00 H new ATOM 0 HG2 LYS A 25 4.313 12.690 -9.892 1.00 0.00 H new ATOM 0 HG3 LYS A 25 5.813 12.967 -9.029 1.00 0.00 H new ATOM 0 HD2 LYS A 25 5.245 10.532 -10.770 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.137 11.945 -11.298 1.00 0.00 H new ATOM 0 HE2 LYS A 25 7.811 11.550 -9.483 1.00 0.00 H new ATOM 0 HE3 LYS A 25 6.927 10.119 -8.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.779 9.554 -10.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.314 9.158 -11.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.171 10.544 -11.664 1.00 0.00 H new ATOM 315 N SER A 26 5.178 14.267 -6.882 1.00 0.00 N ATOM 316 CA SER A 26 6.149 15.184 -6.291 1.00 0.00 C ATOM 317 C SER A 26 5.918 15.328 -4.788 1.00 0.00 C ATOM 318 O SER A 26 6.851 15.217 -3.993 1.00 0.00 O ATOM 319 CB SER A 26 6.058 16.554 -6.966 1.00 0.00 C ATOM 320 OG SER A 26 6.985 17.464 -6.402 1.00 0.00 O ATOM 0 H SER A 26 4.645 14.660 -7.658 1.00 0.00 H new ATOM 0 HA SER A 26 7.146 14.772 -6.448 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.250 16.450 -8.034 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.047 16.948 -6.861 1.00 0.00 H new ATOM 0 HG SER A 26 6.907 18.331 -6.852 1.00 0.00 H new ATOM 326 N LYS A 27 4.666 15.567 -4.410 1.00 0.00 N ATOM 327 CA LYS A 27 4.304 15.722 -3.004 1.00 0.00 C ATOM 328 C LYS A 27 4.577 14.436 -2.228 1.00 0.00 C ATOM 329 O LYS A 27 5.209 14.458 -1.171 1.00 0.00 O ATOM 330 CB LYS A 27 2.827 16.106 -2.885 1.00 0.00 C ATOM 331 CG LYS A 27 2.333 16.220 -1.453 1.00 0.00 C ATOM 332 CD LYS A 27 0.888 16.692 -1.403 1.00 0.00 C ATOM 333 CE LYS A 27 0.358 16.730 0.022 1.00 0.00 C ATOM 334 NZ LYS A 27 0.335 15.377 0.643 1.00 0.00 N ATOM 0 H LYS A 27 3.884 15.658 -5.058 1.00 0.00 H new ATOM 0 HA LYS A 27 4.916 16.516 -2.575 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.668 17.058 -3.391 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.225 15.363 -3.408 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.419 15.253 -0.958 1.00 0.00 H new ATOM 0 HG3 LYS A 27 2.965 16.917 -0.902 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.814 17.685 -1.845 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.267 16.028 -2.005 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.979 17.394 0.623 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.649 17.147 0.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.490 15.298 1.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.273 14.654 -0.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.205 15.233 1.194 1.00 0.00 H new ATOM 348 N LEU A 28 4.100 13.319 -2.765 1.00 0.00 N ATOM 349 CA LEU A 28 4.290 12.019 -2.133 1.00 0.00 C ATOM 350 C LEU A 28 5.775 11.726 -1.930 1.00 0.00 C ATOM 351 O LEU A 28 6.175 11.167 -0.906 1.00 0.00 O ATOM 352 CB LEU A 28 3.635 10.927 -2.983 1.00 0.00 C ATOM 353 CG LEU A 28 2.110 11.030 -3.098 1.00 0.00 C ATOM 354 CD1 LEU A 28 1.583 10.063 -4.146 1.00 0.00 C ATOM 355 CD2 LEU A 28 1.457 10.762 -1.751 1.00 0.00 C ATOM 0 H LEU A 28 3.577 13.288 -3.640 1.00 0.00 H new ATOM 0 HA LEU A 28 3.815 12.034 -1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.064 10.960 -3.985 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.889 9.955 -2.559 1.00 0.00 H new ATOM 0 HG LEU A 28 1.858 12.043 -3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.499 10.153 -4.211 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.025 10.299 -5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.846 9.043 -3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.374 10.839 -1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.720 9.760 -1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.808 11.495 -1.024 1.00 0.00 H new ATOM 367 N GLN A 29 6.589 12.121 -2.904 1.00 0.00 N ATOM 368 CA GLN A 29 8.032 11.918 -2.832 1.00 0.00 C ATOM 369 C GLN A 29 8.626 12.730 -1.688 1.00 0.00 C ATOM 370 O GLN A 29 9.469 12.239 -0.938 1.00 0.00 O ATOM 371 CB GLN A 29 8.691 12.315 -4.154 1.00 0.00 C ATOM 372 CG GLN A 29 10.199 12.123 -4.167 1.00 0.00 C ATOM 373 CD GLN A 29 10.830 12.549 -5.476 1.00 0.00 C ATOM 374 OE1 GLN A 29 10.504 12.018 -6.538 1.00 0.00 O ATOM 375 NE2 GLN A 29 11.739 13.515 -5.408 1.00 0.00 N ATOM 0 H GLN A 29 6.272 12.585 -3.755 1.00 0.00 H new ATOM 0 HA GLN A 29 8.223 10.861 -2.647 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.252 11.727 -4.960 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.465 13.361 -4.363 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.641 12.695 -3.352 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.429 11.074 -3.982 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.979 13.927 -4.506 1.00 0.00 H new ATOM 0 HE22 GLN A 29 12.197 13.845 -6.257 1.00 0.00 H new ATOM 384 N VAL A 30 8.172 13.975 -1.557 1.00 0.00 N ATOM 385 CA VAL A 30 8.651 14.858 -0.500 1.00 0.00 C ATOM 386 C VAL A 30 8.404 14.242 0.873 1.00 0.00 C ATOM 387 O VAL A 30 9.298 14.210 1.719 1.00 0.00 O ATOM 388 CB VAL A 30 7.966 16.238 -0.565 1.00 0.00 C ATOM 389 CG1 VAL A 30 8.422 17.124 0.587 1.00 0.00 C ATOM 390 CG2 VAL A 30 8.247 16.911 -1.899 1.00 0.00 C ATOM 0 H VAL A 30 7.473 14.393 -2.171 1.00 0.00 H new ATOM 0 HA VAL A 30 9.722 14.989 -0.653 1.00 0.00 H new ATOM 0 HB VAL A 30 6.890 16.088 -0.474 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.926 18.092 0.520 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.166 16.650 1.534 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.501 17.265 0.532 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.756 17.884 -1.927 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.322 17.044 -2.020 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.865 16.289 -2.708 1.00 0.00 H new ATOM 400 N HIS A 31 7.188 13.751 1.088 1.00 0.00 N ATOM 401 CA HIS A 31 6.831 13.132 2.358 1.00 0.00 C ATOM 402 C HIS A 31 7.676 11.891 2.614 1.00 0.00 C ATOM 403 O HIS A 31 8.097 11.637 3.742 1.00 0.00 O ATOM 404 CB HIS A 31 5.349 12.761 2.376 1.00 0.00 C ATOM 405 CG HIS A 31 4.438 13.937 2.231 1.00 0.00 C ATOM 406 ND1 HIS A 31 4.424 14.993 3.118 1.00 0.00 N ATOM 407 CD2 HIS A 31 3.507 14.223 1.292 1.00 0.00 C ATOM 408 CE1 HIS A 31 3.523 15.877 2.731 1.00 0.00 C ATOM 409 NE2 HIS A 31 2.953 15.435 1.625 1.00 0.00 N ATOM 0 H HIS A 31 6.435 13.770 0.400 1.00 0.00 H new ATOM 0 HA HIS A 31 7.026 13.856 3.149 1.00 0.00 H new ATOM 0 HB2 HIS A 31 5.149 12.055 1.570 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.122 12.249 3.311 1.00 0.00 H new ATOM 0 HD1 HIS A 31 5.017 15.078 3.944 1.00 0.00 H new ATOM 0 HD2 HIS A 31 3.248 13.612 0.440 1.00 0.00 H new ATOM 0 HE1 HIS A 31 3.291 16.804 3.234 1.00 0.00 H new ATOM 418 N LEU A 32 7.914 11.116 1.561 1.00 0.00 N ATOM 419 CA LEU A 32 8.701 9.895 1.673 1.00 0.00 C ATOM 420 C LEU A 32 10.131 10.200 2.114 1.00 0.00 C ATOM 421 O LEU A 32 10.674 9.532 2.993 1.00 0.00 O ATOM 422 CB LEU A 32 8.716 9.148 0.336 1.00 0.00 C ATOM 423 CG LEU A 32 9.346 7.756 0.382 1.00 0.00 C ATOM 424 CD1 LEU A 32 8.566 6.851 1.324 1.00 0.00 C ATOM 425 CD2 LEU A 32 9.403 7.149 -1.010 1.00 0.00 C ATOM 0 H LEU A 32 7.573 11.313 0.620 1.00 0.00 H new ATOM 0 HA LEU A 32 8.236 9.265 2.431 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.691 9.055 -0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 32 9.256 9.751 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 32 10.365 7.852 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 32 9.028 5.864 1.345 1.00 0.00 H new ATOM 0 HD12 LEU A 32 8.574 7.277 2.327 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.537 6.763 0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.855 6.158 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.393 7.066 -1.413 1.00 0.00 H new ATOM 0 HD23 LEU A 32 10.002 7.786 -1.661 1.00 0.00 H new ATOM 437 N LEU A 33 10.733 11.212 1.496 1.00 0.00 N ATOM 438 CA LEU A 33 12.101 11.606 1.822 1.00 0.00 C ATOM 439 C LEU A 33 12.205 12.089 3.265 1.00 0.00 C ATOM 440 O LEU A 33 13.099 11.675 4.005 1.00 0.00 O ATOM 441 CB LEU A 33 12.575 12.710 0.876 1.00 0.00 C ATOM 442 CG LEU A 33 12.687 12.305 -0.596 1.00 0.00 C ATOM 443 CD1 LEU A 33 13.059 13.506 -1.450 1.00 0.00 C ATOM 444 CD2 LEU A 33 13.714 11.194 -0.765 1.00 0.00 C ATOM 0 H LEU A 33 10.295 11.775 0.766 1.00 0.00 H new ATOM 0 HA LEU A 33 12.738 10.729 1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.887 13.552 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.549 13.062 1.214 1.00 0.00 H new ATOM 0 HG LEU A 33 11.717 11.933 -0.927 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.135 13.201 -2.494 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.292 14.274 -1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.017 13.905 -1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.781 10.918 -1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.687 11.542 -0.418 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.410 10.326 -0.181 1.00 0.00 H new ATOM 456 N GLU A 34 11.293 12.972 3.654 1.00 0.00 N ATOM 457 CA GLU A 34 11.282 13.520 5.005 1.00 0.00 C ATOM 458 C GLU A 34 11.095 12.420 6.046 1.00 0.00 C ATOM 459 O GLU A 34 11.844 12.342 7.021 1.00 0.00 O ATOM 460 CB GLU A 34 10.175 14.565 5.141 1.00 0.00 C ATOM 461 CG GLU A 34 10.349 15.756 4.213 1.00 0.00 C ATOM 462 CD GLU A 34 11.598 16.557 4.524 1.00 0.00 C ATOM 463 OE1 GLU A 34 11.711 17.062 5.661 1.00 0.00 O ATOM 464 OE2 GLU A 34 12.463 16.677 3.631 1.00 0.00 O ATOM 0 H GLU A 34 10.550 13.325 3.051 1.00 0.00 H new ATOM 0 HA GLU A 34 12.247 13.995 5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.214 14.093 4.937 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.145 14.919 6.172 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.393 15.406 3.182 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.476 16.404 4.292 1.00 0.00 H new ATOM 471 N ASN A 35 10.094 11.573 5.834 1.00 0.00 N ATOM 472 CA ASN A 35 9.813 10.477 6.756 1.00 0.00 C ATOM 473 C ASN A 35 10.691 9.265 6.453 1.00 0.00 C ATOM 474 O ASN A 35 10.298 8.130 6.712 1.00 0.00 O ATOM 475 CB ASN A 35 8.336 10.083 6.673 1.00 0.00 C ATOM 476 CG ASN A 35 7.409 11.240 6.992 1.00 0.00 C ATOM 477 OD1 ASN A 35 7.458 11.806 8.084 1.00 0.00 O ATOM 478 ND2 ASN A 35 6.557 11.595 6.038 1.00 0.00 N ATOM 0 H ASN A 35 9.464 11.623 5.033 1.00 0.00 H new ATOM 0 HA ASN A 35 10.038 10.820 7.766 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.118 9.712 5.672 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.142 9.264 7.366 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.908 12.366 6.195 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.552 11.097 5.148 1.00 0.00 H new ATOM 485 N ASN A 36 11.883 9.525 5.907 1.00 0.00 N ATOM 486 CA ASN A 36 12.838 8.472 5.556 1.00 0.00 C ATOM 487 C ASN A 36 12.295 7.584 4.439 1.00 0.00 C ATOM 488 O ASN A 36 12.767 7.640 3.302 1.00 0.00 O ATOM 489 CB ASN A 36 13.178 7.620 6.783 1.00 0.00 C ATOM 490 CG ASN A 36 13.817 8.422 7.906 1.00 0.00 C ATOM 491 OD1 ASN A 36 14.000 9.722 7.693 1.00 0.00 O flip ATOM 492 ND2 ASN A 36 14.142 7.875 8.960 1.00 0.00 N flip ATOM 0 H ASN A 36 12.211 10.468 5.697 1.00 0.00 H new ATOM 0 HA ASN A 36 13.747 8.956 5.199 1.00 0.00 H new ATOM 0 HB2 ASN A 36 12.268 7.148 7.154 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.855 6.819 6.486 1.00 0.00 H new ATOM 0 HD21 ASN A 36 13.985 6.875 9.085 1.00 0.00 H new ATOM 0 HD22 ASN A 36 14.568 8.422 9.708 1.00 0.00 H new ATOM 499 N ASN A 37 11.294 6.776 4.771 1.00 0.00 N ATOM 500 CA ASN A 37 10.665 5.875 3.811 1.00 0.00 C ATOM 501 C ASN A 37 9.505 5.132 4.468 1.00 0.00 C ATOM 502 O ASN A 37 9.225 3.979 4.141 1.00 0.00 O ATOM 503 CB ASN A 37 11.685 4.873 3.263 1.00 0.00 C ATOM 504 CG ASN A 37 12.279 3.997 4.349 1.00 0.00 C ATOM 505 OD1 ASN A 37 12.895 4.491 5.293 1.00 0.00 O ATOM 506 ND2 ASN A 37 12.098 2.689 4.218 1.00 0.00 N ATOM 0 H ASN A 37 10.897 6.727 5.709 1.00 0.00 H new ATOM 0 HA ASN A 37 10.282 6.470 2.982 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.205 4.243 2.515 1.00 0.00 H new ATOM 0 HB3 ASN A 37 12.486 5.414 2.758 1.00 0.00 H new ATOM 0 HD21 ASN A 37 12.476 2.049 4.917 1.00 0.00 H new ATOM 0 HD22 ASN A 37 11.580 2.323 3.419 1.00 0.00 H new ATOM 513 N ASP A 38 8.838 5.805 5.400 1.00 0.00 N ATOM 514 CA ASP A 38 7.709 5.221 6.117 1.00 0.00 C ATOM 515 C ASP A 38 6.431 5.300 5.282 1.00 0.00 C ATOM 516 O ASP A 38 6.128 6.337 4.694 1.00 0.00 O ATOM 517 CB ASP A 38 7.516 5.939 7.454 1.00 0.00 C ATOM 518 CG ASP A 38 6.457 5.283 8.313 1.00 0.00 C ATOM 519 OD1 ASP A 38 5.310 5.164 7.845 1.00 0.00 O ATOM 520 OD2 ASP A 38 6.776 4.892 9.455 1.00 0.00 O ATOM 0 H ASP A 38 9.061 6.761 5.678 1.00 0.00 H new ATOM 0 HA ASP A 38 7.924 4.169 6.304 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.462 5.953 7.996 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.239 6.977 7.269 1.00 0.00 H new ATOM 525 N LEU A 39 5.691 4.193 5.227 1.00 0.00 N ATOM 526 CA LEU A 39 4.451 4.136 4.454 1.00 0.00 C ATOM 527 C LEU A 39 3.206 4.291 5.329 1.00 0.00 C ATOM 528 O LEU A 39 2.314 5.075 5.012 1.00 0.00 O ATOM 529 CB LEU A 39 4.374 2.820 3.678 1.00 0.00 C ATOM 530 CG LEU A 39 5.400 2.671 2.553 1.00 0.00 C ATOM 531 CD1 LEU A 39 5.279 1.303 1.899 1.00 0.00 C ATOM 532 CD2 LEU A 39 5.218 3.774 1.520 1.00 0.00 C ATOM 0 H LEU A 39 5.928 3.325 5.708 1.00 0.00 H new ATOM 0 HA LEU A 39 4.470 4.977 3.761 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.503 1.995 4.378 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.375 2.724 3.253 1.00 0.00 H new ATOM 0 HG LEU A 39 6.398 2.760 2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.016 1.215 1.101 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.455 0.527 2.644 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.278 1.186 1.483 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.955 3.654 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.216 3.714 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.353 4.745 1.997 1.00 0.00 H new ATOM 544 N ASP A 40 3.137 3.526 6.414 1.00 0.00 N ATOM 545 CA ASP A 40 1.979 3.569 7.309 1.00 0.00 C ATOM 546 C ASP A 40 1.706 4.982 7.831 1.00 0.00 C ATOM 547 O ASP A 40 0.574 5.463 7.769 1.00 0.00 O ATOM 548 CB ASP A 40 2.180 2.606 8.481 1.00 0.00 C ATOM 549 CG ASP A 40 3.436 2.908 9.274 1.00 0.00 C ATOM 550 OD1 ASP A 40 4.540 2.814 8.697 1.00 0.00 O ATOM 551 OD2 ASP A 40 3.315 3.238 10.472 1.00 0.00 O ATOM 0 H ASP A 40 3.865 2.870 6.697 1.00 0.00 H new ATOM 0 HA ASP A 40 1.109 3.260 6.729 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.315 2.659 9.143 1.00 0.00 H new ATOM 0 HB3 ASP A 40 2.230 1.585 8.103 1.00 0.00 H new ATOM 556 N LEU A 41 2.739 5.635 8.349 1.00 0.00 N ATOM 557 CA LEU A 41 2.604 6.987 8.887 1.00 0.00 C ATOM 558 C LEU A 41 2.209 7.974 7.790 1.00 0.00 C ATOM 559 O LEU A 41 1.188 8.662 7.896 1.00 0.00 O ATOM 560 CB LEU A 41 3.924 7.418 9.544 1.00 0.00 C ATOM 561 CG LEU A 41 3.885 8.724 10.352 1.00 0.00 C ATOM 562 CD1 LEU A 41 5.133 8.847 11.212 1.00 0.00 C ATOM 563 CD2 LEU A 41 3.770 9.933 9.434 1.00 0.00 C ATOM 0 H LEU A 41 3.682 5.251 8.409 1.00 0.00 H new ATOM 0 HA LEU A 41 1.814 6.985 9.638 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.256 6.617 10.204 1.00 0.00 H new ATOM 0 HB3 LEU A 41 4.678 7.521 8.763 1.00 0.00 H new ATOM 0 HG LEU A 41 3.005 8.696 10.995 1.00 0.00 H new ATOM 0 HD11 LEU A 41 5.093 9.777 11.780 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.185 8.003 11.900 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.016 8.849 10.573 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.744 10.843 10.033 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.629 9.964 8.763 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.854 9.859 8.848 1.00 0.00 H new ATOM 575 N THR A 42 3.026 8.043 6.742 1.00 0.00 N ATOM 576 CA THR A 42 2.766 8.952 5.632 1.00 0.00 C ATOM 577 C THR A 42 1.370 8.732 5.065 1.00 0.00 C ATOM 578 O THR A 42 0.522 9.620 5.128 1.00 0.00 O ATOM 579 CB THR A 42 3.804 8.775 4.506 1.00 0.00 C ATOM 580 OG1 THR A 42 5.123 9.005 5.017 1.00 0.00 O ATOM 581 CG2 THR A 42 3.528 9.734 3.355 1.00 0.00 C ATOM 0 H THR A 42 3.871 7.481 6.639 1.00 0.00 H new ATOM 0 HA THR A 42 2.841 9.966 6.024 1.00 0.00 H new ATOM 0 HB THR A 42 3.730 7.754 4.132 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.641 8.174 4.971 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.274 9.589 2.574 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.535 9.539 2.949 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.577 10.761 3.717 1.00 0.00 H new ATOM 589 N ILE A 43 1.137 7.541 4.525 1.00 0.00 N ATOM 590 CA ILE A 43 -0.160 7.202 3.954 1.00 0.00 C ATOM 591 C ILE A 43 -1.278 7.444 4.959 1.00 0.00 C ATOM 592 O ILE A 43 -2.360 7.903 4.596 1.00 0.00 O ATOM 593 CB ILE A 43 -0.209 5.736 3.488 1.00 0.00 C ATOM 594 CG1 ILE A 43 0.847 5.487 2.411 1.00 0.00 C ATOM 595 CG2 ILE A 43 -1.596 5.398 2.965 1.00 0.00 C ATOM 596 CD1 ILE A 43 0.896 4.052 1.930 1.00 0.00 C ATOM 0 H ILE A 43 1.830 6.794 4.471 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.303 7.850 3.089 1.00 0.00 H new ATOM 0 HB ILE A 43 0.007 5.089 4.338 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.648 6.140 1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.826 5.764 2.803 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.618 4.358 2.638 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.330 5.545 3.758 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.836 6.048 2.124 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.668 3.950 1.167 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.126 3.395 2.769 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.070 3.777 1.508 1.00 0.00 H new ATOM 608 N GLY A 44 -1.008 7.140 6.226 1.00 0.00 N ATOM 609 CA GLY A 44 -2.003 7.343 7.260 1.00 0.00 C ATOM 610 C GLY A 44 -2.542 8.758 7.241 1.00 0.00 C ATOM 611 O GLY A 44 -3.752 8.972 7.293 1.00 0.00 O ATOM 0 H GLY A 44 -0.120 6.758 6.552 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.823 6.638 7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.564 7.133 8.235 1.00 0.00 H new ATOM 615 N LEU A 45 -1.635 9.725 7.152 1.00 0.00 N ATOM 616 CA LEU A 45 -2.019 11.132 7.108 1.00 0.00 C ATOM 617 C LEU A 45 -2.691 11.470 5.777 1.00 0.00 C ATOM 618 O LEU A 45 -3.632 12.264 5.729 1.00 0.00 O ATOM 619 CB LEU A 45 -0.792 12.025 7.320 1.00 0.00 C ATOM 620 CG LEU A 45 -1.060 13.531 7.240 1.00 0.00 C ATOM 621 CD1 LEU A 45 -2.077 13.955 8.289 1.00 0.00 C ATOM 622 CD2 LEU A 45 0.237 14.309 7.411 1.00 0.00 C ATOM 0 H LEU A 45 -0.629 9.561 7.109 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.733 11.315 7.911 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.363 11.800 8.296 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.041 11.766 6.574 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.473 13.754 6.256 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.252 15.028 8.213 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.014 13.422 8.124 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.695 13.719 9.282 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.031 15.378 7.352 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.675 14.077 8.382 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.935 14.030 6.622 1.00 0.00 H new ATOM 634 N LEU A 46 -2.194 10.866 4.699 1.00 0.00 N ATOM 635 CA LEU A 46 -2.731 11.102 3.359 1.00 0.00 C ATOM 636 C LEU A 46 -4.214 10.744 3.257 1.00 0.00 C ATOM 637 O LEU A 46 -4.991 11.487 2.657 1.00 0.00 O ATOM 638 CB LEU A 46 -1.934 10.313 2.317 1.00 0.00 C ATOM 639 CG LEU A 46 -0.690 11.018 1.761 1.00 0.00 C ATOM 640 CD1 LEU A 46 -1.081 12.289 1.029 1.00 0.00 C ATOM 641 CD2 LEU A 46 0.302 11.333 2.871 1.00 0.00 C ATOM 0 H LEU A 46 -1.417 10.206 4.728 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.635 12.170 3.161 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.625 9.367 2.762 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.596 10.073 1.485 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.208 10.341 1.055 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.186 12.776 0.641 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.747 12.042 0.202 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.591 12.963 1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.174 11.832 2.449 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.169 11.986 3.606 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.613 10.407 3.355 1.00 0.00 H new ATOM 653 N LEU A 47 -4.605 9.604 3.825 1.00 0.00 N ATOM 654 CA LEU A 47 -6.000 9.171 3.770 1.00 0.00 C ATOM 655 C LEU A 47 -6.931 10.271 4.270 1.00 0.00 C ATOM 656 O LEU A 47 -7.916 10.610 3.615 1.00 0.00 O ATOM 657 CB LEU A 47 -6.214 7.903 4.598 1.00 0.00 C ATOM 658 CG LEU A 47 -5.389 6.690 4.160 1.00 0.00 C ATOM 659 CD1 LEU A 47 -5.681 5.495 5.054 1.00 0.00 C ATOM 660 CD2 LEU A 47 -5.673 6.350 2.704 1.00 0.00 C ATOM 0 H LEU A 47 -3.982 8.969 4.324 1.00 0.00 H new ATOM 0 HA LEU A 47 -6.235 8.955 2.728 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -5.980 8.125 5.639 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -7.270 7.637 4.559 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.332 6.940 4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.086 4.642 4.728 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.427 5.741 6.085 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.740 5.244 4.991 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.078 5.485 2.410 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.732 6.120 2.584 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.413 7.201 2.074 1.00 0.00 H new ATOM 672 N LYS A 48 -6.608 10.825 5.435 1.00 0.00 N ATOM 673 CA LYS A 48 -7.411 11.890 6.028 1.00 0.00 C ATOM 674 C LYS A 48 -7.068 13.246 5.414 1.00 0.00 C ATOM 675 O LYS A 48 -6.985 14.253 6.118 1.00 0.00 O ATOM 676 CB LYS A 48 -7.197 11.932 7.543 1.00 0.00 C ATOM 677 CG LYS A 48 -7.512 10.616 8.238 1.00 0.00 C ATOM 678 CD LYS A 48 -7.272 10.698 9.739 1.00 0.00 C ATOM 679 CE LYS A 48 -8.231 11.667 10.413 1.00 0.00 C ATOM 680 NZ LYS A 48 -8.034 11.706 11.889 1.00 0.00 N ATOM 0 H LYS A 48 -5.795 10.554 5.988 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.460 11.677 5.820 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.161 12.203 7.748 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.822 12.717 7.968 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.551 10.345 8.050 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.895 9.824 7.814 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.387 9.708 10.180 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.246 11.013 9.926 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.087 12.666 10.001 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.258 11.375 10.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -8.706 12.378 12.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.196 10.758 12.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.062 12.009 12.102 1.00 0.00 H new ATOM 694 N GLU A 49 -6.870 13.268 4.098 1.00 0.00 N ATOM 695 CA GLU A 49 -6.536 14.504 3.397 1.00 0.00 C ATOM 696 C GLU A 49 -7.703 15.485 3.442 1.00 0.00 C ATOM 697 O GLU A 49 -7.540 16.642 3.827 1.00 0.00 O ATOM 698 CB GLU A 49 -6.159 14.207 1.944 1.00 0.00 C ATOM 699 CG GLU A 49 -5.778 15.445 1.145 1.00 0.00 C ATOM 700 CD GLU A 49 -4.520 16.121 1.661 1.00 0.00 C ATOM 701 OE1 GLU A 49 -3.914 15.600 2.622 1.00 0.00 O ATOM 702 OE2 GLU A 49 -4.138 17.169 1.101 1.00 0.00 O ATOM 0 H GLU A 49 -6.935 12.446 3.497 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.682 14.958 3.899 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.325 13.506 1.931 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.998 13.713 1.454 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.632 15.166 0.101 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.603 16.156 1.172 1.00 0.00 H new ATOM 709 N ASN A 50 -8.882 15.011 3.048 1.00 0.00 N ATOM 710 CA ASN A 50 -10.078 15.844 3.047 1.00 0.00 C ATOM 711 C ASN A 50 -10.473 16.219 4.471 1.00 0.00 C ATOM 712 O ASN A 50 -10.808 17.370 4.752 1.00 0.00 O ATOM 713 CB ASN A 50 -11.233 15.115 2.356 1.00 0.00 C ATOM 714 CG ASN A 50 -10.918 14.768 0.914 1.00 0.00 C ATOM 715 OD1 ASN A 50 -9.966 14.039 0.631 1.00 0.00 O ATOM 716 ND2 ASN A 50 -11.718 15.290 -0.008 1.00 0.00 N ATOM 0 H ASN A 50 -9.033 14.055 2.726 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.858 16.758 2.496 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.463 14.202 2.905 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -12.125 15.740 2.390 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.556 15.092 -0.995 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.495 15.889 0.271 1.00 0.00 H new ATOM 723 N ASP A 51 -10.430 15.237 5.366 1.00 0.00 N ATOM 724 CA ASP A 51 -10.780 15.458 6.764 1.00 0.00 C ATOM 725 C ASP A 51 -9.764 16.371 7.441 1.00 0.00 C ATOM 726 O ASP A 51 -8.555 16.190 7.291 1.00 0.00 O ATOM 727 CB ASP A 51 -10.855 14.122 7.506 1.00 0.00 C ATOM 728 CG ASP A 51 -11.234 14.289 8.964 1.00 0.00 C ATOM 729 OD1 ASP A 51 -12.333 14.815 9.235 1.00 0.00 O ATOM 730 OD2 ASP A 51 -10.431 13.894 9.835 1.00 0.00 O ATOM 0 H ASP A 51 -10.156 14.279 5.147 1.00 0.00 H new ATOM 0 HA ASP A 51 -11.756 15.943 6.798 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -11.585 13.478 7.016 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -9.890 13.619 7.440 1.00 0.00 H new ATOM 735 N ASP A 52 -10.262 17.352 8.189 1.00 0.00 N ATOM 736 CA ASP A 52 -9.396 18.291 8.892 1.00 0.00 C ATOM 737 C ASP A 52 -8.516 17.561 9.904 1.00 0.00 C ATOM 738 O ASP A 52 -8.978 16.666 10.610 1.00 0.00 O ATOM 739 CB ASP A 52 -10.231 19.361 9.599 1.00 0.00 C ATOM 740 CG ASP A 52 -11.075 20.171 8.631 1.00 0.00 C ATOM 741 OD1 ASP A 52 -10.993 19.915 7.411 1.00 0.00 O ATOM 742 OD2 ASP A 52 -11.817 21.063 9.094 1.00 0.00 O ATOM 0 H ASP A 52 -11.260 17.516 8.323 1.00 0.00 H new ATOM 0 HA ASP A 52 -8.752 18.774 8.157 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.881 18.884 10.333 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.569 20.031 10.148 1.00 0.00 H new ATOM 747 N LYS A 53 -7.244 17.947 9.960 1.00 0.00 N ATOM 748 CA LYS A 53 -6.294 17.329 10.879 1.00 0.00 C ATOM 749 C LYS A 53 -6.742 17.491 12.329 1.00 0.00 C ATOM 750 O LYS A 53 -7.309 18.518 12.705 1.00 0.00 O ATOM 751 CB LYS A 53 -4.893 17.921 10.668 1.00 0.00 C ATOM 752 CG LYS A 53 -4.817 19.435 10.826 1.00 0.00 C ATOM 753 CD LYS A 53 -4.712 19.851 12.287 1.00 0.00 C ATOM 754 CE LYS A 53 -4.621 21.361 12.431 1.00 0.00 C ATOM 755 NZ LYS A 53 -4.482 21.775 13.854 1.00 0.00 N ATOM 0 H LYS A 53 -6.848 18.686 9.379 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.256 16.261 10.666 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -4.206 17.459 11.378 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -4.546 17.655 9.670 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -3.954 19.814 10.278 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.702 19.891 10.382 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.580 19.484 12.834 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -3.833 19.388 12.736 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.768 21.729 11.861 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.512 21.821 12.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.423 22.812 13.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.308 21.446 14.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.618 21.357 14.254 1.00 0.00 H new ATOM 769 N SER A 54 -6.493 16.464 13.137 1.00 0.00 N ATOM 770 CA SER A 54 -6.874 16.483 14.545 1.00 0.00 C ATOM 771 C SER A 54 -6.209 17.647 15.274 1.00 0.00 C ATOM 772 O SER A 54 -5.009 17.889 15.029 1.00 0.00 O ATOM 773 CB SER A 54 -6.490 15.162 15.216 1.00 0.00 C ATOM 774 OG SER A 54 -7.131 14.066 14.587 1.00 0.00 O ATOM 775 OXT SER A 54 -6.895 18.306 16.084 1.00 0.00 O ATOM 0 H SER A 54 -6.028 15.606 12.839 1.00 0.00 H new ATOM 0 HA SER A 54 -7.955 16.612 14.601 1.00 0.00 H new ATOM 0 HB2 SER A 54 -5.409 15.029 15.173 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.765 15.192 16.270 1.00 0.00 H new ATOM 0 HG SER A 54 -6.868 13.234 15.033 1.00 0.00 H new TER 781 SER A 54 ATOM 782 N MET B 1 -16.470 -11.749 -10.599 1.00 0.00 N ATOM 783 CA MET B 1 -15.767 -10.475 -10.300 1.00 0.00 C ATOM 784 C MET B 1 -14.688 -10.677 -9.242 1.00 0.00 C ATOM 785 O MET B 1 -14.838 -11.496 -8.335 1.00 0.00 O ATOM 786 CB MET B 1 -16.797 -9.446 -9.827 1.00 0.00 C ATOM 787 CG MET B 1 -16.197 -8.085 -9.509 1.00 0.00 C ATOM 788 SD MET B 1 -17.446 -6.862 -9.071 1.00 0.00 S ATOM 789 CE MET B 1 -16.429 -5.404 -8.849 1.00 0.00 C ATOM 0 H1 MET B 1 -17.493 -11.574 -10.666 1.00 0.00 H new ATOM 0 H2 MET B 1 -16.124 -12.133 -11.502 1.00 0.00 H new ATOM 0 H3 MET B 1 -16.286 -12.434 -9.838 1.00 0.00 H new ATOM 0 HA MET B 1 -15.273 -10.117 -11.203 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.559 -9.327 -10.597 1.00 0.00 H new ATOM 0 HB3 MET B 1 -17.299 -9.829 -8.939 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.490 -8.187 -8.686 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.633 -7.730 -10.372 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.850 -4.784 -8.058 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.418 -5.704 -8.575 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.400 -4.836 -9.779 1.00 0.00 H new ATOM 801 N GLN B 2 -13.602 -9.924 -9.368 1.00 0.00 N ATOM 802 CA GLN B 2 -12.492 -10.015 -8.429 1.00 0.00 C ATOM 803 C GLN B 2 -11.761 -8.684 -8.328 1.00 0.00 C ATOM 804 O GLN B 2 -11.742 -7.899 -9.276 1.00 0.00 O ATOM 805 CB GLN B 2 -11.505 -11.117 -8.841 1.00 0.00 C ATOM 806 CG GLN B 2 -10.769 -10.851 -10.150 1.00 0.00 C ATOM 807 CD GLN B 2 -11.650 -10.982 -11.379 1.00 0.00 C ATOM 808 OE1 GLN B 2 -12.551 -10.177 -11.605 1.00 0.00 O ATOM 809 NE2 GLN B 2 -11.391 -12.008 -12.182 1.00 0.00 N ATOM 0 H GLN B 2 -13.467 -9.242 -10.114 1.00 0.00 H new ATOM 0 HA GLN B 2 -12.908 -10.268 -7.454 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -10.771 -11.245 -8.046 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -12.047 -12.058 -8.929 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -10.346 -9.847 -10.122 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -9.934 -11.547 -10.236 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -10.633 -12.653 -11.957 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -11.950 -12.151 -13.023 1.00 0.00 H new ATOM 818 N ILE B 3 -11.164 -8.437 -7.168 1.00 0.00 N ATOM 819 CA ILE B 3 -10.427 -7.206 -6.931 1.00 0.00 C ATOM 820 C ILE B 3 -9.002 -7.517 -6.479 1.00 0.00 C ATOM 821 O ILE B 3 -8.784 -8.390 -5.635 1.00 0.00 O ATOM 822 CB ILE B 3 -11.138 -6.311 -5.888 1.00 0.00 C ATOM 823 CG1 ILE B 3 -11.092 -6.920 -4.475 1.00 0.00 C ATOM 824 CG2 ILE B 3 -12.579 -6.064 -6.310 1.00 0.00 C ATOM 825 CD1 ILE B 3 -11.747 -8.278 -4.343 1.00 0.00 C ATOM 0 H ILE B 3 -11.177 -9.078 -6.374 1.00 0.00 H new ATOM 0 HA ILE B 3 -10.388 -6.656 -7.871 1.00 0.00 H new ATOM 0 HB ILE B 3 -10.603 -5.362 -5.849 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -10.050 -7.004 -4.165 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -11.576 -6.231 -3.783 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -13.072 -5.433 -5.570 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -12.594 -5.566 -7.279 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -13.105 -7.016 -6.383 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -11.664 -8.624 -3.313 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -12.799 -8.202 -4.616 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -11.250 -8.987 -5.005 1.00 0.00 H new ATOM 837 N PHE B 4 -8.031 -6.823 -7.071 1.00 0.00 N ATOM 838 CA PHE B 4 -6.625 -7.048 -6.750 1.00 0.00 C ATOM 839 C PHE B 4 -6.215 -6.385 -5.439 1.00 0.00 C ATOM 840 O PHE B 4 -5.928 -5.190 -5.400 1.00 0.00 O ATOM 841 CB PHE B 4 -5.729 -6.541 -7.884 1.00 0.00 C ATOM 842 CG PHE B 4 -5.784 -7.380 -9.133 1.00 0.00 C ATOM 843 CD1 PHE B 4 -6.996 -7.695 -9.731 1.00 0.00 C ATOM 844 CD2 PHE B 4 -4.616 -7.848 -9.712 1.00 0.00 C ATOM 845 CE1 PHE B 4 -7.038 -8.463 -10.880 1.00 0.00 C ATOM 846 CE2 PHE B 4 -4.652 -8.616 -10.860 1.00 0.00 C ATOM 847 CZ PHE B 4 -5.865 -8.924 -11.445 1.00 0.00 C ATOM 0 H PHE B 4 -8.193 -6.102 -7.774 1.00 0.00 H new ATOM 0 HA PHE B 4 -6.497 -8.124 -6.632 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.018 -5.520 -8.132 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -4.699 -6.503 -7.530 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -7.916 -7.336 -9.294 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -3.665 -7.609 -9.260 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -7.988 -8.702 -11.335 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -3.733 -8.975 -11.299 1.00 0.00 H new ATOM 0 HZ PHE B 4 -5.896 -9.524 -12.342 1.00 0.00 H new ATOM 857 N VAL B 5 -6.156 -7.179 -4.374 1.00 0.00 N ATOM 858 CA VAL B 5 -5.741 -6.680 -3.069 1.00 0.00 C ATOM 859 C VAL B 5 -4.223 -6.542 -3.029 1.00 0.00 C ATOM 860 O VAL B 5 -3.514 -7.438 -2.563 1.00 0.00 O ATOM 861 CB VAL B 5 -6.209 -7.607 -1.929 1.00 0.00 C ATOM 862 CG1 VAL B 5 -5.813 -7.039 -0.574 1.00 0.00 C ATOM 863 CG2 VAL B 5 -7.713 -7.818 -2.003 1.00 0.00 C ATOM 0 H VAL B 5 -6.391 -8.171 -4.390 1.00 0.00 H new ATOM 0 HA VAL B 5 -6.206 -5.706 -2.921 1.00 0.00 H new ATOM 0 HB VAL B 5 -5.717 -8.573 -2.047 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -6.153 -7.709 0.215 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -4.729 -6.940 -0.524 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -6.273 -6.060 -0.441 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -8.029 -8.474 -1.192 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -8.220 -6.858 -1.911 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -7.970 -8.274 -2.959 1.00 0.00 H new ATOM 873 N LYS B 6 -3.733 -5.423 -3.552 1.00 0.00 N ATOM 874 CA LYS B 6 -2.301 -5.161 -3.610 1.00 0.00 C ATOM 875 C LYS B 6 -1.763 -4.663 -2.273 1.00 0.00 C ATOM 876 O LYS B 6 -2.327 -3.759 -1.661 1.00 0.00 O ATOM 877 CB LYS B 6 -1.999 -4.137 -4.705 1.00 0.00 C ATOM 878 CG LYS B 6 -0.522 -3.798 -4.837 1.00 0.00 C ATOM 879 CD LYS B 6 -0.289 -2.747 -5.911 1.00 0.00 C ATOM 880 CE LYS B 6 1.184 -2.396 -6.035 1.00 0.00 C ATOM 881 NZ LYS B 6 2.008 -3.577 -6.418 1.00 0.00 N ATOM 0 H LYS B 6 -4.311 -4.680 -3.944 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.802 -6.102 -3.841 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.361 -4.521 -5.659 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.555 -3.223 -4.498 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.144 -3.435 -3.882 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.040 -4.700 -5.080 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.658 -3.115 -6.868 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.859 -1.849 -5.673 1.00 0.00 H new ATOM 0 HE2 LYS B 6 1.308 -1.610 -6.780 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.543 -1.996 -5.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 2.956 -3.260 -6.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 2.090 -4.221 -5.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.554 -4.075 -7.211 1.00 0.00 H new ATOM 895 N THR B 7 -0.656 -5.250 -1.842 1.00 0.00 N ATOM 896 CA THR B 7 -0.013 -4.863 -0.597 1.00 0.00 C ATOM 897 C THR B 7 1.120 -3.884 -0.880 1.00 0.00 C ATOM 898 O THR B 7 1.760 -3.961 -1.928 1.00 0.00 O ATOM 899 CB THR B 7 0.547 -6.085 0.155 1.00 0.00 C ATOM 900 OG1 THR B 7 1.511 -6.764 -0.658 1.00 0.00 O ATOM 901 CG2 THR B 7 -0.572 -7.047 0.529 1.00 0.00 C ATOM 0 H THR B 7 -0.182 -6.002 -2.342 1.00 0.00 H new ATOM 0 HA THR B 7 -0.767 -4.390 0.032 1.00 0.00 H new ATOM 0 HB THR B 7 1.027 -5.733 1.068 1.00 0.00 H new ATOM 0 HG1 THR B 7 1.063 -7.163 -1.433 1.00 0.00 H new ATOM 0 HG21 THR B 7 -0.154 -7.903 1.059 1.00 0.00 H new ATOM 0 HG22 THR B 7 -1.290 -6.538 1.171 1.00 0.00 H new ATOM 0 HG23 THR B 7 -1.074 -7.390 -0.375 1.00 0.00 H new ATOM 909 N LEU B 8 1.360 -2.962 0.047 1.00 0.00 N ATOM 910 CA LEU B 8 2.416 -1.971 -0.125 1.00 0.00 C ATOM 911 C LEU B 8 3.722 -2.641 -0.541 1.00 0.00 C ATOM 912 O LEU B 8 4.515 -2.066 -1.287 1.00 0.00 O ATOM 913 CB LEU B 8 2.620 -1.168 1.163 1.00 0.00 C ATOM 914 CG LEU B 8 1.388 -0.403 1.654 1.00 0.00 C ATOM 915 CD1 LEU B 8 1.741 0.457 2.859 1.00 0.00 C ATOM 916 CD2 LEU B 8 0.803 0.450 0.537 1.00 0.00 C ATOM 0 H LEU B 8 0.840 -2.881 0.921 1.00 0.00 H new ATOM 0 HA LEU B 8 2.110 -1.286 -0.916 1.00 0.00 H new ATOM 0 HB2 LEU B 8 2.943 -1.849 1.950 1.00 0.00 H new ATOM 0 HB3 LEU B 8 3.431 -0.457 1.005 1.00 0.00 H new ATOM 0 HG LEU B 8 0.633 -1.128 1.958 1.00 0.00 H new ATOM 0 HD11 LEU B 8 0.854 0.994 3.195 1.00 0.00 H new ATOM 0 HD12 LEU B 8 2.108 -0.179 3.665 1.00 0.00 H new ATOM 0 HD13 LEU B 8 2.515 1.173 2.581 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -0.071 0.985 0.908 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.550 1.167 0.198 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.511 -0.191 -0.295 1.00 0.00 H new ATOM 928 N THR B 9 3.934 -3.862 -0.058 1.00 0.00 N ATOM 929 CA THR B 9 5.139 -4.614 -0.386 1.00 0.00 C ATOM 930 C THR B 9 5.215 -4.905 -1.884 1.00 0.00 C ATOM 931 O THR B 9 6.211 -4.588 -2.534 1.00 0.00 O ATOM 932 CB THR B 9 5.198 -5.945 0.390 1.00 0.00 C ATOM 933 OG1 THR B 9 5.150 -5.692 1.798 1.00 0.00 O ATOM 934 CG2 THR B 9 6.468 -6.715 0.053 1.00 0.00 C ATOM 0 H THR B 9 3.287 -4.350 0.561 1.00 0.00 H new ATOM 0 HA THR B 9 5.988 -3.995 -0.096 1.00 0.00 H new ATOM 0 HB THR B 9 4.338 -6.548 0.098 1.00 0.00 H new ATOM 0 HG1 THR B 9 5.186 -6.542 2.285 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.486 -7.650 0.613 1.00 0.00 H new ATOM 0 HG22 THR B 9 6.490 -6.931 -1.015 1.00 0.00 H new ATOM 0 HG23 THR B 9 7.338 -6.116 0.320 1.00 0.00 H new ATOM 942 N GLY B 10 4.158 -5.508 -2.427 1.00 0.00 N ATOM 943 CA GLY B 10 4.133 -5.825 -3.845 1.00 0.00 C ATOM 944 C GLY B 10 3.098 -6.879 -4.198 1.00 0.00 C ATOM 945 O GLY B 10 2.458 -6.800 -5.246 1.00 0.00 O ATOM 0 H GLY B 10 3.322 -5.782 -1.911 1.00 0.00 H new ATOM 0 HA2 GLY B 10 3.927 -4.917 -4.411 1.00 0.00 H new ATOM 0 HA3 GLY B 10 5.119 -6.175 -4.151 1.00 0.00 H new ATOM 949 N LYS B 11 2.949 -7.872 -3.325 1.00 0.00 N ATOM 950 CA LYS B 11 2.000 -8.962 -3.543 1.00 0.00 C ATOM 951 C LYS B 11 0.598 -8.446 -3.855 1.00 0.00 C ATOM 952 O LYS B 11 0.098 -7.539 -3.196 1.00 0.00 O ATOM 953 CB LYS B 11 1.948 -9.866 -2.308 1.00 0.00 C ATOM 954 CG LYS B 11 0.881 -10.946 -2.387 1.00 0.00 C ATOM 955 CD LYS B 11 0.849 -11.795 -1.127 1.00 0.00 C ATOM 956 CE LYS B 11 2.122 -12.609 -0.972 1.00 0.00 C ATOM 957 NZ LYS B 11 2.117 -13.420 0.276 1.00 0.00 N ATOM 0 H LYS B 11 3.476 -7.945 -2.455 1.00 0.00 H new ATOM 0 HA LYS B 11 2.349 -9.529 -4.406 1.00 0.00 H new ATOM 0 HB2 LYS B 11 2.921 -10.338 -2.173 1.00 0.00 H new ATOM 0 HB3 LYS B 11 1.766 -9.252 -1.426 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.094 -10.484 -2.540 1.00 0.00 H new ATOM 0 HG3 LYS B 11 1.071 -11.583 -3.251 1.00 0.00 H new ATOM 0 HD2 LYS B 11 0.719 -11.152 -0.257 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.011 -12.464 -1.160 1.00 0.00 H new ATOM 0 HE2 LYS B 11 2.238 -13.268 -1.832 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.982 -11.939 -0.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 3.003 -13.960 0.343 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 2.033 -12.790 1.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 1.312 -14.078 0.259 1.00 0.00 H new ATOM 971 N THR B 12 -0.036 -9.047 -4.858 1.00 0.00 N ATOM 972 CA THR B 12 -1.387 -8.667 -5.256 1.00 0.00 C ATOM 973 C THR B 12 -2.345 -9.843 -5.097 1.00 0.00 C ATOM 974 O THR B 12 -2.563 -10.610 -6.036 1.00 0.00 O ATOM 975 CB THR B 12 -1.432 -8.177 -6.716 1.00 0.00 C ATOM 976 OG1 THR B 12 -0.908 -9.185 -7.589 1.00 0.00 O ATOM 977 CG2 THR B 12 -0.639 -6.891 -6.883 1.00 0.00 C ATOM 0 H THR B 12 0.367 -9.803 -5.412 1.00 0.00 H new ATOM 0 HA THR B 12 -1.695 -7.850 -4.603 1.00 0.00 H new ATOM 0 HB THR B 12 -2.472 -7.978 -6.975 1.00 0.00 H new ATOM 0 HG1 THR B 12 -1.299 -10.053 -7.358 1.00 0.00 H new ATOM 0 HG21 THR B 12 -0.687 -6.566 -7.922 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.061 -6.117 -6.242 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.400 -7.066 -6.605 1.00 0.00 H new ATOM 985 N ILE B 13 -2.909 -9.988 -3.900 1.00 0.00 N ATOM 986 CA ILE B 13 -3.835 -11.082 -3.625 1.00 0.00 C ATOM 987 C ILE B 13 -5.204 -10.815 -4.245 1.00 0.00 C ATOM 988 O ILE B 13 -5.882 -9.859 -3.877 1.00 0.00 O ATOM 989 CB ILE B 13 -4.002 -11.300 -2.107 1.00 0.00 C ATOM 990 CG1 ILE B 13 -2.634 -11.508 -1.450 1.00 0.00 C ATOM 991 CG2 ILE B 13 -4.917 -12.488 -1.841 1.00 0.00 C ATOM 992 CD1 ILE B 13 -2.695 -11.681 0.053 1.00 0.00 C ATOM 0 H ILE B 13 -2.742 -9.365 -3.110 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.410 -11.981 -4.072 1.00 0.00 H new ATOM 0 HB ILE B 13 -4.461 -10.413 -1.671 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.161 -12.387 -1.888 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.997 -10.655 -1.682 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.026 -12.630 -0.766 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.895 -12.300 -2.283 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.486 -13.386 -2.284 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.688 -11.823 0.444 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.137 -10.793 0.504 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.304 -12.552 0.295 1.00 0.00 H new ATOM 1004 N THR B 14 -5.607 -11.665 -5.184 1.00 0.00 N ATOM 1005 CA THR B 14 -6.898 -11.510 -5.845 1.00 0.00 C ATOM 1006 C THR B 14 -8.018 -12.141 -5.025 1.00 0.00 C ATOM 1007 O THR B 14 -7.932 -13.306 -4.633 1.00 0.00 O ATOM 1008 CB THR B 14 -6.892 -12.136 -7.253 1.00 0.00 C ATOM 1009 OG1 THR B 14 -5.882 -11.515 -8.058 1.00 0.00 O ATOM 1010 CG2 THR B 14 -8.249 -11.979 -7.927 1.00 0.00 C ATOM 0 H THR B 14 -5.061 -12.465 -5.503 1.00 0.00 H new ATOM 0 HA THR B 14 -7.077 -10.438 -5.934 1.00 0.00 H new ATOM 0 HB THR B 14 -6.678 -13.200 -7.151 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.882 -11.918 -8.951 1.00 0.00 H new ATOM 0 HG21 THR B 14 -8.217 -12.429 -8.919 1.00 0.00 H new ATOM 0 HG22 THR B 14 -9.012 -12.475 -7.328 1.00 0.00 H new ATOM 0 HG23 THR B 14 -8.490 -10.920 -8.017 1.00 0.00 H new ATOM 1018 N LEU B 15 -9.073 -11.370 -4.781 1.00 0.00 N ATOM 1019 CA LEU B 15 -10.217 -11.859 -4.020 1.00 0.00 C ATOM 1020 C LEU B 15 -11.476 -11.849 -4.863 1.00 0.00 C ATOM 1021 O LEU B 15 -11.708 -10.935 -5.651 1.00 0.00 O ATOM 1022 CB LEU B 15 -10.452 -11.019 -2.761 1.00 0.00 C ATOM 1023 CG LEU B 15 -9.568 -11.365 -1.558 1.00 0.00 C ATOM 1024 CD1 LEU B 15 -9.831 -12.789 -1.092 1.00 0.00 C ATOM 1025 CD2 LEU B 15 -8.096 -11.180 -1.895 1.00 0.00 C ATOM 0 H LEU B 15 -9.159 -10.405 -5.099 1.00 0.00 H new ATOM 0 HA LEU B 15 -9.987 -12.883 -3.725 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -10.298 -9.970 -3.012 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.496 -11.126 -2.465 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.820 -10.683 -0.746 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -9.194 -13.016 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -10.877 -12.890 -0.802 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -9.611 -13.484 -1.903 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.489 -11.432 -1.025 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.828 -11.833 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -7.915 -10.143 -2.176 1.00 0.00 H new ATOM 1037 N GLU B 16 -12.295 -12.863 -4.668 1.00 0.00 N ATOM 1038 CA GLU B 16 -13.555 -12.972 -5.382 1.00 0.00 C ATOM 1039 C GLU B 16 -14.609 -12.166 -4.641 1.00 0.00 C ATOM 1040 O GLU B 16 -14.821 -12.370 -3.447 1.00 0.00 O ATOM 1041 CB GLU B 16 -13.983 -14.436 -5.500 1.00 0.00 C ATOM 1042 CG GLU B 16 -15.240 -14.641 -6.330 1.00 0.00 C ATOM 1043 CD GLU B 16 -15.617 -16.103 -6.465 1.00 0.00 C ATOM 1044 OE1 GLU B 16 -15.872 -16.750 -5.428 1.00 0.00 O ATOM 1045 OE2 GLU B 16 -15.653 -16.603 -7.610 1.00 0.00 O ATOM 0 H GLU B 16 -12.111 -13.627 -4.018 1.00 0.00 H new ATOM 0 HA GLU B 16 -13.437 -12.579 -6.392 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.168 -15.009 -5.943 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -14.149 -14.838 -4.501 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -16.066 -14.097 -5.872 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.089 -14.215 -7.322 1.00 0.00 H new ATOM 1052 N VAL B 17 -15.254 -11.235 -5.330 1.00 0.00 N ATOM 1053 CA VAL B 17 -16.254 -10.403 -4.683 1.00 0.00 C ATOM 1054 C VAL B 17 -17.134 -9.688 -5.709 1.00 0.00 C ATOM 1055 O VAL B 17 -16.639 -9.114 -6.680 1.00 0.00 O ATOM 1056 CB VAL B 17 -15.568 -9.377 -3.750 1.00 0.00 C ATOM 1057 CG1 VAL B 17 -15.036 -8.177 -4.524 1.00 0.00 C ATOM 1058 CG2 VAL B 17 -16.503 -8.944 -2.639 1.00 0.00 C ATOM 0 H VAL B 17 -15.105 -11.040 -6.320 1.00 0.00 H new ATOM 0 HA VAL B 17 -16.899 -11.050 -4.088 1.00 0.00 H new ATOM 0 HB VAL B 17 -14.710 -9.872 -3.294 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -14.562 -7.480 -3.833 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -14.305 -8.513 -5.259 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -15.860 -7.678 -5.034 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -15.996 -8.223 -1.998 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -17.392 -8.484 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -16.794 -9.813 -2.049 1.00 0.00 H new ATOM 1068 N GLU B 18 -18.446 -9.741 -5.491 1.00 0.00 N ATOM 1069 CA GLU B 18 -19.402 -9.109 -6.395 1.00 0.00 C ATOM 1070 C GLU B 18 -19.624 -7.653 -6.018 1.00 0.00 C ATOM 1071 O GLU B 18 -19.579 -7.296 -4.840 1.00 0.00 O ATOM 1072 CB GLU B 18 -20.742 -9.844 -6.362 1.00 0.00 C ATOM 1073 CG GLU B 18 -20.611 -11.348 -6.474 1.00 0.00 C ATOM 1074 CD GLU B 18 -21.954 -12.051 -6.522 1.00 0.00 C ATOM 1075 OE1 GLU B 18 -22.729 -11.916 -5.552 1.00 0.00 O ATOM 1076 OE2 GLU B 18 -22.229 -12.737 -7.528 1.00 0.00 O ATOM 0 H GLU B 18 -18.871 -10.216 -4.695 1.00 0.00 H new ATOM 0 HA GLU B 18 -18.986 -9.159 -7.401 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -21.258 -9.601 -5.433 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -21.367 -9.480 -7.178 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -20.045 -11.593 -7.373 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -20.039 -11.723 -5.625 1.00 0.00 H new ATOM 1083 N SER B 19 -19.881 -6.818 -7.017 1.00 0.00 N ATOM 1084 CA SER B 19 -20.129 -5.404 -6.775 1.00 0.00 C ATOM 1085 C SER B 19 -21.541 -5.193 -6.229 1.00 0.00 C ATOM 1086 O SER B 19 -22.156 -4.150 -6.454 1.00 0.00 O ATOM 1087 CB SER B 19 -19.933 -4.603 -8.065 1.00 0.00 C ATOM 1088 OG SER B 19 -20.141 -3.218 -7.847 1.00 0.00 O ATOM 0 H SER B 19 -19.923 -7.095 -7.998 1.00 0.00 H new ATOM 0 HA SER B 19 -19.415 -5.050 -6.031 1.00 0.00 H new ATOM 0 HB2 SER B 19 -18.925 -4.766 -8.447 1.00 0.00 H new ATOM 0 HB3 SER B 19 -20.625 -4.961 -8.827 1.00 0.00 H new ATOM 0 HG SER B 19 -20.715 -3.093 -7.062 1.00 0.00 H new ATOM 1094 N SER B 20 -22.048 -6.191 -5.505 1.00 0.00 N ATOM 1095 CA SER B 20 -23.384 -6.111 -4.923 1.00 0.00 C ATOM 1096 C SER B 20 -23.329 -6.354 -3.419 1.00 0.00 C ATOM 1097 O SER B 20 -24.159 -5.843 -2.667 1.00 0.00 O ATOM 1098 CB SER B 20 -24.319 -7.129 -5.581 1.00 0.00 C ATOM 1099 OG SER B 20 -23.842 -8.450 -5.407 1.00 0.00 O ATOM 0 H SER B 20 -21.554 -7.061 -5.309 1.00 0.00 H new ATOM 0 HA SER B 20 -23.772 -5.109 -5.103 1.00 0.00 H new ATOM 0 HB2 SER B 20 -25.317 -7.041 -5.152 1.00 0.00 H new ATOM 0 HB3 SER B 20 -24.409 -6.909 -6.645 1.00 0.00 H new ATOM 0 HG SER B 20 -24.459 -9.080 -5.835 1.00 0.00 H new ATOM 1105 N ASP B 21 -22.345 -7.143 -2.995 1.00 0.00 N ATOM 1106 CA ASP B 21 -22.166 -7.466 -1.584 1.00 0.00 C ATOM 1107 C ASP B 21 -21.903 -6.205 -0.758 1.00 0.00 C ATOM 1108 O ASP B 21 -22.777 -5.349 -0.624 1.00 0.00 O ATOM 1109 CB ASP B 21 -21.020 -8.470 -1.414 1.00 0.00 C ATOM 1110 CG ASP B 21 -21.280 -9.773 -2.145 1.00 0.00 C ATOM 1111 OD1 ASP B 21 -22.286 -10.440 -1.828 1.00 0.00 O ATOM 1112 OD2 ASP B 21 -20.477 -10.125 -3.034 1.00 0.00 O ATOM 0 H ASP B 21 -21.656 -7.572 -3.613 1.00 0.00 H new ATOM 0 HA ASP B 21 -23.088 -7.918 -1.218 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -20.095 -8.027 -1.784 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -20.874 -8.674 -0.353 1.00 0.00 H new ATOM 1117 N THR B 22 -20.699 -6.097 -0.196 1.00 0.00 N ATOM 1118 CA THR B 22 -20.342 -4.942 0.620 1.00 0.00 C ATOM 1119 C THR B 22 -18.853 -4.933 0.944 1.00 0.00 C ATOM 1120 O THR B 22 -18.239 -5.987 1.111 1.00 0.00 O ATOM 1121 CB THR B 22 -21.139 -4.920 1.938 1.00 0.00 C ATOM 1122 OG1 THR B 22 -20.725 -3.810 2.743 1.00 0.00 O ATOM 1123 CG2 THR B 22 -20.942 -6.213 2.715 1.00 0.00 C ATOM 0 H THR B 22 -19.959 -6.793 -0.291 1.00 0.00 H new ATOM 0 HA THR B 22 -20.589 -4.056 0.036 1.00 0.00 H new ATOM 0 HB THR B 22 -22.196 -4.819 1.693 1.00 0.00 H new ATOM 0 HG1 THR B 22 -20.595 -3.023 2.173 1.00 0.00 H new ATOM 0 HG21 THR B 22 -21.515 -6.172 3.641 1.00 0.00 H new ATOM 0 HG22 THR B 22 -21.285 -7.055 2.113 1.00 0.00 H new ATOM 0 HG23 THR B 22 -19.885 -6.340 2.948 1.00 0.00 H new ATOM 1131 N ILE B 23 -18.280 -3.734 1.034 1.00 0.00 N ATOM 1132 CA ILE B 23 -16.863 -3.585 1.343 1.00 0.00 C ATOM 1133 C ILE B 23 -16.504 -4.383 2.592 1.00 0.00 C ATOM 1134 O ILE B 23 -15.449 -5.022 2.656 1.00 0.00 O ATOM 1135 CB ILE B 23 -16.487 -2.106 1.566 1.00 0.00 C ATOM 1136 CG1 ILE B 23 -16.929 -1.251 0.371 1.00 0.00 C ATOM 1137 CG2 ILE B 23 -14.990 -1.968 1.800 1.00 0.00 C ATOM 1138 CD1 ILE B 23 -16.311 -1.671 -0.948 1.00 0.00 C ATOM 0 H ILE B 23 -18.777 -2.854 0.897 1.00 0.00 H new ATOM 0 HA ILE B 23 -16.303 -3.964 0.488 1.00 0.00 H new ATOM 0 HB ILE B 23 -17.008 -1.747 2.453 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -18.014 -1.300 0.284 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -16.671 -0.210 0.567 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -14.741 -0.918 1.956 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -14.705 -2.543 2.681 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -14.450 -2.344 0.931 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -16.673 -1.019 -1.743 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -15.226 -1.595 -0.882 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -16.590 -2.701 -1.169 1.00 0.00 H new ATOM 1150 N ASP B 24 -17.398 -4.350 3.578 1.00 0.00 N ATOM 1151 CA ASP B 24 -17.192 -5.077 4.823 1.00 0.00 C ATOM 1152 C ASP B 24 -16.950 -6.552 4.529 1.00 0.00 C ATOM 1153 O ASP B 24 -16.074 -7.182 5.123 1.00 0.00 O ATOM 1154 CB ASP B 24 -18.408 -4.917 5.739 1.00 0.00 C ATOM 1155 CG ASP B 24 -18.226 -5.598 7.084 1.00 0.00 C ATOM 1156 OD1 ASP B 24 -17.133 -6.153 7.331 1.00 0.00 O ATOM 1157 OD2 ASP B 24 -19.176 -5.572 7.894 1.00 0.00 O ATOM 0 H ASP B 24 -18.272 -3.826 3.536 1.00 0.00 H new ATOM 0 HA ASP B 24 -16.318 -4.667 5.329 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -18.601 -3.856 5.897 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -19.287 -5.330 5.244 1.00 0.00 H new ATOM 1162 N ASN B 25 -17.732 -7.093 3.598 1.00 0.00 N ATOM 1163 CA ASN B 25 -17.605 -8.490 3.209 1.00 0.00 C ATOM 1164 C ASN B 25 -16.227 -8.758 2.616 1.00 0.00 C ATOM 1165 O ASN B 25 -15.610 -9.785 2.900 1.00 0.00 O ATOM 1166 CB ASN B 25 -18.694 -8.865 2.201 1.00 0.00 C ATOM 1167 CG ASN B 25 -18.609 -10.316 1.765 1.00 0.00 C ATOM 1168 OD1 ASN B 25 -17.618 -10.742 1.170 1.00 0.00 O ATOM 1169 ND2 ASN B 25 -19.649 -11.084 2.062 1.00 0.00 N ATOM 0 H ASN B 25 -18.461 -6.582 3.100 1.00 0.00 H new ATOM 0 HA ASN B 25 -17.726 -9.105 4.101 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -19.673 -8.679 2.643 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -18.611 -8.221 1.326 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -19.648 -12.069 1.796 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -20.449 -10.690 2.556 1.00 0.00 H new ATOM 1176 N VAL B 26 -15.748 -7.828 1.792 1.00 0.00 N ATOM 1177 CA VAL B 26 -14.438 -7.968 1.166 1.00 0.00 C ATOM 1178 C VAL B 26 -13.362 -8.145 2.230 1.00 0.00 C ATOM 1179 O VAL B 26 -12.543 -9.063 2.158 1.00 0.00 O ATOM 1180 CB VAL B 26 -14.092 -6.744 0.293 1.00 0.00 C ATOM 1181 CG1 VAL B 26 -12.782 -6.967 -0.447 1.00 0.00 C ATOM 1182 CG2 VAL B 26 -15.222 -6.448 -0.683 1.00 0.00 C ATOM 0 H VAL B 26 -16.246 -6.973 1.544 1.00 0.00 H new ATOM 0 HA VAL B 26 -14.475 -8.849 0.526 1.00 0.00 H new ATOM 0 HB VAL B 26 -13.970 -5.879 0.945 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -12.555 -6.093 -1.057 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -11.979 -7.125 0.273 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -12.871 -7.844 -1.088 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -14.960 -5.582 -1.290 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -15.379 -7.311 -1.330 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -16.137 -6.239 -0.128 1.00 0.00 H new ATOM 1192 N LYS B 27 -13.385 -7.268 3.230 1.00 0.00 N ATOM 1193 CA LYS B 27 -12.426 -7.338 4.323 1.00 0.00 C ATOM 1194 C LYS B 27 -12.594 -8.651 5.078 1.00 0.00 C ATOM 1195 O LYS B 27 -11.614 -9.273 5.488 1.00 0.00 O ATOM 1196 CB LYS B 27 -12.602 -6.153 5.274 1.00 0.00 C ATOM 1197 CG LYS B 27 -12.318 -4.809 4.624 1.00 0.00 C ATOM 1198 CD LYS B 27 -12.461 -3.669 5.618 1.00 0.00 C ATOM 1199 CE LYS B 27 -12.170 -2.325 4.970 1.00 0.00 C ATOM 1200 NZ LYS B 27 -12.337 -1.199 5.930 1.00 0.00 N ATOM 0 H LYS B 27 -14.056 -6.503 3.304 1.00 0.00 H new ATOM 0 HA LYS B 27 -11.420 -7.294 3.906 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -13.622 -6.154 5.658 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -11.939 -6.282 6.129 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -11.309 -4.809 4.211 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -13.003 -4.655 3.791 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -13.471 -3.666 6.027 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -11.780 -3.826 6.454 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -11.152 -2.322 4.581 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -12.837 -2.180 4.120 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -11.795 -0.376 5.598 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -13.344 -0.946 5.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -11.990 -1.487 6.867 1.00 0.00 H new ATOM 1214 N SER B 28 -13.846 -9.073 5.242 1.00 0.00 N ATOM 1215 CA SER B 28 -14.146 -10.322 5.928 1.00 0.00 C ATOM 1216 C SER B 28 -13.445 -11.477 5.227 1.00 0.00 C ATOM 1217 O SER B 28 -12.862 -12.350 5.871 1.00 0.00 O ATOM 1218 CB SER B 28 -15.655 -10.566 5.963 1.00 0.00 C ATOM 1219 OG SER B 28 -16.329 -9.501 6.612 1.00 0.00 O ATOM 0 H SER B 28 -14.666 -8.567 4.909 1.00 0.00 H new ATOM 0 HA SER B 28 -13.784 -10.253 6.954 1.00 0.00 H new ATOM 0 HB2 SER B 28 -16.033 -10.674 4.946 1.00 0.00 H new ATOM 0 HB3 SER B 28 -15.863 -11.502 6.481 1.00 0.00 H new ATOM 0 HG SER B 28 -16.289 -8.698 6.051 1.00 0.00 H new ATOM 1225 N LYS B 29 -13.489 -11.459 3.897 1.00 0.00 N ATOM 1226 CA LYS B 29 -12.842 -12.489 3.101 1.00 0.00 C ATOM 1227 C LYS B 29 -11.340 -12.457 3.348 1.00 0.00 C ATOM 1228 O LYS B 29 -10.700 -13.499 3.498 1.00 0.00 O ATOM 1229 CB LYS B 29 -13.136 -12.292 1.612 1.00 0.00 C ATOM 1230 CG LYS B 29 -14.619 -12.304 1.278 1.00 0.00 C ATOM 1231 CD LYS B 29 -14.868 -12.362 -0.224 1.00 0.00 C ATOM 1232 CE LYS B 29 -14.478 -13.710 -0.817 1.00 0.00 C ATOM 1233 NZ LYS B 29 -13.007 -13.939 -0.786 1.00 0.00 N ATOM 0 H LYS B 29 -13.967 -10.741 3.352 1.00 0.00 H new ATOM 0 HA LYS B 29 -13.237 -13.460 3.399 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -12.707 -11.344 1.288 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -12.638 -13.078 1.045 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.091 -13.162 1.757 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -15.090 -11.411 1.689 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.922 -12.170 -0.424 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -14.301 -11.572 -0.716 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -14.979 -14.505 -0.265 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -14.830 -13.766 -1.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -12.696 -14.319 -1.702 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.519 -13.039 -0.601 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.777 -14.619 -0.033 1.00 0.00 H new ATOM 1247 N ILE B 30 -10.788 -11.246 3.409 1.00 0.00 N ATOM 1248 CA ILE B 30 -9.364 -11.068 3.659 1.00 0.00 C ATOM 1249 C ILE B 30 -8.981 -11.711 4.989 1.00 0.00 C ATOM 1250 O ILE B 30 -7.899 -12.278 5.130 1.00 0.00 O ATOM 1251 CB ILE B 30 -8.972 -9.576 3.675 1.00 0.00 C ATOM 1252 CG1 ILE B 30 -9.353 -8.918 2.346 1.00 0.00 C ATOM 1253 CG2 ILE B 30 -7.481 -9.422 3.941 1.00 0.00 C ATOM 1254 CD1 ILE B 30 -9.062 -7.432 2.297 1.00 0.00 C ATOM 0 H ILE B 30 -11.307 -10.376 3.288 1.00 0.00 H new ATOM 0 HA ILE B 30 -8.823 -11.553 2.846 1.00 0.00 H new ATOM 0 HB ILE B 30 -9.516 -9.078 4.478 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -8.813 -9.412 1.538 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -10.416 -9.077 2.163 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -7.220 -8.364 3.949 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -7.236 -9.863 4.907 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -6.917 -9.928 3.157 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -9.358 -7.035 1.326 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -9.623 -6.925 3.082 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -7.995 -7.265 2.448 1.00 0.00 H new ATOM 1266 N GLN B 31 -9.886 -11.623 5.958 1.00 0.00 N ATOM 1267 CA GLN B 31 -9.670 -12.201 7.275 1.00 0.00 C ATOM 1268 C GLN B 31 -9.579 -13.714 7.184 1.00 0.00 C ATOM 1269 O GLN B 31 -8.665 -14.333 7.717 1.00 0.00 O ATOM 1270 CB GLN B 31 -10.834 -11.828 8.186 1.00 0.00 C ATOM 1271 CG GLN B 31 -10.998 -10.338 8.379 1.00 0.00 C ATOM 1272 CD GLN B 31 -9.958 -9.742 9.312 1.00 0.00 C ATOM 1273 OE1 GLN B 31 -9.938 -8.534 9.544 1.00 0.00 O ATOM 1274 NE2 GLN B 31 -9.089 -10.589 9.862 1.00 0.00 N ATOM 0 H GLN B 31 -10.784 -11.151 5.852 1.00 0.00 H new ATOM 0 HA GLN B 31 -8.735 -11.812 7.679 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -11.755 -12.236 7.770 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -10.688 -12.298 9.159 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -10.935 -9.843 7.410 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -11.993 -10.136 8.776 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -9.139 -11.584 9.644 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -8.374 -10.242 10.501 1.00 0.00 H new ATOM 1283 N ASP B 32 -10.557 -14.297 6.515 1.00 0.00 N ATOM 1284 CA ASP B 32 -10.631 -15.739 6.354 1.00 0.00 C ATOM 1285 C ASP B 32 -9.361 -16.305 5.715 1.00 0.00 C ATOM 1286 O ASP B 32 -8.861 -17.348 6.134 1.00 0.00 O ATOM 1287 CB ASP B 32 -11.850 -16.083 5.504 1.00 0.00 C ATOM 1288 CG ASP B 32 -12.193 -17.561 5.543 1.00 0.00 C ATOM 1289 OD1 ASP B 32 -11.488 -18.318 6.246 1.00 0.00 O ATOM 1290 OD2 ASP B 32 -13.167 -17.961 4.872 1.00 0.00 O ATOM 0 H ASP B 32 -11.320 -13.787 6.069 1.00 0.00 H new ATOM 0 HA ASP B 32 -10.724 -16.193 7.341 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -12.706 -15.506 5.854 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -11.664 -15.784 4.472 1.00 0.00 H new ATOM 1295 N LYS B 33 -8.858 -15.622 4.692 1.00 0.00 N ATOM 1296 CA LYS B 33 -7.659 -16.071 3.986 1.00 0.00 C ATOM 1297 C LYS B 33 -6.370 -15.631 4.688 1.00 0.00 C ATOM 1298 O LYS B 33 -5.560 -16.465 5.095 1.00 0.00 O ATOM 1299 CB LYS B 33 -7.676 -15.540 2.550 1.00 0.00 C ATOM 1300 CG LYS B 33 -6.464 -15.944 1.725 1.00 0.00 C ATOM 1301 CD LYS B 33 -6.558 -15.407 0.304 1.00 0.00 C ATOM 1302 CE LYS B 33 -5.314 -15.744 -0.505 1.00 0.00 C ATOM 1303 NZ LYS B 33 -5.102 -17.213 -0.617 1.00 0.00 N ATOM 0 H LYS B 33 -9.260 -14.756 4.332 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.671 -17.161 3.982 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.577 -15.898 2.052 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.738 -14.452 2.577 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -5.557 -15.568 2.199 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.384 -17.031 1.701 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -7.436 -15.826 -0.187 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -6.693 -14.326 0.331 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.403 -15.314 -1.502 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.442 -15.287 -0.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.339 -17.403 -1.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -4.841 -17.598 0.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -5.979 -17.666 -0.945 1.00 0.00 H new ATOM 1317 N GLU B 34 -6.177 -14.321 4.803 1.00 0.00 N ATOM 1318 CA GLU B 34 -4.973 -13.765 5.425 1.00 0.00 C ATOM 1319 C GLU B 34 -5.031 -13.790 6.953 1.00 0.00 C ATOM 1320 O GLU B 34 -4.035 -14.101 7.608 1.00 0.00 O ATOM 1321 CB GLU B 34 -4.747 -12.333 4.940 1.00 0.00 C ATOM 1322 CG GLU B 34 -4.488 -12.237 3.446 1.00 0.00 C ATOM 1323 CD GLU B 34 -3.241 -12.988 3.022 1.00 0.00 C ATOM 1324 OE1 GLU B 34 -2.145 -12.639 3.509 1.00 0.00 O ATOM 1325 OE2 GLU B 34 -3.360 -13.925 2.205 1.00 0.00 O ATOM 0 H GLU B 34 -6.840 -13.619 4.473 1.00 0.00 H new ATOM 0 HA GLU B 34 -4.139 -14.399 5.124 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.620 -11.730 5.190 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -3.900 -11.905 5.477 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -5.348 -12.633 2.906 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -4.390 -11.189 3.164 1.00 0.00 H new ATOM 1332 N GLY B 35 -6.184 -13.449 7.519 1.00 0.00 N ATOM 1333 CA GLY B 35 -6.316 -13.431 8.967 1.00 0.00 C ATOM 1334 C GLY B 35 -5.570 -12.272 9.598 1.00 0.00 C ATOM 1335 O GLY B 35 -4.880 -12.443 10.604 1.00 0.00 O ATOM 0 H GLY B 35 -7.026 -13.186 7.006 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -7.371 -13.369 9.233 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -5.939 -14.369 9.376 1.00 0.00 H new ATOM 1339 N ILE B 36 -5.709 -11.091 9.003 1.00 0.00 N ATOM 1340 CA ILE B 36 -5.046 -9.895 9.509 1.00 0.00 C ATOM 1341 C ILE B 36 -6.013 -9.042 10.328 1.00 0.00 C ATOM 1342 O ILE B 36 -7.144 -8.805 9.905 1.00 0.00 O ATOM 1343 CB ILE B 36 -4.469 -9.046 8.356 1.00 0.00 C ATOM 1344 CG1 ILE B 36 -3.503 -9.880 7.506 1.00 0.00 C ATOM 1345 CG2 ILE B 36 -3.773 -7.805 8.899 1.00 0.00 C ATOM 1346 CD1 ILE B 36 -2.332 -10.446 8.284 1.00 0.00 C ATOM 0 H ILE B 36 -6.276 -10.937 8.169 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.227 -10.225 10.148 1.00 0.00 H new ATOM 0 HB ILE B 36 -5.294 -8.723 7.721 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.054 -10.702 7.049 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -3.122 -9.261 6.694 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.373 -7.220 8.071 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.489 -7.201 9.457 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.958 -8.104 9.558 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -1.695 -11.023 7.614 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.756 -9.630 8.719 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.702 -11.093 9.079 1.00 0.00 H new ATOM 1358 N PRO B 37 -5.582 -8.563 11.513 1.00 0.00 N ATOM 1359 CA PRO B 37 -6.426 -7.735 12.381 1.00 0.00 C ATOM 1360 C PRO B 37 -7.121 -6.614 11.608 1.00 0.00 C ATOM 1361 O PRO B 37 -6.496 -5.929 10.802 1.00 0.00 O ATOM 1362 CB PRO B 37 -5.430 -7.160 13.387 1.00 0.00 C ATOM 1363 CG PRO B 37 -4.354 -8.185 13.472 1.00 0.00 C ATOM 1364 CD PRO B 37 -4.246 -8.793 12.099 1.00 0.00 C ATOM 0 HA PRO B 37 -7.234 -8.305 12.840 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -5.038 -6.199 13.053 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -5.897 -6.993 14.358 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.409 -7.734 13.774 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -4.597 -8.944 14.216 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.462 -8.317 11.510 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.007 -9.855 12.148 1.00 0.00 H new ATOM 1372 N PRO B 38 -8.434 -6.421 11.839 1.00 0.00 N ATOM 1373 CA PRO B 38 -9.215 -5.385 11.150 1.00 0.00 C ATOM 1374 C PRO B 38 -8.636 -3.988 11.341 1.00 0.00 C ATOM 1375 O PRO B 38 -8.518 -3.220 10.386 1.00 0.00 O ATOM 1376 CB PRO B 38 -10.596 -5.480 11.804 1.00 0.00 C ATOM 1377 CG PRO B 38 -10.663 -6.858 12.362 1.00 0.00 C ATOM 1378 CD PRO B 38 -9.262 -7.199 12.778 1.00 0.00 C ATOM 0 HA PRO B 38 -9.225 -5.543 10.071 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -10.715 -4.731 12.587 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -11.390 -5.309 11.077 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -11.345 -6.903 13.211 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -11.033 -7.564 11.618 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -9.069 -6.918 13.813 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.067 -8.268 12.697 1.00 0.00 H new ATOM 1386 N ASP B 39 -8.283 -3.663 12.579 1.00 0.00 N ATOM 1387 CA ASP B 39 -7.723 -2.354 12.895 1.00 0.00 C ATOM 1388 C ASP B 39 -6.421 -2.114 12.136 1.00 0.00 C ATOM 1389 O ASP B 39 -6.194 -1.027 11.606 1.00 0.00 O ATOM 1390 CB ASP B 39 -7.480 -2.231 14.400 1.00 0.00 C ATOM 1391 CG ASP B 39 -8.756 -2.385 15.204 1.00 0.00 C ATOM 1392 OD1 ASP B 39 -9.687 -1.579 14.997 1.00 0.00 O ATOM 1393 OD2 ASP B 39 -8.825 -3.312 16.037 1.00 0.00 O ATOM 0 H ASP B 39 -8.374 -4.287 13.380 1.00 0.00 H new ATOM 0 HA ASP B 39 -8.444 -1.597 12.585 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -6.762 -2.989 14.713 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -7.033 -1.261 14.615 1.00 0.00 H new ATOM 1398 N GLN B 40 -5.569 -3.133 12.096 1.00 0.00 N ATOM 1399 CA GLN B 40 -4.284 -3.029 11.411 1.00 0.00 C ATOM 1400 C GLN B 40 -4.467 -2.888 9.901 1.00 0.00 C ATOM 1401 O GLN B 40 -4.050 -1.894 9.308 1.00 0.00 O ATOM 1402 CB GLN B 40 -3.423 -4.256 11.717 1.00 0.00 C ATOM 1403 CG GLN B 40 -2.063 -4.232 11.037 1.00 0.00 C ATOM 1404 CD GLN B 40 -1.238 -5.467 11.342 1.00 0.00 C ATOM 1405 OE1 GLN B 40 -1.639 -6.589 11.029 1.00 0.00 O ATOM 1406 NE2 GLN B 40 -0.079 -5.269 11.960 1.00 0.00 N ATOM 0 H GLN B 40 -5.744 -4.040 12.529 1.00 0.00 H new ATOM 0 HA GLN B 40 -3.782 -2.133 11.777 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -3.279 -4.329 12.795 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -3.959 -5.152 11.406 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -2.201 -4.149 9.959 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.516 -3.345 11.358 1.00 0.00 H new ATOM 0 HE21 GLN B 40 0.215 -4.323 12.201 1.00 0.00 H new ATOM 0 HE22 GLN B 40 0.517 -6.063 12.193 1.00 0.00 H new ATOM 1415 N GLN B 41 -5.085 -3.890 9.283 1.00 0.00 N ATOM 1416 CA GLN B 41 -5.309 -3.873 7.842 1.00 0.00 C ATOM 1417 C GLN B 41 -6.225 -2.722 7.444 1.00 0.00 C ATOM 1418 O GLN B 41 -7.217 -2.442 8.117 1.00 0.00 O ATOM 1419 CB GLN B 41 -5.913 -5.200 7.375 1.00 0.00 C ATOM 1420 CG GLN B 41 -7.328 -5.438 7.877 1.00 0.00 C ATOM 1421 CD GLN B 41 -7.937 -6.731 7.360 1.00 0.00 C ATOM 1422 OE1 GLN B 41 -9.101 -7.026 7.625 1.00 0.00 O ATOM 1423 NE2 GLN B 41 -7.154 -7.512 6.621 1.00 0.00 N ATOM 0 H GLN B 41 -5.439 -4.722 9.756 1.00 0.00 H new ATOM 0 HA GLN B 41 -4.343 -3.732 7.358 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -5.915 -5.225 6.285 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -5.275 -6.018 7.711 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -7.322 -5.457 8.967 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -7.959 -4.601 7.577 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -6.194 -7.231 6.424 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -7.514 -8.392 6.251 1.00 0.00 H new ATOM 1432 N ARG B 42 -5.887 -2.059 6.343 1.00 0.00 N ATOM 1433 CA ARG B 42 -6.681 -0.939 5.850 1.00 0.00 C ATOM 1434 C ARG B 42 -6.661 -0.891 4.326 1.00 0.00 C ATOM 1435 O ARG B 42 -5.654 -0.522 3.720 1.00 0.00 O ATOM 1436 CB ARG B 42 -6.148 0.378 6.416 1.00 0.00 C ATOM 1437 CG ARG B 42 -6.281 0.497 7.926 1.00 0.00 C ATOM 1438 CD ARG B 42 -5.702 1.808 8.432 1.00 0.00 C ATOM 1439 NE ARG B 42 -5.819 1.937 9.883 1.00 0.00 N ATOM 1440 CZ ARG B 42 -5.370 2.985 10.568 1.00 0.00 C ATOM 1441 NH1 ARG B 42 -4.777 3.990 9.938 1.00 0.00 N ATOM 1442 NH2 ARG B 42 -5.515 3.028 11.886 1.00 0.00 N ATOM 0 H ARG B 42 -5.069 -2.278 5.775 1.00 0.00 H new ATOM 0 HA ARG B 42 -7.710 -1.081 6.181 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -5.097 0.480 6.144 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -6.681 1.206 5.948 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -7.332 0.429 8.207 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -5.769 -0.338 8.405 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -4.652 1.875 8.146 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -6.217 2.640 7.952 1.00 0.00 H new ATOM 0 HE ARG B 42 -6.270 1.182 10.399 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -4.664 3.961 8.925 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -4.434 4.792 10.467 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -5.971 2.257 12.374 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -5.171 3.832 12.411 1.00 0.00 H new ATOM 1456 N LEU B 43 -7.783 -1.261 3.711 1.00 0.00 N ATOM 1457 CA LEU B 43 -7.895 -1.253 2.257 1.00 0.00 C ATOM 1458 C LEU B 43 -8.057 0.174 1.740 1.00 0.00 C ATOM 1459 O LEU B 43 -9.045 0.842 2.040 1.00 0.00 O ATOM 1460 CB LEU B 43 -9.080 -2.115 1.799 1.00 0.00 C ATOM 1461 CG LEU B 43 -8.934 -3.625 2.022 1.00 0.00 C ATOM 1462 CD1 LEU B 43 -7.688 -4.154 1.327 1.00 0.00 C ATOM 1463 CD2 LEU B 43 -8.902 -3.949 3.505 1.00 0.00 C ATOM 0 H LEU B 43 -8.625 -1.569 4.197 1.00 0.00 H new ATOM 0 HA LEU B 43 -6.978 -1.674 1.845 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.975 -1.775 2.320 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -9.244 -1.938 0.736 1.00 0.00 H new ATOM 0 HG LEU B 43 -9.802 -4.119 1.585 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -7.604 -5.227 1.498 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.759 -3.962 0.256 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -6.807 -3.652 1.728 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -8.798 -5.026 3.640 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.057 -3.442 3.970 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.828 -3.613 3.971 1.00 0.00 H new ATOM 1475 N ILE B 44 -7.079 0.634 0.965 1.00 0.00 N ATOM 1476 CA ILE B 44 -7.111 1.985 0.411 1.00 0.00 C ATOM 1477 C ILE B 44 -7.483 1.980 -1.068 1.00 0.00 C ATOM 1478 O ILE B 44 -7.079 1.094 -1.823 1.00 0.00 O ATOM 1479 CB ILE B 44 -5.758 2.703 0.597 1.00 0.00 C ATOM 1480 CG1 ILE B 44 -5.488 2.941 2.082 1.00 0.00 C ATOM 1481 CG2 ILE B 44 -5.743 4.026 -0.159 1.00 0.00 C ATOM 1482 CD1 ILE B 44 -4.073 3.377 2.374 1.00 0.00 C ATOM 0 H ILE B 44 -6.255 0.092 0.706 1.00 0.00 H new ATOM 0 HA ILE B 44 -7.879 2.528 0.962 1.00 0.00 H new ATOM 0 HB ILE B 44 -4.971 2.066 0.192 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -6.177 3.700 2.451 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -5.698 2.024 2.633 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.780 4.517 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -5.900 3.840 -1.221 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -6.538 4.669 0.218 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -3.953 3.528 3.447 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.378 2.608 2.035 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.865 4.310 1.851 1.00 0.00 H new ATOM 1494 N PHE B 45 -8.253 2.987 -1.465 1.00 0.00 N ATOM 1495 CA PHE B 45 -8.695 3.134 -2.844 1.00 0.00 C ATOM 1496 C PHE B 45 -9.126 4.575 -3.098 1.00 0.00 C ATOM 1497 O PHE B 45 -9.669 5.232 -2.211 1.00 0.00 O ATOM 1498 CB PHE B 45 -9.850 2.173 -3.142 1.00 0.00 C ATOM 1499 CG PHE B 45 -10.350 2.243 -4.558 1.00 0.00 C ATOM 1500 CD1 PHE B 45 -9.476 2.100 -5.626 1.00 0.00 C ATOM 1501 CD2 PHE B 45 -11.694 2.452 -4.822 1.00 0.00 C ATOM 1502 CE1 PHE B 45 -9.936 2.165 -6.928 1.00 0.00 C ATOM 1503 CE2 PHE B 45 -12.159 2.518 -6.121 1.00 0.00 C ATOM 1504 CZ PHE B 45 -11.278 2.375 -7.176 1.00 0.00 C ATOM 0 H PHE B 45 -8.587 3.722 -0.841 1.00 0.00 H new ATOM 0 HA PHE B 45 -7.866 2.889 -3.508 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -9.525 1.154 -2.932 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -10.675 2.391 -2.464 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -8.425 1.936 -5.438 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -12.387 2.565 -4.001 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -9.246 2.052 -7.751 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -13.209 2.681 -6.312 1.00 0.00 H new ATOM 0 HZ PHE B 45 -11.638 2.427 -8.193 1.00 0.00 H new ATOM 1514 N ALA B 46 -8.863 5.069 -4.302 1.00 0.00 N ATOM 1515 CA ALA B 46 -9.210 6.440 -4.655 1.00 0.00 C ATOM 1516 C ALA B 46 -8.586 7.421 -3.668 1.00 0.00 C ATOM 1517 O ALA B 46 -9.168 8.457 -3.344 1.00 0.00 O ATOM 1518 CB ALA B 46 -10.722 6.613 -4.701 1.00 0.00 C ATOM 0 H ALA B 46 -8.411 4.542 -5.049 1.00 0.00 H new ATOM 0 HA ALA B 46 -8.811 6.652 -5.647 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -10.963 7.643 -4.966 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -11.143 5.939 -5.447 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -11.145 6.382 -3.723 1.00 0.00 H new ATOM 1524 N GLY B 47 -7.389 7.082 -3.204 1.00 0.00 N ATOM 1525 CA GLY B 47 -6.674 7.926 -2.266 1.00 0.00 C ATOM 1526 C GLY B 47 -7.294 7.964 -0.879 1.00 0.00 C ATOM 1527 O GLY B 47 -7.144 8.954 -0.162 1.00 0.00 O ATOM 0 H GLY B 47 -6.897 6.228 -3.465 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -5.646 7.573 -2.185 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -6.632 8.940 -2.663 1.00 0.00 H new ATOM 1531 N LYS B 48 -7.974 6.886 -0.484 1.00 0.00 N ATOM 1532 CA LYS B 48 -8.587 6.825 0.844 1.00 0.00 C ATOM 1533 C LYS B 48 -9.162 5.444 1.142 1.00 0.00 C ATOM 1534 O LYS B 48 -9.780 4.814 0.286 1.00 0.00 O ATOM 1535 CB LYS B 48 -9.676 7.888 0.992 1.00 0.00 C ATOM 1536 CG LYS B 48 -10.403 7.829 2.327 1.00 0.00 C ATOM 1537 CD LYS B 48 -11.300 9.039 2.534 1.00 0.00 C ATOM 1538 CE LYS B 48 -12.428 9.086 1.514 1.00 0.00 C ATOM 1539 NZ LYS B 48 -13.313 7.893 1.608 1.00 0.00 N ATOM 0 H LYS B 48 -8.113 6.053 -1.056 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.797 7.023 1.568 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.228 8.875 0.874 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -10.401 7.769 0.187 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -11.002 6.920 2.375 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.674 7.774 3.136 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.720 9.013 3.540 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.705 9.949 2.461 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -13.019 9.989 1.668 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.007 9.147 0.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -14.189 8.068 1.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.824 7.066 1.210 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -13.545 7.711 2.605 1.00 0.00 H new ATOM 1553 N GLN B 49 -8.957 4.985 2.374 1.00 0.00 N ATOM 1554 CA GLN B 49 -9.455 3.684 2.805 1.00 0.00 C ATOM 1555 C GLN B 49 -10.970 3.607 2.648 1.00 0.00 C ATOM 1556 O GLN B 49 -11.700 4.468 3.140 1.00 0.00 O ATOM 1557 CB GLN B 49 -9.069 3.431 4.264 1.00 0.00 C ATOM 1558 CG GLN B 49 -9.577 2.105 4.810 1.00 0.00 C ATOM 1559 CD GLN B 49 -9.260 1.906 6.284 1.00 0.00 C ATOM 1560 OE1 GLN B 49 -8.618 2.894 6.902 1.00 0.00 O flip ATOM 1561 NE2 GLN B 49 -9.592 0.872 6.863 1.00 0.00 N flip ATOM 0 H GLN B 49 -8.447 5.498 3.093 1.00 0.00 H new ATOM 0 HA GLN B 49 -9.002 2.918 2.176 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -7.983 3.458 4.353 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -9.460 4.241 4.880 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -10.656 2.049 4.666 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -9.136 1.290 4.236 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -10.083 0.137 6.354 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -9.376 0.750 7.852 1.00 0.00 H new ATOM 1570 N LEU B 50 -11.439 2.568 1.963 1.00 0.00 N ATOM 1571 CA LEU B 50 -12.870 2.383 1.747 1.00 0.00 C ATOM 1572 C LEU B 50 -13.556 1.955 3.039 1.00 0.00 C ATOM 1573 O LEU B 50 -13.152 0.980 3.673 1.00 0.00 O ATOM 1574 CB LEU B 50 -13.111 1.337 0.654 1.00 0.00 C ATOM 1575 CG LEU B 50 -12.339 1.568 -0.648 1.00 0.00 C ATOM 1576 CD1 LEU B 50 -12.673 0.487 -1.666 1.00 0.00 C ATOM 1577 CD2 LEU B 50 -12.641 2.946 -1.216 1.00 0.00 C ATOM 0 H LEU B 50 -10.851 1.844 1.549 1.00 0.00 H new ATOM 0 HA LEU B 50 -13.295 3.334 1.426 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -12.845 0.356 1.047 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -14.177 1.311 0.427 1.00 0.00 H new ATOM 0 HG LEU B 50 -11.273 1.516 -0.426 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -12.115 0.668 -2.585 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -12.402 -0.489 -1.263 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -13.742 0.507 -1.880 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -12.082 3.089 -2.141 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -13.708 3.029 -1.421 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -12.349 3.709 -0.494 1.00 0.00 H new ATOM 1589 N GLU B 51 -14.593 2.689 3.426 1.00 0.00 N ATOM 1590 CA GLU B 51 -15.333 2.382 4.646 1.00 0.00 C ATOM 1591 C GLU B 51 -16.080 1.059 4.509 1.00 0.00 C ATOM 1592 O GLU B 51 -16.846 0.864 3.565 1.00 0.00 O ATOM 1593 CB GLU B 51 -16.316 3.509 4.969 1.00 0.00 C ATOM 1594 CG GLU B 51 -15.648 4.858 5.182 1.00 0.00 C ATOM 1595 CD GLU B 51 -16.642 5.956 5.504 1.00 0.00 C ATOM 1596 OE1 GLU B 51 -17.534 6.214 4.668 1.00 0.00 O ATOM 1597 OE2 GLU B 51 -16.530 6.560 6.591 1.00 0.00 O ATOM 0 H GLU B 51 -14.941 3.500 2.914 1.00 0.00 H new ATOM 0 HA GLU B 51 -14.618 2.291 5.463 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.037 3.595 4.156 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -16.876 3.245 5.866 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -14.926 4.777 5.994 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -15.091 5.129 4.285 1.00 0.00 H new ATOM 1604 N ASP B 52 -15.856 0.156 5.459 1.00 0.00 N ATOM 1605 CA ASP B 52 -16.513 -1.146 5.443 1.00 0.00 C ATOM 1606 C ASP B 52 -18.008 -1.000 5.707 1.00 0.00 C ATOM 1607 O ASP B 52 -18.418 -0.303 6.634 1.00 0.00 O ATOM 1608 CB ASP B 52 -15.882 -2.074 6.485 1.00 0.00 C ATOM 1609 CG ASP B 52 -15.986 -1.522 7.894 1.00 0.00 C ATOM 1610 OD1 ASP B 52 -15.447 -0.423 8.144 1.00 0.00 O ATOM 1611 OD2 ASP B 52 -16.603 -2.191 8.749 1.00 0.00 O ATOM 0 H ASP B 52 -15.226 0.302 6.248 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.378 -1.584 4.454 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -16.370 -3.048 6.443 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -14.833 -2.233 6.237 1.00 0.00 H new ATOM 1616 N GLY B 53 -18.820 -1.659 4.883 1.00 0.00 N ATOM 1617 CA GLY B 53 -20.260 -1.583 5.047 1.00 0.00 C ATOM 1618 C GLY B 53 -20.964 -1.124 3.784 1.00 0.00 C ATOM 1619 O GLY B 53 -22.073 -1.568 3.489 1.00 0.00 O ATOM 0 H GLY B 53 -18.506 -2.242 4.107 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -20.642 -2.562 5.337 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -20.494 -0.896 5.860 1.00 0.00 H new ATOM 1623 N ARG B 54 -20.317 -0.228 3.043 1.00 0.00 N ATOM 1624 CA ARG B 54 -20.884 0.302 1.806 1.00 0.00 C ATOM 1625 C ARG B 54 -20.979 -0.782 0.729 1.00 0.00 C ATOM 1626 O ARG B 54 -21.310 -1.930 1.021 1.00 0.00 O ATOM 1627 CB ARG B 54 -20.037 1.473 1.303 1.00 0.00 C ATOM 1628 CG ARG B 54 -19.971 2.643 2.272 1.00 0.00 C ATOM 1629 CD ARG B 54 -21.347 3.236 2.531 1.00 0.00 C ATOM 1630 NE ARG B 54 -21.287 4.382 3.436 1.00 0.00 N ATOM 1631 CZ ARG B 54 -20.664 5.522 3.148 1.00 0.00 C ATOM 1632 NH1 ARG B 54 -20.063 5.677 1.975 1.00 0.00 N ATOM 1633 NH2 ARG B 54 -20.645 6.509 4.033 1.00 0.00 N ATOM 0 H ARG B 54 -19.398 0.147 3.278 1.00 0.00 H new ATOM 0 HA ARG B 54 -21.894 0.653 2.018 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -19.025 1.119 1.106 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -20.443 1.822 0.354 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -19.534 2.311 3.214 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -19.313 3.413 1.869 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -21.793 3.544 1.585 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -21.997 2.472 2.956 1.00 0.00 H new ATOM 0 HE ARG B 54 -21.750 4.303 4.342 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -20.078 4.921 1.291 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -19.586 6.552 1.758 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -21.108 6.394 4.935 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -20.167 7.383 3.812 1.00 0.00 H new ATOM 1647 N THR B 55 -20.689 -0.410 -0.519 1.00 0.00 N ATOM 1648 CA THR B 55 -20.745 -1.349 -1.636 1.00 0.00 C ATOM 1649 C THR B 55 -19.743 -0.972 -2.723 1.00 0.00 C ATOM 1650 O THR B 55 -19.465 0.207 -2.943 1.00 0.00 O ATOM 1651 CB THR B 55 -22.152 -1.407 -2.266 1.00 0.00 C ATOM 1652 OG1 THR B 55 -22.565 -0.097 -2.670 1.00 0.00 O ATOM 1653 CG2 THR B 55 -23.166 -1.988 -1.292 1.00 0.00 C ATOM 0 H THR B 55 -20.413 0.537 -0.780 1.00 0.00 H new ATOM 0 HA THR B 55 -20.496 -2.328 -1.227 1.00 0.00 H new ATOM 0 HB THR B 55 -22.103 -2.057 -3.139 1.00 0.00 H new ATOM 0 HG1 THR B 55 -23.458 -0.145 -3.070 1.00 0.00 H new ATOM 0 HG21 THR B 55 -24.148 -2.017 -1.763 1.00 0.00 H new ATOM 0 HG22 THR B 55 -22.867 -2.999 -1.015 1.00 0.00 H new ATOM 0 HG23 THR B 55 -23.210 -1.365 -0.398 1.00 0.00 H new ATOM 1661 N LEU B 56 -19.205 -1.985 -3.396 1.00 0.00 N ATOM 1662 CA LEU B 56 -18.232 -1.771 -4.464 1.00 0.00 C ATOM 1663 C LEU B 56 -18.768 -0.787 -5.502 1.00 0.00 C ATOM 1664 O LEU B 56 -18.054 0.109 -5.949 1.00 0.00 O ATOM 1665 CB LEU B 56 -17.890 -3.100 -5.142 1.00 0.00 C ATOM 1666 CG LEU B 56 -17.203 -4.138 -4.251 1.00 0.00 C ATOM 1667 CD1 LEU B 56 -17.142 -5.482 -4.955 1.00 0.00 C ATOM 1668 CD2 LEU B 56 -15.804 -3.676 -3.877 1.00 0.00 C ATOM 0 H LEU B 56 -19.427 -2.965 -3.220 1.00 0.00 H new ATOM 0 HA LEU B 56 -17.330 -1.350 -4.019 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -18.809 -3.535 -5.534 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -17.245 -2.896 -5.996 1.00 0.00 H new ATOM 0 HG LEU B 56 -17.788 -4.249 -3.338 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -16.651 -6.209 -4.309 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -18.153 -5.821 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -16.578 -5.382 -5.882 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -15.330 -4.426 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.212 -3.539 -4.782 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -15.865 -2.731 -3.337 1.00 0.00 H new ATOM 1680 N SER B 57 -20.029 -0.969 -5.881 1.00 0.00 N ATOM 1681 CA SER B 57 -20.668 -0.105 -6.870 1.00 0.00 C ATOM 1682 C SER B 57 -20.709 1.346 -6.398 1.00 0.00 C ATOM 1683 O SER B 57 -20.572 2.271 -7.199 1.00 0.00 O ATOM 1684 CB SER B 57 -22.087 -0.595 -7.162 1.00 0.00 C ATOM 1685 OG SER B 57 -22.722 0.224 -8.128 1.00 0.00 O ATOM 0 H SER B 57 -20.630 -1.708 -5.518 1.00 0.00 H new ATOM 0 HA SER B 57 -20.074 -0.149 -7.783 1.00 0.00 H new ATOM 0 HB2 SER B 57 -22.053 -1.624 -7.519 1.00 0.00 H new ATOM 0 HB3 SER B 57 -22.671 -0.596 -6.242 1.00 0.00 H new ATOM 0 HG SER B 57 -23.627 -0.112 -8.298 1.00 0.00 H new ATOM 1691 N ASP B 58 -20.915 1.537 -5.097 1.00 0.00 N ATOM 1692 CA ASP B 58 -20.992 2.876 -4.519 1.00 0.00 C ATOM 1693 C ASP B 58 -19.763 3.713 -4.872 1.00 0.00 C ATOM 1694 O ASP B 58 -19.890 4.820 -5.397 1.00 0.00 O ATOM 1695 CB ASP B 58 -21.138 2.787 -2.999 1.00 0.00 C ATOM 1696 CG ASP B 58 -21.259 4.150 -2.346 1.00 0.00 C ATOM 1697 OD1 ASP B 58 -22.227 4.874 -2.660 1.00 0.00 O ATOM 1698 OD2 ASP B 58 -20.387 4.493 -1.521 1.00 0.00 O ATOM 0 H ASP B 58 -21.032 0.781 -4.423 1.00 0.00 H new ATOM 0 HA ASP B 58 -21.868 3.368 -4.941 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -22.018 2.192 -2.756 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -20.276 2.264 -2.584 1.00 0.00 H new ATOM 1703 N TYR B 59 -18.577 3.184 -4.580 1.00 0.00 N ATOM 1704 CA TYR B 59 -17.336 3.897 -4.871 1.00 0.00 C ATOM 1705 C TYR B 59 -16.938 3.742 -6.338 1.00 0.00 C ATOM 1706 O TYR B 59 -15.765 3.886 -6.688 1.00 0.00 O ATOM 1707 CB TYR B 59 -16.202 3.396 -3.970 1.00 0.00 C ATOM 1708 CG TYR B 59 -16.411 3.675 -2.494 1.00 0.00 C ATOM 1709 CD1 TYR B 59 -17.469 3.106 -1.796 1.00 0.00 C ATOM 1710 CD2 TYR B 59 -15.544 4.512 -1.801 1.00 0.00 C ATOM 1711 CE1 TYR B 59 -17.655 3.360 -0.450 1.00 0.00 C ATOM 1712 CE2 TYR B 59 -15.724 4.770 -0.455 1.00 0.00 C ATOM 1713 CZ TYR B 59 -16.781 4.192 0.216 1.00 0.00 C ATOM 1714 OH TYR B 59 -16.963 4.448 1.555 1.00 0.00 O ATOM 0 H TYR B 59 -18.449 2.270 -4.145 1.00 0.00 H new ATOM 0 HA TYR B 59 -17.510 4.954 -4.671 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -16.088 2.321 -4.112 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -15.269 3.861 -4.287 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -18.157 2.454 -2.314 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -14.716 4.968 -2.323 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -18.482 2.908 0.078 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -15.040 5.421 0.069 1.00 0.00 H new ATOM 0 HH TYR B 59 -16.259 5.052 1.871 1.00 0.00 H new ATOM 1724 N ASN B 60 -17.920 3.457 -7.189 1.00 0.00 N ATOM 1725 CA ASN B 60 -17.678 3.289 -8.621 1.00 0.00 C ATOM 1726 C ASN B 60 -16.497 2.355 -8.876 1.00 0.00 C ATOM 1727 O ASN B 60 -15.735 2.549 -9.824 1.00 0.00 O ATOM 1728 CB ASN B 60 -17.418 4.647 -9.277 1.00 0.00 C ATOM 1729 CG ASN B 60 -18.597 5.590 -9.141 1.00 0.00 C ATOM 1730 OD1 ASN B 60 -19.697 5.301 -9.612 1.00 0.00 O ATOM 1731 ND2 ASN B 60 -18.372 6.728 -8.494 1.00 0.00 N ATOM 0 H ASN B 60 -18.894 3.337 -6.912 1.00 0.00 H new ATOM 0 HA ASN B 60 -18.569 2.841 -9.061 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -16.537 5.103 -8.825 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -17.194 4.500 -10.334 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -19.127 7.403 -8.372 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -17.444 6.927 -8.120 1.00 0.00 H new ATOM 1738 N ILE B 61 -16.351 1.343 -8.027 1.00 0.00 N ATOM 1739 CA ILE B 61 -15.262 0.385 -8.169 1.00 0.00 C ATOM 1740 C ILE B 61 -15.453 -0.478 -9.412 1.00 0.00 C ATOM 1741 O ILE B 61 -16.489 -1.121 -9.582 1.00 0.00 O ATOM 1742 CB ILE B 61 -15.144 -0.521 -6.925 1.00 0.00 C ATOM 1743 CG1 ILE B 61 -14.916 0.332 -5.673 1.00 0.00 C ATOM 1744 CG2 ILE B 61 -14.013 -1.524 -7.106 1.00 0.00 C ATOM 1745 CD1 ILE B 61 -14.833 -0.471 -4.393 1.00 0.00 C ATOM 0 H ILE B 61 -16.971 1.166 -7.237 1.00 0.00 H new ATOM 0 HA ILE B 61 -14.341 0.958 -8.271 1.00 0.00 H new ATOM 0 HB ILE B 61 -16.075 -1.075 -6.802 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -13.994 0.900 -5.795 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -15.727 1.055 -5.585 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -13.942 -2.156 -6.221 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -14.213 -2.144 -7.980 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -13.073 -0.991 -7.247 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -14.671 0.202 -3.551 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -15.764 -1.018 -4.246 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -14.004 -1.176 -4.459 1.00 0.00 H new ATOM 1757 N GLN B 62 -14.447 -0.481 -10.278 1.00 0.00 N ATOM 1758 CA GLN B 62 -14.497 -1.255 -11.513 1.00 0.00 C ATOM 1759 C GLN B 62 -13.988 -2.679 -11.297 1.00 0.00 C ATOM 1760 O GLN B 62 -13.103 -2.915 -10.476 1.00 0.00 O ATOM 1761 CB GLN B 62 -13.675 -0.566 -12.603 1.00 0.00 C ATOM 1762 CG GLN B 62 -12.210 -0.389 -12.239 1.00 0.00 C ATOM 1763 CD GLN B 62 -11.418 0.303 -13.331 1.00 0.00 C ATOM 1764 OE1 GLN B 62 -11.710 1.441 -13.700 1.00 0.00 O ATOM 1765 NE2 GLN B 62 -10.410 -0.383 -13.858 1.00 0.00 N ATOM 0 H GLN B 62 -13.583 0.046 -10.147 1.00 0.00 H new ATOM 0 HA GLN B 62 -15.538 -1.311 -11.830 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -13.745 -1.148 -13.522 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -14.110 0.412 -12.811 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.135 0.190 -11.319 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -11.769 -1.365 -12.038 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -10.203 -1.324 -13.522 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -9.843 0.031 -14.598 1.00 0.00 H new ATOM 1774 N LYS B 63 -14.552 -3.619 -12.051 1.00 0.00 N ATOM 1775 CA LYS B 63 -14.161 -5.018 -11.966 1.00 0.00 C ATOM 1776 C LYS B 63 -12.652 -5.172 -12.151 1.00 0.00 C ATOM 1777 O LYS B 63 -12.043 -4.467 -12.955 1.00 0.00 O ATOM 1778 CB LYS B 63 -14.911 -5.819 -13.031 1.00 0.00 C ATOM 1779 CG LYS B 63 -14.430 -7.248 -13.173 1.00 0.00 C ATOM 1780 CD LYS B 63 -15.176 -7.979 -14.279 1.00 0.00 C ATOM 1781 CE LYS B 63 -14.628 -9.380 -14.493 1.00 0.00 C ATOM 1782 NZ LYS B 63 -14.735 -10.214 -13.265 1.00 0.00 N ATOM 0 H LYS B 63 -15.287 -3.432 -12.733 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.419 -5.398 -10.977 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -15.973 -5.826 -12.786 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -14.808 -5.314 -13.991 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -13.361 -7.254 -13.388 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -14.568 -7.775 -12.229 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -16.235 -8.037 -14.028 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -15.099 -7.412 -15.207 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -15.171 -9.861 -15.307 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -13.584 -9.318 -14.799 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.577 -11.213 -13.509 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -14.020 -9.909 -12.575 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -15.683 -10.104 -12.852 1.00 0.00 H new ATOM 1796 N GLU B 64 -12.056 -6.093 -11.395 1.00 0.00 N ATOM 1797 CA GLU B 64 -10.617 -6.335 -11.467 1.00 0.00 C ATOM 1798 C GLU B 64 -9.841 -5.083 -11.078 1.00 0.00 C ATOM 1799 O GLU B 64 -8.796 -4.782 -11.656 1.00 0.00 O ATOM 1800 CB GLU B 64 -10.214 -6.789 -12.874 1.00 0.00 C ATOM 1801 CG GLU B 64 -10.870 -8.092 -13.307 1.00 0.00 C ATOM 1802 CD GLU B 64 -10.453 -8.523 -14.701 1.00 0.00 C ATOM 1803 OE1 GLU B 64 -9.654 -7.801 -15.333 1.00 0.00 O ATOM 1804 OE2 GLU B 64 -10.927 -9.583 -15.160 1.00 0.00 O ATOM 0 H GLU B 64 -12.548 -6.684 -10.725 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.373 -7.129 -10.762 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -10.474 -6.007 -13.587 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -9.131 -6.907 -12.912 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -10.613 -8.877 -12.596 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -11.953 -7.976 -13.276 1.00 0.00 H new ATOM 1811 N SER B 65 -10.358 -4.357 -10.091 1.00 0.00 N ATOM 1812 CA SER B 65 -9.713 -3.138 -9.621 1.00 0.00 C ATOM 1813 C SER B 65 -8.453 -3.468 -8.825 1.00 0.00 C ATOM 1814 O SER B 65 -7.813 -4.495 -9.056 1.00 0.00 O ATOM 1815 CB SER B 65 -10.680 -2.325 -8.758 1.00 0.00 C ATOM 1816 OG SER B 65 -11.078 -3.056 -7.611 1.00 0.00 O ATOM 0 H SER B 65 -11.222 -4.593 -9.602 1.00 0.00 H new ATOM 0 HA SER B 65 -9.429 -2.544 -10.490 1.00 0.00 H new ATOM 0 HB2 SER B 65 -10.204 -1.393 -8.452 1.00 0.00 H new ATOM 0 HB3 SER B 65 -11.558 -2.057 -9.345 1.00 0.00 H new ATOM 0 HG SER B 65 -11.418 -2.438 -6.931 1.00 0.00 H new ATOM 1822 N THR B 66 -8.106 -2.596 -7.880 1.00 0.00 N ATOM 1823 CA THR B 66 -6.925 -2.800 -7.052 1.00 0.00 C ATOM 1824 C THR B 66 -6.990 -1.950 -5.785 1.00 0.00 C ATOM 1825 O THR B 66 -7.180 -0.735 -5.848 1.00 0.00 O ATOM 1826 CB THR B 66 -5.634 -2.454 -7.822 1.00 0.00 C ATOM 1827 OG1 THR B 66 -5.531 -3.265 -8.998 1.00 0.00 O ATOM 1828 CG2 THR B 66 -4.404 -2.665 -6.950 1.00 0.00 C ATOM 0 H THR B 66 -8.626 -1.744 -7.671 1.00 0.00 H new ATOM 0 HA THR B 66 -6.906 -3.855 -6.779 1.00 0.00 H new ATOM 0 HB THR B 66 -5.683 -1.403 -8.106 1.00 0.00 H new ATOM 0 HG1 THR B 66 -6.235 -3.947 -8.988 1.00 0.00 H new ATOM 0 HG21 THR B 66 -3.508 -2.414 -7.518 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.468 -2.025 -6.070 1.00 0.00 H new ATOM 0 HG23 THR B 66 -4.354 -3.708 -6.637 1.00 0.00 H new ATOM 1836 N LEU B 67 -6.828 -2.603 -4.640 1.00 0.00 N ATOM 1837 CA LEU B 67 -6.861 -1.922 -3.352 1.00 0.00 C ATOM 1838 C LEU B 67 -5.566 -2.169 -2.587 1.00 0.00 C ATOM 1839 O LEU B 67 -5.076 -3.298 -2.528 1.00 0.00 O ATOM 1840 CB LEU B 67 -8.055 -2.397 -2.514 1.00 0.00 C ATOM 1841 CG LEU B 67 -9.440 -2.082 -3.091 1.00 0.00 C ATOM 1842 CD1 LEU B 67 -9.717 -2.920 -4.330 1.00 0.00 C ATOM 1843 CD2 LEU B 67 -10.515 -2.312 -2.040 1.00 0.00 C ATOM 0 H LEU B 67 -6.672 -3.609 -4.578 1.00 0.00 H new ATOM 0 HA LEU B 67 -6.968 -0.853 -3.539 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -7.975 -3.476 -2.379 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -7.983 -1.946 -1.524 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.457 -1.032 -3.384 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.706 -2.677 -4.720 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.965 -2.706 -5.090 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -9.679 -3.978 -4.070 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.493 -2.084 -2.464 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -10.492 -3.353 -1.718 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -10.331 -1.664 -1.183 1.00 0.00 H new ATOM 1855 N HIS B 68 -5.011 -1.108 -2.009 1.00 0.00 N ATOM 1856 CA HIS B 68 -3.769 -1.216 -1.252 1.00 0.00 C ATOM 1857 C HIS B 68 -4.036 -1.534 0.217 1.00 0.00 C ATOM 1858 O HIS B 68 -4.439 -0.666 0.990 1.00 0.00 O ATOM 1859 CB HIS B 68 -2.954 0.069 -1.389 1.00 0.00 C ATOM 1860 CG HIS B 68 -2.451 0.307 -2.784 1.00 0.00 C ATOM 1861 ND1 HIS B 68 -1.694 1.405 -3.138 1.00 0.00 N ATOM 1862 CD2 HIS B 68 -2.595 -0.426 -3.916 1.00 0.00 C ATOM 1863 CE1 HIS B 68 -1.395 1.336 -4.423 1.00 0.00 C ATOM 1864 NE2 HIS B 68 -1.929 0.235 -4.916 1.00 0.00 N ATOM 0 H HIS B 68 -5.401 -0.166 -2.050 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.192 -2.043 -1.666 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -3.569 0.915 -1.082 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.105 0.027 -0.706 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -3.134 -1.357 -4.012 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.812 2.058 -4.976 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -1.858 -0.075 -5.885 1.00 0.00 H new ATOM 1873 N LEU B 69 -3.804 -2.792 0.590 1.00 0.00 N ATOM 1874 CA LEU B 69 -4.012 -3.246 1.962 1.00 0.00 C ATOM 1875 C LEU B 69 -2.879 -2.760 2.863 1.00 0.00 C ATOM 1876 O LEU B 69 -1.948 -3.506 3.166 1.00 0.00 O ATOM 1877 CB LEU B 69 -4.107 -4.780 1.997 1.00 0.00 C ATOM 1878 CG LEU B 69 -4.766 -5.384 3.246 1.00 0.00 C ATOM 1879 CD1 LEU B 69 -5.001 -6.873 3.047 1.00 0.00 C ATOM 1880 CD2 LEU B 69 -3.914 -5.154 4.486 1.00 0.00 C ATOM 0 H LEU B 69 -3.470 -3.518 -0.044 1.00 0.00 H new ATOM 0 HA LEU B 69 -4.947 -2.827 2.334 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.664 -5.110 1.120 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -3.101 -5.189 1.907 1.00 0.00 H new ATOM 0 HG LEU B 69 -5.724 -4.885 3.394 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -5.469 -7.290 3.939 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -5.655 -7.027 2.189 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -4.048 -7.371 2.870 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -4.407 -5.593 5.353 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -2.938 -5.620 4.349 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -3.785 -4.083 4.645 1.00 0.00 H new ATOM 1892 N VAL B 70 -2.957 -1.500 3.279 1.00 0.00 N ATOM 1893 CA VAL B 70 -1.935 -0.919 4.139 1.00 0.00 C ATOM 1894 C VAL B 70 -2.108 -1.359 5.590 1.00 0.00 C ATOM 1895 O VAL B 70 -3.214 -1.331 6.131 1.00 0.00 O ATOM 1896 CB VAL B 70 -1.950 0.619 4.068 1.00 0.00 C ATOM 1897 CG1 VAL B 70 -0.917 1.214 5.015 1.00 0.00 C ATOM 1898 CG2 VAL B 70 -1.700 1.083 2.643 1.00 0.00 C ATOM 0 H VAL B 70 -3.716 -0.864 3.035 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.975 -1.282 3.773 1.00 0.00 H new ATOM 0 HB VAL B 70 -2.934 0.968 4.379 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.946 2.302 4.948 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -1.141 0.907 6.037 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.076 0.860 4.739 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.713 2.172 2.607 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -0.728 0.721 2.308 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.479 0.689 1.990 1.00 0.00 H new ATOM 1908 N LEU B 71 -1.003 -1.759 6.211 1.00 0.00 N ATOM 1909 CA LEU B 71 -1.016 -2.200 7.601 1.00 0.00 C ATOM 1910 C LEU B 71 -0.764 -1.024 8.542 1.00 0.00 C ATOM 1911 O LEU B 71 0.090 -0.179 8.276 1.00 0.00 O ATOM 1912 CB LEU B 71 0.041 -3.285 7.835 1.00 0.00 C ATOM 1913 CG LEU B 71 -0.183 -4.603 7.085 1.00 0.00 C ATOM 1914 CD1 LEU B 71 -0.015 -4.412 5.586 1.00 0.00 C ATOM 1915 CD2 LEU B 71 0.775 -5.670 7.598 1.00 0.00 C ATOM 0 H LEU B 71 -0.083 -1.787 5.771 1.00 0.00 H new ATOM 0 HA LEU B 71 -2.001 -2.616 7.811 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.014 -2.886 7.549 1.00 0.00 H new ATOM 0 HB3 LEU B 71 0.086 -3.499 8.903 1.00 0.00 H new ATOM 0 HG LEU B 71 -1.206 -4.932 7.270 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -0.179 -5.362 5.078 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -0.739 -3.680 5.229 1.00 0.00 H new ATOM 0 HD13 LEU B 71 0.994 -4.057 5.375 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.606 -6.601 7.057 1.00 0.00 H new ATOM 0 HD22 LEU B 71 1.803 -5.342 7.442 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.603 -5.832 8.662 1.00 0.00 H new ATOM 1927 N ARG B 72 -1.508 -0.980 9.642 1.00 0.00 N ATOM 1928 CA ARG B 72 -1.356 0.092 10.621 1.00 0.00 C ATOM 1929 C ARG B 72 0.019 0.003 11.269 1.00 0.00 C ATOM 1930 O ARG B 72 0.837 0.916 11.147 1.00 0.00 O ATOM 1931 CB ARG B 72 -2.455 -0.016 11.685 1.00 0.00 C ATOM 1932 CG ARG B 72 -2.794 1.292 12.390 1.00 0.00 C ATOM 1933 CD ARG B 72 -1.746 1.682 13.420 1.00 0.00 C ATOM 1934 NE ARG B 72 -0.561 2.282 12.814 1.00 0.00 N ATOM 1935 CZ ARG B 72 0.488 2.706 13.513 1.00 0.00 C ATOM 1936 NH1 ARG B 72 0.495 2.596 14.835 1.00 0.00 N ATOM 1937 NH2 ARG B 72 1.529 3.242 12.891 1.00 0.00 N ATOM 0 H ARG B 72 -2.220 -1.671 9.878 1.00 0.00 H new ATOM 0 HA ARG B 72 -1.448 1.056 10.120 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -3.359 -0.404 11.215 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -2.146 -0.746 12.433 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -2.886 2.087 11.650 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -3.763 1.198 12.879 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -2.183 2.385 14.129 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -1.452 0.799 13.987 1.00 0.00 H new ATOM 0 HE ARG B 72 -0.536 2.381 11.799 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -0.305 2.186 15.317 1.00 0.00 H new ATOM 0 HH12 ARG B 72 1.300 2.922 15.370 1.00 0.00 H new ATOM 0 HH21 ARG B 72 1.526 3.330 11.875 1.00 0.00 H new ATOM 0 HH22 ARG B 72 2.333 3.567 13.429 1.00 0.00 H new ATOM 1951 N LEU B 73 0.271 -1.114 11.943 1.00 0.00 N ATOM 1952 CA LEU B 73 1.553 -1.338 12.600 1.00 0.00 C ATOM 1953 C LEU B 73 2.664 -1.382 11.551 1.00 0.00 C ATOM 1954 O LEU B 73 2.526 -2.044 10.522 1.00 0.00 O ATOM 1955 CB LEU B 73 1.507 -2.648 13.402 1.00 0.00 C ATOM 1956 CG LEU B 73 2.502 -2.762 14.564 1.00 0.00 C ATOM 1957 CD1 LEU B 73 3.936 -2.769 14.062 1.00 0.00 C ATOM 1958 CD2 LEU B 73 2.293 -1.631 15.562 1.00 0.00 C ATOM 0 H LEU B 73 -0.396 -1.878 12.049 1.00 0.00 H new ATOM 0 HA LEU B 73 1.758 -0.520 13.291 1.00 0.00 H new ATOM 0 HB2 LEU B 73 0.500 -2.772 13.799 1.00 0.00 H new ATOM 0 HB3 LEU B 73 1.684 -3.477 12.716 1.00 0.00 H new ATOM 0 HG LEU B 73 2.318 -3.710 15.069 1.00 0.00 H new ATOM 0 HD11 LEU B 73 4.618 -2.851 14.909 1.00 0.00 H new ATOM 0 HD12 LEU B 73 4.084 -3.618 13.394 1.00 0.00 H new ATOM 0 HD13 LEU B 73 4.137 -1.844 13.522 1.00 0.00 H new ATOM 0 HD21 LEU B 73 3.008 -1.730 16.379 1.00 0.00 H new ATOM 0 HD22 LEU B 73 2.442 -0.673 15.063 1.00 0.00 H new ATOM 0 HD23 LEU B 73 1.279 -1.679 15.960 1.00 0.00 H new ATOM 1970 N ARG B 74 3.754 -0.660 11.807 1.00 0.00 N ATOM 1971 CA ARG B 74 4.877 -0.606 10.873 1.00 0.00 C ATOM 1972 C ARG B 74 5.332 -2.005 10.465 1.00 0.00 C ATOM 1973 O ARG B 74 5.464 -2.301 9.277 1.00 0.00 O ATOM 1974 CB ARG B 74 6.043 0.168 11.492 1.00 0.00 C ATOM 1975 CG ARG B 74 5.709 1.618 11.805 1.00 0.00 C ATOM 1976 CD ARG B 74 6.896 2.348 12.413 1.00 0.00 C ATOM 1977 NE ARG B 74 8.061 2.327 11.532 1.00 0.00 N ATOM 1978 CZ ARG B 74 9.205 2.948 11.806 1.00 0.00 C ATOM 1979 NH1 ARG B 74 9.332 3.652 12.923 1.00 0.00 N ATOM 1980 NH2 ARG B 74 10.223 2.866 10.961 1.00 0.00 N ATOM 0 H ARG B 74 3.883 -0.105 12.653 1.00 0.00 H new ATOM 0 HA ARG B 74 4.540 -0.088 9.975 1.00 0.00 H new ATOM 0 HB2 ARG B 74 6.354 -0.331 12.410 1.00 0.00 H new ATOM 0 HB3 ARG B 74 6.892 0.138 10.809 1.00 0.00 H new ATOM 0 HG2 ARG B 74 5.398 2.125 10.892 1.00 0.00 H new ATOM 0 HG3 ARG B 74 4.865 1.657 12.494 1.00 0.00 H new ATOM 0 HD2 ARG B 74 6.618 3.381 12.622 1.00 0.00 H new ATOM 0 HD3 ARG B 74 7.154 1.888 13.367 1.00 0.00 H new ATOM 0 HE ARG B 74 7.993 1.807 10.657 1.00 0.00 H new ATOM 0 HH11 ARG B 74 8.551 3.719 13.575 1.00 0.00 H new ATOM 0 HH12 ARG B 74 10.211 4.127 13.129 1.00 0.00 H new ATOM 0 HH21 ARG B 74 10.129 2.327 10.100 1.00 0.00 H new ATOM 0 HH22 ARG B 74 11.100 3.342 11.171 1.00 0.00 H new ATOM 1994 N GLY B 75 5.568 -2.863 11.452 1.00 0.00 N ATOM 1995 CA GLY B 75 6.001 -4.219 11.172 1.00 0.00 C ATOM 1996 C GLY B 75 7.419 -4.280 10.640 1.00 0.00 C ATOM 1997 O GLY B 75 7.807 -3.479 9.790 1.00 0.00 O ATOM 0 H GLY B 75 5.467 -2.643 12.443 1.00 0.00 H new ATOM 0 HA2 GLY B 75 5.933 -4.814 12.083 1.00 0.00 H new ATOM 0 HA3 GLY B 75 5.325 -4.670 10.446 1.00 0.00 H new ATOM 2001 N GLY B 76 8.194 -5.233 11.145 1.00 0.00 N ATOM 2002 CA GLY B 76 9.570 -5.380 10.708 1.00 0.00 C ATOM 2003 C GLY B 76 10.272 -6.544 11.377 1.00 0.00 C ATOM 2004 O GLY B 76 11.354 -6.328 11.963 1.00 0.00 O ATOM 2005 OXT GLY B 76 9.741 -7.673 11.318 1.00 0.00 O ATOM 0 H GLY B 76 7.894 -5.907 11.850 1.00 0.00 H new ATOM 0 HA2 GLY B 76 9.591 -5.520 9.627 1.00 0.00 H new ATOM 0 HA3 GLY B 76 10.115 -4.461 10.921 1.00 0.00 H new TER 2009 GLY B 76