USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 768 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 75 ASN : amide:sc= 0.307 K(o=1.5,f=-1.5!) USER MOD Set 1.2: A 77 LYS NZ :NH3+ 168:sc= 1.2 (180deg=0.949) USER MOD Set 2.1: A 2 ASN : amide:sc= 0.351 K(o=0.31,f=-5.9!) USER MOD Set 2.2: A 3 ASN : amide:sc= -0.0408 K(o=0.31,f=-2.1!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN :FLIP amide:sc= -0.201 F(o=-1.5,f=-0.2) USER MOD Single : A 14 LYS NZ :NH3+ 167:sc= 1.19 (180deg=1.04) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -2.01 K(o=-2,f=-4.7!) USER MOD Single : A 28 SER OG : rot 170:sc= -0.0755 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -0.0173 K(o=-0.017,f=-4.6!) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00101 USER MOD Single : A 42 THR OG1 : rot 142:sc= 0.381 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 152:sc= 1.25 (180deg=1.13) USER MOD Single : A 45 LYS NZ :NH3+ -127:sc= 1.12 (180deg=-0.111) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -100:sc= 1.21 USER MOD Single : A 53 SER OG : rot -170:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot -176:sc= 1.21 USER MOD Single : A 57 MET CE :methyl -146:sc= -0.0655 (180deg=-3.08) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 73:sc= 1.26 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -100:sc= -0.783 USER MOD Single : A 83 SER OG : rot 160:sc= -0.242 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 68:sc= 0.302 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc=-0.00777 X(o=-0.0078,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 108:sc= 1.13 USER MOD Single : A 106 THR OG1 : rot -170:sc= 0.286 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.606 -17.165 8.728 1.00 0.00 N ATOM 2 CA MET A 1 10.610 -16.333 8.051 1.00 0.00 C ATOM 3 C MET A 1 10.007 -14.970 7.766 1.00 0.00 C ATOM 4 O MET A 1 10.503 -13.980 8.304 1.00 0.00 O ATOM 5 CB MET A 1 11.205 -16.994 6.795 1.00 0.00 C ATOM 6 CG MET A 1 12.108 -18.167 7.192 1.00 0.00 C ATOM 7 SD MET A 1 13.247 -18.772 5.923 1.00 0.00 S ATOM 8 CE MET A 1 12.104 -19.696 4.868 1.00 0.00 C ATOM 0 H1 MET A 1 10.010 -18.102 8.928 1.00 0.00 H new ATOM 0 H2 MET A 1 9.324 -16.712 9.621 1.00 0.00 H new ATOM 0 H3 MET A 1 8.772 -17.271 8.115 1.00 0.00 H new ATOM 0 HA MET A 1 11.463 -16.213 8.719 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.403 -17.346 6.146 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.777 -16.261 6.226 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.693 -17.868 8.062 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.473 -18.996 7.504 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.652 -20.134 4.034 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.633 -20.489 5.449 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.337 -19.023 4.485 1.00 0.00 H new ATOM 16 N ASN A 2 8.935 -14.905 6.972 1.00 0.00 N ATOM 17 CA ASN A 2 8.174 -13.689 6.719 1.00 0.00 C ATOM 18 C ASN A 2 6.720 -13.921 7.143 1.00 0.00 C ATOM 19 O ASN A 2 6.320 -15.060 7.403 1.00 0.00 O ATOM 20 CB ASN A 2 8.290 -13.355 5.223 1.00 0.00 C ATOM 21 CG ASN A 2 8.108 -11.880 4.892 1.00 0.00 C ATOM 22 OD1 ASN A 2 7.654 -11.089 5.714 1.00 0.00 O ATOM 23 ND2 ASN A 2 8.489 -11.499 3.688 1.00 0.00 N ATOM 0 H ASN A 2 8.567 -15.718 6.478 1.00 0.00 H new ATOM 0 HA ASN A 2 8.559 -12.846 7.292 1.00 0.00 H new ATOM 0 HB2 ASN A 2 9.268 -13.677 4.866 1.00 0.00 H new ATOM 0 HB3 ASN A 2 7.545 -13.932 4.675 1.00 0.00 H new ATOM 0 HD21 ASN A 2 8.411 -10.519 3.415 1.00 0.00 H new ATOM 0 HD22 ASN A 2 8.862 -12.184 3.030 1.00 0.00 H new ATOM 29 N ASN A 3 5.920 -12.859 7.177 1.00 0.00 N ATOM 30 CA ASN A 3 4.484 -12.868 7.464 1.00 0.00 C ATOM 31 C ASN A 3 3.736 -12.152 6.339 1.00 0.00 C ATOM 32 O ASN A 3 2.820 -11.372 6.575 1.00 0.00 O ATOM 33 CB ASN A 3 4.183 -12.295 8.863 1.00 0.00 C ATOM 34 CG ASN A 3 4.509 -10.815 9.073 1.00 0.00 C ATOM 35 OD1 ASN A 3 5.414 -10.250 8.465 1.00 0.00 O ATOM 36 ND2 ASN A 3 3.832 -10.177 10.016 1.00 0.00 N ATOM 0 H ASN A 3 6.272 -11.919 6.996 1.00 0.00 H new ATOM 0 HA ASN A 3 4.124 -13.896 7.493 1.00 0.00 H new ATOM 0 HB2 ASN A 3 3.124 -12.446 9.074 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.740 -12.876 9.598 1.00 0.00 H new ATOM 0 HD21 ASN A 3 4.061 -9.209 10.242 1.00 0.00 H new ATOM 0 HD22 ASN A 3 3.082 -10.654 10.516 1.00 0.00 H new ATOM 42 N LEU A 4 4.173 -12.393 5.101 1.00 0.00 N ATOM 43 CA LEU A 4 3.750 -11.698 3.894 1.00 0.00 C ATOM 44 C LEU A 4 2.261 -11.927 3.627 1.00 0.00 C ATOM 45 O LEU A 4 1.875 -13.079 3.400 1.00 0.00 O ATOM 46 CB LEU A 4 4.614 -12.220 2.733 1.00 0.00 C ATOM 47 CG LEU A 4 4.589 -11.333 1.486 1.00 0.00 C ATOM 48 CD1 LEU A 4 5.357 -10.040 1.788 1.00 0.00 C ATOM 49 CD2 LEU A 4 5.198 -12.111 0.303 1.00 0.00 C ATOM 0 H LEU A 4 4.867 -13.116 4.909 1.00 0.00 H new ATOM 0 HA LEU A 4 3.885 -10.622 4.005 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.644 -12.317 3.076 1.00 0.00 H new ATOM 0 HB3 LEU A 4 4.273 -13.219 2.462 1.00 0.00 H new ATOM 0 HG LEU A 4 3.569 -11.063 1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 4 5.348 -9.397 0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.883 -9.521 2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 4 6.387 -10.281 2.050 1.00 0.00 H new ATOM 0 HD21 LEU A 4 5.184 -11.486 -0.590 1.00 0.00 H new ATOM 0 HD22 LEU A 4 6.227 -12.384 0.538 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.615 -13.014 0.123 1.00 0.00 H new ATOM 60 N LYS A 5 1.448 -10.860 3.674 1.00 0.00 N ATOM 61 CA LYS A 5 -0.015 -10.793 3.536 1.00 0.00 C ATOM 62 C LYS A 5 -0.474 -9.444 4.039 1.00 0.00 C ATOM 63 O LYS A 5 0.344 -8.593 4.372 1.00 0.00 O ATOM 64 CB LYS A 5 -0.732 -11.967 4.246 1.00 0.00 C ATOM 65 CG LYS A 5 -1.348 -12.894 3.189 1.00 0.00 C ATOM 66 CD LYS A 5 -1.316 -14.363 3.593 1.00 0.00 C ATOM 67 CE LYS A 5 -2.367 -15.119 2.788 1.00 0.00 C ATOM 68 NZ LYS A 5 -2.251 -16.565 3.006 1.00 0.00 N ATOM 0 H LYS A 5 1.838 -9.930 3.825 1.00 0.00 H new ATOM 0 HA LYS A 5 -0.285 -10.898 2.485 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.025 -12.520 4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -1.508 -11.587 4.910 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.381 -12.595 3.009 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -0.812 -12.770 2.248 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -0.327 -14.783 3.410 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -1.513 -14.465 4.660 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.363 -14.782 3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.249 -14.896 1.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.976 -17.059 2.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.307 -16.886 2.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.387 -16.776 4.015 1.00 0.00 H new ATOM 78 N LEU A 6 -1.770 -9.181 4.019 1.00 0.00 N ATOM 79 CA LEU A 6 -2.403 -8.015 4.578 1.00 0.00 C ATOM 80 C LEU A 6 -3.486 -8.477 5.545 1.00 0.00 C ATOM 81 O LEU A 6 -3.899 -9.634 5.540 1.00 0.00 O ATOM 82 CB LEU A 6 -2.956 -7.073 3.503 1.00 0.00 C ATOM 83 CG LEU A 6 -3.226 -7.624 2.096 1.00 0.00 C ATOM 84 CD1 LEU A 6 -4.334 -8.682 2.191 1.00 0.00 C ATOM 85 CD2 LEU A 6 -3.608 -6.525 1.110 1.00 0.00 C ATOM 0 H LEU A 6 -2.440 -9.816 3.586 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.658 -7.427 5.114 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -3.891 -6.658 3.879 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.257 -6.243 3.402 1.00 0.00 H new ATOM 0 HG LEU A 6 -2.309 -8.073 1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -4.539 -9.084 1.199 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -4.012 -9.488 2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.239 -8.226 2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.789 -6.963 0.129 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -4.512 -6.024 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.796 -5.801 1.040 1.00 0.00 H new ATOM 96 N ASP A 7 -3.941 -7.534 6.364 1.00 0.00 N ATOM 97 CA ASP A 7 -4.473 -7.768 7.695 1.00 0.00 C ATOM 98 C ASP A 7 -5.918 -7.292 7.768 1.00 0.00 C ATOM 99 O ASP A 7 -6.760 -7.958 8.363 1.00 0.00 O ATOM 100 CB ASP A 7 -3.636 -6.951 8.702 1.00 0.00 C ATOM 101 CG ASP A 7 -3.277 -7.661 9.996 1.00 0.00 C ATOM 102 OD1 ASP A 7 -3.418 -8.894 10.105 1.00 0.00 O ATOM 103 OD2 ASP A 7 -2.799 -6.932 10.896 1.00 0.00 O ATOM 0 H ASP A 7 -3.948 -6.548 6.105 1.00 0.00 H new ATOM 0 HA ASP A 7 -4.430 -8.833 7.924 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -2.713 -6.642 8.211 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -4.185 -6.042 8.949 1.00 0.00 H new ATOM 107 N ILE A 8 -6.154 -6.149 7.108 1.00 0.00 N ATOM 108 CA ILE A 8 -7.412 -5.514 6.741 1.00 0.00 C ATOM 109 C ILE A 8 -8.267 -5.059 7.938 1.00 0.00 C ATOM 110 O ILE A 8 -8.577 -5.805 8.862 1.00 0.00 O ATOM 111 CB ILE A 8 -8.169 -6.400 5.737 1.00 0.00 C ATOM 112 CG1 ILE A 8 -7.311 -6.845 4.534 1.00 0.00 C ATOM 113 CG2 ILE A 8 -9.388 -5.606 5.229 1.00 0.00 C ATOM 114 CD1 ILE A 8 -8.080 -7.724 3.530 1.00 0.00 C ATOM 0 H ILE A 8 -5.367 -5.587 6.783 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.171 -4.573 6.246 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.461 -7.313 6.256 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -6.934 -5.962 4.019 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.444 -7.396 4.899 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -9.944 -6.212 4.514 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.034 -5.353 6.070 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.049 -4.691 4.743 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.419 -8.002 2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -8.434 -8.625 4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -8.932 -7.168 3.138 1.00 0.00 H new ATOM 125 N VAL A 9 -8.659 -3.784 7.901 1.00 0.00 N ATOM 126 CA VAL A 9 -9.375 -3.049 8.925 1.00 0.00 C ATOM 127 C VAL A 9 -10.333 -2.098 8.205 1.00 0.00 C ATOM 128 O VAL A 9 -10.012 -0.956 7.903 1.00 0.00 O ATOM 129 CB VAL A 9 -8.360 -2.403 9.902 1.00 0.00 C ATOM 130 CG1 VAL A 9 -9.081 -1.633 11.018 1.00 0.00 C ATOM 131 CG2 VAL A 9 -7.396 -3.410 10.554 1.00 0.00 C ATOM 0 H VAL A 9 -8.465 -3.200 7.087 1.00 0.00 H new ATOM 0 HA VAL A 9 -9.991 -3.676 9.570 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.769 -1.727 9.285 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -8.345 -1.190 11.689 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -9.693 -0.845 10.579 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -9.718 -2.317 11.579 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.717 -2.882 11.224 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -7.967 -4.145 11.121 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.820 -3.917 9.779 1.00 0.00 H new ATOM 141 N GLU A 10 -11.501 -2.595 7.807 1.00 0.00 N ATOM 142 CA GLU A 10 -12.532 -1.761 7.206 1.00 0.00 C ATOM 143 C GLU A 10 -13.049 -0.795 8.262 1.00 0.00 C ATOM 144 O GLU A 10 -13.692 -1.203 9.230 1.00 0.00 O ATOM 145 CB GLU A 10 -13.644 -2.625 6.617 1.00 0.00 C ATOM 146 CG GLU A 10 -13.257 -3.058 5.210 1.00 0.00 C ATOM 147 CD GLU A 10 -14.322 -3.966 4.635 1.00 0.00 C ATOM 148 OE1 GLU A 10 -15.296 -3.441 4.048 1.00 0.00 O ATOM 149 OE2 GLU A 10 -14.146 -5.202 4.697 1.00 0.00 O ATOM 0 H GLU A 10 -11.756 -3.579 7.892 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.119 -1.183 6.379 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.811 -3.500 7.245 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.580 -2.066 6.593 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.132 -2.182 4.573 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.298 -3.577 5.231 1.00 0.00 H new ATOM 154 N GLN A 11 -12.720 0.483 8.074 1.00 0.00 N ATOM 155 CA GLN A 11 -13.192 1.568 8.906 1.00 0.00 C ATOM 156 C GLN A 11 -14.625 1.933 8.459 1.00 0.00 C ATOM 157 O GLN A 11 -15.393 1.067 8.025 1.00 0.00 O ATOM 158 CB GLN A 11 -12.185 2.724 8.863 1.00 0.00 C ATOM 159 CG GLN A 11 -11.821 3.338 10.220 1.00 0.00 C ATOM 160 CD GLN A 11 -12.998 4.015 10.908 1.00 0.00 C ATOM 161 OE1 GLN A 11 -13.467 5.147 10.407 1.00 0.00 O flip ATOM 162 NE2 GLN A 11 -13.541 3.500 11.879 1.00 0.00 N flip ATOM 0 H GLN A 11 -12.104 0.790 7.321 1.00 0.00 H new ATOM 0 HA GLN A 11 -13.257 1.286 9.957 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -11.270 2.368 8.389 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -12.589 3.510 8.226 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -11.428 2.557 10.871 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -11.023 4.067 10.079 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -13.178 2.628 12.263 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.356 3.944 12.303 1.00 0.00 H new ATOM 169 N ASP A 12 -15.034 3.197 8.576 1.00 0.00 N ATOM 170 CA ASP A 12 -16.394 3.618 8.213 1.00 0.00 C ATOM 171 C ASP A 12 -16.519 3.825 6.699 1.00 0.00 C ATOM 172 O ASP A 12 -17.371 3.219 6.048 1.00 0.00 O ATOM 173 CB ASP A 12 -16.822 4.881 8.968 1.00 0.00 C ATOM 174 CG ASP A 12 -18.332 4.899 9.197 1.00 0.00 C ATOM 175 OD1 ASP A 12 -19.107 4.450 8.326 1.00 0.00 O ATOM 176 OD2 ASP A 12 -18.770 5.359 10.275 1.00 0.00 O ATOM 0 H ASP A 12 -14.442 3.953 8.921 1.00 0.00 H new ATOM 0 HA ASP A 12 -17.069 2.815 8.509 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -16.305 4.928 9.926 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -16.526 5.765 8.402 1.00 0.00 H new ATOM 180 N ASP A 13 -15.631 4.625 6.109 1.00 0.00 N ATOM 181 CA ASP A 13 -15.581 4.912 4.662 1.00 0.00 C ATOM 182 C ASP A 13 -14.199 4.674 4.061 1.00 0.00 C ATOM 183 O ASP A 13 -14.012 4.688 2.839 1.00 0.00 O ATOM 184 CB ASP A 13 -16.079 6.319 4.302 1.00 0.00 C ATOM 185 CG ASP A 13 -15.226 7.441 4.870 1.00 0.00 C ATOM 186 OD1 ASP A 13 -15.359 7.729 6.081 1.00 0.00 O ATOM 187 OD2 ASP A 13 -14.506 8.112 4.099 1.00 0.00 O ATOM 0 H ASP A 13 -14.902 5.109 6.634 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.273 4.197 4.217 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.112 6.415 3.217 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -17.101 6.435 4.663 1.00 0.00 H new ATOM 191 N LYS A 14 -13.241 4.356 4.926 1.00 0.00 N ATOM 192 CA LYS A 14 -11.847 4.148 4.617 1.00 0.00 C ATOM 193 C LYS A 14 -11.544 2.683 4.863 1.00 0.00 C ATOM 194 O LYS A 14 -11.906 2.140 5.903 1.00 0.00 O ATOM 195 CB LYS A 14 -10.997 5.180 5.394 1.00 0.00 C ATOM 196 CG LYS A 14 -11.196 5.226 6.907 1.00 0.00 C ATOM 197 CD LYS A 14 -10.693 6.501 7.588 1.00 0.00 C ATOM 198 CE LYS A 14 -9.178 6.421 7.661 1.00 0.00 C ATOM 199 NZ LYS A 14 -8.590 7.486 8.496 1.00 0.00 N ATOM 0 H LYS A 14 -13.438 4.231 5.919 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.590 4.332 3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.945 4.975 5.194 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.211 6.170 4.992 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.259 5.112 7.122 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -10.688 4.370 7.351 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.002 7.382 7.026 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.119 6.594 8.587 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.889 5.450 8.062 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.766 6.486 6.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -7.594 7.263 8.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -8.648 8.394 7.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.113 7.553 9.392 1.00 0.00 H new ATOM 209 N ALA A 15 -11.022 2.005 3.850 1.00 0.00 N ATOM 210 CA ALA A 15 -10.649 0.601 3.962 1.00 0.00 C ATOM 211 C ALA A 15 -9.206 0.596 4.433 1.00 0.00 C ATOM 212 O ALA A 15 -8.319 0.833 3.610 1.00 0.00 O ATOM 213 CB ALA A 15 -10.833 -0.121 2.617 1.00 0.00 C ATOM 0 H ALA A 15 -10.846 2.410 2.931 1.00 0.00 H new ATOM 0 HA ALA A 15 -11.281 0.061 4.667 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.549 -1.168 2.724 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -11.877 -0.058 2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -10.204 0.350 1.862 1.00 0.00 H new ATOM 219 N ILE A 16 -8.931 0.403 5.728 1.00 0.00 N ATOM 220 CA ILE A 16 -7.524 0.363 6.105 1.00 0.00 C ATOM 221 C ILE A 16 -7.040 -1.030 5.698 1.00 0.00 C ATOM 222 O ILE A 16 -7.668 -2.025 6.061 1.00 0.00 O ATOM 223 CB ILE A 16 -7.350 0.718 7.593 1.00 0.00 C ATOM 224 CG1 ILE A 16 -7.932 2.119 7.911 1.00 0.00 C ATOM 225 CG2 ILE A 16 -5.877 0.604 7.997 1.00 0.00 C ATOM 226 CD1 ILE A 16 -8.305 2.274 9.384 1.00 0.00 C ATOM 0 H ILE A 16 -9.610 0.281 6.479 1.00 0.00 H new ATOM 0 HA ILE A 16 -6.911 1.109 5.600 1.00 0.00 H new ATOM 0 HB ILE A 16 -7.916 0.002 8.188 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -7.202 2.882 7.642 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -8.815 2.291 7.295 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -5.768 0.858 9.051 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.532 -0.417 7.832 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.281 1.290 7.395 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -8.708 3.272 9.554 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -9.056 1.530 9.649 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -7.418 2.130 10.001 1.00 0.00 H new ATOM 237 N VAL A 17 -5.980 -1.153 4.906 1.00 0.00 N ATOM 238 CA VAL A 17 -5.322 -2.427 4.679 1.00 0.00 C ATOM 239 C VAL A 17 -3.964 -2.330 5.355 1.00 0.00 C ATOM 240 O VAL A 17 -2.986 -1.860 4.788 1.00 0.00 O ATOM 241 CB VAL A 17 -5.296 -2.735 3.178 1.00 0.00 C ATOM 242 CG1 VAL A 17 -4.559 -4.042 2.869 1.00 0.00 C ATOM 243 CG2 VAL A 17 -6.720 -2.833 2.607 1.00 0.00 C ATOM 0 H VAL A 17 -5.556 -0.372 4.406 1.00 0.00 H new ATOM 0 HA VAL A 17 -5.847 -3.278 5.114 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.762 -1.908 2.709 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.566 -4.218 1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -3.529 -3.970 3.218 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.057 -4.869 3.376 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.670 -3.052 1.540 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -7.262 -3.630 3.116 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -7.239 -1.887 2.759 1.00 0.00 H new ATOM 253 N ARG A 18 -3.891 -2.785 6.602 1.00 0.00 N ATOM 254 CA ARG A 18 -2.634 -3.092 7.236 1.00 0.00 C ATOM 255 C ARG A 18 -1.927 -4.093 6.340 1.00 0.00 C ATOM 256 O ARG A 18 -2.482 -5.157 6.076 1.00 0.00 O ATOM 257 CB ARG A 18 -2.887 -3.675 8.633 1.00 0.00 C ATOM 258 CG ARG A 18 -2.280 -2.794 9.695 1.00 0.00 C ATOM 259 CD ARG A 18 -2.501 -3.339 11.116 1.00 0.00 C ATOM 260 NE ARG A 18 -1.397 -2.971 12.022 1.00 0.00 N ATOM 261 CZ ARG A 18 -1.465 -2.344 13.206 1.00 0.00 C ATOM 262 NH1 ARG A 18 -2.622 -2.077 13.802 1.00 0.00 N ATOM 263 NH2 ARG A 18 -0.326 -1.978 13.774 1.00 0.00 N ATOM 0 H ARG A 18 -4.706 -2.948 7.193 1.00 0.00 H new ATOM 0 HA ARG A 18 -2.018 -2.202 7.365 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -3.959 -3.773 8.803 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.462 -4.677 8.697 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.210 -2.694 9.511 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -2.710 -1.795 9.622 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -3.440 -2.952 11.512 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.594 -4.424 11.079 1.00 0.00 H new ATOM 0 HE ARG A 18 -0.461 -3.226 11.708 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -3.499 -2.351 13.359 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -2.633 -1.598 14.703 1.00 0.00 H new ATOM 0 HH21 ARG A 18 0.561 -2.175 13.311 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -0.336 -1.499 14.674 1.00 0.00 H new ATOM 274 N VAL A 19 -0.752 -3.741 5.853 1.00 0.00 N ATOM 275 CA VAL A 19 0.136 -4.648 5.150 1.00 0.00 C ATOM 276 C VAL A 19 0.910 -5.446 6.204 1.00 0.00 C ATOM 277 O VAL A 19 1.007 -4.992 7.352 1.00 0.00 O ATOM 278 CB VAL A 19 1.026 -3.735 4.281 1.00 0.00 C ATOM 279 CG1 VAL A 19 2.309 -4.371 3.748 1.00 0.00 C ATOM 280 CG2 VAL A 19 0.212 -3.165 3.112 1.00 0.00 C ATOM 0 H VAL A 19 -0.380 -2.795 5.937 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.358 -5.379 4.510 1.00 0.00 H new ATOM 0 HB VAL A 19 1.357 -2.948 4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.856 -3.641 3.151 1.00 0.00 H new ATOM 0 HG12 VAL A 19 2.929 -4.695 4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 19 2.058 -5.232 3.128 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.849 -2.522 2.505 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.167 -3.983 2.500 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.625 -2.584 3.500 1.00 0.00 H new ATOM 290 N GLN A 20 1.498 -6.586 5.834 1.00 0.00 N ATOM 291 CA GLN A 20 2.523 -7.282 6.583 1.00 0.00 C ATOM 292 C GLN A 20 3.633 -7.735 5.634 1.00 0.00 C ATOM 293 O GLN A 20 3.351 -8.137 4.500 1.00 0.00 O ATOM 294 CB GLN A 20 1.940 -8.503 7.296 1.00 0.00 C ATOM 295 CG GLN A 20 0.905 -8.069 8.325 1.00 0.00 C ATOM 296 CD GLN A 20 0.695 -9.105 9.429 1.00 0.00 C ATOM 297 OE1 GLN A 20 0.771 -10.313 9.211 1.00 0.00 O ATOM 298 NE2 GLN A 20 0.450 -8.655 10.647 1.00 0.00 N ATOM 0 H GLN A 20 1.256 -7.062 4.965 1.00 0.00 H new ATOM 0 HA GLN A 20 2.927 -6.599 7.330 1.00 0.00 H new ATOM 0 HB2 GLN A 20 1.481 -9.173 6.569 1.00 0.00 H new ATOM 0 HB3 GLN A 20 2.737 -9.062 7.786 1.00 0.00 H new ATOM 0 HG2 GLN A 20 1.218 -7.126 8.773 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -0.044 -7.883 7.822 1.00 0.00 H new ATOM 0 HE21 GLN A 20 0.389 -7.651 10.817 1.00 0.00 H new ATOM 0 HE22 GLN A 20 0.322 -9.312 11.417 1.00 0.00 H new ATOM 305 N GLY A 21 4.872 -7.717 6.126 1.00 0.00 N ATOM 306 CA GLY A 21 6.037 -8.282 5.476 1.00 0.00 C ATOM 307 C GLY A 21 6.807 -7.198 4.736 1.00 0.00 C ATOM 308 O GLY A 21 6.242 -6.194 4.294 1.00 0.00 O ATOM 0 H GLY A 21 5.092 -7.289 7.025 1.00 0.00 H new ATOM 0 HA2 GLY A 21 6.682 -8.754 6.217 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.730 -9.061 4.778 1.00 0.00 H new ATOM 312 N ASP A 22 8.110 -7.419 4.576 1.00 0.00 N ATOM 313 CA ASP A 22 8.893 -6.795 3.521 1.00 0.00 C ATOM 314 C ASP A 22 8.301 -7.136 2.159 1.00 0.00 C ATOM 315 O ASP A 22 7.441 -8.003 2.020 1.00 0.00 O ATOM 316 CB ASP A 22 10.385 -7.165 3.588 1.00 0.00 C ATOM 317 CG ASP A 22 10.729 -8.653 3.459 1.00 0.00 C ATOM 318 OD1 ASP A 22 10.620 -9.362 4.486 1.00 0.00 O ATOM 319 OD2 ASP A 22 11.233 -9.085 2.396 1.00 0.00 O ATOM 0 H ASP A 22 8.651 -8.039 5.179 1.00 0.00 H new ATOM 0 HA ASP A 22 8.841 -5.717 3.672 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.906 -6.625 2.797 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.783 -6.804 4.536 1.00 0.00 H new ATOM 323 N ILE A 23 8.726 -6.403 1.146 1.00 0.00 N ATOM 324 CA ILE A 23 8.110 -6.390 -0.161 1.00 0.00 C ATOM 325 C ILE A 23 9.189 -6.577 -1.207 1.00 0.00 C ATOM 326 O ILE A 23 10.228 -5.913 -1.172 1.00 0.00 O ATOM 327 CB ILE A 23 7.301 -5.090 -0.277 1.00 0.00 C ATOM 328 CG1 ILE A 23 6.504 -5.015 -1.575 1.00 0.00 C ATOM 329 CG2 ILE A 23 8.088 -3.780 -0.161 1.00 0.00 C ATOM 330 CD1 ILE A 23 5.092 -4.524 -1.300 1.00 0.00 C ATOM 0 H ILE A 23 9.533 -5.783 1.216 1.00 0.00 H new ATOM 0 HA ILE A 23 7.408 -7.209 -0.320 1.00 0.00 H new ATOM 0 HB ILE A 23 6.654 -5.162 0.597 1.00 0.00 H new ATOM 0 HG12 ILE A 23 7.000 -4.343 -2.276 1.00 0.00 H new ATOM 0 HG13 ILE A 23 6.469 -5.998 -2.046 1.00 0.00 H new ATOM 0 HG21 ILE A 23 7.406 -2.936 -0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.581 -3.737 0.810 1.00 0.00 H new ATOM 0 HG23 ILE A 23 8.837 -3.735 -0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 23 4.535 -4.476 -2.236 1.00 0.00 H new ATOM 0 HD12 ILE A 23 4.594 -5.212 -0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 23 5.133 -3.532 -0.850 1.00 0.00 H new ATOM 341 N ASP A 24 8.946 -7.451 -2.178 1.00 0.00 N ATOM 342 CA ASP A 24 9.970 -7.923 -3.094 1.00 0.00 C ATOM 343 C ASP A 24 9.384 -8.519 -4.372 1.00 0.00 C ATOM 344 O ASP A 24 8.175 -8.464 -4.600 1.00 0.00 O ATOM 345 CB ASP A 24 10.836 -8.957 -2.380 1.00 0.00 C ATOM 346 CG ASP A 24 10.131 -10.236 -1.941 1.00 0.00 C ATOM 347 OD1 ASP A 24 8.962 -10.438 -2.325 1.00 0.00 O ATOM 348 OD2 ASP A 24 10.798 -11.062 -1.281 1.00 0.00 O ATOM 0 H ASP A 24 8.024 -7.853 -2.350 1.00 0.00 H new ATOM 0 HA ASP A 24 10.571 -7.066 -3.396 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.660 -9.229 -3.040 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.275 -8.488 -1.499 1.00 0.00 H new ATOM 352 N ALA A 25 10.262 -9.090 -5.201 1.00 0.00 N ATOM 353 CA ALA A 25 9.926 -9.813 -6.412 1.00 0.00 C ATOM 354 C ALA A 25 9.051 -11.052 -6.169 1.00 0.00 C ATOM 355 O ALA A 25 8.413 -11.523 -7.108 1.00 0.00 O ATOM 356 CB ALA A 25 11.229 -10.225 -7.103 1.00 0.00 C ATOM 0 H ALA A 25 11.267 -9.055 -5.032 1.00 0.00 H new ATOM 0 HA ALA A 25 9.333 -9.146 -7.038 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.999 -10.771 -8.018 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.808 -9.335 -7.348 1.00 0.00 H new ATOM 0 HB3 ALA A 25 11.809 -10.863 -6.436 1.00 0.00 H new ATOM 362 N TYR A 26 8.991 -11.598 -4.952 1.00 0.00 N ATOM 363 CA TYR A 26 8.149 -12.725 -4.605 1.00 0.00 C ATOM 364 C TYR A 26 6.759 -12.226 -4.190 1.00 0.00 C ATOM 365 O TYR A 26 5.803 -12.991 -4.250 1.00 0.00 O ATOM 366 CB TYR A 26 8.834 -13.524 -3.486 1.00 0.00 C ATOM 367 CG TYR A 26 9.988 -14.421 -3.918 1.00 0.00 C ATOM 368 CD1 TYR A 26 11.116 -13.887 -4.572 1.00 0.00 C ATOM 369 CD2 TYR A 26 9.941 -15.804 -3.656 1.00 0.00 C ATOM 370 CE1 TYR A 26 12.158 -14.725 -5.001 1.00 0.00 C ATOM 371 CE2 TYR A 26 10.988 -16.647 -4.070 1.00 0.00 C ATOM 372 CZ TYR A 26 12.100 -16.114 -4.760 1.00 0.00 C ATOM 373 OH TYR A 26 13.106 -16.930 -5.187 1.00 0.00 O ATOM 0 H TYR A 26 9.544 -11.253 -4.167 1.00 0.00 H new ATOM 0 HA TYR A 26 8.012 -13.383 -5.463 1.00 0.00 H new ATOM 0 HB2 TYR A 26 9.205 -12.822 -2.740 1.00 0.00 H new ATOM 0 HB3 TYR A 26 8.082 -14.143 -2.996 1.00 0.00 H new ATOM 0 HD1 TYR A 26 11.180 -12.823 -4.745 1.00 0.00 H new ATOM 0 HD2 TYR A 26 9.093 -16.221 -3.132 1.00 0.00 H new ATOM 0 HE1 TYR A 26 13.008 -14.304 -5.518 1.00 0.00 H new ATOM 0 HE2 TYR A 26 10.942 -17.705 -3.860 1.00 0.00 H new ATOM 0 HH TYR A 26 12.905 -17.856 -4.936 1.00 0.00 H new ATOM 382 N ASN A 27 6.592 -10.931 -3.905 1.00 0.00 N ATOM 383 CA ASN A 27 5.365 -10.321 -3.421 1.00 0.00 C ATOM 384 C ASN A 27 4.763 -9.386 -4.468 1.00 0.00 C ATOM 385 O ASN A 27 3.601 -9.003 -4.367 1.00 0.00 O ATOM 386 CB ASN A 27 5.721 -9.521 -2.176 1.00 0.00 C ATOM 387 CG ASN A 27 4.542 -8.804 -1.549 1.00 0.00 C ATOM 388 OD1 ASN A 27 4.549 -7.589 -1.468 1.00 0.00 O ATOM 389 ND2 ASN A 27 3.545 -9.496 -1.040 1.00 0.00 N ATOM 0 H ASN A 27 7.348 -10.254 -4.013 1.00 0.00 H new ATOM 0 HA ASN A 27 4.628 -11.095 -3.205 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.160 -10.192 -1.438 1.00 0.00 H new ATOM 0 HB3 ASN A 27 6.485 -8.787 -2.434 1.00 0.00 H new ATOM 0 HD21 ASN A 27 2.775 -9.015 -0.576 1.00 0.00 H new ATOM 0 HD22 ASN A 27 3.543 -10.514 -1.110 1.00 0.00 H new ATOM 395 N SER A 28 5.523 -9.028 -5.501 1.00 0.00 N ATOM 396 CA SER A 28 5.102 -8.157 -6.576 1.00 0.00 C ATOM 397 C SER A 28 3.960 -8.717 -7.444 1.00 0.00 C ATOM 398 O SER A 28 3.461 -7.995 -8.314 1.00 0.00 O ATOM 399 CB SER A 28 6.328 -7.753 -7.397 1.00 0.00 C ATOM 400 OG SER A 28 7.024 -8.870 -7.907 1.00 0.00 O ATOM 0 H SER A 28 6.484 -9.353 -5.608 1.00 0.00 H new ATOM 0 HA SER A 28 4.658 -7.270 -6.125 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.015 -7.115 -8.223 1.00 0.00 H new ATOM 0 HB3 SER A 28 7.000 -7.162 -6.775 1.00 0.00 H new ATOM 0 HG SER A 28 7.698 -8.569 -8.552 1.00 0.00 H new ATOM 405 N SER A 29 3.519 -9.959 -7.226 1.00 0.00 N ATOM 406 CA SER A 29 2.214 -10.436 -7.685 1.00 0.00 C ATOM 407 C SER A 29 1.318 -10.798 -6.510 1.00 0.00 C ATOM 408 O SER A 29 0.101 -10.718 -6.660 1.00 0.00 O ATOM 409 CB SER A 29 2.292 -11.579 -8.706 1.00 0.00 C ATOM 410 OG SER A 29 3.407 -12.436 -8.543 1.00 0.00 O ATOM 0 H SER A 29 4.060 -10.663 -6.724 1.00 0.00 H new ATOM 0 HA SER A 29 1.764 -9.600 -8.220 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.380 -12.173 -8.638 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.321 -11.152 -9.709 1.00 0.00 H new ATOM 0 HG SER A 29 3.384 -13.136 -9.228 1.00 0.00 H new ATOM 415 N GLU A 30 1.890 -11.129 -5.351 1.00 0.00 N ATOM 416 CA GLU A 30 1.144 -11.443 -4.154 1.00 0.00 C ATOM 417 C GLU A 30 0.354 -10.221 -3.693 1.00 0.00 C ATOM 418 O GLU A 30 -0.856 -10.213 -3.894 1.00 0.00 O ATOM 419 CB GLU A 30 2.049 -11.993 -3.051 1.00 0.00 C ATOM 420 CG GLU A 30 1.212 -12.937 -2.187 1.00 0.00 C ATOM 421 CD GLU A 30 2.019 -13.438 -1.005 1.00 0.00 C ATOM 422 OE1 GLU A 30 2.015 -12.750 0.041 1.00 0.00 O ATOM 423 OE2 GLU A 30 2.653 -14.511 -1.130 1.00 0.00 O ATOM 0 H GLU A 30 2.901 -11.184 -5.227 1.00 0.00 H new ATOM 0 HA GLU A 30 0.433 -12.235 -4.389 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.899 -12.522 -3.482 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.453 -11.180 -2.448 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.321 -12.419 -1.832 1.00 0.00 H new ATOM 0 HG3 GLU A 30 0.872 -13.782 -2.786 1.00 0.00 H new ATOM 428 N LEU A 31 0.995 -9.172 -3.149 1.00 0.00 N ATOM 429 CA LEU A 31 0.337 -7.946 -2.706 1.00 0.00 C ATOM 430 C LEU A 31 -0.549 -7.384 -3.806 1.00 0.00 C ATOM 431 O LEU A 31 -1.658 -6.918 -3.561 1.00 0.00 O ATOM 432 CB LEU A 31 1.381 -6.890 -2.305 1.00 0.00 C ATOM 433 CG LEU A 31 0.724 -5.564 -1.877 1.00 0.00 C ATOM 434 CD1 LEU A 31 -0.216 -5.803 -0.707 1.00 0.00 C ATOM 435 CD2 LEU A 31 1.775 -4.545 -1.464 1.00 0.00 C ATOM 0 H LEU A 31 2.005 -9.160 -3.005 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.280 -8.191 -1.841 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.990 -7.274 -1.486 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.053 -6.708 -3.143 1.00 0.00 H new ATOM 0 HG LEU A 31 0.167 -5.175 -2.729 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.676 -4.860 -0.411 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.993 -6.509 -1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.345 -6.212 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.286 -3.618 -1.166 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.352 -4.936 -0.626 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.442 -4.350 -2.304 1.00 0.00 H new ATOM 446 N LYS A 32 -0.037 -7.428 -5.031 1.00 0.00 N ATOM 447 CA LYS A 32 -0.759 -6.983 -6.198 1.00 0.00 C ATOM 448 C LYS A 32 -2.108 -7.708 -6.288 1.00 0.00 C ATOM 449 O LYS A 32 -3.123 -7.022 -6.388 1.00 0.00 O ATOM 450 CB LYS A 32 0.177 -7.182 -7.409 1.00 0.00 C ATOM 451 CG LYS A 32 -0.189 -6.228 -8.557 1.00 0.00 C ATOM 452 CD LYS A 32 0.896 -6.121 -9.633 1.00 0.00 C ATOM 453 CE LYS A 32 1.028 -7.407 -10.452 1.00 0.00 C ATOM 454 NZ LYS A 32 1.991 -7.246 -11.559 1.00 0.00 N ATOM 0 H LYS A 32 0.899 -7.778 -5.234 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.023 -5.926 -6.158 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.210 -7.011 -7.106 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.113 -8.213 -7.756 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.116 -6.568 -9.019 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.382 -5.237 -8.147 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.664 -5.290 -10.299 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.852 -5.893 -9.161 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.350 -8.221 -9.803 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.054 -7.686 -10.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.057 -8.135 -12.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.670 -6.485 -12.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.926 -7.004 -11.173 1.00 0.00 H new ATOM 464 N GLU A 33 -2.144 -9.042 -6.180 1.00 0.00 N ATOM 465 CA GLU A 33 -3.370 -9.833 -6.072 1.00 0.00 C ATOM 466 C GLU A 33 -4.194 -9.451 -4.852 1.00 0.00 C ATOM 467 O GLU A 33 -5.394 -9.210 -4.982 1.00 0.00 O ATOM 468 CB GLU A 33 -3.101 -11.347 -6.060 1.00 0.00 C ATOM 469 CG GLU A 33 -3.087 -11.885 -7.489 1.00 0.00 C ATOM 470 CD GLU A 33 -3.189 -13.410 -7.578 1.00 0.00 C ATOM 471 OE1 GLU A 33 -2.813 -14.131 -6.627 1.00 0.00 O ATOM 472 OE2 GLU A 33 -3.696 -13.859 -8.638 1.00 0.00 O ATOM 0 H GLU A 33 -1.299 -9.613 -6.165 1.00 0.00 H new ATOM 0 HA GLU A 33 -3.944 -9.598 -6.969 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.146 -11.551 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -3.869 -11.857 -5.478 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.916 -11.442 -8.042 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.168 -11.563 -7.979 1.00 0.00 H new ATOM 477 N GLN A 34 -3.567 -9.376 -3.676 1.00 0.00 N ATOM 478 CA GLN A 34 -4.193 -9.117 -2.400 1.00 0.00 C ATOM 479 C GLN A 34 -4.938 -7.777 -2.418 1.00 0.00 C ATOM 480 O GLN A 34 -5.797 -7.549 -1.573 1.00 0.00 O ATOM 481 CB GLN A 34 -3.094 -9.140 -1.310 1.00 0.00 C ATOM 482 CG GLN A 34 -2.175 -10.372 -1.254 1.00 0.00 C ATOM 483 CD GLN A 34 -2.371 -11.351 -0.106 1.00 0.00 C ATOM 484 OE1 GLN A 34 -2.612 -10.988 1.037 1.00 0.00 O ATOM 485 NE2 GLN A 34 -2.282 -12.635 -0.424 1.00 0.00 N ATOM 0 H GLN A 34 -2.558 -9.502 -3.596 1.00 0.00 H new ATOM 0 HA GLN A 34 -4.936 -9.885 -2.184 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -2.467 -8.259 -1.446 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -3.580 -9.039 -0.340 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -2.295 -10.922 -2.187 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -1.144 -10.020 -1.222 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -2.080 -12.909 -1.385 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -2.416 -13.348 0.293 1.00 0.00 H new ATOM 492 N LEU A 35 -4.675 -6.899 -3.392 1.00 0.00 N ATOM 493 CA LEU A 35 -5.294 -5.592 -3.493 1.00 0.00 C ATOM 494 C LEU A 35 -6.157 -5.465 -4.715 1.00 0.00 C ATOM 495 O LEU A 35 -7.232 -4.953 -4.516 1.00 0.00 O ATOM 496 CB LEU A 35 -4.237 -4.514 -3.575 1.00 0.00 C ATOM 497 CG LEU A 35 -3.425 -4.344 -2.284 1.00 0.00 C ATOM 498 CD1 LEU A 35 -2.266 -3.361 -2.449 1.00 0.00 C ATOM 499 CD2 LEU A 35 -4.309 -3.890 -1.112 1.00 0.00 C ATOM 0 H LEU A 35 -4.011 -7.090 -4.143 1.00 0.00 H new ATOM 0 HA LEU A 35 -5.910 -5.476 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.556 -4.747 -4.394 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.716 -3.566 -3.819 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.013 -5.329 -2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.724 -3.277 -1.507 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.591 -3.721 -3.225 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -2.656 -2.383 -2.732 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.698 -3.781 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.772 -2.933 -1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.086 -4.633 -0.933 1.00 0.00 H new ATOM 510 N ARG A 36 -5.790 -5.874 -5.936 1.00 0.00 N ATOM 511 CA ARG A 36 -6.757 -5.895 -7.039 1.00 0.00 C ATOM 512 C ARG A 36 -8.009 -6.672 -6.635 1.00 0.00 C ATOM 513 O ARG A 36 -9.123 -6.216 -6.897 1.00 0.00 O ATOM 514 CB ARG A 36 -6.138 -6.460 -8.334 1.00 0.00 C ATOM 515 CG ARG A 36 -5.652 -7.914 -8.219 1.00 0.00 C ATOM 516 CD ARG A 36 -4.776 -8.407 -9.383 1.00 0.00 C ATOM 517 NE ARG A 36 -5.579 -9.033 -10.444 1.00 0.00 N ATOM 518 CZ ARG A 36 -6.235 -8.385 -11.411 1.00 0.00 C ATOM 519 NH1 ARG A 36 -6.023 -7.093 -11.627 1.00 0.00 N ATOM 520 NH2 ARG A 36 -7.068 -9.035 -12.213 1.00 0.00 N ATOM 0 H ARG A 36 -4.851 -6.188 -6.182 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.045 -4.865 -7.250 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -6.876 -6.398 -9.133 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -5.298 -5.830 -8.627 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -5.089 -8.019 -7.292 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.522 -8.566 -8.139 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -4.217 -7.568 -9.797 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -4.045 -9.124 -9.009 1.00 0.00 H new ATOM 0 HE ARG A 36 -5.641 -10.051 -10.442 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -5.353 -6.583 -11.052 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -6.530 -6.610 -12.368 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -7.212 -10.038 -12.094 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.565 -8.532 -12.948 1.00 0.00 H new ATOM 531 N ASN A 37 -7.833 -7.805 -5.946 1.00 0.00 N ATOM 532 CA ASN A 37 -8.939 -8.691 -5.679 1.00 0.00 C ATOM 533 C ASN A 37 -9.806 -8.081 -4.579 1.00 0.00 C ATOM 534 O ASN A 37 -11.032 -8.164 -4.631 1.00 0.00 O ATOM 535 CB ASN A 37 -8.427 -10.095 -5.328 1.00 0.00 C ATOM 536 CG ASN A 37 -9.602 -11.033 -5.108 1.00 0.00 C ATOM 537 OD1 ASN A 37 -10.451 -11.199 -5.981 1.00 0.00 O ATOM 538 ND2 ASN A 37 -9.690 -11.651 -3.948 1.00 0.00 N ATOM 0 H ASN A 37 -6.937 -8.116 -5.571 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.559 -8.806 -6.568 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.794 -10.472 -6.131 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.811 -10.053 -4.430 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -10.472 -12.279 -3.763 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.976 -11.501 -3.235 1.00 0.00 H new ATOM 544 N PHE A 38 -9.191 -7.389 -3.612 1.00 0.00 N ATOM 545 CA PHE A 38 -9.904 -6.652 -2.605 1.00 0.00 C ATOM 546 C PHE A 38 -10.516 -5.377 -3.150 1.00 0.00 C ATOM 547 O PHE A 38 -11.648 -5.085 -2.802 1.00 0.00 O ATOM 548 CB PHE A 38 -8.948 -6.327 -1.476 1.00 0.00 C ATOM 549 CG PHE A 38 -9.451 -5.351 -0.441 1.00 0.00 C ATOM 550 CD1 PHE A 38 -10.289 -5.779 0.608 1.00 0.00 C ATOM 551 CD2 PHE A 38 -8.972 -4.032 -0.472 1.00 0.00 C ATOM 552 CE1 PHE A 38 -10.636 -4.882 1.633 1.00 0.00 C ATOM 553 CE2 PHE A 38 -9.306 -3.144 0.556 1.00 0.00 C ATOM 554 CZ PHE A 38 -10.137 -3.568 1.609 1.00 0.00 C ATOM 0 H PHE A 38 -8.177 -7.335 -3.521 1.00 0.00 H new ATOM 0 HA PHE A 38 -10.727 -7.270 -2.247 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -8.684 -7.256 -0.972 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -8.031 -5.927 -1.908 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -10.663 -6.792 0.624 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -8.346 -3.703 -1.289 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -11.284 -5.201 2.436 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -8.926 -2.133 0.541 1.00 0.00 H new ATOM 0 HZ PHE A 38 -10.393 -2.881 2.402 1.00 0.00 H new ATOM 563 N ILE A 39 -9.810 -4.594 -3.964 1.00 0.00 N ATOM 564 CA ILE A 39 -10.362 -3.403 -4.606 1.00 0.00 C ATOM 565 C ILE A 39 -11.652 -3.722 -5.362 1.00 0.00 C ATOM 566 O ILE A 39 -12.588 -2.913 -5.303 1.00 0.00 O ATOM 567 CB ILE A 39 -9.268 -2.772 -5.481 1.00 0.00 C ATOM 568 CG1 ILE A 39 -8.438 -1.843 -4.566 1.00 0.00 C ATOM 569 CG2 ILE A 39 -9.777 -2.013 -6.715 1.00 0.00 C ATOM 570 CD1 ILE A 39 -7.048 -1.536 -5.109 1.00 0.00 C ATOM 0 H ILE A 39 -8.833 -4.770 -4.198 1.00 0.00 H new ATOM 0 HA ILE A 39 -10.657 -2.668 -3.857 1.00 0.00 H new ATOM 0 HB ILE A 39 -8.670 -3.580 -5.903 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.979 -0.907 -4.426 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.341 -2.306 -3.584 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -8.930 -1.605 -7.266 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.334 -2.695 -7.358 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.429 -1.199 -6.398 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -6.523 -0.879 -4.415 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.489 -2.465 -5.223 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.136 -1.044 -6.078 1.00 0.00 H new ATOM 581 N SER A 40 -11.703 -4.869 -6.043 1.00 0.00 N ATOM 582 CA SER A 40 -12.882 -5.410 -6.699 1.00 0.00 C ATOM 583 C SER A 40 -14.036 -5.483 -5.687 1.00 0.00 C ATOM 584 O SER A 40 -15.086 -4.865 -5.899 1.00 0.00 O ATOM 585 CB SER A 40 -12.488 -6.753 -7.323 1.00 0.00 C ATOM 586 OG SER A 40 -13.485 -7.312 -8.152 1.00 0.00 O ATOM 0 H SER A 40 -10.885 -5.468 -6.153 1.00 0.00 H new ATOM 0 HA SER A 40 -13.247 -4.776 -7.507 1.00 0.00 H new ATOM 0 HB2 SER A 40 -11.577 -6.618 -7.907 1.00 0.00 H new ATOM 0 HB3 SER A 40 -12.254 -7.459 -6.526 1.00 0.00 H new ATOM 0 HG SER A 40 -13.167 -8.164 -8.517 1.00 0.00 H new ATOM 591 N THR A 41 -13.847 -6.161 -4.553 1.00 0.00 N ATOM 592 CA THR A 41 -14.794 -6.245 -3.459 1.00 0.00 C ATOM 593 C THR A 41 -15.162 -4.867 -2.904 1.00 0.00 C ATOM 594 O THR A 41 -16.350 -4.554 -2.754 1.00 0.00 O ATOM 595 CB THR A 41 -14.195 -7.162 -2.388 1.00 0.00 C ATOM 596 OG1 THR A 41 -13.876 -8.394 -2.987 1.00 0.00 O ATOM 597 CG2 THR A 41 -15.121 -7.371 -1.194 1.00 0.00 C ATOM 0 H THR A 41 -12.991 -6.686 -4.373 1.00 0.00 H new ATOM 0 HA THR A 41 -15.734 -6.665 -3.818 1.00 0.00 H new ATOM 0 HB THR A 41 -13.301 -6.682 -1.991 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.489 -8.994 -2.315 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.639 -8.029 -0.471 1.00 0.00 H new ATOM 0 HG22 THR A 41 -15.333 -6.410 -0.725 1.00 0.00 H new ATOM 0 HG23 THR A 41 -16.054 -7.823 -1.532 1.00 0.00 H new ATOM 605 N THR A 42 -14.157 -4.083 -2.513 1.00 0.00 N ATOM 606 CA THR A 42 -14.270 -3.360 -1.264 1.00 0.00 C ATOM 607 C THR A 42 -15.382 -2.311 -1.262 1.00 0.00 C ATOM 608 O THR A 42 -15.589 -1.551 -2.211 1.00 0.00 O ATOM 609 CB THR A 42 -12.898 -2.863 -0.767 1.00 0.00 C ATOM 610 OG1 THR A 42 -13.011 -2.238 0.496 1.00 0.00 O ATOM 611 CG2 THR A 42 -12.236 -1.874 -1.710 1.00 0.00 C ATOM 0 H THR A 42 -13.288 -3.940 -3.028 1.00 0.00 H new ATOM 0 HA THR A 42 -14.606 -4.072 -0.510 1.00 0.00 H new ATOM 0 HB THR A 42 -12.278 -3.758 -0.709 1.00 0.00 H new ATOM 0 HG1 THR A 42 -12.234 -2.470 1.047 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.275 -1.566 -1.298 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.081 -2.345 -2.681 1.00 0.00 H new ATOM 0 HG23 THR A 42 -12.876 -1.000 -1.829 1.00 0.00 H new ATOM 619 N SER A 43 -16.110 -2.282 -0.153 1.00 0.00 N ATOM 620 CA SER A 43 -17.204 -1.372 0.122 1.00 0.00 C ATOM 621 C SER A 43 -16.729 0.025 0.557 1.00 0.00 C ATOM 622 O SER A 43 -17.561 0.901 0.800 1.00 0.00 O ATOM 623 CB SER A 43 -18.052 -2.044 1.200 1.00 0.00 C ATOM 624 OG SER A 43 -18.855 -3.056 0.620 1.00 0.00 O ATOM 0 H SER A 43 -15.940 -2.929 0.617 1.00 0.00 H new ATOM 0 HA SER A 43 -17.781 -1.191 -0.785 1.00 0.00 H new ATOM 0 HB2 SER A 43 -17.407 -2.474 1.967 1.00 0.00 H new ATOM 0 HB3 SER A 43 -18.683 -1.304 1.692 1.00 0.00 H new ATOM 0 HG SER A 43 -19.395 -3.484 1.317 1.00 0.00 H new ATOM 629 N LYS A 44 -15.418 0.272 0.671 1.00 0.00 N ATOM 630 CA LYS A 44 -14.852 1.569 1.043 1.00 0.00 C ATOM 631 C LYS A 44 -13.970 2.069 -0.075 1.00 0.00 C ATOM 632 O LYS A 44 -13.547 1.316 -0.947 1.00 0.00 O ATOM 633 CB LYS A 44 -14.029 1.456 2.335 1.00 0.00 C ATOM 634 CG LYS A 44 -14.853 1.443 3.626 1.00 0.00 C ATOM 635 CD LYS A 44 -15.587 0.125 3.816 1.00 0.00 C ATOM 636 CE LYS A 44 -15.952 -0.094 5.285 1.00 0.00 C ATOM 637 NZ LYS A 44 -17.250 0.496 5.660 1.00 0.00 N ATOM 0 H LYS A 44 -14.708 -0.441 0.503 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.669 2.270 1.214 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.435 0.543 2.291 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.329 2.290 2.377 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.196 1.619 4.478 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.574 2.260 3.605 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.492 0.118 3.208 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.962 -0.697 3.467 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.975 -1.164 5.490 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.171 0.335 5.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.662 -0.044 6.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.111 1.484 5.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.894 0.464 4.844 1.00 0.00 H new ATOM 647 N LYS A 45 -13.719 3.369 -0.034 1.00 0.00 N ATOM 648 CA LYS A 45 -12.946 4.060 -1.042 1.00 0.00 C ATOM 649 C LYS A 45 -11.543 4.343 -0.550 1.00 0.00 C ATOM 650 O LYS A 45 -10.602 4.046 -1.271 1.00 0.00 O ATOM 651 CB LYS A 45 -13.686 5.328 -1.481 1.00 0.00 C ATOM 652 CG LYS A 45 -15.041 4.938 -2.092 1.00 0.00 C ATOM 653 CD LYS A 45 -16.229 4.889 -1.123 1.00 0.00 C ATOM 654 CE LYS A 45 -16.978 3.567 -1.312 1.00 0.00 C ATOM 655 NZ LYS A 45 -18.090 3.436 -0.361 1.00 0.00 N ATOM 0 H LYS A 45 -14.054 3.978 0.713 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.838 3.421 -1.918 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.836 5.990 -0.628 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -13.090 5.877 -2.210 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -15.276 5.646 -2.887 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.938 3.958 -2.558 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -15.879 4.979 -0.095 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -16.898 5.730 -1.306 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -17.361 3.507 -2.331 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -16.287 2.734 -1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.007 2.533 0.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -18.059 4.221 0.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -18.993 3.461 -0.877 1.00 0.00 H new ATOM 665 N LYS A 46 -11.376 4.916 0.644 1.00 0.00 N ATOM 666 CA LYS A 46 -10.049 5.363 1.086 1.00 0.00 C ATOM 667 C LYS A 46 -9.186 4.177 1.465 1.00 0.00 C ATOM 668 O LYS A 46 -9.323 3.712 2.589 1.00 0.00 O ATOM 669 CB LYS A 46 -10.182 6.433 2.185 1.00 0.00 C ATOM 670 CG LYS A 46 -8.898 7.207 2.515 1.00 0.00 C ATOM 671 CD LYS A 46 -8.928 7.857 3.918 1.00 0.00 C ATOM 672 CE LYS A 46 -8.595 9.357 3.975 1.00 0.00 C ATOM 673 NZ LYS A 46 -9.754 10.212 3.662 1.00 0.00 N ATOM 0 H LYS A 46 -12.128 5.080 1.314 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.527 5.850 0.263 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.948 7.147 1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.539 5.951 3.095 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -8.046 6.530 2.452 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -8.745 7.982 1.765 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.921 7.709 4.344 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -8.224 7.325 4.558 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -8.225 9.605 4.970 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -7.790 9.573 3.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -9.472 11.212 3.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.094 9.999 2.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -10.515 10.030 4.347 1.00 0.00 H new ATOM 683 N ILE A 47 -8.360 3.641 0.559 1.00 0.00 N ATOM 684 CA ILE A 47 -7.539 2.486 0.890 1.00 0.00 C ATOM 685 C ILE A 47 -6.274 3.006 1.589 1.00 0.00 C ATOM 686 O ILE A 47 -5.451 3.687 0.975 1.00 0.00 O ATOM 687 CB ILE A 47 -7.259 1.540 -0.304 1.00 0.00 C ATOM 688 CG1 ILE A 47 -8.436 1.301 -1.285 1.00 0.00 C ATOM 689 CG2 ILE A 47 -6.831 0.177 0.278 1.00 0.00 C ATOM 690 CD1 ILE A 47 -9.762 0.852 -0.659 1.00 0.00 C ATOM 0 H ILE A 47 -8.248 3.987 -0.394 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.089 1.834 1.569 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.492 2.034 -0.901 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.614 2.224 -1.837 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.129 0.549 -2.011 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.625 -0.518 -0.536 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.933 0.305 0.882 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.633 -0.221 0.900 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -10.507 0.718 -1.443 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -9.615 -0.091 -0.133 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -10.108 1.610 0.044 1.00 0.00 H new ATOM 701 N VAL A 48 -6.155 2.739 2.888 1.00 0.00 N ATOM 702 CA VAL A 48 -5.112 3.253 3.782 1.00 0.00 C ATOM 703 C VAL A 48 -4.152 2.134 4.147 1.00 0.00 C ATOM 704 O VAL A 48 -4.580 1.152 4.740 1.00 0.00 O ATOM 705 CB VAL A 48 -5.759 3.834 5.058 1.00 0.00 C ATOM 706 CG1 VAL A 48 -4.795 4.687 5.868 1.00 0.00 C ATOM 707 CG2 VAL A 48 -7.008 4.676 4.781 1.00 0.00 C ATOM 0 H VAL A 48 -6.814 2.129 3.372 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.559 4.043 3.274 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.045 2.951 5.629 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -5.303 5.069 6.753 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.941 4.082 6.173 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.449 5.522 5.259 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.410 5.052 5.722 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.745 5.516 4.137 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.759 4.061 4.286 1.00 0.00 H new ATOM 717 N LEU A 49 -2.882 2.231 3.765 1.00 0.00 N ATOM 718 CA LEU A 49 -1.964 1.104 3.774 1.00 0.00 C ATOM 719 C LEU A 49 -0.742 1.339 4.630 1.00 0.00 C ATOM 720 O LEU A 49 0.096 2.151 4.285 1.00 0.00 O ATOM 721 CB LEU A 49 -1.634 0.733 2.335 1.00 0.00 C ATOM 722 CG LEU A 49 -2.800 -0.079 1.740 1.00 0.00 C ATOM 723 CD1 LEU A 49 -3.327 0.602 0.491 1.00 0.00 C ATOM 724 CD2 LEU A 49 -2.435 -1.539 1.485 1.00 0.00 C ATOM 0 H LEU A 49 -2.461 3.101 3.439 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.452 0.254 4.250 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.464 1.633 1.745 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.714 0.150 2.299 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.597 -0.103 2.483 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.151 0.019 0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.680 1.602 0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.529 0.675 -0.248 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.295 -2.061 1.066 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.603 -1.589 0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.146 -2.011 2.424 1.00 0.00 H new ATOM 735 N ASP A 50 -0.684 0.636 5.751 1.00 0.00 N ATOM 736 CA ASP A 50 0.239 0.824 6.873 1.00 0.00 C ATOM 737 C ASP A 50 1.486 -0.031 6.676 1.00 0.00 C ATOM 738 O ASP A 50 1.344 -1.255 6.613 1.00 0.00 O ATOM 739 CB ASP A 50 -0.456 0.309 8.134 1.00 0.00 C ATOM 740 CG ASP A 50 0.322 0.677 9.397 1.00 0.00 C ATOM 741 OD1 ASP A 50 1.396 0.079 9.644 1.00 0.00 O ATOM 742 OD2 ASP A 50 -0.169 1.538 10.161 1.00 0.00 O ATOM 0 H ASP A 50 -1.326 -0.139 5.918 1.00 0.00 H new ATOM 0 HA ASP A 50 0.513 1.877 6.945 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.462 0.726 8.191 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.563 -0.774 8.075 1.00 0.00 H new ATOM 746 N LEU A 51 2.691 0.534 6.572 1.00 0.00 N ATOM 747 CA LEU A 51 3.893 -0.173 6.187 1.00 0.00 C ATOM 748 C LEU A 51 4.858 -0.395 7.344 1.00 0.00 C ATOM 749 O LEU A 51 6.050 -0.618 7.118 1.00 0.00 O ATOM 750 CB LEU A 51 4.560 0.531 4.998 1.00 0.00 C ATOM 751 CG LEU A 51 3.723 0.621 3.714 1.00 0.00 C ATOM 752 CD1 LEU A 51 2.748 -0.526 3.418 1.00 0.00 C ATOM 753 CD2 LEU A 51 2.985 1.939 3.616 1.00 0.00 C ATOM 0 H LEU A 51 2.851 1.524 6.761 1.00 0.00 H new ATOM 0 HA LEU A 51 3.596 -1.174 5.874 1.00 0.00 H new ATOM 0 HB2 LEU A 51 4.829 1.542 5.304 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.489 0.010 4.767 1.00 0.00 H new ATOM 0 HG LEU A 51 4.491 0.535 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.226 -0.328 2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.301 -1.461 3.334 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.023 -0.605 4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.405 1.963 2.694 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.315 2.045 4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.703 2.759 3.614 1.00 0.00 H new ATOM 764 N SER A 52 4.364 -0.393 8.578 1.00 0.00 N ATOM 765 CA SER A 52 5.190 -0.623 9.745 1.00 0.00 C ATOM 766 C SER A 52 5.920 -1.979 9.701 1.00 0.00 C ATOM 767 O SER A 52 6.967 -2.157 10.336 1.00 0.00 O ATOM 768 CB SER A 52 4.320 -0.484 11.000 1.00 0.00 C ATOM 769 OG SER A 52 3.181 -1.321 10.946 1.00 0.00 O ATOM 0 H SER A 52 3.380 -0.231 8.791 1.00 0.00 H new ATOM 0 HA SER A 52 5.980 0.128 9.764 1.00 0.00 H new ATOM 0 HB2 SER A 52 4.912 -0.732 11.881 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.004 0.553 11.110 1.00 0.00 H new ATOM 0 HG SER A 52 2.400 -0.794 10.675 1.00 0.00 H new ATOM 774 N SER A 53 5.373 -2.966 8.983 1.00 0.00 N ATOM 775 CA SER A 53 5.941 -4.304 8.834 1.00 0.00 C ATOM 776 C SER A 53 6.955 -4.374 7.687 1.00 0.00 C ATOM 777 O SER A 53 7.580 -5.417 7.495 1.00 0.00 O ATOM 778 CB SER A 53 4.828 -5.328 8.587 1.00 0.00 C ATOM 779 OG SER A 53 3.721 -5.116 9.445 1.00 0.00 O ATOM 0 H SER A 53 4.496 -2.849 8.475 1.00 0.00 H new ATOM 0 HA SER A 53 6.462 -4.536 9.763 1.00 0.00 H new ATOM 0 HB2 SER A 53 4.501 -5.267 7.549 1.00 0.00 H new ATOM 0 HB3 SER A 53 5.219 -6.334 8.739 1.00 0.00 H new ATOM 0 HG SER A 53 3.102 -5.872 9.374 1.00 0.00 H new ATOM 784 N VAL A 54 7.108 -3.321 6.884 1.00 0.00 N ATOM 785 CA VAL A 54 7.794 -3.422 5.605 1.00 0.00 C ATOM 786 C VAL A 54 9.265 -3.063 5.835 1.00 0.00 C ATOM 787 O VAL A 54 9.710 -1.938 5.612 1.00 0.00 O ATOM 788 CB VAL A 54 7.073 -2.574 4.535 1.00 0.00 C ATOM 789 CG1 VAL A 54 7.653 -2.856 3.136 1.00 0.00 C ATOM 790 CG2 VAL A 54 5.577 -2.898 4.495 1.00 0.00 C ATOM 0 H VAL A 54 6.763 -2.386 7.102 1.00 0.00 H new ATOM 0 HA VAL A 54 7.768 -4.436 5.205 1.00 0.00 H new ATOM 0 HB VAL A 54 7.221 -1.528 4.802 1.00 0.00 H new ATOM 0 HG11 VAL A 54 7.131 -2.249 2.397 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.714 -2.608 3.125 1.00 0.00 H new ATOM 0 HG13 VAL A 54 7.524 -3.911 2.895 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.093 -2.287 3.733 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.439 -3.953 4.256 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.133 -2.685 5.467 1.00 0.00 H new ATOM 800 N SER A 55 10.019 -4.028 6.355 1.00 0.00 N ATOM 801 CA SER A 55 11.397 -3.889 6.781 1.00 0.00 C ATOM 802 C SER A 55 12.386 -3.767 5.619 1.00 0.00 C ATOM 803 O SER A 55 13.515 -3.304 5.814 1.00 0.00 O ATOM 804 CB SER A 55 11.696 -5.136 7.598 1.00 0.00 C ATOM 805 OG SER A 55 11.284 -4.963 8.944 1.00 0.00 O ATOM 0 H SER A 55 9.662 -4.973 6.495 1.00 0.00 H new ATOM 0 HA SER A 55 11.516 -2.967 7.350 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.183 -5.994 7.163 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.764 -5.352 7.564 1.00 0.00 H new ATOM 0 HG SER A 55 11.483 -5.776 9.454 1.00 0.00 H new ATOM 810 N TYR A 56 11.991 -4.163 4.418 1.00 0.00 N ATOM 811 CA TYR A 56 12.745 -4.010 3.191 1.00 0.00 C ATOM 812 C TYR A 56 11.749 -3.757 2.074 1.00 0.00 C ATOM 813 O TYR A 56 10.588 -4.153 2.195 1.00 0.00 O ATOM 814 CB TYR A 56 13.561 -5.287 2.947 1.00 0.00 C ATOM 815 CG TYR A 56 14.135 -5.426 1.551 1.00 0.00 C ATOM 816 CD1 TYR A 56 15.374 -4.847 1.235 1.00 0.00 C ATOM 817 CD2 TYR A 56 13.401 -6.101 0.557 1.00 0.00 C ATOM 818 CE1 TYR A 56 15.892 -4.954 -0.067 1.00 0.00 C ATOM 819 CE2 TYR A 56 13.902 -6.191 -0.753 1.00 0.00 C ATOM 820 CZ TYR A 56 15.157 -5.619 -1.073 1.00 0.00 C ATOM 821 OH TYR A 56 15.699 -5.732 -2.318 1.00 0.00 O ATOM 0 H TYR A 56 11.092 -4.621 4.270 1.00 0.00 H new ATOM 0 HA TYR A 56 13.444 -3.175 3.243 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.381 -5.319 3.665 1.00 0.00 H new ATOM 0 HB3 TYR A 56 12.926 -6.150 3.150 1.00 0.00 H new ATOM 0 HD1 TYR A 56 15.931 -4.318 1.994 1.00 0.00 H new ATOM 0 HD2 TYR A 56 12.450 -6.551 0.802 1.00 0.00 H new ATOM 0 HE1 TYR A 56 16.856 -4.526 -0.299 1.00 0.00 H new ATOM 0 HE2 TYR A 56 13.329 -6.697 -1.516 1.00 0.00 H new ATOM 0 HH TYR A 56 15.053 -6.158 -2.919 1.00 0.00 H new ATOM 830 N MET A 57 12.221 -3.129 1.002 1.00 0.00 N ATOM 831 CA MET A 57 11.486 -2.900 -0.215 1.00 0.00 C ATOM 832 C MET A 57 12.483 -3.031 -1.355 1.00 0.00 C ATOM 833 O MET A 57 13.616 -2.557 -1.240 1.00 0.00 O ATOM 834 CB MET A 57 10.872 -1.499 -0.159 1.00 0.00 C ATOM 835 CG MET A 57 9.999 -1.128 -1.354 1.00 0.00 C ATOM 836 SD MET A 57 9.604 0.631 -1.485 1.00 0.00 S ATOM 837 CE MET A 57 7.957 0.419 -2.181 1.00 0.00 C ATOM 0 H MET A 57 13.169 -2.753 0.967 1.00 0.00 H new ATOM 0 HA MET A 57 10.673 -3.612 -0.355 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.273 -1.417 0.748 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.677 -0.769 -0.076 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.505 -1.442 -2.267 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.068 -1.692 -1.295 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.748 1.232 -2.876 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.905 -0.533 -2.710 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.219 0.429 -1.379 1.00 0.00 H new ATOM 845 N ASP A 58 12.049 -3.663 -2.439 1.00 0.00 N ATOM 846 CA ASP A 58 12.782 -3.785 -3.683 1.00 0.00 C ATOM 847 C ASP A 58 12.228 -2.774 -4.685 1.00 0.00 C ATOM 848 O ASP A 58 11.139 -2.226 -4.497 1.00 0.00 O ATOM 849 CB ASP A 58 12.571 -5.209 -4.220 1.00 0.00 C ATOM 850 CG ASP A 58 13.739 -5.713 -5.044 1.00 0.00 C ATOM 851 OD1 ASP A 58 13.898 -5.282 -6.207 1.00 0.00 O ATOM 852 OD2 ASP A 58 14.464 -6.589 -4.524 1.00 0.00 O ATOM 0 H ASP A 58 11.139 -4.122 -2.471 1.00 0.00 H new ATOM 0 HA ASP A 58 13.844 -3.594 -3.528 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.406 -5.886 -3.382 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.668 -5.231 -4.830 1.00 0.00 H new ATOM 856 N SER A 59 12.893 -2.630 -5.827 1.00 0.00 N ATOM 857 CA SER A 59 12.384 -1.897 -6.981 1.00 0.00 C ATOM 858 C SER A 59 11.021 -2.406 -7.472 1.00 0.00 C ATOM 859 O SER A 59 10.339 -1.695 -8.218 1.00 0.00 O ATOM 860 CB SER A 59 13.412 -2.010 -8.105 1.00 0.00 C ATOM 861 OG SER A 59 14.465 -1.101 -7.880 1.00 0.00 O ATOM 0 H SER A 59 13.820 -3.028 -5.979 1.00 0.00 H new ATOM 0 HA SER A 59 12.231 -0.861 -6.679 1.00 0.00 H new ATOM 0 HB2 SER A 59 13.801 -3.027 -8.154 1.00 0.00 H new ATOM 0 HB3 SER A 59 12.939 -1.803 -9.065 1.00 0.00 H new ATOM 0 HG SER A 59 15.123 -1.178 -8.602 1.00 0.00 H new ATOM 866 N ALA A 60 10.610 -3.609 -7.064 1.00 0.00 N ATOM 867 CA ALA A 60 9.371 -4.226 -7.489 1.00 0.00 C ATOM 868 C ALA A 60 8.170 -3.681 -6.716 1.00 0.00 C ATOM 869 O ALA A 60 7.056 -3.704 -7.238 1.00 0.00 O ATOM 870 CB ALA A 60 9.487 -5.744 -7.328 1.00 0.00 C ATOM 0 H ALA A 60 11.147 -4.185 -6.416 1.00 0.00 H new ATOM 0 HA ALA A 60 9.202 -3.984 -8.538 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.557 -6.216 -7.646 1.00 0.00 H new ATOM 0 HB2 ALA A 60 10.309 -6.113 -7.941 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.677 -5.986 -6.282 1.00 0.00 H new ATOM 876 N GLY A 61 8.369 -3.202 -5.488 1.00 0.00 N ATOM 877 CA GLY A 61 7.302 -2.864 -4.558 1.00 0.00 C ATOM 878 C GLY A 61 6.588 -1.609 -5.014 1.00 0.00 C ATOM 879 O GLY A 61 5.373 -1.577 -5.160 1.00 0.00 O ATOM 0 H GLY A 61 9.301 -3.036 -5.107 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.594 -3.690 -4.490 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.714 -2.715 -3.560 1.00 0.00 H new ATOM 883 N LEU A 62 7.367 -0.579 -5.316 1.00 0.00 N ATOM 884 CA LEU A 62 6.910 0.701 -5.840 1.00 0.00 C ATOM 885 C LEU A 62 6.216 0.496 -7.183 1.00 0.00 C ATOM 886 O LEU A 62 5.116 1.007 -7.393 1.00 0.00 O ATOM 887 CB LEU A 62 8.068 1.710 -5.952 1.00 0.00 C ATOM 888 CG LEU A 62 9.461 1.157 -6.308 1.00 0.00 C ATOM 889 CD1 LEU A 62 10.267 2.199 -7.077 1.00 0.00 C ATOM 890 CD2 LEU A 62 10.215 0.801 -5.026 1.00 0.00 C ATOM 0 H LEU A 62 8.379 -0.615 -5.197 1.00 0.00 H new ATOM 0 HA LEU A 62 6.189 1.123 -5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.797 2.450 -6.705 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.148 2.237 -5.001 1.00 0.00 H new ATOM 0 HG LEU A 62 9.333 0.270 -6.928 1.00 0.00 H new ATOM 0 HD11 LEU A 62 11.249 1.792 -7.321 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.743 2.458 -7.997 1.00 0.00 H new ATOM 0 HD13 LEU A 62 10.386 3.092 -6.464 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.200 0.410 -5.280 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.327 1.693 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 62 9.656 0.046 -4.473 1.00 0.00 H new ATOM 901 N GLY A 63 6.834 -0.298 -8.056 1.00 0.00 N ATOM 902 CA GLY A 63 6.318 -0.691 -9.359 1.00 0.00 C ATOM 903 C GLY A 63 5.090 -1.597 -9.294 1.00 0.00 C ATOM 904 O GLY A 63 4.482 -1.841 -10.338 1.00 0.00 O ATOM 0 H GLY A 63 7.750 -0.702 -7.862 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.065 0.206 -9.924 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.106 -1.204 -9.911 1.00 0.00 H new ATOM 908 N THR A 64 4.710 -2.062 -8.104 1.00 0.00 N ATOM 909 CA THR A 64 3.512 -2.813 -7.791 1.00 0.00 C ATOM 910 C THR A 64 2.508 -1.834 -7.185 1.00 0.00 C ATOM 911 O THR A 64 1.397 -1.760 -7.696 1.00 0.00 O ATOM 912 CB THR A 64 3.889 -4.009 -6.892 1.00 0.00 C ATOM 913 OG1 THR A 64 4.708 -4.853 -7.678 1.00 0.00 O ATOM 914 CG2 THR A 64 2.699 -4.804 -6.347 1.00 0.00 C ATOM 0 H THR A 64 5.283 -1.907 -7.274 1.00 0.00 H new ATOM 0 HA THR A 64 3.036 -3.254 -8.667 1.00 0.00 H new ATOM 0 HB THR A 64 4.391 -3.623 -6.005 1.00 0.00 H new ATOM 0 HG1 THR A 64 5.589 -4.440 -7.792 1.00 0.00 H new ATOM 0 HG21 THR A 64 3.062 -5.624 -5.727 1.00 0.00 H new ATOM 0 HG22 THR A 64 2.067 -4.148 -5.748 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.119 -5.207 -7.178 1.00 0.00 H new ATOM 922 N LEU A 65 2.891 -0.982 -6.227 1.00 0.00 N ATOM 923 CA LEU A 65 1.969 -0.022 -5.629 1.00 0.00 C ATOM 924 C LEU A 65 1.373 0.876 -6.706 1.00 0.00 C ATOM 925 O LEU A 65 0.161 1.063 -6.755 1.00 0.00 O ATOM 926 CB LEU A 65 2.674 0.824 -4.561 1.00 0.00 C ATOM 927 CG LEU A 65 2.872 0.132 -3.198 1.00 0.00 C ATOM 928 CD1 LEU A 65 3.853 0.955 -2.349 1.00 0.00 C ATOM 929 CD2 LEU A 65 1.559 0.014 -2.414 1.00 0.00 C ATOM 0 H LEU A 65 3.838 -0.942 -5.851 1.00 0.00 H new ATOM 0 HA LEU A 65 1.165 -0.577 -5.146 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.650 1.123 -4.943 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.099 1.737 -4.406 1.00 0.00 H new ATOM 0 HG LEU A 65 3.254 -0.870 -3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.996 0.469 -1.384 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.811 1.025 -2.865 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.450 1.956 -2.195 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.748 -0.480 -1.461 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.153 1.009 -2.233 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.842 -0.571 -2.990 1.00 0.00 H new ATOM 940 N VAL A 66 2.195 1.401 -7.604 1.00 0.00 N ATOM 941 CA VAL A 66 1.753 2.335 -8.628 1.00 0.00 C ATOM 942 C VAL A 66 0.726 1.720 -9.603 1.00 0.00 C ATOM 943 O VAL A 66 -0.114 2.446 -10.136 1.00 0.00 O ATOM 944 CB VAL A 66 3.019 2.900 -9.282 1.00 0.00 C ATOM 945 CG1 VAL A 66 3.735 1.906 -10.174 1.00 0.00 C ATOM 946 CG2 VAL A 66 2.740 4.195 -10.047 1.00 0.00 C ATOM 0 H VAL A 66 3.192 1.189 -7.642 1.00 0.00 H new ATOM 0 HA VAL A 66 1.184 3.157 -8.194 1.00 0.00 H new ATOM 0 HB VAL A 66 3.690 3.123 -8.453 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.621 2.374 -10.603 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.032 1.038 -9.586 1.00 0.00 H new ATOM 0 HG13 VAL A 66 3.068 1.590 -10.976 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.665 4.560 -10.494 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.008 4.003 -10.832 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.348 4.946 -9.361 1.00 0.00 H new ATOM 956 N VAL A 67 0.734 0.392 -9.787 1.00 0.00 N ATOM 957 CA VAL A 67 -0.335 -0.356 -10.474 1.00 0.00 C ATOM 958 C VAL A 67 -1.647 -0.155 -9.709 1.00 0.00 C ATOM 959 O VAL A 67 -2.675 0.137 -10.325 1.00 0.00 O ATOM 960 CB VAL A 67 0.018 -1.871 -10.584 1.00 0.00 C ATOM 961 CG1 VAL A 67 -1.072 -2.739 -11.230 1.00 0.00 C ATOM 962 CG2 VAL A 67 1.307 -2.126 -11.373 1.00 0.00 C ATOM 0 H VAL A 67 1.494 -0.204 -9.459 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.443 0.022 -11.491 1.00 0.00 H new ATOM 0 HB VAL A 67 0.133 -2.161 -9.540 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.739 -3.776 -11.264 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -1.987 -2.671 -10.642 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.265 -2.387 -12.243 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.501 -3.198 -11.416 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.197 -1.736 -12.385 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.140 -1.626 -10.880 1.00 0.00 H new ATOM 972 N ILE A 68 -1.618 -0.311 -8.387 1.00 0.00 N ATOM 973 CA ILE A 68 -2.813 -0.379 -7.557 1.00 0.00 C ATOM 974 C ILE A 68 -3.544 0.962 -7.532 1.00 0.00 C ATOM 975 O ILE A 68 -4.769 0.954 -7.551 1.00 0.00 O ATOM 976 CB ILE A 68 -2.482 -0.850 -6.127 1.00 0.00 C ATOM 977 CG1 ILE A 68 -1.646 -2.136 -6.049 1.00 0.00 C ATOM 978 CG2 ILE A 68 -3.775 -1.088 -5.331 1.00 0.00 C ATOM 979 CD1 ILE A 68 -2.270 -3.371 -6.684 1.00 0.00 C ATOM 0 H ILE A 68 -0.750 -0.395 -7.857 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.478 -1.118 -8.004 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.881 -0.044 -5.706 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.684 -1.951 -6.527 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -1.444 -2.353 -5.000 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.526 -1.420 -4.323 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -4.345 -0.160 -5.277 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.373 -1.852 -5.828 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.595 -4.219 -6.571 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -3.217 -3.593 -6.193 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -2.446 -3.186 -7.744 1.00 0.00 H new ATOM 990 N LEU A 69 -2.847 2.108 -7.553 1.00 0.00 N ATOM 991 CA LEU A 69 -3.527 3.412 -7.570 1.00 0.00 C ATOM 992 C LEU A 69 -4.513 3.487 -8.732 1.00 0.00 C ATOM 993 O LEU A 69 -5.618 4.008 -8.581 1.00 0.00 O ATOM 994 CB LEU A 69 -2.507 4.552 -7.669 1.00 0.00 C ATOM 995 CG LEU A 69 -3.146 5.950 -7.867 1.00 0.00 C ATOM 996 CD1 LEU A 69 -2.712 6.901 -6.757 1.00 0.00 C ATOM 997 CD2 LEU A 69 -2.816 6.534 -9.247 1.00 0.00 C ATOM 0 H LEU A 69 -1.828 2.159 -7.559 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.079 3.520 -6.636 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.902 4.565 -6.762 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.831 4.351 -8.500 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.228 5.829 -7.815 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.171 7.877 -6.914 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.027 6.503 -5.793 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.627 7.004 -6.770 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -3.282 7.514 -9.348 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.736 6.633 -9.351 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.196 5.870 -10.023 1.00 0.00 H new ATOM 1008 N LYS A 70 -4.104 2.946 -9.880 1.00 0.00 N ATOM 1009 CA LYS A 70 -4.946 2.856 -11.055 1.00 0.00 C ATOM 1010 C LYS A 70 -6.117 1.962 -10.694 1.00 0.00 C ATOM 1011 O LYS A 70 -7.217 2.466 -10.636 1.00 0.00 O ATOM 1012 CB LYS A 70 -4.181 2.381 -12.295 1.00 0.00 C ATOM 1013 CG LYS A 70 -2.734 2.880 -12.342 1.00 0.00 C ATOM 1014 CD LYS A 70 -2.036 2.437 -13.629 1.00 0.00 C ATOM 1015 CE LYS A 70 -0.526 2.678 -13.530 1.00 0.00 C ATOM 1016 NZ LYS A 70 -0.099 3.992 -14.054 1.00 0.00 N ATOM 0 H LYS A 70 -3.170 2.557 -10.013 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.310 3.844 -11.338 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.183 1.291 -12.319 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.704 2.721 -13.189 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.720 3.968 -12.274 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.187 2.499 -11.479 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.231 1.380 -13.810 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.443 2.986 -14.478 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -0.222 2.596 -12.487 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -0.005 1.892 -14.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.932 4.087 -13.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.359 4.066 -15.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.569 4.749 -13.518 1.00 0.00 H new ATOM 1026 N ASP A 71 -5.902 0.680 -10.407 1.00 0.00 N ATOM 1027 CA ASP A 71 -6.905 -0.311 -9.996 1.00 0.00 C ATOM 1028 C ASP A 71 -7.935 0.254 -9.008 1.00 0.00 C ATOM 1029 O ASP A 71 -9.136 0.085 -9.209 1.00 0.00 O ATOM 1030 CB ASP A 71 -6.212 -1.584 -9.458 1.00 0.00 C ATOM 1031 CG ASP A 71 -5.699 -2.504 -10.566 1.00 0.00 C ATOM 1032 OD1 ASP A 71 -5.168 -2.003 -11.583 1.00 0.00 O ATOM 1033 OD2 ASP A 71 -5.775 -3.744 -10.439 1.00 0.00 O ATOM 0 H ASP A 71 -4.967 0.276 -10.457 1.00 0.00 H new ATOM 0 HA ASP A 71 -7.478 -0.584 -10.882 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.377 -1.293 -8.820 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -6.914 -2.135 -8.833 1.00 0.00 H new ATOM 1037 N ALA A 72 -7.489 0.975 -7.978 1.00 0.00 N ATOM 1038 CA ALA A 72 -8.296 1.696 -7.022 1.00 0.00 C ATOM 1039 C ALA A 72 -9.193 2.668 -7.782 1.00 0.00 C ATOM 1040 O ALA A 72 -10.410 2.502 -7.760 1.00 0.00 O ATOM 1041 CB ALA A 72 -7.370 2.389 -6.002 1.00 0.00 C ATOM 0 H ALA A 72 -6.492 1.070 -7.787 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.945 1.029 -6.455 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.972 2.936 -5.277 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -6.772 1.639 -5.485 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.710 3.083 -6.523 1.00 0.00 H new ATOM 1047 N LYS A 73 -8.615 3.646 -8.477 1.00 0.00 N ATOM 1048 CA LYS A 73 -9.333 4.613 -9.300 1.00 0.00 C ATOM 1049 C LYS A 73 -10.271 3.935 -10.311 1.00 0.00 C ATOM 1050 O LYS A 73 -11.418 4.368 -10.410 1.00 0.00 O ATOM 1051 CB LYS A 73 -8.301 5.558 -9.939 1.00 0.00 C ATOM 1052 CG LYS A 73 -8.896 6.552 -10.948 1.00 0.00 C ATOM 1053 CD LYS A 73 -8.432 6.274 -12.384 1.00 0.00 C ATOM 1054 CE LYS A 73 -6.978 6.723 -12.592 1.00 0.00 C ATOM 1055 NZ LYS A 73 -6.854 7.682 -13.707 1.00 0.00 N ATOM 0 H LYS A 73 -7.605 3.790 -8.482 1.00 0.00 H new ATOM 0 HA LYS A 73 -10.005 5.208 -8.681 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.799 6.116 -9.149 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.540 4.960 -10.441 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -9.984 6.503 -10.904 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -8.611 7.566 -10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -8.521 5.209 -12.599 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -9.081 6.796 -13.087 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -6.604 7.181 -11.676 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -6.354 5.852 -12.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -5.858 7.961 -13.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -7.187 7.237 -14.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -7.430 8.524 -13.506 1.00 0.00 H new ATOM 1065 N ILE A 74 -9.864 2.868 -11.008 1.00 0.00 N ATOM 1066 CA ILE A 74 -10.672 2.094 -11.958 1.00 0.00 C ATOM 1067 C ILE A 74 -11.959 1.608 -11.273 1.00 0.00 C ATOM 1068 O ILE A 74 -12.977 1.438 -11.945 1.00 0.00 O ATOM 1069 CB ILE A 74 -9.856 0.908 -12.553 1.00 0.00 C ATOM 1070 CG1 ILE A 74 -8.607 1.363 -13.347 1.00 0.00 C ATOM 1071 CG2 ILE A 74 -10.720 0.025 -13.480 1.00 0.00 C ATOM 1072 CD1 ILE A 74 -7.659 0.221 -13.734 1.00 0.00 C ATOM 0 H ILE A 74 -8.916 2.503 -10.921 1.00 0.00 H new ATOM 0 HA ILE A 74 -10.950 2.739 -12.792 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.528 0.335 -11.686 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -8.932 1.873 -14.254 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.057 2.091 -12.751 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.114 -0.791 -13.874 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -11.557 -0.385 -12.915 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.100 0.627 -14.306 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -6.811 0.624 -14.287 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.301 -0.276 -12.832 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.191 -0.497 -14.358 1.00 0.00 H new ATOM 1083 N ASN A 75 -11.944 1.407 -9.950 1.00 0.00 N ATOM 1084 CA ASN A 75 -13.102 0.962 -9.189 1.00 0.00 C ATOM 1085 C ASN A 75 -13.627 2.014 -8.214 1.00 0.00 C ATOM 1086 O ASN A 75 -14.317 1.657 -7.250 1.00 0.00 O ATOM 1087 CB ASN A 75 -12.789 -0.362 -8.472 1.00 0.00 C ATOM 1088 CG ASN A 75 -14.009 -1.280 -8.450 1.00 0.00 C ATOM 1089 OD1 ASN A 75 -15.006 -1.054 -9.120 1.00 0.00 O ATOM 1090 ND2 ASN A 75 -14.000 -2.324 -7.650 1.00 0.00 N ATOM 0 H ASN A 75 -11.113 1.553 -9.377 1.00 0.00 H new ATOM 0 HA ASN A 75 -13.908 0.798 -9.904 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.962 -0.864 -8.974 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -12.466 -0.158 -7.451 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -14.817 -2.932 -7.595 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -13.176 -2.526 -7.084 1.00 0.00 H new ATOM 1096 N GLY A 76 -13.284 3.287 -8.422 1.00 0.00 N ATOM 1097 CA GLY A 76 -13.787 4.415 -7.653 1.00 0.00 C ATOM 1098 C GLY A 76 -13.162 4.528 -6.264 1.00 0.00 C ATOM 1099 O GLY A 76 -13.845 4.950 -5.330 1.00 0.00 O ATOM 0 H GLY A 76 -12.629 3.564 -9.153 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.597 5.335 -8.205 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.868 4.322 -7.551 1.00 0.00 H new ATOM 1103 N LYS A 77 -11.905 4.099 -6.077 1.00 0.00 N ATOM 1104 CA LYS A 77 -11.276 4.028 -4.755 1.00 0.00 C ATOM 1105 C LYS A 77 -10.099 5.011 -4.703 1.00 0.00 C ATOM 1106 O LYS A 77 -9.752 5.603 -5.725 1.00 0.00 O ATOM 1107 CB LYS A 77 -10.900 2.567 -4.418 1.00 0.00 C ATOM 1108 CG LYS A 77 -11.853 1.488 -4.994 1.00 0.00 C ATOM 1109 CD LYS A 77 -12.335 0.435 -4.002 1.00 0.00 C ATOM 1110 CE LYS A 77 -13.864 0.267 -4.018 1.00 0.00 C ATOM 1111 NZ LYS A 77 -14.380 -0.462 -5.198 1.00 0.00 N ATOM 0 H LYS A 77 -11.299 3.793 -6.838 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.973 4.335 -3.975 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.893 2.374 -4.788 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.868 2.458 -3.334 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -12.724 1.988 -5.418 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.345 0.982 -5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -11.865 -0.521 -4.235 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.014 0.712 -2.998 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -14.170 -0.262 -3.115 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -14.327 1.253 -3.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -15.377 -0.712 -5.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -14.302 0.142 -6.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -13.824 -1.329 -5.341 1.00 0.00 H new ATOM 1121 N GLU A 78 -9.492 5.207 -3.535 1.00 0.00 N ATOM 1122 CA GLU A 78 -8.423 6.163 -3.252 1.00 0.00 C ATOM 1123 C GLU A 78 -7.270 5.426 -2.574 1.00 0.00 C ATOM 1124 O GLU A 78 -7.452 4.286 -2.151 1.00 0.00 O ATOM 1125 CB GLU A 78 -8.948 7.265 -2.312 1.00 0.00 C ATOM 1126 CG GLU A 78 -8.390 8.642 -2.670 1.00 0.00 C ATOM 1127 CD GLU A 78 -8.809 9.138 -4.058 1.00 0.00 C ATOM 1128 OE1 GLU A 78 -9.939 8.862 -4.501 1.00 0.00 O ATOM 1129 OE2 GLU A 78 -7.992 9.797 -4.746 1.00 0.00 O ATOM 0 H GLU A 78 -9.750 4.668 -2.708 1.00 0.00 H new ATOM 0 HA GLU A 78 -8.081 6.618 -4.181 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -10.037 7.292 -2.359 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.679 7.022 -1.284 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.720 9.363 -1.922 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.302 8.607 -2.620 1.00 0.00 H new ATOM 1134 N PHE A 79 -6.110 6.058 -2.386 1.00 0.00 N ATOM 1135 CA PHE A 79 -4.918 5.352 -1.945 1.00 0.00 C ATOM 1136 C PHE A 79 -3.995 6.255 -1.135 1.00 0.00 C ATOM 1137 O PHE A 79 -3.660 7.367 -1.564 1.00 0.00 O ATOM 1138 CB PHE A 79 -4.197 4.797 -3.170 1.00 0.00 C ATOM 1139 CG PHE A 79 -2.732 4.534 -2.900 1.00 0.00 C ATOM 1140 CD1 PHE A 79 -2.354 3.471 -2.060 1.00 0.00 C ATOM 1141 CD2 PHE A 79 -1.762 5.435 -3.372 1.00 0.00 C ATOM 1142 CE1 PHE A 79 -0.999 3.263 -1.773 1.00 0.00 C ATOM 1143 CE2 PHE A 79 -0.410 5.241 -3.066 1.00 0.00 C ATOM 1144 CZ PHE A 79 -0.026 4.127 -2.308 1.00 0.00 C ATOM 0 H PHE A 79 -5.976 7.058 -2.534 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.213 4.535 -1.287 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.679 3.871 -3.485 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -4.292 5.502 -3.996 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.105 2.819 -1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.061 6.281 -3.973 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.701 2.439 -1.141 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.332 5.945 -3.412 1.00 0.00 H new ATOM 0 HZ PHE A 79 1.022 3.931 -2.134 1.00 0.00 H new ATOM 1153 N ILE A 80 -3.577 5.751 0.027 1.00 0.00 N ATOM 1154 CA ILE A 80 -2.728 6.432 0.990 1.00 0.00 C ATOM 1155 C ILE A 80 -1.811 5.376 1.605 1.00 0.00 C ATOM 1156 O ILE A 80 -2.265 4.263 1.865 1.00 0.00 O ATOM 1157 CB ILE A 80 -3.620 7.164 2.038 1.00 0.00 C ATOM 1158 CG1 ILE A 80 -4.717 8.017 1.346 1.00 0.00 C ATOM 1159 CG2 ILE A 80 -2.746 8.020 2.980 1.00 0.00 C ATOM 1160 CD1 ILE A 80 -5.768 8.627 2.254 1.00 0.00 C ATOM 0 H ILE A 80 -3.837 4.813 0.331 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.108 7.202 0.530 1.00 0.00 H new ATOM 0 HB ILE A 80 -4.131 6.413 2.640 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.229 8.823 0.799 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -5.222 7.392 0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -3.382 8.526 3.707 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.037 7.378 3.503 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.201 8.762 2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -6.478 9.199 1.656 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.296 7.834 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.287 9.287 2.975 1.00 0.00 H new ATOM 1171 N LEU A 81 -0.563 5.716 1.936 1.00 0.00 N ATOM 1172 CA LEU A 81 0.388 4.881 2.682 1.00 0.00 C ATOM 1173 C LEU A 81 0.578 5.475 4.074 1.00 0.00 C ATOM 1174 O LEU A 81 0.482 6.691 4.210 1.00 0.00 O ATOM 1175 CB LEU A 81 1.764 4.907 2.004 1.00 0.00 C ATOM 1176 CG LEU A 81 1.837 4.307 0.595 1.00 0.00 C ATOM 1177 CD1 LEU A 81 3.229 4.572 0.018 1.00 0.00 C ATOM 1178 CD2 LEU A 81 1.600 2.794 0.521 1.00 0.00 C ATOM 0 H LEU A 81 -0.168 6.621 1.681 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.002 3.864 2.721 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.101 5.942 1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.469 4.373 2.641 1.00 0.00 H new ATOM 0 HG LEU A 81 1.034 4.786 0.035 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.294 4.150 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.405 5.647 -0.029 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.982 4.109 0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.672 2.465 -0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.352 2.278 1.119 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.608 2.562 0.907 1.00 0.00 H new ATOM 1189 N SER A 82 0.841 4.663 5.096 1.00 0.00 N ATOM 1190 CA SER A 82 0.931 5.077 6.475 1.00 0.00 C ATOM 1191 C SER A 82 2.087 4.357 7.170 1.00 0.00 C ATOM 1192 O SER A 82 2.520 3.304 6.713 1.00 0.00 O ATOM 1193 CB SER A 82 -0.449 4.779 7.079 1.00 0.00 C ATOM 1194 OG SER A 82 -1.073 3.597 6.655 1.00 0.00 O ATOM 0 H SER A 82 1.002 3.664 4.971 1.00 0.00 H new ATOM 0 HA SER A 82 1.159 6.136 6.595 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.346 4.741 8.163 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.110 5.615 6.850 1.00 0.00 H new ATOM 0 HG SER A 82 -1.742 3.808 5.970 1.00 0.00 H new ATOM 1199 N SER A 83 2.575 4.867 8.299 1.00 0.00 N ATOM 1200 CA SER A 83 3.556 4.193 9.148 1.00 0.00 C ATOM 1201 C SER A 83 4.827 3.771 8.392 1.00 0.00 C ATOM 1202 O SER A 83 5.407 2.719 8.680 1.00 0.00 O ATOM 1203 CB SER A 83 2.854 3.013 9.838 1.00 0.00 C ATOM 1204 OG SER A 83 3.333 2.865 11.157 1.00 0.00 O ATOM 0 H SER A 83 2.294 5.780 8.657 1.00 0.00 H new ATOM 0 HA SER A 83 3.919 4.894 9.900 1.00 0.00 H new ATOM 0 HB2 SER A 83 1.777 3.178 9.851 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.029 2.096 9.275 1.00 0.00 H new ATOM 0 HG SER A 83 2.687 2.350 11.684 1.00 0.00 H new ATOM 1209 N LEU A 84 5.253 4.550 7.394 1.00 0.00 N ATOM 1210 CA LEU A 84 6.376 4.176 6.547 1.00 0.00 C ATOM 1211 C LEU A 84 7.661 4.223 7.350 1.00 0.00 C ATOM 1212 O LEU A 84 7.888 5.134 8.145 1.00 0.00 O ATOM 1213 CB LEU A 84 6.455 5.098 5.323 1.00 0.00 C ATOM 1214 CG LEU A 84 5.553 4.579 4.195 1.00 0.00 C ATOM 1215 CD1 LEU A 84 5.101 5.738 3.316 1.00 0.00 C ATOM 1216 CD2 LEU A 84 6.306 3.516 3.376 1.00 0.00 C ATOM 0 H LEU A 84 4.831 5.448 7.156 1.00 0.00 H new ATOM 0 HA LEU A 84 6.230 3.158 6.187 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.153 6.108 5.602 1.00 0.00 H new ATOM 0 HB3 LEU A 84 7.485 5.159 4.973 1.00 0.00 H new ATOM 0 HG LEU A 84 4.664 4.114 4.621 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.461 5.361 2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.545 6.456 3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.973 6.227 2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.662 3.150 2.576 1.00 0.00 H new ATOM 0 HD22 LEU A 84 7.205 3.958 2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.585 2.686 4.026 1.00 0.00 H new ATOM 1227 N LYS A 85 8.522 3.227 7.136 1.00 0.00 N ATOM 1228 CA LYS A 85 9.857 3.236 7.708 1.00 0.00 C ATOM 1229 C LYS A 85 10.662 4.307 7.037 1.00 0.00 C ATOM 1230 O LYS A 85 10.575 4.457 5.824 1.00 0.00 O ATOM 1231 CB LYS A 85 10.561 1.906 7.516 1.00 0.00 C ATOM 1232 CG LYS A 85 9.800 0.825 8.269 1.00 0.00 C ATOM 1233 CD LYS A 85 10.721 -0.355 8.559 1.00 0.00 C ATOM 1234 CE LYS A 85 10.102 -1.172 9.689 1.00 0.00 C ATOM 1235 NZ LYS A 85 10.994 -1.209 10.868 1.00 0.00 N ATOM 0 H LYS A 85 8.312 2.405 6.569 1.00 0.00 H new ATOM 0 HA LYS A 85 9.766 3.422 8.778 1.00 0.00 H new ATOM 0 HB2 LYS A 85 10.614 1.659 6.456 1.00 0.00 H new ATOM 0 HB3 LYS A 85 11.586 1.967 7.881 1.00 0.00 H new ATOM 0 HG2 LYS A 85 9.407 1.228 9.202 1.00 0.00 H new ATOM 0 HG3 LYS A 85 8.945 0.493 7.680 1.00 0.00 H new ATOM 0 HD2 LYS A 85 10.844 -0.970 7.668 1.00 0.00 H new ATOM 0 HD3 LYS A 85 11.713 -0.003 8.843 1.00 0.00 H new ATOM 0 HE2 LYS A 85 9.141 -0.741 9.969 1.00 0.00 H new ATOM 0 HE3 LYS A 85 9.908 -2.187 9.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.550 -1.771 11.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 11.902 -1.642 10.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 11.159 -0.240 11.209 1.00 0.00 H new ATOM 1245 N GLU A 86 11.566 4.902 7.794 1.00 0.00 N ATOM 1246 CA GLU A 86 12.440 5.966 7.317 1.00 0.00 C ATOM 1247 C GLU A 86 13.222 5.479 6.088 1.00 0.00 C ATOM 1248 O GLU A 86 13.371 6.195 5.094 1.00 0.00 O ATOM 1249 CB GLU A 86 13.374 6.384 8.467 1.00 0.00 C ATOM 1250 CG GLU A 86 14.273 7.586 8.150 1.00 0.00 C ATOM 1251 CD GLU A 86 13.613 8.947 8.390 1.00 0.00 C ATOM 1252 OE1 GLU A 86 12.455 9.185 7.979 1.00 0.00 O ATOM 1253 OE2 GLU A 86 14.301 9.818 8.970 1.00 0.00 O ATOM 0 H GLU A 86 11.718 4.658 8.773 1.00 0.00 H new ATOM 0 HA GLU A 86 11.861 6.837 7.009 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.769 6.620 9.343 1.00 0.00 H new ATOM 0 HB3 GLU A 86 14.004 5.535 8.734 1.00 0.00 H new ATOM 0 HG2 GLU A 86 15.175 7.520 8.758 1.00 0.00 H new ATOM 0 HG3 GLU A 86 14.586 7.526 7.108 1.00 0.00 H new ATOM 1258 N SER A 87 13.652 4.213 6.127 1.00 0.00 N ATOM 1259 CA SER A 87 14.461 3.617 5.067 1.00 0.00 C ATOM 1260 C SER A 87 13.661 3.378 3.786 1.00 0.00 C ATOM 1261 O SER A 87 14.259 3.192 2.733 1.00 0.00 O ATOM 1262 CB SER A 87 15.053 2.284 5.532 1.00 0.00 C ATOM 1263 OG SER A 87 15.726 2.425 6.768 1.00 0.00 O ATOM 0 H SER A 87 13.447 3.575 6.896 1.00 0.00 H new ATOM 0 HA SER A 87 15.256 4.330 4.846 1.00 0.00 H new ATOM 0 HB2 SER A 87 14.258 1.545 5.630 1.00 0.00 H new ATOM 0 HB3 SER A 87 15.746 1.909 4.779 1.00 0.00 H new ATOM 0 HG SER A 87 16.092 1.558 7.042 1.00 0.00 H new ATOM 1268 N ILE A 88 12.330 3.371 3.855 1.00 0.00 N ATOM 1269 CA ILE A 88 11.447 3.159 2.721 1.00 0.00 C ATOM 1270 C ILE A 88 10.931 4.527 2.274 1.00 0.00 C ATOM 1271 O ILE A 88 10.805 4.799 1.081 1.00 0.00 O ATOM 1272 CB ILE A 88 10.310 2.200 3.120 1.00 0.00 C ATOM 1273 CG1 ILE A 88 10.811 0.825 3.644 1.00 0.00 C ATOM 1274 CG2 ILE A 88 9.362 2.000 1.930 1.00 0.00 C ATOM 1275 CD1 ILE A 88 11.924 0.151 2.839 1.00 0.00 C ATOM 0 H ILE A 88 11.827 3.518 4.730 1.00 0.00 H new ATOM 0 HA ILE A 88 11.970 2.692 1.886 1.00 0.00 H new ATOM 0 HB ILE A 88 9.782 2.667 3.951 1.00 0.00 H new ATOM 0 HG12 ILE A 88 11.163 0.958 4.667 1.00 0.00 H new ATOM 0 HG13 ILE A 88 9.960 0.145 3.685 1.00 0.00 H new ATOM 0 HG21 ILE A 88 8.558 1.321 2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 88 8.938 2.961 1.637 1.00 0.00 H new ATOM 0 HG23 ILE A 88 9.915 1.576 1.092 1.00 0.00 H new ATOM 0 HD11 ILE A 88 12.186 -0.799 3.305 1.00 0.00 H new ATOM 0 HD12 ILE A 88 11.580 -0.027 1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 88 12.801 0.798 2.818 1.00 0.00 H new ATOM 1286 N SER A 89 10.701 5.434 3.216 1.00 0.00 N ATOM 1287 CA SER A 89 10.239 6.773 2.925 1.00 0.00 C ATOM 1288 C SER A 89 11.239 7.462 1.987 1.00 0.00 C ATOM 1289 O SER A 89 10.871 7.957 0.919 1.00 0.00 O ATOM 1290 CB SER A 89 10.058 7.586 4.207 1.00 0.00 C ATOM 1291 OG SER A 89 9.118 6.974 5.055 1.00 0.00 O ATOM 0 H SER A 89 10.833 5.252 4.211 1.00 0.00 H new ATOM 0 HA SER A 89 9.267 6.710 2.436 1.00 0.00 H new ATOM 0 HB2 SER A 89 11.014 7.679 4.723 1.00 0.00 H new ATOM 0 HB3 SER A 89 9.729 8.596 3.960 1.00 0.00 H new ATOM 0 HG SER A 89 9.484 6.130 5.394 1.00 0.00 H new ATOM 1296 N ARG A 90 12.534 7.412 2.332 1.00 0.00 N ATOM 1297 CA ARG A 90 13.606 7.920 1.473 1.00 0.00 C ATOM 1298 C ARG A 90 13.602 7.276 0.096 1.00 0.00 C ATOM 1299 O ARG A 90 13.967 7.955 -0.854 1.00 0.00 O ATOM 1300 CB ARG A 90 14.970 7.712 2.134 1.00 0.00 C ATOM 1301 CG ARG A 90 15.472 6.272 1.988 1.00 0.00 C ATOM 1302 CD ARG A 90 16.726 6.048 2.790 1.00 0.00 C ATOM 1303 NE ARG A 90 17.929 6.519 2.085 1.00 0.00 N ATOM 1304 CZ ARG A 90 18.830 7.417 2.501 1.00 0.00 C ATOM 1305 NH1 ARG A 90 18.691 8.044 3.664 1.00 0.00 N ATOM 1306 NH2 ARG A 90 19.876 7.681 1.728 1.00 0.00 N ATOM 0 H ARG A 90 12.864 7.018 3.213 1.00 0.00 H new ATOM 0 HA ARG A 90 13.421 8.986 1.340 1.00 0.00 H new ATOM 0 HB2 ARG A 90 15.695 8.394 1.689 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.901 7.965 3.192 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.698 5.579 2.318 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.666 6.057 0.937 1.00 0.00 H new ATOM 0 HD2 ARG A 90 16.641 6.565 3.746 1.00 0.00 H new ATOM 0 HD3 ARG A 90 16.829 4.986 3.011 1.00 0.00 H new ATOM 0 HE ARG A 90 18.097 6.110 1.166 1.00 0.00 H new ATOM 0 HH11 ARG A 90 17.886 7.844 4.258 1.00 0.00 H new ATOM 0 HH12 ARG A 90 19.389 8.725 3.963 1.00 0.00 H new ATOM 0 HH21 ARG A 90 19.983 7.203 0.834 1.00 0.00 H new ATOM 0 HH22 ARG A 90 20.573 8.362 2.028 1.00 0.00 H new ATOM 1317 N ILE A 91 13.275 5.986 -0.003 1.00 0.00 N ATOM 1318 CA ILE A 91 13.370 5.184 -1.207 1.00 0.00 C ATOM 1319 C ILE A 91 12.313 5.730 -2.171 1.00 0.00 C ATOM 1320 O ILE A 91 12.609 6.098 -3.310 1.00 0.00 O ATOM 1321 CB ILE A 91 13.156 3.693 -0.812 1.00 0.00 C ATOM 1322 CG1 ILE A 91 14.497 2.989 -0.554 1.00 0.00 C ATOM 1323 CG2 ILE A 91 12.310 2.910 -1.825 1.00 0.00 C ATOM 1324 CD1 ILE A 91 14.340 1.549 -0.033 1.00 0.00 C ATOM 0 H ILE A 91 12.922 5.456 0.794 1.00 0.00 H new ATOM 0 HA ILE A 91 14.340 5.236 -1.701 1.00 0.00 H new ATOM 0 HB ILE A 91 12.585 3.707 0.116 1.00 0.00 H new ATOM 0 HG12 ILE A 91 15.074 2.972 -1.479 1.00 0.00 H new ATOM 0 HG13 ILE A 91 15.070 3.569 0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 91 12.201 1.879 -1.488 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.326 3.370 -1.910 1.00 0.00 H new ATOM 0 HG23 ILE A 91 12.802 2.923 -2.798 1.00 0.00 H new ATOM 0 HD11 ILE A 91 15.325 1.111 0.128 1.00 0.00 H new ATOM 0 HD12 ILE A 91 13.790 1.560 0.908 1.00 0.00 H new ATOM 0 HD13 ILE A 91 13.794 0.955 -0.765 1.00 0.00 H new ATOM 1335 N LEU A 92 11.073 5.844 -1.680 1.00 0.00 N ATOM 1336 CA LEU A 92 9.955 6.396 -2.409 1.00 0.00 C ATOM 1337 C LEU A 92 10.346 7.800 -2.836 1.00 0.00 C ATOM 1338 O LEU A 92 10.291 8.129 -4.017 1.00 0.00 O ATOM 1339 CB LEU A 92 8.689 6.410 -1.534 1.00 0.00 C ATOM 1340 CG LEU A 92 8.241 5.018 -1.033 1.00 0.00 C ATOM 1341 CD1 LEU A 92 7.298 5.132 0.169 1.00 0.00 C ATOM 1342 CD2 LEU A 92 7.588 4.218 -2.159 1.00 0.00 C ATOM 0 H LEU A 92 10.826 5.543 -0.737 1.00 0.00 H new ATOM 0 HA LEU A 92 9.724 5.787 -3.283 1.00 0.00 H new ATOM 0 HB2 LEU A 92 8.866 7.053 -0.672 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.874 6.857 -2.103 1.00 0.00 H new ATOM 0 HG LEU A 92 9.133 4.484 -0.706 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.003 4.135 0.496 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.808 5.645 0.984 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.411 5.698 -0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.281 3.242 -1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.714 4.755 -2.528 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.302 4.085 -2.972 1.00 0.00 H new ATOM 1353 N LYS A 93 10.810 8.629 -1.903 1.00 0.00 N ATOM 1354 CA LYS A 93 11.215 9.989 -2.169 1.00 0.00 C ATOM 1355 C LYS A 93 12.241 10.041 -3.303 1.00 0.00 C ATOM 1356 O LYS A 93 12.046 10.786 -4.263 1.00 0.00 O ATOM 1357 CB LYS A 93 11.686 10.573 -0.836 1.00 0.00 C ATOM 1358 CG LYS A 93 12.408 11.893 -1.015 1.00 0.00 C ATOM 1359 CD LYS A 93 12.147 12.855 0.148 1.00 0.00 C ATOM 1360 CE LYS A 93 13.133 14.022 0.081 1.00 0.00 C ATOM 1361 NZ LYS A 93 12.789 15.095 1.029 1.00 0.00 N ATOM 0 H LYS A 93 10.913 8.359 -0.925 1.00 0.00 H new ATOM 0 HA LYS A 93 10.396 10.606 -2.538 1.00 0.00 H new ATOM 0 HB2 LYS A 93 10.827 10.716 -0.180 1.00 0.00 H new ATOM 0 HB3 LYS A 93 12.349 9.862 -0.343 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.479 11.711 -1.101 1.00 0.00 H new ATOM 0 HG3 LYS A 93 12.088 12.357 -1.948 1.00 0.00 H new ATOM 0 HD2 LYS A 93 11.124 13.228 0.102 1.00 0.00 H new ATOM 0 HD3 LYS A 93 12.253 12.330 1.098 1.00 0.00 H new ATOM 0 HE2 LYS A 93 14.138 13.659 0.295 1.00 0.00 H new ATOM 0 HE3 LYS A 93 13.148 14.425 -0.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 13.484 15.865 0.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 11.840 15.461 0.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 12.800 14.718 1.998 1.00 0.00 H new ATOM 1371 N LEU A 94 13.279 9.211 -3.221 1.00 0.00 N ATOM 1372 CA LEU A 94 14.385 9.104 -4.159 1.00 0.00 C ATOM 1373 C LEU A 94 13.893 8.844 -5.572 1.00 0.00 C ATOM 1374 O LEU A 94 14.168 9.636 -6.476 1.00 0.00 O ATOM 1375 CB LEU A 94 15.350 7.986 -3.710 1.00 0.00 C ATOM 1376 CG LEU A 94 16.474 8.469 -2.783 1.00 0.00 C ATOM 1377 CD1 LEU A 94 17.333 7.292 -2.332 1.00 0.00 C ATOM 1378 CD2 LEU A 94 17.352 9.536 -3.432 1.00 0.00 C ATOM 0 H LEU A 94 13.372 8.555 -2.446 1.00 0.00 H new ATOM 0 HA LEU A 94 14.917 10.055 -4.165 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.779 7.211 -3.199 1.00 0.00 H new ATOM 0 HB3 LEU A 94 15.793 7.526 -4.593 1.00 0.00 H new ATOM 0 HG LEU A 94 15.995 8.926 -1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 94 18.126 7.651 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 94 16.713 6.574 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 94 17.775 6.809 -3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 94 18.130 9.842 -2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 94 17.813 9.130 -4.333 1.00 0.00 H new ATOM 0 HD23 LEU A 94 16.741 10.400 -3.695 1.00 0.00 H new ATOM 1389 N THR A 95 13.155 7.761 -5.781 1.00 0.00 N ATOM 1390 CA THR A 95 12.653 7.397 -7.100 1.00 0.00 C ATOM 1391 C THR A 95 11.500 8.299 -7.575 1.00 0.00 C ATOM 1392 O THR A 95 11.026 8.155 -8.704 1.00 0.00 O ATOM 1393 CB THR A 95 12.412 5.877 -7.081 1.00 0.00 C ATOM 1394 OG1 THR A 95 13.692 5.261 -7.077 1.00 0.00 O ATOM 1395 CG2 THR A 95 11.649 5.282 -8.259 1.00 0.00 C ATOM 0 H THR A 95 12.888 7.111 -5.042 1.00 0.00 H new ATOM 0 HA THR A 95 13.380 7.594 -7.888 1.00 0.00 H new ATOM 0 HB THR A 95 11.789 5.694 -6.206 1.00 0.00 H new ATOM 0 HG1 THR A 95 13.586 4.287 -7.063 1.00 0.00 H new ATOM 0 HG21 THR A 95 11.549 4.205 -8.121 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.659 5.734 -8.317 1.00 0.00 H new ATOM 0 HG23 THR A 95 12.193 5.480 -9.182 1.00 0.00 H new ATOM 1403 N HIS A 96 11.154 9.317 -6.785 1.00 0.00 N ATOM 1404 CA HIS A 96 10.175 10.364 -7.025 1.00 0.00 C ATOM 1405 C HIS A 96 8.759 9.851 -6.844 1.00 0.00 C ATOM 1406 O HIS A 96 7.875 10.293 -7.564 1.00 0.00 O ATOM 1407 CB HIS A 96 10.302 11.082 -8.383 1.00 0.00 C ATOM 1408 CG HIS A 96 11.709 11.515 -8.710 1.00 0.00 C ATOM 1409 ND1 HIS A 96 12.406 12.576 -8.157 1.00 0.00 N ATOM 1410 CD2 HIS A 96 12.561 10.834 -9.533 1.00 0.00 C ATOM 1411 CE1 HIS A 96 13.669 12.515 -8.621 1.00 0.00 C ATOM 1412 NE2 HIS A 96 13.784 11.464 -9.454 1.00 0.00 N ATOM 0 H HIS A 96 11.599 9.435 -5.875 1.00 0.00 H new ATOM 0 HA HIS A 96 10.400 11.116 -6.268 1.00 0.00 H new ATOM 0 HB2 HIS A 96 9.943 10.418 -9.170 1.00 0.00 H new ATOM 0 HB3 HIS A 96 9.652 11.957 -8.383 1.00 0.00 H new ATOM 0 HD2 HIS A 96 12.322 9.967 -10.131 1.00 0.00 H new ATOM 0 HE1 HIS A 96 14.463 13.201 -8.365 1.00 0.00 H new ATOM 0 HE2 HIS A 96 14.633 11.182 -9.944 1.00 0.00 H new ATOM 1420 N LEU A 97 8.546 8.900 -5.942 1.00 0.00 N ATOM 1421 CA LEU A 97 7.248 8.375 -5.586 1.00 0.00 C ATOM 1422 C LEU A 97 6.585 9.210 -4.517 1.00 0.00 C ATOM 1423 O LEU A 97 5.376 9.385 -4.593 1.00 0.00 O ATOM 1424 CB LEU A 97 7.353 6.942 -5.055 1.00 0.00 C ATOM 1425 CG LEU A 97 6.954 5.952 -6.147 1.00 0.00 C ATOM 1426 CD1 LEU A 97 8.119 5.711 -7.106 1.00 0.00 C ATOM 1427 CD2 LEU A 97 6.518 4.665 -5.477 1.00 0.00 C ATOM 0 H LEU A 97 9.307 8.462 -5.423 1.00 0.00 H new ATOM 0 HA LEU A 97 6.652 8.396 -6.498 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.372 6.741 -4.725 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.706 6.819 -4.186 1.00 0.00 H new ATOM 0 HG LEU A 97 6.131 6.353 -6.739 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.815 5.003 -7.877 1.00 0.00 H new ATOM 0 HD12 LEU A 97 8.407 6.653 -7.572 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.967 5.305 -6.554 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.227 3.940 -6.237 1.00 0.00 H new ATOM 0 HD22 LEU A 97 7.343 4.263 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.670 4.865 -4.823 1.00 0.00 H new ATOM 1438 N ASP A 98 7.302 9.677 -3.494 1.00 0.00 N ATOM 1439 CA ASP A 98 6.615 10.273 -2.343 1.00 0.00 C ATOM 1440 C ASP A 98 5.847 11.523 -2.784 1.00 0.00 C ATOM 1441 O ASP A 98 4.719 11.753 -2.353 1.00 0.00 O ATOM 1442 CB ASP A 98 7.553 10.511 -1.148 1.00 0.00 C ATOM 1443 CG ASP A 98 7.961 11.971 -0.966 1.00 0.00 C ATOM 1444 OD1 ASP A 98 8.779 12.461 -1.771 1.00 0.00 O ATOM 1445 OD2 ASP A 98 7.457 12.627 -0.024 1.00 0.00 O ATOM 0 H ASP A 98 8.320 9.658 -3.435 1.00 0.00 H new ATOM 0 HA ASP A 98 5.883 9.557 -1.968 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.062 10.164 -0.238 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.451 9.906 -1.276 1.00 0.00 H new ATOM 1449 N LYS A 99 6.384 12.249 -3.766 1.00 0.00 N ATOM 1450 CA LYS A 99 5.723 13.359 -4.436 1.00 0.00 C ATOM 1451 C LYS A 99 4.430 12.996 -5.171 1.00 0.00 C ATOM 1452 O LYS A 99 3.567 13.867 -5.279 1.00 0.00 O ATOM 1453 CB LYS A 99 6.723 14.114 -5.318 1.00 0.00 C ATOM 1454 CG LYS A 99 7.411 13.252 -6.361 1.00 0.00 C ATOM 1455 CD LYS A 99 8.780 13.869 -6.711 1.00 0.00 C ATOM 1456 CE LYS A 99 8.845 14.388 -8.152 1.00 0.00 C ATOM 1457 NZ LYS A 99 8.165 15.678 -8.369 1.00 0.00 N ATOM 0 H LYS A 99 7.322 12.071 -4.125 1.00 0.00 H new ATOM 0 HA LYS A 99 5.376 14.029 -3.649 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.202 14.928 -5.822 1.00 0.00 H new ATOM 0 HB3 LYS A 99 7.482 14.568 -4.680 1.00 0.00 H new ATOM 0 HG2 LYS A 99 7.542 12.238 -5.982 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.792 13.180 -7.256 1.00 0.00 H new ATOM 0 HD2 LYS A 99 8.990 14.689 -6.024 1.00 0.00 H new ATOM 0 HD3 LYS A 99 9.559 13.121 -6.563 1.00 0.00 H new ATOM 0 HE2 LYS A 99 9.891 14.490 -8.441 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.403 13.643 -8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 8.257 15.955 -9.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 7.158 15.585 -8.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 8.600 16.405 -7.766 1.00 0.00 H new ATOM 1467 N ILE A 100 4.227 11.748 -5.599 1.00 0.00 N ATOM 1468 CA ILE A 100 3.127 11.340 -6.479 1.00 0.00 C ATOM 1469 C ILE A 100 2.229 10.293 -5.810 1.00 0.00 C ATOM 1470 O ILE A 100 1.310 9.753 -6.419 1.00 0.00 O ATOM 1471 CB ILE A 100 3.686 10.832 -7.824 1.00 0.00 C ATOM 1472 CG1 ILE A 100 4.782 9.786 -7.643 1.00 0.00 C ATOM 1473 CG2 ILE A 100 4.258 11.981 -8.673 1.00 0.00 C ATOM 1474 CD1 ILE A 100 5.150 9.013 -8.916 1.00 0.00 C ATOM 0 H ILE A 100 4.837 10.974 -5.338 1.00 0.00 H new ATOM 0 HA ILE A 100 2.502 12.211 -6.674 1.00 0.00 H new ATOM 0 HB ILE A 100 2.838 10.377 -8.336 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.677 10.279 -7.263 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.463 9.074 -6.882 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.642 11.583 -9.612 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.471 12.706 -8.881 1.00 0.00 H new ATOM 0 HG23 ILE A 100 5.066 12.469 -8.128 1.00 0.00 H new ATOM 0 HD11 ILE A 100 5.936 8.293 -8.690 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.272 8.486 -9.288 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.504 9.710 -9.676 1.00 0.00 H new ATOM 1485 N PHE A 101 2.502 9.970 -4.556 1.00 0.00 N ATOM 1486 CA PHE A 101 1.764 9.061 -3.699 1.00 0.00 C ATOM 1487 C PHE A 101 1.257 9.900 -2.510 1.00 0.00 C ATOM 1488 O PHE A 101 1.273 11.138 -2.579 1.00 0.00 O ATOM 1489 CB PHE A 101 2.743 7.953 -3.299 1.00 0.00 C ATOM 1490 CG PHE A 101 2.904 6.728 -4.201 1.00 0.00 C ATOM 1491 CD1 PHE A 101 3.049 6.779 -5.605 1.00 0.00 C ATOM 1492 CD2 PHE A 101 2.983 5.473 -3.585 1.00 0.00 C ATOM 1493 CE1 PHE A 101 3.239 5.607 -6.358 1.00 0.00 C ATOM 1494 CE2 PHE A 101 3.182 4.308 -4.315 1.00 0.00 C ATOM 1495 CZ PHE A 101 3.280 4.378 -5.700 1.00 0.00 C ATOM 0 H PHE A 101 3.309 10.369 -4.075 1.00 0.00 H new ATOM 0 HA PHE A 101 0.900 8.589 -4.166 1.00 0.00 H new ATOM 0 HB2 PHE A 101 3.727 8.410 -3.190 1.00 0.00 H new ATOM 0 HB3 PHE A 101 2.447 7.596 -2.313 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.013 7.734 -6.108 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.886 5.409 -2.511 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.352 5.658 -7.431 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.260 3.356 -3.811 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.389 3.469 -6.274 1.00 0.00 H new ATOM 1504 N LYS A 102 0.772 9.283 -1.430 1.00 0.00 N ATOM 1505 CA LYS A 102 0.299 9.950 -0.218 1.00 0.00 C ATOM 1506 C LYS A 102 0.817 9.168 0.966 1.00 0.00 C ATOM 1507 O LYS A 102 0.804 7.942 0.898 1.00 0.00 O ATOM 1508 CB LYS A 102 -1.228 10.053 -0.294 1.00 0.00 C ATOM 1509 CG LYS A 102 -1.863 10.913 0.799 1.00 0.00 C ATOM 1510 CD LYS A 102 -3.211 11.461 0.310 1.00 0.00 C ATOM 1511 CE LYS A 102 -4.153 11.713 1.490 1.00 0.00 C ATOM 1512 NZ LYS A 102 -4.972 12.925 1.314 1.00 0.00 N ATOM 0 H LYS A 102 0.696 8.267 -1.375 1.00 0.00 H new ATOM 0 HA LYS A 102 0.670 10.969 -0.111 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.504 10.462 -1.266 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.650 9.049 -0.239 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.007 10.321 1.703 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.198 11.736 1.059 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.054 12.388 -0.241 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.668 10.753 -0.382 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -4.809 10.852 1.617 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.567 11.805 2.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.591 13.049 2.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.350 13.753 1.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -5.553 12.830 0.457 1.00 0.00 H new ATOM 1522 N ILE A 103 1.349 9.869 1.963 1.00 0.00 N ATOM 1523 CA ILE A 103 2.071 9.311 3.092 1.00 0.00 C ATOM 1524 C ILE A 103 1.538 9.947 4.379 1.00 0.00 C ATOM 1525 O ILE A 103 1.514 11.178 4.478 1.00 0.00 O ATOM 1526 CB ILE A 103 3.600 9.539 2.954 1.00 0.00 C ATOM 1527 CG1 ILE A 103 4.232 8.709 1.811 1.00 0.00 C ATOM 1528 CG2 ILE A 103 4.315 9.202 4.281 1.00 0.00 C ATOM 1529 CD1 ILE A 103 4.259 9.422 0.457 1.00 0.00 C ATOM 0 H ILE A 103 1.283 10.886 2.004 1.00 0.00 H new ATOM 0 HA ILE A 103 1.912 8.233 3.122 1.00 0.00 H new ATOM 0 HB ILE A 103 3.733 10.593 2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 103 5.252 8.445 2.090 1.00 0.00 H new ATOM 0 HG13 ILE A 103 3.679 7.776 1.706 1.00 0.00 H new ATOM 0 HG21 ILE A 103 5.387 9.367 4.169 1.00 0.00 H new ATOM 0 HG22 ILE A 103 3.930 9.843 5.074 1.00 0.00 H new ATOM 0 HG23 ILE A 103 4.133 8.158 4.537 1.00 0.00 H new ATOM 0 HD11 ILE A 103 4.718 8.771 -0.288 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.240 9.662 0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 103 4.838 10.341 0.541 1.00 0.00 H new ATOM 1540 N THR A 104 1.208 9.136 5.380 1.00 0.00 N ATOM 1541 CA THR A 104 0.851 9.578 6.719 1.00 0.00 C ATOM 1542 C THR A 104 1.603 8.788 7.786 1.00 0.00 C ATOM 1543 O THR A 104 2.393 7.887 7.496 1.00 0.00 O ATOM 1544 CB THR A 104 -0.681 9.560 6.873 1.00 0.00 C ATOM 1545 OG1 THR A 104 -1.245 8.285 6.616 1.00 0.00 O ATOM 1546 CG2 THR A 104 -1.287 10.601 5.927 1.00 0.00 C ATOM 0 H THR A 104 1.182 8.122 5.275 1.00 0.00 H new ATOM 0 HA THR A 104 1.169 10.610 6.869 1.00 0.00 H new ATOM 0 HB THR A 104 -0.913 9.800 7.911 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.553 7.888 7.457 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.372 10.596 6.028 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.903 11.589 6.180 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.017 10.359 4.899 1.00 0.00 H new ATOM 1554 N ASP A 105 1.392 9.174 9.038 1.00 0.00 N ATOM 1555 CA ASP A 105 1.997 8.565 10.210 1.00 0.00 C ATOM 1556 C ASP A 105 1.158 7.357 10.564 1.00 0.00 C ATOM 1557 O ASP A 105 1.641 6.230 10.620 1.00 0.00 O ATOM 1558 CB ASP A 105 1.983 9.540 11.398 1.00 0.00 C ATOM 1559 CG ASP A 105 3.324 10.225 11.551 1.00 0.00 C ATOM 1560 OD1 ASP A 105 4.234 9.610 12.144 1.00 0.00 O ATOM 1561 OD2 ASP A 105 3.477 11.363 11.053 1.00 0.00 O ATOM 0 H ASP A 105 0.771 9.949 9.271 1.00 0.00 H new ATOM 0 HA ASP A 105 3.032 8.296 9.999 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.203 10.287 11.251 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.739 9.001 12.313 1.00 0.00 H new ATOM 1565 N THR A 106 -0.132 7.602 10.753 1.00 0.00 N ATOM 1566 CA THR A 106 -1.101 6.602 11.127 1.00 0.00 C ATOM 1567 C THR A 106 -2.071 6.418 9.968 1.00 0.00 C ATOM 1568 O THR A 106 -2.147 7.232 9.036 1.00 0.00 O ATOM 1569 CB THR A 106 -1.801 7.062 12.417 1.00 0.00 C ATOM 1570 OG1 THR A 106 -2.375 8.337 12.202 1.00 0.00 O ATOM 1571 CG2 THR A 106 -0.830 7.136 13.598 1.00 0.00 C ATOM 0 H THR A 106 -0.536 8.532 10.645 1.00 0.00 H new ATOM 0 HA THR A 106 -0.636 5.637 11.328 1.00 0.00 H new ATOM 0 HB THR A 106 -2.570 6.330 12.664 1.00 0.00 H new ATOM 0 HG1 THR A 106 -2.684 8.705 13.056 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.365 7.465 14.489 1.00 0.00 H new ATOM 0 HG22 THR A 106 -0.399 6.151 13.777 1.00 0.00 H new ATOM 0 HG23 THR A 106 -0.034 7.845 13.371 1.00 0.00 H new ATOM 1579 N VAL A 107 -2.856 5.352 10.045 1.00 0.00 N ATOM 1580 CA VAL A 107 -4.005 5.150 9.185 1.00 0.00 C ATOM 1581 C VAL A 107 -5.138 6.126 9.552 1.00 0.00 C ATOM 1582 O VAL A 107 -6.003 6.425 8.731 1.00 0.00 O ATOM 1583 CB VAL A 107 -4.430 3.672 9.272 1.00 0.00 C ATOM 1584 CG1 VAL A 107 -3.321 2.735 8.776 1.00 0.00 C ATOM 1585 CG2 VAL A 107 -4.738 3.228 10.696 1.00 0.00 C ATOM 0 H VAL A 107 -2.708 4.597 10.715 1.00 0.00 H new ATOM 0 HA VAL A 107 -3.749 5.368 8.148 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.323 3.608 8.650 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -3.657 1.701 8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -3.088 2.965 7.736 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.429 2.872 9.386 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.032 2.178 10.694 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.851 3.356 11.317 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.552 3.832 11.097 1.00 0.00 H new ATOM 1595 N GLU A 108 -5.111 6.672 10.770 1.00 0.00 N ATOM 1596 CA GLU A 108 -5.966 7.776 11.202 1.00 0.00 C ATOM 1597 C GLU A 108 -5.686 9.015 10.339 1.00 0.00 C ATOM 1598 O GLU A 108 -6.588 9.530 9.679 1.00 0.00 O ATOM 1599 CB GLU A 108 -5.771 8.051 12.699 1.00 0.00 C ATOM 1600 CG GLU A 108 -6.691 7.166 13.547 1.00 0.00 C ATOM 1601 CD GLU A 108 -8.079 7.770 13.768 1.00 0.00 C ATOM 1602 OE1 GLU A 108 -8.998 7.528 12.946 1.00 0.00 O ATOM 1603 OE2 GLU A 108 -8.285 8.450 14.792 1.00 0.00 O ATOM 0 H GLU A 108 -4.477 6.349 11.501 1.00 0.00 H new ATOM 0 HA GLU A 108 -7.013 7.506 11.064 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -4.732 7.869 12.973 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -5.976 9.101 12.909 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.798 6.196 13.062 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.222 6.989 14.515 1.00 0.00 H new ATOM 1608 N GLU A 109 -4.435 9.482 10.284 1.00 0.00 N ATOM 1609 CA GLU A 109 -4.101 10.766 9.661 1.00 0.00 C ATOM 1610 C GLU A 109 -4.254 10.793 8.136 1.00 0.00 C ATOM 1611 O GLU A 109 -4.170 11.879 7.556 1.00 0.00 O ATOM 1612 CB GLU A 109 -2.682 11.208 10.069 1.00 0.00 C ATOM 1613 CG GLU A 109 -2.695 12.580 10.743 1.00 0.00 C ATOM 1614 CD GLU A 109 -3.512 12.557 12.033 1.00 0.00 C ATOM 1615 OE1 GLU A 109 -3.014 12.037 13.057 1.00 0.00 O ATOM 1616 OE2 GLU A 109 -4.666 13.046 12.021 1.00 0.00 O ATOM 0 H GLU A 109 -3.631 8.985 10.667 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.837 11.475 10.040 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.252 10.472 10.748 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.042 11.241 9.187 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -1.673 12.889 10.963 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -3.112 13.319 10.059 1.00 0.00 H new ATOM 1621 N ALA A 110 -4.481 9.623 7.523 1.00 0.00 N ATOM 1622 CA ALA A 110 -4.575 9.341 6.093 1.00 0.00 C ATOM 1623 C ALA A 110 -5.173 10.498 5.317 1.00 0.00 C ATOM 1624 O ALA A 110 -4.431 11.140 4.538 1.00 0.00 O ATOM 1625 CB ALA A 110 -5.356 8.046 5.898 1.00 0.00 C ATOM 0 H ALA A 110 -4.615 8.774 8.072 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.571 9.214 5.688 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -5.433 7.824 4.834 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.839 7.230 6.402 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -6.355 8.157 6.319 1.00 0.00 H new TER 1631 ALA A 110