USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1160 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 49 LYS NZ :NH3+ -161:sc= 1.23 (180deg=1.09) USER MOD Set 1.2: A 91 GLN :FLIP amide:sc= -2.66 F(o=-3.3!,f=-1.4) USER MOD Set 2.1: A 34 LYS NZ :NH3+ -133:sc= 0.501 (180deg=0) USER MOD Set 2.2: A 86 TYR OH : rot -96:sc= 0.562 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 1.3 (180deg=0.808) USER MOD Single : A 3 HIS : no HD1:sc= -0.0412 X(o=-0.041,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 5 HIS : no HD1:sc= -0.604 X(o=-0.6,f=-0.25) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0583 X(o=-0.058,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 1 K(o=1,f=-5.4!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc=-0.00552 X(o=-0.0055,f=0) USER MOD Single : A 11 MET CE :methyl -127:sc= -1.48 (180deg=-4.39!) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -59:sc= 0.0995 USER MOD Single : A 18 LYS NZ :NH3+ -175:sc= -1.19! (180deg=-1.66!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.997 X(o=-1,f=-0.61) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.13) USER MOD Single : A 35 HIS : no HE2:sc= 0.811 K(o=0.81,f=-2.8!) USER MOD Single : A 37 GLN : amide:sc= -0.522 X(o=-0.52,f=-0.024) USER MOD Single : A 40 TYR OH : rot 30:sc= -1.21 USER MOD Single : A 50 SER OG : rot -14:sc= 0.817 USER MOD Single : A 51 HIS : no HE2:sc= -0.144 X(o=-0.14,f=-0.39) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 59 GLN : amide:sc= -1.62 K(o=-1.6,f=-3.8!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.656 K(o=-0.66,f=-2.2!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -120:sc= -1.76 (180deg=-2.37!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -135:sc= 0.0168 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 1.17 K(o=1.2,f=-0.067) USER MOD Single : A 100 GLN : amide:sc= 0.504 K(o=0.5,f=-0.13) USER MOD Single : A 105 SER OG : rot 74:sc= 1.12 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0.00214 USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= 1.22 (180deg=1.1) USER MOD Single : A 122 SER OG : rot 180:sc= 0.447 USER MOD Single : A 124 TYR OH : rot 68:sc= 1.18 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.708 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot -80:sc= 0.539 USER MOD Single : A 139 MET CE :methyl -172:sc= 0 (180deg=-0.0163) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot -32:sc= 1.29 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 169:sc= 1.3 (180deg=1.12) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.087 30.636 -18.934 1.00 0.00 N ATOM 2 CA MET A 1 -9.029 29.549 -19.940 1.00 0.00 C ATOM 3 C MET A 1 -8.599 28.241 -19.283 1.00 0.00 C ATOM 4 O MET A 1 -7.627 28.210 -18.526 1.00 0.00 O ATOM 5 CB MET A 1 -8.052 29.896 -21.071 1.00 0.00 C ATOM 6 CG MET A 1 -8.517 31.027 -21.982 1.00 0.00 C ATOM 7 SD MET A 1 -8.619 32.622 -21.146 1.00 0.00 S ATOM 8 CE MET A 1 -9.125 33.678 -22.501 1.00 0.00 C ATOM 0 H1 MET A 1 -8.874 31.545 -19.392 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.039 30.673 -18.517 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.388 30.454 -18.185 1.00 0.00 H new ATOM 0 HA MET A 1 -10.027 29.433 -20.362 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.092 30.170 -20.634 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.884 29.005 -21.676 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.831 31.110 -22.825 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.496 30.776 -22.391 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.232 34.702 -22.144 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.372 33.645 -23.289 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.079 33.330 -22.896 1.00 0.00 H new ATOM 20 N GLY A 2 -9.327 27.169 -19.565 1.00 0.00 N ATOM 21 CA GLY A 2 -8.983 25.871 -19.019 1.00 0.00 C ATOM 22 C GLY A 2 -9.829 24.766 -19.616 1.00 0.00 C ATOM 23 O GLY A 2 -11.051 24.905 -19.718 1.00 0.00 O ATOM 0 H GLY A 2 -10.152 27.175 -20.164 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -7.930 25.665 -19.209 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -9.115 25.885 -17.937 1.00 0.00 H new ATOM 27 N HIS A 3 -9.182 23.681 -20.026 1.00 0.00 N ATOM 28 CA HIS A 3 -9.880 22.548 -20.626 1.00 0.00 C ATOM 29 C HIS A 3 -8.945 21.345 -20.745 1.00 0.00 C ATOM 30 O HIS A 3 -9.345 20.206 -20.497 1.00 0.00 O ATOM 31 CB HIS A 3 -10.430 22.927 -22.010 1.00 0.00 C ATOM 32 CG HIS A 3 -11.314 21.880 -22.623 1.00 0.00 C ATOM 33 ND1 HIS A 3 -12.691 21.960 -22.614 1.00 0.00 N ATOM 34 CD2 HIS A 3 -11.013 20.731 -23.276 1.00 0.00 C ATOM 35 CE1 HIS A 3 -13.196 20.908 -23.231 1.00 0.00 C ATOM 36 NE2 HIS A 3 -12.199 20.149 -23.640 1.00 0.00 N ATOM 0 H HIS A 3 -8.172 23.561 -19.954 1.00 0.00 H new ATOM 0 HA HIS A 3 -10.715 22.279 -19.979 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -10.992 23.857 -21.924 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -9.594 23.120 -22.682 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -10.023 20.346 -23.473 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -14.247 20.704 -23.376 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -12.295 19.269 -24.147 1.00 0.00 H new ATOM 45 N HIS A 4 -7.701 21.602 -21.127 1.00 0.00 N ATOM 46 CA HIS A 4 -6.725 20.538 -21.337 1.00 0.00 C ATOM 47 C HIS A 4 -6.122 20.085 -20.006 1.00 0.00 C ATOM 48 O HIS A 4 -4.963 20.372 -19.706 1.00 0.00 O ATOM 49 CB HIS A 4 -5.619 21.018 -22.284 1.00 0.00 C ATOM 50 CG HIS A 4 -4.807 19.912 -22.885 1.00 0.00 C ATOM 51 ND1 HIS A 4 -3.469 19.716 -22.619 1.00 0.00 N ATOM 52 CD2 HIS A 4 -5.153 18.954 -23.774 1.00 0.00 C ATOM 53 CE1 HIS A 4 -3.030 18.687 -23.318 1.00 0.00 C ATOM 54 NE2 HIS A 4 -4.033 18.204 -24.031 1.00 0.00 N ATOM 0 H HIS A 4 -7.342 22.541 -21.299 1.00 0.00 H new ATOM 0 HA HIS A 4 -7.234 19.687 -21.789 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -6.070 21.601 -23.087 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -4.954 21.688 -21.739 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -6.133 18.806 -24.204 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -2.020 18.303 -23.309 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -3.983 17.407 -24.666 1.00 0.00 H new ATOM 63 N HIS A 5 -6.919 19.384 -19.209 1.00 0.00 N ATOM 64 CA HIS A 5 -6.473 18.922 -17.896 1.00 0.00 C ATOM 65 C HIS A 5 -5.629 17.648 -18.004 1.00 0.00 C ATOM 66 O HIS A 5 -6.088 16.547 -17.706 1.00 0.00 O ATOM 67 CB HIS A 5 -7.667 18.724 -16.937 1.00 0.00 C ATOM 68 CG HIS A 5 -8.801 17.894 -17.481 1.00 0.00 C ATOM 69 ND1 HIS A 5 -9.937 18.446 -18.030 1.00 0.00 N ATOM 70 CD2 HIS A 5 -8.976 16.551 -17.541 1.00 0.00 C ATOM 71 CE1 HIS A 5 -10.757 17.482 -18.403 1.00 0.00 C ATOM 72 NE2 HIS A 5 -10.199 16.321 -18.118 1.00 0.00 N ATOM 0 H HIS A 5 -7.876 19.122 -19.446 1.00 0.00 H new ATOM 0 HA HIS A 5 -5.836 19.700 -17.476 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -7.303 18.256 -16.022 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -8.056 19.704 -16.661 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -8.280 15.800 -17.197 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -11.724 17.620 -18.865 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -10.609 15.404 -18.297 1.00 0.00 H new ATOM 81 N HIS A 6 -4.394 17.816 -18.458 1.00 0.00 N ATOM 82 CA HIS A 6 -3.435 16.719 -18.548 1.00 0.00 C ATOM 83 C HIS A 6 -2.043 17.278 -18.811 1.00 0.00 C ATOM 84 O HIS A 6 -1.717 17.637 -19.945 1.00 0.00 O ATOM 85 CB HIS A 6 -3.824 15.727 -19.658 1.00 0.00 C ATOM 86 CG HIS A 6 -2.812 14.637 -19.889 1.00 0.00 C ATOM 87 ND1 HIS A 6 -2.627 13.576 -19.029 1.00 0.00 N ATOM 88 CD2 HIS A 6 -1.915 14.465 -20.891 1.00 0.00 C ATOM 89 CE1 HIS A 6 -1.661 12.800 -19.490 1.00 0.00 C ATOM 90 NE2 HIS A 6 -1.214 13.316 -20.618 1.00 0.00 N ATOM 0 H HIS A 6 -4.028 18.714 -18.774 1.00 0.00 H new ATOM 0 HA HIS A 6 -3.440 16.180 -17.601 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -4.781 15.272 -19.405 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -3.969 16.277 -20.588 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -1.777 15.111 -21.745 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -1.299 11.896 -19.022 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -0.469 12.925 -21.194 1.00 0.00 H new ATOM 99 N HIS A 7 -1.234 17.360 -17.765 1.00 0.00 N ATOM 100 CA HIS A 7 0.100 17.937 -17.872 1.00 0.00 C ATOM 101 C HIS A 7 0.905 17.670 -16.607 1.00 0.00 C ATOM 102 O HIS A 7 0.413 17.875 -15.499 1.00 0.00 O ATOM 103 CB HIS A 7 -0.001 19.451 -18.123 1.00 0.00 C ATOM 104 CG HIS A 7 1.321 20.144 -18.261 1.00 0.00 C ATOM 105 ND1 HIS A 7 2.111 20.045 -19.386 1.00 0.00 N ATOM 106 CD2 HIS A 7 1.987 20.956 -17.406 1.00 0.00 C ATOM 107 CE1 HIS A 7 3.206 20.762 -19.216 1.00 0.00 C ATOM 108 NE2 HIS A 7 3.154 21.326 -18.024 1.00 0.00 N ATOM 0 H HIS A 7 -1.478 17.034 -16.830 1.00 0.00 H new ATOM 0 HA HIS A 7 0.613 17.469 -18.712 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -0.582 19.619 -19.030 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -0.553 19.907 -17.301 1.00 0.00 H new ATOM 0 HD2 HIS A 7 1.660 21.256 -16.421 1.00 0.00 H new ATOM 0 HE1 HIS A 7 4.008 20.869 -19.931 1.00 0.00 H new ATOM 0 HE2 HIS A 7 3.867 21.938 -17.627 1.00 0.00 H new ATOM 117 N HIS A 8 2.140 17.213 -16.779 1.00 0.00 N ATOM 118 CA HIS A 8 3.056 17.038 -15.656 1.00 0.00 C ATOM 119 C HIS A 8 3.420 18.397 -15.079 1.00 0.00 C ATOM 120 O HIS A 8 4.218 19.128 -15.663 1.00 0.00 O ATOM 121 CB HIS A 8 4.340 16.316 -16.087 1.00 0.00 C ATOM 122 CG HIS A 8 4.181 14.849 -16.337 1.00 0.00 C ATOM 123 ND1 HIS A 8 4.780 14.202 -17.394 1.00 0.00 N ATOM 124 CD2 HIS A 8 3.539 13.891 -15.628 1.00 0.00 C ATOM 125 CE1 HIS A 8 4.514 12.912 -17.326 1.00 0.00 C ATOM 126 NE2 HIS A 8 3.763 12.696 -16.263 1.00 0.00 N ATOM 0 H HIS A 8 2.531 16.957 -17.685 1.00 0.00 H new ATOM 0 HA HIS A 8 2.553 16.429 -14.904 1.00 0.00 H new ATOM 0 HB2 HIS A 8 4.717 16.786 -16.995 1.00 0.00 H new ATOM 0 HB3 HIS A 8 5.097 16.459 -15.316 1.00 0.00 H new ATOM 0 HD2 HIS A 8 2.958 14.040 -14.730 1.00 0.00 H new ATOM 0 HE1 HIS A 8 4.854 12.160 -18.023 1.00 0.00 H new ATOM 0 HE2 HIS A 8 3.407 11.789 -15.962 1.00 0.00 H new ATOM 135 N SER A 9 2.825 18.743 -13.952 1.00 0.00 N ATOM 136 CA SER A 9 3.041 20.049 -13.354 1.00 0.00 C ATOM 137 C SER A 9 3.556 19.913 -11.924 1.00 0.00 C ATOM 138 O SER A 9 3.220 18.959 -11.218 1.00 0.00 O ATOM 139 CB SER A 9 1.734 20.852 -13.370 1.00 0.00 C ATOM 140 OG SER A 9 1.919 22.164 -12.865 1.00 0.00 O ATOM 0 H SER A 9 2.189 18.139 -13.432 1.00 0.00 H new ATOM 0 HA SER A 9 3.794 20.577 -13.939 1.00 0.00 H new ATOM 0 HB2 SER A 9 1.352 20.905 -14.389 1.00 0.00 H new ATOM 0 HB3 SER A 9 0.982 20.335 -12.774 1.00 0.00 H new ATOM 0 HG SER A 9 1.067 22.648 -12.891 1.00 0.00 H new ATOM 146 N HIS A 10 4.393 20.857 -11.516 1.00 0.00 N ATOM 147 CA HIS A 10 4.825 20.950 -10.129 1.00 0.00 C ATOM 148 C HIS A 10 3.799 21.739 -9.329 1.00 0.00 C ATOM 149 O HIS A 10 3.658 22.951 -9.504 1.00 0.00 O ATOM 150 CB HIS A 10 6.204 21.612 -10.023 1.00 0.00 C ATOM 151 CG HIS A 10 7.351 20.676 -10.261 1.00 0.00 C ATOM 152 ND1 HIS A 10 8.623 20.916 -9.787 1.00 0.00 N ATOM 153 CD2 HIS A 10 7.417 19.498 -10.926 1.00 0.00 C ATOM 154 CE1 HIS A 10 9.419 19.927 -10.147 1.00 0.00 C ATOM 155 NE2 HIS A 10 8.712 19.054 -10.837 1.00 0.00 N ATOM 0 H HIS A 10 4.787 21.571 -12.128 1.00 0.00 H new ATOM 0 HA HIS A 10 4.907 19.942 -9.722 1.00 0.00 H new ATOM 0 HB2 HIS A 10 6.260 22.429 -10.743 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.308 22.053 -9.032 1.00 0.00 H new ATOM 0 HD2 HIS A 10 6.602 19.001 -11.432 1.00 0.00 H new ATOM 0 HE1 HIS A 10 10.471 19.846 -9.916 1.00 0.00 H new ATOM 0 HE2 HIS A 10 9.070 18.188 -11.240 1.00 0.00 H new ATOM 164 N MET A 11 3.072 21.044 -8.472 1.00 0.00 N ATOM 165 CA MET A 11 1.991 21.657 -7.714 1.00 0.00 C ATOM 166 C MET A 11 2.529 22.583 -6.632 1.00 0.00 C ATOM 167 O MET A 11 3.588 22.341 -6.050 1.00 0.00 O ATOM 168 CB MET A 11 1.091 20.584 -7.087 1.00 0.00 C ATOM 169 CG MET A 11 1.775 19.754 -6.009 1.00 0.00 C ATOM 170 SD MET A 11 0.693 18.497 -5.295 1.00 0.00 S ATOM 171 CE MET A 11 -0.640 19.505 -4.646 1.00 0.00 C ATOM 0 H MET A 11 3.210 20.051 -8.282 1.00 0.00 H new ATOM 0 HA MET A 11 1.399 22.252 -8.409 1.00 0.00 H new ATOM 0 HB2 MET A 11 0.213 21.067 -6.657 1.00 0.00 H new ATOM 0 HB3 MET A 11 0.736 19.918 -7.873 1.00 0.00 H new ATOM 0 HG2 MET A 11 2.654 19.270 -6.434 1.00 0.00 H new ATOM 0 HG3 MET A 11 2.127 20.415 -5.217 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.799 19.265 -3.595 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.379 20.559 -4.742 1.00 0.00 H new ATOM 0 HE3 MET A 11 -1.553 19.305 -5.206 1.00 0.00 H new ATOM 181 N ASP A 12 1.797 23.652 -6.381 1.00 0.00 N ATOM 182 CA ASP A 12 2.146 24.587 -5.327 1.00 0.00 C ATOM 183 C ASP A 12 1.287 24.302 -4.112 1.00 0.00 C ATOM 184 O ASP A 12 1.719 24.494 -2.972 1.00 0.00 O ATOM 185 CB ASP A 12 1.925 26.031 -5.779 1.00 0.00 C ATOM 186 CG ASP A 12 2.693 26.380 -7.036 1.00 0.00 C ATOM 187 OD1 ASP A 12 3.886 26.737 -6.935 1.00 0.00 O ATOM 188 OD2 ASP A 12 2.100 26.310 -8.133 1.00 0.00 O ATOM 0 H ASP A 12 0.951 23.896 -6.896 1.00 0.00 H new ATOM 0 HA ASP A 12 3.201 24.463 -5.083 1.00 0.00 H new ATOM 0 HB2 ASP A 12 0.861 26.193 -5.953 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.224 26.707 -4.978 1.00 0.00 H new ATOM 193 N TYR A 13 0.072 23.831 -4.384 1.00 0.00 N ATOM 194 CA TYR A 13 -0.899 23.489 -3.352 1.00 0.00 C ATOM 195 C TYR A 13 -1.354 24.730 -2.586 1.00 0.00 C ATOM 196 O TYR A 13 -0.753 25.120 -1.584 1.00 0.00 O ATOM 197 CB TYR A 13 -0.332 22.428 -2.400 1.00 0.00 C ATOM 198 CG TYR A 13 -1.244 22.072 -1.248 1.00 0.00 C ATOM 199 CD1 TYR A 13 -2.514 21.552 -1.469 1.00 0.00 C ATOM 200 CD2 TYR A 13 -0.829 22.255 0.066 1.00 0.00 C ATOM 201 CE1 TYR A 13 -3.345 21.227 -0.412 1.00 0.00 C ATOM 202 CE2 TYR A 13 -1.651 21.933 1.125 1.00 0.00 C ATOM 203 CZ TYR A 13 -2.907 21.422 0.883 1.00 0.00 C ATOM 204 OH TYR A 13 -3.726 21.104 1.943 1.00 0.00 O ATOM 0 H TYR A 13 -0.267 23.676 -5.333 1.00 0.00 H new ATOM 0 HA TYR A 13 -1.775 23.067 -3.844 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -0.116 21.524 -2.970 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.616 22.786 -2.000 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.857 21.399 -2.482 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.155 22.656 0.261 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.329 20.824 -0.598 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -1.312 22.081 2.140 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.264 21.301 2.784 1.00 0.00 H new ATOM 214 N PRO A 14 -2.408 25.388 -3.085 1.00 0.00 N ATOM 215 CA PRO A 14 -3.023 26.525 -2.412 1.00 0.00 C ATOM 216 C PRO A 14 -3.897 26.067 -1.251 1.00 0.00 C ATOM 217 O PRO A 14 -4.868 25.332 -1.441 1.00 0.00 O ATOM 218 CB PRO A 14 -3.877 27.190 -3.506 1.00 0.00 C ATOM 219 CG PRO A 14 -3.580 26.443 -4.769 1.00 0.00 C ATOM 220 CD PRO A 14 -3.083 25.091 -4.350 1.00 0.00 C ATOM 0 HA PRO A 14 -2.285 27.203 -1.983 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -4.938 27.136 -3.260 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -3.627 28.246 -3.609 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -4.473 26.355 -5.388 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -2.831 26.966 -5.363 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -3.899 24.380 -4.219 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -2.401 24.662 -5.084 1.00 0.00 H new ATOM 228 N SER A 15 -3.546 26.487 -0.051 1.00 0.00 N ATOM 229 CA SER A 15 -4.271 26.067 1.133 1.00 0.00 C ATOM 230 C SER A 15 -5.427 27.015 1.426 1.00 0.00 C ATOM 231 O SER A 15 -5.248 28.042 2.081 1.00 0.00 O ATOM 232 CB SER A 15 -3.330 25.997 2.335 1.00 0.00 C ATOM 233 OG SER A 15 -2.205 25.178 2.057 1.00 0.00 O ATOM 0 H SER A 15 -2.765 27.117 0.130 1.00 0.00 H new ATOM 0 HA SER A 15 -4.680 25.074 0.947 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.997 27.001 2.598 1.00 0.00 H new ATOM 0 HB3 SER A 15 -3.866 25.602 3.198 1.00 0.00 H new ATOM 0 HG SER A 15 -2.507 24.272 1.835 1.00 0.00 H new ATOM 239 N PHE A 16 -6.601 26.686 0.911 1.00 0.00 N ATOM 240 CA PHE A 16 -7.794 27.468 1.182 1.00 0.00 C ATOM 241 C PHE A 16 -8.973 26.540 1.432 1.00 0.00 C ATOM 242 O PHE A 16 -9.118 25.511 0.771 1.00 0.00 O ATOM 243 CB PHE A 16 -8.096 28.443 0.031 1.00 0.00 C ATOM 244 CG PHE A 16 -8.391 27.786 -1.290 1.00 0.00 C ATOM 245 CD1 PHE A 16 -7.361 27.380 -2.121 1.00 0.00 C ATOM 246 CD2 PHE A 16 -9.700 27.590 -1.704 1.00 0.00 C ATOM 247 CE1 PHE A 16 -7.629 26.785 -3.339 1.00 0.00 C ATOM 248 CE2 PHE A 16 -9.974 26.995 -2.919 1.00 0.00 C ATOM 249 CZ PHE A 16 -8.937 26.593 -3.739 1.00 0.00 C ATOM 0 H PHE A 16 -6.752 25.882 0.302 1.00 0.00 H new ATOM 0 HA PHE A 16 -7.620 28.066 2.077 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.948 29.062 0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -7.244 29.111 -0.094 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.336 27.530 -1.814 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -10.514 27.906 -1.069 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.817 26.470 -3.977 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -10.998 26.844 -3.228 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.149 26.129 -4.691 1.00 0.00 H new ATOM 259 N ASP A 17 -9.795 26.892 2.406 1.00 0.00 N ATOM 260 CA ASP A 17 -10.955 26.085 2.754 1.00 0.00 C ATOM 261 C ASP A 17 -12.209 26.668 2.116 1.00 0.00 C ATOM 262 O ASP A 17 -12.175 27.758 1.537 1.00 0.00 O ATOM 263 CB ASP A 17 -11.126 26.000 4.276 1.00 0.00 C ATOM 264 CG ASP A 17 -11.530 27.323 4.898 1.00 0.00 C ATOM 265 OD1 ASP A 17 -10.636 28.137 5.218 1.00 0.00 O ATOM 266 OD2 ASP A 17 -12.742 27.553 5.077 1.00 0.00 O ATOM 0 H ASP A 17 -9.681 27.733 2.972 1.00 0.00 H new ATOM 0 HA ASP A 17 -10.797 25.076 2.372 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.880 25.248 4.511 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -10.191 25.664 4.724 1.00 0.00 H new ATOM 271 N LYS A 18 -13.311 25.946 2.225 1.00 0.00 N ATOM 272 CA LYS A 18 -14.561 26.379 1.622 1.00 0.00 C ATOM 273 C LYS A 18 -15.626 26.603 2.688 1.00 0.00 C ATOM 274 O LYS A 18 -15.715 25.849 3.661 1.00 0.00 O ATOM 275 CB LYS A 18 -15.048 25.378 0.560 1.00 0.00 C ATOM 276 CG LYS A 18 -15.320 23.960 1.057 1.00 0.00 C ATOM 277 CD LYS A 18 -14.035 23.184 1.325 1.00 0.00 C ATOM 278 CE LYS A 18 -14.312 21.703 1.534 1.00 0.00 C ATOM 279 NZ LYS A 18 -14.731 21.036 0.271 1.00 0.00 N ATOM 0 H LYS A 18 -13.366 25.058 2.725 1.00 0.00 H new ATOM 0 HA LYS A 18 -14.376 27.328 1.119 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -15.963 25.768 0.113 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -14.302 25.328 -0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -15.912 24.005 1.971 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -15.916 23.426 0.317 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.350 23.312 0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.540 23.591 2.207 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.417 21.217 1.922 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -15.092 21.582 2.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -14.992 20.049 0.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -15.549 21.536 -0.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.945 21.056 -0.409 1.00 0.00 H new ATOM 293 N PHE A 19 -16.435 27.637 2.485 1.00 0.00 N ATOM 294 CA PHE A 19 -17.418 28.070 3.449 1.00 0.00 C ATOM 295 C PHE A 19 -18.240 29.152 2.786 1.00 0.00 C ATOM 296 O PHE A 19 -17.958 30.337 2.956 1.00 0.00 O ATOM 297 CB PHE A 19 -16.737 28.596 4.719 1.00 0.00 C ATOM 298 CG PHE A 19 -17.667 29.222 5.727 1.00 0.00 C ATOM 299 CD1 PHE A 19 -18.580 28.453 6.427 1.00 0.00 C ATOM 300 CD2 PHE A 19 -17.613 30.585 5.978 1.00 0.00 C ATOM 301 CE1 PHE A 19 -19.424 29.029 7.357 1.00 0.00 C ATOM 302 CE2 PHE A 19 -18.454 31.167 6.905 1.00 0.00 C ATOM 303 CZ PHE A 19 -19.361 30.389 7.596 1.00 0.00 C ATOM 0 H PHE A 19 -16.420 28.199 1.634 1.00 0.00 H new ATOM 0 HA PHE A 19 -18.055 27.239 3.754 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -16.208 27.772 5.198 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.987 29.333 4.432 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.633 27.390 6.244 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -16.904 31.198 5.442 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -20.132 28.417 7.897 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -18.402 32.230 7.089 1.00 0.00 H new ATOM 0 HZ PHE A 19 -20.020 30.842 8.322 1.00 0.00 H new ATOM 313 N LEU A 20 -19.230 28.785 1.972 1.00 0.00 N ATOM 314 CA LEU A 20 -19.774 27.433 1.820 1.00 0.00 C ATOM 315 C LEU A 20 -20.028 26.729 3.158 1.00 0.00 C ATOM 316 O LEU A 20 -20.276 27.382 4.173 1.00 0.00 O ATOM 317 CB LEU A 20 -18.874 26.606 0.913 1.00 0.00 C ATOM 318 CG LEU A 20 -18.671 27.175 -0.496 1.00 0.00 C ATOM 319 CD1 LEU A 20 -17.840 26.225 -1.342 1.00 0.00 C ATOM 320 CD2 LEU A 20 -20.010 27.445 -1.165 1.00 0.00 C ATOM 0 H LEU A 20 -19.700 29.459 1.368 1.00 0.00 H new ATOM 0 HA LEU A 20 -20.754 27.531 1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -17.899 26.503 1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -19.294 25.604 0.826 1.00 0.00 H new ATOM 0 HG LEU A 20 -18.134 28.119 -0.407 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -17.707 26.647 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -16.865 26.081 -0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -18.351 25.265 -1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -19.843 27.848 -2.164 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -20.574 26.515 -1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -20.574 28.165 -0.572 1.00 0.00 H new ATOM 332 N GLY A 21 -20.011 25.405 3.141 1.00 0.00 N ATOM 333 CA GLY A 21 -20.212 24.643 4.355 1.00 0.00 C ATOM 334 C GLY A 21 -19.633 23.249 4.245 1.00 0.00 C ATOM 335 O GLY A 21 -18.429 23.056 4.419 1.00 0.00 O ATOM 0 H GLY A 21 -19.861 24.842 2.304 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -19.748 25.164 5.192 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -21.278 24.578 4.571 1.00 0.00 H new ATOM 339 N THR A 22 -20.483 22.283 3.937 1.00 0.00 N ATOM 340 CA THR A 22 -20.045 20.905 3.786 1.00 0.00 C ATOM 341 C THR A 22 -19.896 20.556 2.303 1.00 0.00 C ATOM 342 O THR A 22 -20.643 21.058 1.457 1.00 0.00 O ATOM 343 CB THR A 22 -21.021 19.920 4.469 1.00 0.00 C ATOM 344 OG1 THR A 22 -20.456 18.604 4.507 1.00 0.00 O ATOM 345 CG2 THR A 22 -22.358 19.866 3.745 1.00 0.00 C ATOM 0 H THR A 22 -21.481 22.428 3.787 1.00 0.00 H new ATOM 0 HA THR A 22 -19.076 20.809 4.277 1.00 0.00 H new ATOM 0 HB THR A 22 -21.188 20.281 5.484 1.00 0.00 H new ATOM 0 HG1 THR A 22 -21.084 17.991 4.944 1.00 0.00 H new ATOM 0 HG21 THR A 22 -23.019 19.164 4.253 1.00 0.00 H new ATOM 0 HG22 THR A 22 -22.812 20.857 3.746 1.00 0.00 H new ATOM 0 HG23 THR A 22 -22.202 19.539 2.717 1.00 0.00 H new ATOM 353 N GLU A 23 -18.925 19.707 1.989 1.00 0.00 N ATOM 354 CA GLU A 23 -18.649 19.333 0.610 1.00 0.00 C ATOM 355 C GLU A 23 -17.746 18.103 0.571 1.00 0.00 C ATOM 356 O GLU A 23 -16.753 18.033 1.296 1.00 0.00 O ATOM 357 CB GLU A 23 -17.999 20.506 -0.123 1.00 0.00 C ATOM 358 CG GLU A 23 -17.720 20.245 -1.589 1.00 0.00 C ATOM 359 CD GLU A 23 -17.169 21.468 -2.285 1.00 0.00 C ATOM 360 OE1 GLU A 23 -16.121 21.982 -1.843 1.00 0.00 O ATOM 361 OE2 GLU A 23 -17.774 21.915 -3.281 1.00 0.00 O ATOM 0 H GLU A 23 -18.314 19.264 2.675 1.00 0.00 H new ATOM 0 HA GLU A 23 -19.585 19.086 0.109 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.648 21.378 -0.038 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -17.062 20.756 0.375 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -17.010 19.423 -1.683 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.639 19.930 -2.083 1.00 0.00 H new ATOM 368 N ASN A 24 -18.094 17.144 -0.278 1.00 0.00 N ATOM 369 CA ASN A 24 -17.380 15.871 -0.350 1.00 0.00 C ATOM 370 C ASN A 24 -16.624 15.746 -1.679 1.00 0.00 C ATOM 371 O ASN A 24 -16.057 14.701 -1.992 1.00 0.00 O ATOM 372 CB ASN A 24 -18.385 14.720 -0.175 1.00 0.00 C ATOM 373 CG ASN A 24 -17.731 13.353 -0.036 1.00 0.00 C ATOM 374 OD1 ASN A 24 -17.311 12.960 1.055 1.00 0.00 O ATOM 375 ND2 ASN A 24 -17.671 12.607 -1.131 1.00 0.00 N ATOM 0 H ASN A 24 -18.873 17.223 -0.932 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.641 15.824 0.450 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.995 14.913 0.708 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -19.059 14.705 -1.031 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -17.266 11.672 -1.089 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -18.030 12.969 -2.015 1.00 0.00 H new ATOM 382 N ALA A 25 -16.591 16.837 -2.436 1.00 0.00 N ATOM 383 CA ALA A 25 -15.964 16.851 -3.758 1.00 0.00 C ATOM 384 C ALA A 25 -14.517 16.358 -3.715 1.00 0.00 C ATOM 385 O ALA A 25 -14.063 15.659 -4.624 1.00 0.00 O ATOM 386 CB ALA A 25 -16.022 18.250 -4.347 1.00 0.00 C ATOM 0 H ALA A 25 -16.994 17.731 -2.156 1.00 0.00 H new ATOM 0 HA ALA A 25 -16.523 16.164 -4.393 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.553 18.250 -5.331 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -17.062 18.562 -4.441 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -15.493 18.943 -3.693 1.00 0.00 H new ATOM 392 N GLU A 26 -13.799 16.722 -2.659 1.00 0.00 N ATOM 393 CA GLU A 26 -12.412 16.307 -2.490 1.00 0.00 C ATOM 394 C GLU A 26 -12.293 14.794 -2.424 1.00 0.00 C ATOM 395 O GLU A 26 -11.408 14.196 -3.037 1.00 0.00 O ATOM 396 CB GLU A 26 -11.821 16.923 -1.239 1.00 0.00 C ATOM 397 CG GLU A 26 -11.609 18.413 -1.376 1.00 0.00 C ATOM 398 CD GLU A 26 -12.889 19.216 -1.251 1.00 0.00 C ATOM 399 OE1 GLU A 26 -13.900 18.673 -0.755 1.00 0.00 O ATOM 400 OE2 GLU A 26 -12.895 20.399 -1.652 1.00 0.00 O ATOM 0 H GLU A 26 -14.157 17.307 -1.904 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.855 16.658 -3.359 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.482 16.729 -0.394 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.869 16.442 -1.015 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.905 18.744 -0.613 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.152 18.620 -2.343 1.00 0.00 H new ATOM 407 N LEU A 27 -13.206 14.185 -1.684 1.00 0.00 N ATOM 408 CA LEU A 27 -13.229 12.747 -1.507 1.00 0.00 C ATOM 409 C LEU A 27 -13.596 12.052 -2.813 1.00 0.00 C ATOM 410 O LEU A 27 -13.107 10.961 -3.103 1.00 0.00 O ATOM 411 CB LEU A 27 -14.225 12.363 -0.410 1.00 0.00 C ATOM 412 CG LEU A 27 -13.800 12.678 1.033 1.00 0.00 C ATOM 413 CD1 LEU A 27 -12.414 12.123 1.320 1.00 0.00 C ATOM 414 CD2 LEU A 27 -13.851 14.173 1.311 1.00 0.00 C ATOM 0 H LEU A 27 -13.951 14.677 -1.190 1.00 0.00 H new ATOM 0 HA LEU A 27 -12.232 12.422 -1.208 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -15.167 12.874 -0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.420 11.293 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.510 12.191 1.702 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.134 12.358 2.347 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.420 11.042 1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.694 12.571 0.636 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -13.545 14.362 2.340 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.177 14.693 0.630 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.868 14.536 1.162 1.00 0.00 H new ATOM 426 N VAL A 28 -14.451 12.694 -3.599 1.00 0.00 N ATOM 427 CA VAL A 28 -14.846 12.164 -4.899 1.00 0.00 C ATOM 428 C VAL A 28 -13.643 12.090 -5.838 1.00 0.00 C ATOM 429 O VAL A 28 -13.526 11.169 -6.645 1.00 0.00 O ATOM 430 CB VAL A 28 -15.956 13.020 -5.547 1.00 0.00 C ATOM 431 CG1 VAL A 28 -16.367 12.453 -6.896 1.00 0.00 C ATOM 432 CG2 VAL A 28 -17.159 13.122 -4.627 1.00 0.00 C ATOM 0 H VAL A 28 -14.886 13.585 -3.359 1.00 0.00 H new ATOM 0 HA VAL A 28 -15.238 11.160 -4.734 1.00 0.00 H new ATOM 0 HB VAL A 28 -15.556 14.021 -5.708 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -17.150 13.076 -7.329 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -15.505 12.438 -7.562 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -16.742 11.438 -6.765 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -17.930 13.729 -5.102 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -17.552 12.125 -4.431 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -16.860 13.586 -3.687 1.00 0.00 H new ATOM 442 N TYR A 29 -12.744 13.059 -5.716 1.00 0.00 N ATOM 443 CA TYR A 29 -11.523 13.078 -6.517 1.00 0.00 C ATOM 444 C TYR A 29 -10.598 11.933 -6.098 1.00 0.00 C ATOM 445 O TYR A 29 -9.800 11.439 -6.893 1.00 0.00 O ATOM 446 CB TYR A 29 -10.810 14.427 -6.362 1.00 0.00 C ATOM 447 CG TYR A 29 -9.645 14.627 -7.309 1.00 0.00 C ATOM 448 CD1 TYR A 29 -9.853 15.055 -8.614 1.00 0.00 C ATOM 449 CD2 TYR A 29 -8.337 14.392 -6.895 1.00 0.00 C ATOM 450 CE1 TYR A 29 -8.795 15.244 -9.482 1.00 0.00 C ATOM 451 CE2 TYR A 29 -7.272 14.578 -7.759 1.00 0.00 C ATOM 452 CZ TYR A 29 -7.507 15.004 -9.052 1.00 0.00 C ATOM 453 OH TYR A 29 -6.450 15.191 -9.919 1.00 0.00 O ATOM 0 H TYR A 29 -12.836 13.843 -5.070 1.00 0.00 H new ATOM 0 HA TYR A 29 -11.788 12.944 -7.566 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -11.533 15.227 -6.519 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -10.450 14.519 -5.337 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -10.860 15.243 -8.956 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -8.150 14.060 -5.885 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.976 15.578 -10.493 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.262 14.391 -7.424 1.00 0.00 H new ATOM 0 HH TYR A 29 -5.610 14.980 -9.461 1.00 0.00 H new ATOM 463 N VAL A 30 -10.718 11.514 -4.844 1.00 0.00 N ATOM 464 CA VAL A 30 -9.913 10.416 -4.315 1.00 0.00 C ATOM 465 C VAL A 30 -10.422 9.069 -4.833 1.00 0.00 C ATOM 466 O VAL A 30 -9.642 8.149 -5.078 1.00 0.00 O ATOM 467 CB VAL A 30 -9.924 10.408 -2.769 1.00 0.00 C ATOM 468 CG1 VAL A 30 -9.078 9.271 -2.216 1.00 0.00 C ATOM 469 CG2 VAL A 30 -9.438 11.741 -2.222 1.00 0.00 C ATOM 0 H VAL A 30 -11.368 11.919 -4.170 1.00 0.00 H new ATOM 0 HA VAL A 30 -8.890 10.569 -4.659 1.00 0.00 H new ATOM 0 HB VAL A 30 -10.953 10.251 -2.446 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -9.106 9.293 -1.127 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.472 8.319 -2.570 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -8.048 9.386 -2.554 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -9.453 11.715 -1.132 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.420 11.926 -2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -10.091 12.539 -2.575 1.00 0.00 H new ATOM 479 N LEU A 31 -11.733 8.965 -4.997 1.00 0.00 N ATOM 480 CA LEU A 31 -12.360 7.736 -5.477 1.00 0.00 C ATOM 481 C LEU A 31 -11.918 7.428 -6.900 1.00 0.00 C ATOM 482 O LEU A 31 -12.346 8.099 -7.842 1.00 0.00 O ATOM 483 CB LEU A 31 -13.882 7.870 -5.456 1.00 0.00 C ATOM 484 CG LEU A 31 -14.491 8.281 -4.119 1.00 0.00 C ATOM 485 CD1 LEU A 31 -15.982 8.527 -4.280 1.00 0.00 C ATOM 486 CD2 LEU A 31 -14.238 7.218 -3.064 1.00 0.00 C ATOM 0 H LEU A 31 -12.390 9.721 -4.804 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.052 6.926 -4.816 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -14.174 8.603 -6.208 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -14.317 6.916 -5.754 1.00 0.00 H new ATOM 0 HG LEU A 31 -14.016 9.205 -3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -16.408 8.820 -3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -16.143 9.323 -5.007 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -16.466 7.615 -4.628 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -14.681 7.531 -2.118 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.687 6.277 -3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -13.164 7.082 -2.935 1.00 0.00 H new ATOM 498 N ARG A 32 -11.058 6.433 -7.068 1.00 0.00 N ATOM 499 CA ARG A 32 -10.618 6.068 -8.405 1.00 0.00 C ATOM 500 C ARG A 32 -11.417 4.884 -8.943 1.00 0.00 C ATOM 501 O ARG A 32 -12.431 5.084 -9.608 1.00 0.00 O ATOM 502 CB ARG A 32 -9.117 5.775 -8.444 1.00 0.00 C ATOM 503 CG ARG A 32 -8.577 5.705 -9.864 1.00 0.00 C ATOM 504 CD ARG A 32 -7.064 5.610 -9.901 1.00 0.00 C ATOM 505 NE ARG A 32 -6.563 5.685 -11.272 1.00 0.00 N ATOM 506 CZ ARG A 32 -5.272 5.733 -11.599 1.00 0.00 C ATOM 507 NH1 ARG A 32 -4.338 5.696 -10.656 1.00 0.00 N ATOM 508 NH2 ARG A 32 -4.919 5.833 -12.872 1.00 0.00 N ATOM 0 H ARG A 32 -10.659 5.875 -6.313 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.804 6.925 -9.053 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.584 6.550 -7.893 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.921 4.831 -7.936 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.005 4.840 -10.371 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.897 6.589 -10.416 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.632 6.416 -9.308 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.745 4.673 -9.445 1.00 0.00 H new ATOM 0 HE ARG A 32 -7.247 5.702 -12.029 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.607 5.630 -9.674 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.352 5.733 -10.913 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.634 5.873 -13.598 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.932 5.870 -13.126 1.00 0.00 H new ATOM 522 N HIS A 33 -10.998 3.652 -8.632 1.00 0.00 N ATOM 523 CA HIS A 33 -11.674 2.477 -9.189 1.00 0.00 C ATOM 524 C HIS A 33 -11.120 1.162 -8.617 1.00 0.00 C ATOM 525 O HIS A 33 -11.113 0.137 -9.304 1.00 0.00 O ATOM 526 CB HIS A 33 -11.532 2.486 -10.718 1.00 0.00 C ATOM 527 CG HIS A 33 -12.541 1.638 -11.429 1.00 0.00 C ATOM 528 ND1 HIS A 33 -12.195 0.620 -12.285 1.00 0.00 N ATOM 529 CD2 HIS A 33 -13.894 1.673 -11.417 1.00 0.00 C ATOM 530 CE1 HIS A 33 -13.288 0.066 -12.771 1.00 0.00 C ATOM 531 NE2 HIS A 33 -14.334 0.685 -12.259 1.00 0.00 N ATOM 0 H HIS A 33 -10.214 3.446 -8.013 1.00 0.00 H new ATOM 0 HA HIS A 33 -12.726 2.532 -8.909 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -11.619 3.512 -11.075 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -10.532 2.141 -10.982 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -14.512 2.353 -10.849 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -13.321 -0.756 -13.471 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -15.310 0.465 -12.457 1.00 0.00 H new ATOM 540 N LYS A 34 -10.680 1.194 -7.356 1.00 0.00 N ATOM 541 CA LYS A 34 -10.190 -0.009 -6.665 1.00 0.00 C ATOM 542 C LYS A 34 -8.951 -0.593 -7.373 1.00 0.00 C ATOM 543 O LYS A 34 -8.411 0.017 -8.302 1.00 0.00 O ATOM 544 CB LYS A 34 -11.319 -1.059 -6.587 1.00 0.00 C ATOM 545 CG LYS A 34 -11.061 -2.199 -5.614 1.00 0.00 C ATOM 546 CD LYS A 34 -12.126 -3.279 -5.719 1.00 0.00 C ATOM 547 CE LYS A 34 -11.830 -4.436 -4.780 1.00 0.00 C ATOM 548 NZ LYS A 34 -12.873 -5.494 -4.843 1.00 0.00 N ATOM 0 H LYS A 34 -10.652 2.041 -6.789 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.890 0.269 -5.655 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.244 -0.558 -6.301 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.477 -1.477 -7.581 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.081 -2.633 -5.814 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.036 -1.810 -4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.102 -2.855 -5.482 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.178 -3.644 -6.745 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -10.862 -4.868 -5.033 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.756 -4.062 -3.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.149 -5.767 -3.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.704 -5.132 -5.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.496 -6.324 -5.343 1.00 0.00 H new ATOM 562 N HIS A 35 -8.490 -1.752 -6.901 1.00 0.00 N ATOM 563 CA HIS A 35 -7.400 -2.496 -7.533 1.00 0.00 C ATOM 564 C HIS A 35 -7.297 -3.889 -6.913 1.00 0.00 C ATOM 565 O HIS A 35 -8.162 -4.278 -6.124 1.00 0.00 O ATOM 566 CB HIS A 35 -6.067 -1.751 -7.411 1.00 0.00 C ATOM 567 CG HIS A 35 -5.477 -1.377 -8.741 1.00 0.00 C ATOM 568 ND1 HIS A 35 -6.019 -0.405 -9.552 1.00 0.00 N ATOM 569 CD2 HIS A 35 -4.396 -1.854 -9.406 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.301 -0.298 -10.653 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.310 -1.166 -10.591 1.00 0.00 N ATOM 0 H HIS A 35 -8.864 -2.203 -6.066 1.00 0.00 H new ATOM 0 HA HIS A 35 -7.623 -2.592 -8.596 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -6.215 -0.848 -6.819 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -5.357 -2.375 -6.868 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -6.848 0.147 -9.335 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.727 -2.631 -9.067 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.492 0.385 -11.468 1.00 0.00 H new ATOM 580 N GLY A 36 -6.243 -4.622 -7.271 1.00 0.00 N ATOM 581 CA GLY A 36 -6.084 -6.000 -6.825 1.00 0.00 C ATOM 582 C GLY A 36 -5.861 -6.145 -5.331 1.00 0.00 C ATOM 583 O GLY A 36 -5.773 -5.155 -4.604 1.00 0.00 O ATOM 0 H GLY A 36 -5.489 -4.282 -7.868 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.972 -6.566 -7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.241 -6.447 -7.353 1.00 0.00 H new ATOM 587 N GLN A 37 -5.766 -7.395 -4.882 1.00 0.00 N ATOM 588 CA GLN A 37 -5.620 -7.707 -3.462 1.00 0.00 C ATOM 589 C GLN A 37 -4.238 -7.329 -2.930 1.00 0.00 C ATOM 590 O GLN A 37 -4.089 -6.331 -2.238 1.00 0.00 O ATOM 591 CB GLN A 37 -5.871 -9.197 -3.210 1.00 0.00 C ATOM 592 CG GLN A 37 -7.237 -9.682 -3.669 1.00 0.00 C ATOM 593 CD GLN A 37 -7.498 -11.136 -3.317 1.00 0.00 C ATOM 594 OE1 GLN A 37 -8.193 -11.845 -4.042 1.00 0.00 O ATOM 595 NE2 GLN A 37 -6.969 -11.583 -2.187 1.00 0.00 N ATOM 0 H GLN A 37 -5.788 -8.215 -5.488 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.363 -7.113 -2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.101 -9.776 -3.721 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.766 -9.397 -2.144 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -8.009 -9.060 -3.216 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.318 -9.555 -4.749 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.397 -10.964 -1.612 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.133 -12.546 -1.893 1.00 0.00 H new ATOM 604 N PHE A 38 -3.235 -8.141 -3.248 1.00 0.00 N ATOM 605 CA PHE A 38 -1.883 -7.937 -2.726 1.00 0.00 C ATOM 606 C PHE A 38 -1.024 -7.139 -3.700 1.00 0.00 C ATOM 607 O PHE A 38 -0.540 -7.673 -4.699 1.00 0.00 O ATOM 608 CB PHE A 38 -1.211 -9.283 -2.436 1.00 0.00 C ATOM 609 CG PHE A 38 -1.782 -10.016 -1.254 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.920 -10.798 -1.380 1.00 0.00 C ATOM 611 CD2 PHE A 38 -1.168 -9.929 -0.014 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.434 -11.478 -0.291 1.00 0.00 C ATOM 613 CE2 PHE A 38 -1.678 -10.605 1.076 1.00 0.00 C ATOM 614 CZ PHE A 38 -2.812 -11.381 0.937 1.00 0.00 C ATOM 0 H PHE A 38 -3.330 -8.948 -3.865 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.973 -7.369 -1.800 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.297 -9.917 -3.319 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.147 -9.116 -2.266 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -3.410 -10.877 -2.339 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.280 -9.325 0.100 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -4.321 -12.084 -0.401 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.191 -10.527 2.037 1.00 0.00 H new ATOM 0 HZ PHE A 38 -3.212 -11.911 1.789 1.00 0.00 H new ATOM 624 N ILE A 39 -0.826 -5.862 -3.402 1.00 0.00 N ATOM 625 CA ILE A 39 -0.041 -4.993 -4.266 1.00 0.00 C ATOM 626 C ILE A 39 0.925 -4.133 -3.455 1.00 0.00 C ATOM 627 O ILE A 39 0.554 -3.549 -2.436 1.00 0.00 O ATOM 628 CB ILE A 39 -0.948 -4.075 -5.123 1.00 0.00 C ATOM 629 CG1 ILE A 39 -1.851 -4.915 -6.032 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.110 -3.111 -5.955 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.795 -4.093 -6.881 1.00 0.00 C ATOM 0 H ILE A 39 -1.198 -5.406 -2.569 1.00 0.00 H new ATOM 0 HA ILE A 39 0.530 -5.642 -4.930 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.575 -3.491 -4.450 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.227 -5.525 -6.685 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.434 -5.601 -5.417 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.768 -2.476 -6.549 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.494 -2.490 -5.294 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.544 -3.677 -6.618 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.401 -4.757 -7.497 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.445 -3.503 -6.235 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.220 -3.426 -7.523 1.00 0.00 H new ATOM 643 N TYR A 40 2.169 -4.086 -3.903 1.00 0.00 N ATOM 644 CA TYR A 40 3.164 -3.188 -3.336 1.00 0.00 C ATOM 645 C TYR A 40 3.418 -2.035 -4.304 1.00 0.00 C ATOM 646 O TYR A 40 3.783 -2.259 -5.461 1.00 0.00 O ATOM 647 CB TYR A 40 4.471 -3.944 -3.058 1.00 0.00 C ATOM 648 CG TYR A 40 5.553 -3.094 -2.424 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.411 -2.329 -3.204 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.716 -3.058 -1.045 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.398 -1.556 -2.627 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.701 -2.285 -0.461 1.00 0.00 C ATOM 653 CZ TYR A 40 7.537 -1.535 -1.256 1.00 0.00 C ATOM 654 OH TYR A 40 8.517 -0.761 -0.680 1.00 0.00 O ATOM 0 H TYR A 40 2.517 -4.666 -4.666 1.00 0.00 H new ATOM 0 HA TYR A 40 2.790 -2.791 -2.392 1.00 0.00 H new ATOM 0 HB2 TYR A 40 4.257 -4.789 -2.404 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.848 -4.354 -3.995 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.304 -2.339 -4.279 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.061 -3.645 -0.418 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.059 -0.970 -3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.814 -2.269 0.613 1.00 0.00 H new ATOM 0 HH TYR A 40 8.690 0.021 -1.244 1.00 0.00 H new ATOM 664 N VAL A 41 3.217 -0.811 -3.840 1.00 0.00 N ATOM 665 CA VAL A 41 3.407 0.362 -4.679 1.00 0.00 C ATOM 666 C VAL A 41 4.412 1.330 -4.065 1.00 0.00 C ATOM 667 O VAL A 41 4.151 1.955 -3.040 1.00 0.00 O ATOM 668 CB VAL A 41 2.073 1.096 -4.955 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.216 0.291 -5.917 1.00 0.00 C ATOM 670 CG2 VAL A 41 1.304 1.352 -3.663 1.00 0.00 C ATOM 0 H VAL A 41 2.922 -0.604 -2.886 1.00 0.00 H new ATOM 0 HA VAL A 41 3.802 0.003 -5.629 1.00 0.00 H new ATOM 0 HB VAL A 41 2.310 2.059 -5.407 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.281 0.820 -6.101 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.750 0.160 -6.858 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.001 -0.685 -5.483 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.372 1.869 -3.891 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.083 0.402 -3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.907 1.968 -2.997 1.00 0.00 H new ATOM 680 N TRP A 42 5.571 1.442 -4.694 1.00 0.00 N ATOM 681 CA TRP A 42 6.604 2.348 -4.216 1.00 0.00 C ATOM 682 C TRP A 42 6.826 3.490 -5.206 1.00 0.00 C ATOM 683 O TRP A 42 6.896 4.657 -4.818 1.00 0.00 O ATOM 684 CB TRP A 42 7.915 1.586 -3.949 1.00 0.00 C ATOM 685 CG TRP A 42 8.480 0.870 -5.149 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.943 -0.210 -5.796 1.00 0.00 C ATOM 687 CD2 TRP A 42 9.704 1.174 -5.832 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.755 -0.587 -6.840 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.841 0.246 -6.880 1.00 0.00 C ATOM 690 CE3 TRP A 42 10.695 2.144 -5.657 1.00 0.00 C ATOM 691 CZ2 TRP A 42 10.929 0.261 -7.750 1.00 0.00 C ATOM 692 CZ3 TRP A 42 11.773 2.158 -6.520 1.00 0.00 C ATOM 693 CH2 TRP A 42 11.885 1.221 -7.556 1.00 0.00 C ATOM 0 H TRP A 42 5.820 0.919 -5.534 1.00 0.00 H new ATOM 0 HA TRP A 42 6.268 2.782 -3.274 1.00 0.00 H new ATOM 0 HB2 TRP A 42 8.660 2.290 -3.578 1.00 0.00 H new ATOM 0 HB3 TRP A 42 7.742 0.858 -3.156 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.017 -0.695 -5.526 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.577 -1.361 -7.480 1.00 0.00 H new ATOM 0 HE3 TRP A 42 10.619 2.870 -4.861 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 11.015 -0.460 -8.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 12.543 2.904 -6.394 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.741 1.257 -8.213 1.00 0.00 H new ATOM 704 N GLY A 43 6.908 3.149 -6.489 1.00 0.00 N ATOM 705 CA GLY A 43 7.160 4.151 -7.506 1.00 0.00 C ATOM 706 C GLY A 43 8.638 4.435 -7.657 1.00 0.00 C ATOM 707 O GLY A 43 9.320 4.726 -6.677 1.00 0.00 O ATOM 0 H GLY A 43 6.804 2.197 -6.841 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.755 3.812 -8.459 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.637 5.072 -7.247 1.00 0.00 H new ATOM 711 N GLU A 44 9.136 4.364 -8.884 1.00 0.00 N ATOM 712 CA GLU A 44 10.566 4.504 -9.133 1.00 0.00 C ATOM 713 C GLU A 44 11.047 5.919 -8.807 1.00 0.00 C ATOM 714 O GLU A 44 12.116 6.103 -8.220 1.00 0.00 O ATOM 715 CB GLU A 44 10.888 4.138 -10.584 1.00 0.00 C ATOM 716 CG GLU A 44 12.376 4.101 -10.886 1.00 0.00 C ATOM 717 CD GLU A 44 12.673 3.487 -12.235 1.00 0.00 C ATOM 718 OE1 GLU A 44 12.551 4.192 -13.252 1.00 0.00 O ATOM 719 OE2 GLU A 44 13.031 2.289 -12.283 1.00 0.00 O ATOM 0 H GLU A 44 8.574 4.211 -9.721 1.00 0.00 H new ATOM 0 HA GLU A 44 11.097 3.816 -8.475 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.456 3.163 -10.808 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.409 4.859 -11.247 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.776 5.114 -10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.888 3.532 -10.110 1.00 0.00 H new ATOM 726 N GLU A 45 10.256 6.916 -9.186 1.00 0.00 N ATOM 727 CA GLU A 45 10.550 8.299 -8.822 1.00 0.00 C ATOM 728 C GLU A 45 9.737 8.707 -7.592 1.00 0.00 C ATOM 729 O GLU A 45 9.651 9.890 -7.251 1.00 0.00 O ATOM 730 CB GLU A 45 10.241 9.255 -9.983 1.00 0.00 C ATOM 731 CG GLU A 45 10.992 8.940 -11.270 1.00 0.00 C ATOM 732 CD GLU A 45 10.152 8.163 -12.262 1.00 0.00 C ATOM 733 OE1 GLU A 45 9.803 7.001 -11.976 1.00 0.00 O ATOM 734 OE2 GLU A 45 9.831 8.722 -13.336 1.00 0.00 O ATOM 0 H GLU A 45 9.410 6.795 -9.743 1.00 0.00 H new ATOM 0 HA GLU A 45 11.614 8.365 -8.593 1.00 0.00 H new ATOM 0 HB2 GLU A 45 9.170 9.229 -10.185 1.00 0.00 H new ATOM 0 HB3 GLU A 45 10.482 10.272 -9.675 1.00 0.00 H new ATOM 0 HG2 GLU A 45 11.322 9.871 -11.730 1.00 0.00 H new ATOM 0 HG3 GLU A 45 11.888 8.367 -11.032 1.00 0.00 H new ATOM 741 N GLY A 46 9.158 7.719 -6.925 1.00 0.00 N ATOM 742 CA GLY A 46 8.311 7.986 -5.780 1.00 0.00 C ATOM 743 C GLY A 46 6.844 7.916 -6.148 1.00 0.00 C ATOM 744 O GLY A 46 6.427 6.986 -6.835 1.00 0.00 O ATOM 0 H GLY A 46 9.261 6.731 -7.158 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.524 7.264 -4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.540 8.973 -5.379 1.00 0.00 H new ATOM 748 N ALA A 47 6.066 8.895 -5.682 1.00 0.00 N ATOM 749 CA ALA A 47 4.637 9.020 -6.012 1.00 0.00 C ATOM 750 C ALA A 47 3.766 8.000 -5.267 1.00 0.00 C ATOM 751 O ALA A 47 2.601 8.271 -4.980 1.00 0.00 O ATOM 752 CB ALA A 47 4.401 8.932 -7.517 1.00 0.00 C ATOM 0 H ALA A 47 6.407 9.629 -5.062 1.00 0.00 H new ATOM 0 HA ALA A 47 4.332 10.010 -5.673 1.00 0.00 H new ATOM 0 HB1 ALA A 47 3.335 9.028 -7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 47 4.942 9.735 -8.018 1.00 0.00 H new ATOM 0 HB3 ALA A 47 4.757 7.970 -7.885 1.00 0.00 H new ATOM 758 N GLY A 48 4.324 6.845 -4.938 1.00 0.00 N ATOM 759 CA GLY A 48 3.566 5.837 -4.219 1.00 0.00 C ATOM 760 C GLY A 48 3.325 6.217 -2.770 1.00 0.00 C ATOM 761 O GLY A 48 2.420 5.693 -2.128 1.00 0.00 O ATOM 0 H GLY A 48 5.286 6.586 -5.155 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.608 5.684 -4.716 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.100 4.888 -4.259 1.00 0.00 H new ATOM 765 N LYS A 49 4.133 7.145 -2.272 1.00 0.00 N ATOM 766 CA LYS A 49 4.091 7.570 -0.875 1.00 0.00 C ATOM 767 C LYS A 49 2.700 8.055 -0.437 1.00 0.00 C ATOM 768 O LYS A 49 2.282 9.169 -0.779 1.00 0.00 O ATOM 769 CB LYS A 49 5.135 8.671 -0.640 1.00 0.00 C ATOM 770 CG LYS A 49 5.140 9.228 0.775 1.00 0.00 C ATOM 771 CD LYS A 49 5.417 8.147 1.805 1.00 0.00 C ATOM 772 CE LYS A 49 5.348 8.697 3.217 1.00 0.00 C ATOM 773 NZ LYS A 49 5.504 7.625 4.230 1.00 0.00 N ATOM 0 H LYS A 49 4.840 7.627 -2.827 1.00 0.00 H new ATOM 0 HA LYS A 49 4.322 6.697 -0.265 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.124 8.273 -0.866 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.952 9.486 -1.340 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.896 10.009 0.856 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.177 9.693 0.986 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.693 7.340 1.691 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.403 7.718 1.628 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.129 9.445 3.355 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.393 9.202 3.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.140 7.957 5.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.971 6.784 3.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.511 7.381 4.325 1.00 0.00 H new ATOM 787 N SER A 50 2.000 7.187 0.299 1.00 0.00 N ATOM 788 CA SER A 50 0.765 7.527 1.020 1.00 0.00 C ATOM 789 C SER A 50 -0.425 7.862 0.103 1.00 0.00 C ATOM 790 O SER A 50 -1.413 7.127 0.072 1.00 0.00 O ATOM 791 CB SER A 50 1.016 8.685 1.992 1.00 0.00 C ATOM 792 OG SER A 50 2.059 8.373 2.906 1.00 0.00 O ATOM 0 H SER A 50 2.278 6.212 0.414 1.00 0.00 H new ATOM 0 HA SER A 50 0.485 6.627 1.568 1.00 0.00 H new ATOM 0 HB2 SER A 50 1.276 9.583 1.432 1.00 0.00 H new ATOM 0 HB3 SER A 50 0.101 8.906 2.542 1.00 0.00 H new ATOM 0 HG SER A 50 2.251 7.413 2.868 1.00 0.00 H new ATOM 798 N HIS A 51 -0.323 8.960 -0.645 1.00 0.00 N ATOM 799 CA HIS A 51 -1.463 9.521 -1.381 1.00 0.00 C ATOM 800 C HIS A 51 -2.049 8.546 -2.400 1.00 0.00 C ATOM 801 O HIS A 51 -3.238 8.594 -2.691 1.00 0.00 O ATOM 802 CB HIS A 51 -1.116 10.875 -2.036 1.00 0.00 C ATOM 803 CG HIS A 51 -0.072 10.840 -3.113 1.00 0.00 C ATOM 804 ND1 HIS A 51 1.271 11.028 -2.865 1.00 0.00 N ATOM 805 CD2 HIS A 51 -0.189 10.703 -4.456 1.00 0.00 C ATOM 806 CE1 HIS A 51 1.931 11.011 -4.008 1.00 0.00 C ATOM 807 NE2 HIS A 51 1.070 10.815 -4.988 1.00 0.00 N ATOM 0 H HIS A 51 0.544 9.485 -0.760 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.240 9.701 -0.638 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -2.029 11.296 -2.457 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -0.780 11.558 -1.255 1.00 0.00 H new ATOM 0 HD1 HIS A 51 1.689 11.159 -1.944 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -1.104 10.537 -5.005 1.00 0.00 H new ATOM 0 HE1 HIS A 51 2.998 11.137 -4.122 1.00 0.00 H new ATOM 816 N LEU A 52 -1.223 7.677 -2.957 1.00 0.00 N ATOM 817 CA LEU A 52 -1.686 6.723 -3.940 1.00 0.00 C ATOM 818 C LEU A 52 -2.554 5.639 -3.285 1.00 0.00 C ATOM 819 O LEU A 52 -3.472 5.105 -3.905 1.00 0.00 O ATOM 820 CB LEU A 52 -0.473 6.111 -4.643 1.00 0.00 C ATOM 821 CG LEU A 52 -0.780 4.946 -5.568 1.00 0.00 C ATOM 822 CD1 LEU A 52 -1.638 5.392 -6.743 1.00 0.00 C ATOM 823 CD2 LEU A 52 0.506 4.300 -6.055 1.00 0.00 C ATOM 0 H LEU A 52 -0.228 7.615 -2.742 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.309 7.231 -4.676 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.024 6.891 -5.220 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.235 5.775 -3.885 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.346 4.205 -5.003 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.843 4.538 -7.389 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.578 5.800 -6.373 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.109 6.157 -7.310 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.267 3.467 -6.716 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.100 5.036 -6.598 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.075 3.933 -5.201 1.00 0.00 H new ATOM 835 N LEU A 53 -2.280 5.348 -2.017 1.00 0.00 N ATOM 836 CA LEU A 53 -2.979 4.285 -1.296 1.00 0.00 C ATOM 837 C LEU A 53 -4.409 4.690 -0.931 1.00 0.00 C ATOM 838 O LEU A 53 -5.314 3.855 -0.921 1.00 0.00 O ATOM 839 CB LEU A 53 -2.215 3.895 -0.020 1.00 0.00 C ATOM 840 CG LEU A 53 -0.926 3.087 -0.226 1.00 0.00 C ATOM 841 CD1 LEU A 53 0.170 3.941 -0.841 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.453 2.489 1.092 1.00 0.00 C ATOM 0 H LEU A 53 -1.575 5.835 -1.464 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.026 3.426 -1.966 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.966 4.807 0.523 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.884 3.317 0.618 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.150 2.276 -0.919 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.069 3.339 -0.974 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.161 4.317 -1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.390 4.781 -0.182 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.462 1.920 0.926 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.258 3.290 1.806 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.224 1.829 1.489 1.00 0.00 H new ATOM 854 N GLN A 54 -4.606 5.972 -0.636 1.00 0.00 N ATOM 855 CA GLN A 54 -5.904 6.461 -0.165 1.00 0.00 C ATOM 856 C GLN A 54 -6.986 6.268 -1.223 1.00 0.00 C ATOM 857 O GLN A 54 -8.137 5.966 -0.905 1.00 0.00 O ATOM 858 CB GLN A 54 -5.810 7.939 0.229 1.00 0.00 C ATOM 859 CG GLN A 54 -5.590 8.888 -0.936 1.00 0.00 C ATOM 860 CD GLN A 54 -5.356 10.319 -0.492 1.00 0.00 C ATOM 861 OE1 GLN A 54 -4.812 10.567 0.580 1.00 0.00 O ATOM 862 NE2 GLN A 54 -5.763 11.270 -1.317 1.00 0.00 N ATOM 0 H GLN A 54 -3.887 6.692 -0.714 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.180 5.877 0.713 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.727 8.224 0.745 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.993 8.061 0.940 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -4.734 8.548 -1.519 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -6.457 8.854 -1.595 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -6.211 11.022 -2.199 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -5.629 12.251 -1.071 1.00 0.00 H new ATOM 871 N ALA A 55 -6.596 6.435 -2.479 1.00 0.00 N ATOM 872 CA ALA A 55 -7.509 6.286 -3.611 1.00 0.00 C ATOM 873 C ALA A 55 -8.079 4.870 -3.686 1.00 0.00 C ATOM 874 O ALA A 55 -9.175 4.650 -4.205 1.00 0.00 O ATOM 875 CB ALA A 55 -6.795 6.640 -4.907 1.00 0.00 C ATOM 0 H ALA A 55 -5.641 6.677 -2.745 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.344 6.971 -3.464 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.483 6.526 -5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.448 7.672 -4.861 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.942 5.976 -5.046 1.00 0.00 H new ATOM 881 N TRP A 56 -7.325 3.919 -3.162 1.00 0.00 N ATOM 882 CA TRP A 56 -7.734 2.523 -3.150 1.00 0.00 C ATOM 883 C TRP A 56 -8.625 2.245 -1.944 1.00 0.00 C ATOM 884 O TRP A 56 -9.640 1.554 -2.049 1.00 0.00 O ATOM 885 CB TRP A 56 -6.483 1.642 -3.122 1.00 0.00 C ATOM 886 CG TRP A 56 -6.740 0.167 -3.059 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.160 -0.641 -4.076 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.561 -0.681 -1.918 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.255 -1.940 -3.637 1.00 0.00 N ATOM 890 CE2 TRP A 56 -6.892 -1.988 -2.314 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.152 -0.459 -0.598 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -6.829 -3.068 -1.440 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.090 -1.531 0.268 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.425 -2.822 -0.155 1.00 0.00 C ATOM 0 H TRP A 56 -6.415 4.091 -2.734 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.310 2.297 -4.047 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -5.890 1.853 -4.012 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -5.878 1.926 -2.261 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -7.385 -0.308 -5.079 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -7.547 -2.738 -4.202 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -5.890 0.534 -0.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.089 -4.065 -1.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.778 -1.371 1.289 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.364 -3.641 0.546 1.00 0.00 H new ATOM 905 N VAL A 57 -8.250 2.812 -0.808 1.00 0.00 N ATOM 906 CA VAL A 57 -8.969 2.595 0.440 1.00 0.00 C ATOM 907 C VAL A 57 -10.345 3.259 0.425 1.00 0.00 C ATOM 908 O VAL A 57 -11.354 2.618 0.714 1.00 0.00 O ATOM 909 CB VAL A 57 -8.163 3.128 1.643 1.00 0.00 C ATOM 910 CG1 VAL A 57 -8.906 2.904 2.953 1.00 0.00 C ATOM 911 CG2 VAL A 57 -6.790 2.477 1.696 1.00 0.00 C ATOM 0 H VAL A 57 -7.444 3.432 -0.724 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.103 1.518 0.541 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.038 4.202 1.508 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.310 3.291 3.780 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.864 3.423 2.921 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.076 1.837 3.097 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.236 2.865 2.551 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.903 1.398 1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.245 2.701 0.779 1.00 0.00 H new ATOM 921 N ALA A 58 -10.383 4.539 0.077 1.00 0.00 N ATOM 922 CA ALA A 58 -11.623 5.306 0.134 1.00 0.00 C ATOM 923 C ALA A 58 -12.674 4.745 -0.817 1.00 0.00 C ATOM 924 O ALA A 58 -13.867 4.743 -0.507 1.00 0.00 O ATOM 925 CB ALA A 58 -11.354 6.765 -0.183 1.00 0.00 C ATOM 0 H ALA A 58 -9.573 5.067 -0.247 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.016 5.227 1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.288 7.325 -0.137 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.651 7.171 0.544 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -10.930 6.848 -1.184 1.00 0.00 H new ATOM 931 N GLN A 59 -12.227 4.261 -1.970 1.00 0.00 N ATOM 932 CA GLN A 59 -13.140 3.720 -2.965 1.00 0.00 C ATOM 933 C GLN A 59 -13.757 2.423 -2.451 1.00 0.00 C ATOM 934 O GLN A 59 -14.961 2.202 -2.584 1.00 0.00 O ATOM 935 CB GLN A 59 -12.403 3.499 -4.294 1.00 0.00 C ATOM 936 CG GLN A 59 -13.317 3.361 -5.508 1.00 0.00 C ATOM 937 CD GLN A 59 -13.957 1.993 -5.633 1.00 0.00 C ATOM 938 OE1 GLN A 59 -13.382 0.985 -5.231 1.00 0.00 O ATOM 939 NE2 GLN A 59 -15.156 1.952 -6.192 1.00 0.00 N ATOM 0 H GLN A 59 -11.243 4.233 -2.236 1.00 0.00 H new ATOM 0 HA GLN A 59 -13.945 4.433 -3.143 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.722 4.334 -4.461 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -11.792 2.600 -4.211 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -14.101 4.116 -5.450 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -12.742 3.568 -6.411 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -15.599 2.813 -6.513 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -15.637 1.059 -6.302 1.00 0.00 H new ATOM 948 N ALA A 60 -12.933 1.589 -1.827 1.00 0.00 N ATOM 949 CA ALA A 60 -13.390 0.319 -1.277 1.00 0.00 C ATOM 950 C ALA A 60 -14.326 0.541 -0.093 1.00 0.00 C ATOM 951 O ALA A 60 -15.274 -0.221 0.118 1.00 0.00 O ATOM 952 CB ALA A 60 -12.199 -0.526 -0.861 1.00 0.00 C ATOM 0 H ALA A 60 -11.939 1.772 -1.689 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.947 -0.210 -2.050 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.550 -1.473 -0.451 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.568 -0.718 -1.729 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.623 0.005 -0.104 1.00 0.00 H new ATOM 958 N LEU A 61 -14.054 1.592 0.671 1.00 0.00 N ATOM 959 CA LEU A 61 -14.883 1.955 1.811 1.00 0.00 C ATOM 960 C LEU A 61 -16.312 2.262 1.383 1.00 0.00 C ATOM 961 O LEU A 61 -17.265 1.727 1.947 1.00 0.00 O ATOM 962 CB LEU A 61 -14.282 3.166 2.534 1.00 0.00 C ATOM 963 CG LEU A 61 -13.144 2.849 3.505 1.00 0.00 C ATOM 964 CD1 LEU A 61 -12.533 4.132 4.049 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.657 1.982 4.644 1.00 0.00 C ATOM 0 H LEU A 61 -13.258 2.212 0.519 1.00 0.00 H new ATOM 0 HA LEU A 61 -14.910 1.104 2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.914 3.869 1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.076 3.671 3.084 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.369 2.302 2.968 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.725 3.887 4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.139 4.725 3.224 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.297 4.704 4.575 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.839 1.762 5.330 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.446 2.512 5.178 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.054 1.050 4.242 1.00 0.00 H new ATOM 977 N GLU A 62 -16.468 3.113 0.375 1.00 0.00 N ATOM 978 CA GLU A 62 -17.801 3.476 -0.090 1.00 0.00 C ATOM 979 C GLU A 62 -18.397 2.379 -0.959 1.00 0.00 C ATOM 980 O GLU A 62 -19.586 2.397 -1.283 1.00 0.00 O ATOM 981 CB GLU A 62 -17.786 4.808 -0.823 1.00 0.00 C ATOM 982 CG GLU A 62 -17.312 5.932 0.068 1.00 0.00 C ATOM 983 CD GLU A 62 -17.699 7.303 -0.442 1.00 0.00 C ATOM 984 OE1 GLU A 62 -17.340 7.649 -1.579 1.00 0.00 O ATOM 985 OE2 GLU A 62 -18.392 8.038 0.296 1.00 0.00 O ATOM 0 H GLU A 62 -15.701 3.558 -0.129 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.437 3.589 0.788 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.136 4.736 -1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -18.788 5.032 -1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -17.725 5.793 1.067 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.227 5.880 0.162 1.00 0.00 H new ATOM 992 N ALA A 63 -17.562 1.422 -1.331 1.00 0.00 N ATOM 993 CA ALA A 63 -18.026 0.235 -2.036 1.00 0.00 C ATOM 994 C ALA A 63 -18.740 -0.708 -1.070 1.00 0.00 C ATOM 995 O ALA A 63 -19.370 -1.681 -1.485 1.00 0.00 O ATOM 996 CB ALA A 63 -16.864 -0.473 -2.717 1.00 0.00 C ATOM 0 H ALA A 63 -16.557 1.443 -1.157 1.00 0.00 H new ATOM 0 HA ALA A 63 -18.733 0.543 -2.806 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -17.232 -1.357 -3.238 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -16.396 0.202 -3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.131 -0.772 -1.968 1.00 0.00 H new ATOM 1002 N GLY A 64 -18.627 -0.418 0.222 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.341 -1.191 1.219 1.00 0.00 C ATOM 1004 C GLY A 64 -18.462 -2.209 1.915 1.00 0.00 C ATOM 1005 O GLY A 64 -18.952 -3.045 2.676 1.00 0.00 O ATOM 0 H GLY A 64 -18.054 0.338 0.595 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.763 -0.515 1.962 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.177 -1.704 0.744 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.162 -2.147 1.664 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.235 -3.087 2.263 1.00 0.00 C ATOM 1011 C LYS A 65 -15.381 -2.359 3.283 1.00 0.00 C ATOM 1012 O LYS A 65 -15.190 -1.147 3.189 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.351 -3.736 1.194 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.116 -4.210 -0.036 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.273 -5.130 0.328 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.105 -5.476 -0.896 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.362 -6.178 -0.534 1.00 0.00 N ATOM 0 H LYS A 65 -16.729 -1.456 1.051 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.798 -3.879 2.756 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.590 -3.021 0.883 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.829 -4.585 1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.498 -3.346 -0.580 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -15.435 -4.733 -0.707 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.886 -6.044 0.779 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.903 -4.648 1.075 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -18.344 -4.563 -1.442 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -17.519 -6.104 -1.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -19.899 -6.395 -1.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.135 -7.062 -0.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.934 -5.569 0.085 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.877 -3.087 4.258 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.107 -2.472 5.329 1.00 0.00 C ATOM 1033 C ASN A 66 -12.669 -2.267 4.890 1.00 0.00 C ATOM 1034 O ASN A 66 -12.035 -3.181 4.360 1.00 0.00 O ATOM 1035 CB ASN A 66 -14.147 -3.329 6.592 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.934 -2.507 7.851 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -14.187 -1.301 7.870 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.498 -3.153 8.921 1.00 0.00 N ATOM 0 H ASN A 66 -14.983 -4.099 4.335 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.554 -1.504 5.555 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -15.108 -3.840 6.652 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.379 -4.100 6.530 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.361 -2.652 9.799 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.299 -4.152 8.868 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.152 -1.079 5.146 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.823 -0.703 4.698 1.00 0.00 C ATOM 1047 C ALA A 67 -10.217 0.330 5.635 1.00 0.00 C ATOM 1048 O ALA A 67 -10.934 1.133 6.230 1.00 0.00 O ATOM 1049 CB ALA A 67 -10.885 -0.153 3.281 1.00 0.00 C ATOM 0 H ALA A 67 -12.639 -0.350 5.668 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.190 -1.590 4.706 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.883 0.126 2.955 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.285 -0.915 2.612 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.531 0.725 3.259 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.902 0.293 5.774 1.00 0.00 N ATOM 1056 CA ALA A 68 -8.189 1.256 6.595 1.00 0.00 C ATOM 1057 C ALA A 68 -6.745 1.378 6.134 1.00 0.00 C ATOM 1058 O ALA A 68 -6.154 0.403 5.659 1.00 0.00 O ATOM 1059 CB ALA A 68 -8.245 0.843 8.058 1.00 0.00 C ATOM 0 H ALA A 68 -8.303 -0.400 5.325 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.669 2.229 6.489 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.707 1.573 8.663 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -9.284 0.797 8.384 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.784 -0.137 8.177 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.181 2.570 6.251 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.795 2.775 5.906 1.00 0.00 C ATOM 1067 C TYR A 69 -4.024 3.246 7.127 1.00 0.00 C ATOM 1068 O TYR A 69 -4.528 4.037 7.924 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.643 3.772 4.745 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.015 5.206 5.067 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.319 5.661 4.916 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.052 6.109 5.504 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -6.652 6.975 5.192 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -4.377 7.422 5.780 1.00 0.00 C ATOM 1075 CZ TYR A 69 -5.676 7.852 5.624 1.00 0.00 C ATOM 1076 OH TYR A 69 -5.998 9.165 5.893 1.00 0.00 O ATOM 0 H TYR A 69 -6.666 3.404 6.582 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.382 1.824 5.570 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.608 3.751 4.403 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.260 3.432 3.913 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.085 4.978 4.578 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.032 5.777 5.630 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.670 7.314 5.070 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -3.615 8.109 6.117 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.196 9.645 6.187 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.823 2.731 7.283 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.971 3.093 8.400 1.00 0.00 C ATOM 1088 C ILE A 70 -0.547 3.322 7.919 1.00 0.00 C ATOM 1089 O ILE A 70 0.065 2.441 7.313 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.976 2.001 9.497 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.381 1.836 10.086 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.978 2.332 10.599 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.492 0.740 11.123 1.00 0.00 C ATOM 0 H ILE A 70 -2.409 2.053 6.643 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.367 4.012 8.832 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.678 1.059 9.036 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.687 2.780 10.537 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.080 1.627 9.276 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.001 1.550 11.358 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.024 2.397 10.175 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.242 3.286 11.054 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.517 0.689 11.490 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.219 -0.215 10.674 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.820 0.956 11.954 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.038 4.516 8.170 1.00 0.00 N ATOM 1106 CA ASP A 71 1.335 4.856 7.832 1.00 0.00 C ATOM 1107 C ASP A 71 2.153 4.915 9.109 1.00 0.00 C ATOM 1108 O ASP A 71 1.985 5.801 9.948 1.00 0.00 O ATOM 1109 CB ASP A 71 1.387 6.161 7.012 1.00 0.00 C ATOM 1110 CG ASP A 71 0.994 7.405 7.782 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -0.104 7.428 8.378 1.00 0.00 O ATOM 1112 OD2 ASP A 71 1.784 8.369 7.779 1.00 0.00 O ATOM 0 H ASP A 71 -0.560 5.273 8.611 1.00 0.00 H new ATOM 0 HA ASP A 71 1.773 4.089 7.193 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.398 6.292 6.626 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.728 6.060 6.150 1.00 0.00 H new ATOM 1117 N ALA A 72 3.027 3.922 9.237 1.00 0.00 N ATOM 1118 CA ALA A 72 3.718 3.602 10.486 1.00 0.00 C ATOM 1119 C ALA A 72 4.356 4.803 11.173 1.00 0.00 C ATOM 1120 O ALA A 72 4.425 4.845 12.400 1.00 0.00 O ATOM 1121 CB ALA A 72 4.771 2.539 10.233 1.00 0.00 C ATOM 0 H ALA A 72 3.281 3.306 8.465 1.00 0.00 H new ATOM 0 HA ALA A 72 2.951 3.235 11.168 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.283 2.304 11.166 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.294 1.639 9.845 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.494 2.909 9.506 1.00 0.00 H new ATOM 1127 N ALA A 73 4.821 5.778 10.408 1.00 0.00 N ATOM 1128 CA ALA A 73 5.560 6.887 11.020 1.00 0.00 C ATOM 1129 C ALA A 73 4.657 8.038 11.458 1.00 0.00 C ATOM 1130 O ALA A 73 5.143 9.037 11.994 1.00 0.00 O ATOM 1131 CB ALA A 73 6.651 7.394 10.098 1.00 0.00 C ATOM 0 H ALA A 73 4.709 5.832 9.396 1.00 0.00 H new ATOM 0 HA ALA A 73 6.018 6.482 11.922 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.181 8.216 10.579 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.351 6.586 9.884 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.206 7.745 9.167 1.00 0.00 H new ATOM 1137 N SER A 74 3.360 7.905 11.242 1.00 0.00 N ATOM 1138 CA SER A 74 2.418 8.929 11.674 1.00 0.00 C ATOM 1139 C SER A 74 1.286 8.307 12.484 1.00 0.00 C ATOM 1140 O SER A 74 0.697 8.952 13.356 1.00 0.00 O ATOM 1141 CB SER A 74 1.864 9.681 10.461 1.00 0.00 C ATOM 1142 OG SER A 74 0.993 10.733 10.844 1.00 0.00 O ATOM 0 H SER A 74 2.935 7.105 10.774 1.00 0.00 H new ATOM 0 HA SER A 74 2.943 9.639 12.313 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.690 10.088 9.878 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.330 8.984 9.815 1.00 0.00 H new ATOM 0 HG SER A 74 0.661 11.191 10.044 1.00 0.00 H new ATOM 1148 N MET A 75 0.982 7.051 12.195 1.00 0.00 N ATOM 1149 CA MET A 75 -0.052 6.331 12.918 1.00 0.00 C ATOM 1150 C MET A 75 0.445 4.948 13.308 1.00 0.00 C ATOM 1151 O MET A 75 1.173 4.310 12.549 1.00 0.00 O ATOM 1152 CB MET A 75 -1.323 6.218 12.068 1.00 0.00 C ATOM 1153 CG MET A 75 -1.997 7.554 11.808 1.00 0.00 C ATOM 1154 SD MET A 75 -3.601 7.385 10.995 1.00 0.00 S ATOM 1155 CE MET A 75 -3.120 6.626 9.444 1.00 0.00 C ATOM 0 H MET A 75 1.439 6.509 11.462 1.00 0.00 H new ATOM 0 HA MET A 75 -0.291 6.887 13.825 1.00 0.00 H new ATOM 0 HB2 MET A 75 -1.073 5.754 11.114 1.00 0.00 H new ATOM 0 HB3 MET A 75 -2.028 5.555 12.569 1.00 0.00 H new ATOM 0 HG2 MET A 75 -2.128 8.079 12.754 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.345 8.170 11.189 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.414 7.271 8.616 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.039 6.485 9.428 1.00 0.00 H new ATOM 0 HE3 MET A 75 -3.613 5.659 9.344 1.00 0.00 H new ATOM 1165 N PRO A 76 0.061 4.468 14.498 1.00 0.00 N ATOM 1166 CA PRO A 76 0.475 3.156 14.985 1.00 0.00 C ATOM 1167 C PRO A 76 -0.365 2.025 14.410 1.00 0.00 C ATOM 1168 O PRO A 76 -1.529 2.216 14.049 1.00 0.00 O ATOM 1169 CB PRO A 76 0.260 3.259 16.491 1.00 0.00 C ATOM 1170 CG PRO A 76 -0.842 4.251 16.664 1.00 0.00 C ATOM 1171 CD PRO A 76 -0.791 5.179 15.473 1.00 0.00 C ATOM 0 HA PRO A 76 1.499 2.922 14.695 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -0.010 2.293 16.917 1.00 0.00 H new ATOM 0 HB3 PRO A 76 1.168 3.588 16.997 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -1.808 3.749 16.721 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -0.717 4.808 17.593 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.787 5.366 15.071 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -0.368 6.147 15.740 1.00 0.00 H new ATOM 1179 N LEU A 77 0.234 0.847 14.326 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.475 -0.327 13.849 1.00 0.00 C ATOM 1181 C LEU A 77 -1.167 -1.010 15.022 1.00 0.00 C ATOM 1182 O LEU A 77 -0.634 -1.046 16.134 1.00 0.00 O ATOM 1183 CB LEU A 77 0.490 -1.291 13.148 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.166 -2.505 12.483 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.158 -2.065 11.417 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.891 -3.408 11.876 1.00 0.00 C ATOM 0 H LEU A 77 1.207 0.680 14.582 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.227 -0.023 13.122 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.044 -0.737 12.390 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.217 -1.646 13.878 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.708 -3.062 13.247 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.612 -2.943 10.958 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.935 -1.452 11.874 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.639 -1.484 10.654 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.410 -4.267 11.407 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.456 -2.854 11.126 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.567 -3.753 12.658 1.00 0.00 H new ATOM 1198 N THR A 78 -2.351 -1.546 14.776 1.00 0.00 N ATOM 1199 CA THR A 78 -3.151 -2.144 15.826 1.00 0.00 C ATOM 1200 C THR A 78 -3.730 -3.478 15.375 1.00 0.00 C ATOM 1201 O THR A 78 -3.824 -3.751 14.177 1.00 0.00 O ATOM 1202 CB THR A 78 -4.302 -1.204 16.240 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.981 -0.728 15.071 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.783 -0.025 17.048 1.00 0.00 C ATOM 0 H THR A 78 -2.780 -1.578 13.851 1.00 0.00 H new ATOM 0 HA THR A 78 -2.497 -2.310 16.682 1.00 0.00 H new ATOM 0 HB THR A 78 -4.996 -1.767 16.865 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.713 -0.133 15.337 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.616 0.621 17.326 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.290 -0.390 17.949 1.00 0.00 H new ATOM 0 HG23 THR A 78 -3.070 0.541 16.449 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.122 -4.297 16.341 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.733 -5.592 16.060 1.00 0.00 C ATOM 1214 C ASP A 79 -6.160 -5.408 15.545 1.00 0.00 C ATOM 1215 O ASP A 79 -6.775 -6.339 15.031 1.00 0.00 O ATOM 1216 CB ASP A 79 -4.725 -6.474 17.314 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.651 -5.965 18.401 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.242 -5.055 19.155 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -6.785 -6.473 18.512 1.00 0.00 O ATOM 0 H ASP A 79 -4.027 -4.087 17.335 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.147 -6.089 15.286 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.017 -7.488 17.040 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.709 -6.530 17.706 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.675 -4.190 15.685 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.988 -3.835 15.156 1.00 0.00 C ATOM 1226 C ALA A 80 -8.021 -3.970 13.636 1.00 0.00 C ATOM 1227 O ALA A 80 -9.083 -4.152 13.046 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.361 -2.420 15.568 1.00 0.00 C ATOM 0 H ALA A 80 -6.198 -3.426 16.165 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.719 -4.527 15.575 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.343 -2.171 15.165 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.387 -2.353 16.656 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.621 -1.721 15.179 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.849 -3.870 13.010 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.730 -3.950 11.554 1.00 0.00 C ATOM 1236 C ALA A 81 -7.313 -5.252 10.998 1.00 0.00 C ATOM 1237 O ALA A 81 -7.692 -5.318 9.831 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.271 -3.810 11.143 1.00 0.00 C ATOM 0 H ALA A 81 -5.961 -3.732 13.493 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.309 -3.129 11.132 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.191 -3.871 10.058 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.888 -2.847 11.482 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.687 -4.612 11.595 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.402 -6.278 11.841 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.933 -7.572 11.425 1.00 0.00 C ATOM 1246 C PHE A 82 -9.430 -7.500 11.124 1.00 0.00 C ATOM 1247 O PHE A 82 -9.994 -8.426 10.539 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.670 -8.632 12.498 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.231 -9.057 12.593 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.733 -10.042 11.755 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.382 -8.484 13.521 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.414 -10.441 11.842 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -4.062 -8.879 13.613 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.579 -9.861 12.774 1.00 0.00 C ATOM 0 H PHE A 82 -7.112 -6.237 12.818 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.417 -7.853 10.507 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.989 -8.243 13.465 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.284 -9.508 12.288 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.383 -10.502 11.026 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.756 -7.717 14.183 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.036 -11.207 11.181 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.409 -8.420 14.341 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.548 -10.175 12.847 1.00 0.00 H new ATOM 1264 N GLU A 83 -10.068 -6.410 11.526 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.489 -6.216 11.272 1.00 0.00 C ATOM 1266 C GLU A 83 -11.735 -5.783 9.834 1.00 0.00 C ATOM 1267 O GLU A 83 -12.827 -5.958 9.289 1.00 0.00 O ATOM 1268 CB GLU A 83 -12.051 -5.161 12.213 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.905 -5.517 13.679 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.568 -4.505 14.587 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -11.936 -3.479 14.909 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.727 -4.730 14.987 1.00 0.00 O ATOM 0 H GLU A 83 -9.623 -5.644 12.031 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.990 -7.169 11.443 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.546 -4.213 12.026 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.107 -5.010 11.988 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.340 -6.500 13.856 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.846 -5.587 13.929 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.723 -5.196 9.229 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.830 -4.699 7.875 1.00 0.00 C ATOM 1281 C ALA A 84 -10.411 -5.767 6.881 1.00 0.00 C ATOM 1282 O ALA A 84 -9.580 -6.621 7.184 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.989 -3.441 7.707 1.00 0.00 C ATOM 0 H ALA A 84 -9.810 -5.051 9.659 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.871 -4.444 7.678 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.079 -3.077 6.683 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.340 -2.674 8.397 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.945 -3.670 7.921 1.00 0.00 H new ATOM 1289 N GLU A 85 -11.021 -5.737 5.714 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.656 -6.660 4.651 1.00 0.00 C ATOM 1291 C GLU A 85 -9.601 -6.020 3.750 1.00 0.00 C ATOM 1292 O GLU A 85 -8.787 -6.705 3.128 1.00 0.00 O ATOM 1293 CB GLU A 85 -11.893 -7.035 3.838 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.777 -8.374 3.128 1.00 0.00 C ATOM 1295 CD GLU A 85 -11.718 -9.544 4.094 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -12.792 -9.996 4.555 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -10.607 -10.014 4.405 1.00 0.00 O ATOM 0 H GLU A 85 -11.770 -5.087 5.475 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.240 -7.567 5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.758 -7.059 4.500 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.080 -6.257 3.098 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.629 -8.502 2.460 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.882 -8.375 2.507 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.629 -4.694 3.691 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.697 -3.925 2.877 1.00 0.00 C ATOM 1306 C TYR A 86 -7.742 -3.138 3.772 1.00 0.00 C ATOM 1307 O TYR A 86 -8.148 -2.177 4.431 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.459 -2.957 1.961 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.348 -3.623 0.926 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.457 -4.372 1.303 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.077 -3.493 -0.431 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.265 -4.975 0.360 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -10.882 -4.092 -1.379 1.00 0.00 C ATOM 1314 CZ TYR A 86 -11.975 -4.832 -0.980 1.00 0.00 C ATOM 1315 OH TYR A 86 -12.769 -5.439 -1.928 1.00 0.00 O ATOM 0 H TYR A 86 -10.298 -4.122 4.206 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.124 -4.619 2.262 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.073 -2.302 2.579 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.737 -2.324 1.445 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.690 -4.484 2.352 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.223 -2.914 -0.749 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.121 -5.556 0.671 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.657 -3.981 -2.429 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.368 -6.294 -2.192 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.484 -3.551 3.813 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.488 -2.877 4.636 1.00 0.00 C ATOM 1327 C LEU A 87 -4.405 -2.249 3.774 1.00 0.00 C ATOM 1328 O LEU A 87 -3.773 -2.919 2.953 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.840 -3.838 5.644 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.687 -4.228 6.859 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -6.242 -2.993 7.549 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.804 -5.177 6.461 1.00 0.00 C ATOM 0 H LEU A 87 -6.128 -4.349 3.287 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.010 -2.095 5.187 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.562 -4.750 5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.917 -3.384 6.004 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.042 -4.749 7.567 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.840 -3.295 8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.418 -2.362 7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.866 -2.435 6.851 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.390 -5.438 7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.448 -4.693 5.727 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.376 -6.081 6.028 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.199 -0.960 3.958 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.137 -0.253 3.266 1.00 0.00 C ATOM 1346 C ALA A 88 -2.099 0.233 4.269 1.00 0.00 C ATOM 1347 O ALA A 88 -2.358 1.141 5.058 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.704 0.910 2.462 1.00 0.00 C ATOM 0 H ALA A 88 -4.755 -0.378 4.584 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.652 -0.936 2.569 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -2.893 1.428 1.950 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.414 0.532 1.727 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.211 1.603 3.133 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.931 -0.381 4.244 1.00 0.00 N ATOM 1355 CA VAL A 89 0.114 -0.065 5.204 1.00 0.00 C ATOM 1356 C VAL A 89 1.286 0.620 4.509 1.00 0.00 C ATOM 1357 O VAL A 89 1.927 0.046 3.625 1.00 0.00 O ATOM 1358 CB VAL A 89 0.618 -1.328 5.937 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.632 -0.961 7.013 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.549 -2.105 6.537 1.00 0.00 C ATOM 0 H VAL A 89 -0.680 -1.103 3.569 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.319 0.610 5.943 1.00 0.00 H new ATOM 0 HB VAL A 89 1.115 -1.968 5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 89 1.973 -1.866 7.516 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.483 -0.458 6.554 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.166 -0.296 7.740 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.172 -2.991 7.049 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.079 -1.473 7.249 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.231 -2.408 5.743 1.00 0.00 H new ATOM 1370 N ASP A 90 1.554 1.856 4.902 1.00 0.00 N ATOM 1371 CA ASP A 90 2.645 2.616 4.319 1.00 0.00 C ATOM 1372 C ASP A 90 3.845 2.612 5.254 1.00 0.00 C ATOM 1373 O ASP A 90 3.689 2.450 6.467 1.00 0.00 O ATOM 1374 CB ASP A 90 2.207 4.053 4.010 1.00 0.00 C ATOM 1375 CG ASP A 90 3.300 4.859 3.331 1.00 0.00 C ATOM 1376 OD1 ASP A 90 4.082 4.269 2.553 1.00 0.00 O ATOM 1377 OD2 ASP A 90 3.389 6.080 3.586 1.00 0.00 O ATOM 0 H ASP A 90 1.030 2.353 5.622 1.00 0.00 H new ATOM 0 HA ASP A 90 2.931 2.142 3.380 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.325 4.031 3.370 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.917 4.548 4.936 1.00 0.00 H new ATOM 1382 N GLN A 91 5.029 2.788 4.667 1.00 0.00 N ATOM 1383 CA GLN A 91 6.310 2.753 5.378 1.00 0.00 C ATOM 1384 C GLN A 91 6.395 1.590 6.366 1.00 0.00 C ATOM 1385 O GLN A 91 6.584 1.777 7.569 1.00 0.00 O ATOM 1386 CB GLN A 91 6.640 4.105 6.038 1.00 0.00 C ATOM 1387 CG GLN A 91 5.571 4.687 6.942 1.00 0.00 C ATOM 1388 CD GLN A 91 5.796 6.165 7.171 1.00 0.00 C ATOM 1389 OE1 GLN A 91 4.730 6.907 7.419 1.00 0.00 O flip ATOM 1390 NE2 GLN A 91 6.927 6.641 7.126 1.00 0.00 N flip ATOM 0 H GLN A 91 5.128 2.962 3.667 1.00 0.00 H new ATOM 0 HA GLN A 91 7.079 2.574 4.627 1.00 0.00 H new ATOM 0 HB2 GLN A 91 7.554 3.988 6.620 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.853 4.828 5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 91 4.589 4.530 6.496 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.574 4.163 7.898 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.727 6.038 6.932 1.00 0.00 H new ATOM 0 HE22 GLN A 91 7.067 7.639 7.283 1.00 0.00 H new ATOM 1399 N VAL A 92 6.276 0.382 5.824 1.00 0.00 N ATOM 1400 CA VAL A 92 6.377 -0.844 6.608 1.00 0.00 C ATOM 1401 C VAL A 92 7.799 -1.005 7.127 1.00 0.00 C ATOM 1402 O VAL A 92 8.047 -1.626 8.160 1.00 0.00 O ATOM 1403 CB VAL A 92 6.001 -2.069 5.747 1.00 0.00 C ATOM 1404 CG1 VAL A 92 5.999 -3.347 6.564 1.00 0.00 C ATOM 1405 CG2 VAL A 92 4.650 -1.854 5.091 1.00 0.00 C ATOM 0 H VAL A 92 6.107 0.226 4.830 1.00 0.00 H new ATOM 0 HA VAL A 92 5.685 -0.779 7.448 1.00 0.00 H new ATOM 0 HB VAL A 92 6.759 -2.177 4.971 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.730 -4.187 5.924 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.992 -3.513 6.982 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.274 -3.260 7.373 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.396 -2.725 4.487 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.891 -1.712 5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.691 -0.970 4.454 1.00 0.00 H new ATOM 1415 N GLU A 93 8.721 -0.403 6.401 1.00 0.00 N ATOM 1416 CA GLU A 93 10.130 -0.403 6.758 1.00 0.00 C ATOM 1417 C GLU A 93 10.385 0.372 8.054 1.00 0.00 C ATOM 1418 O GLU A 93 11.478 0.311 8.618 1.00 0.00 O ATOM 1419 CB GLU A 93 10.931 0.215 5.609 1.00 0.00 C ATOM 1420 CG GLU A 93 10.371 1.551 5.133 1.00 0.00 C ATOM 1421 CD GLU A 93 11.084 2.090 3.913 1.00 0.00 C ATOM 1422 OE1 GLU A 93 12.120 2.766 4.085 1.00 0.00 O ATOM 1423 OE2 GLU A 93 10.606 1.847 2.784 1.00 0.00 O ATOM 0 H GLU A 93 8.514 0.104 5.540 1.00 0.00 H new ATOM 0 HA GLU A 93 10.446 -1.432 6.928 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.963 0.355 5.929 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.949 -0.483 4.772 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.311 1.434 4.906 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.445 2.278 5.941 1.00 0.00 H new ATOM 1430 N LYS A 94 9.373 1.093 8.528 1.00 0.00 N ATOM 1431 CA LYS A 94 9.524 1.944 9.692 1.00 0.00 C ATOM 1432 C LYS A 94 8.719 1.416 10.885 1.00 0.00 C ATOM 1433 O LYS A 94 8.563 2.114 11.885 1.00 0.00 O ATOM 1434 CB LYS A 94 9.068 3.362 9.346 1.00 0.00 C ATOM 1435 CG LYS A 94 9.521 3.862 8.007 1.00 0.00 C ATOM 1436 CD LYS A 94 11.010 4.058 7.944 1.00 0.00 C ATOM 1437 CE LYS A 94 11.315 4.861 6.718 1.00 0.00 C ATOM 1438 NZ LYS A 94 12.769 4.927 6.414 1.00 0.00 N ATOM 0 H LYS A 94 8.439 1.101 8.119 1.00 0.00 H new ATOM 0 HA LYS A 94 10.576 1.949 9.977 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.979 3.396 9.381 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.433 4.043 10.115 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.217 3.154 7.236 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.023 4.806 7.787 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.365 4.573 8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.521 3.096 7.907 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.791 4.427 5.866 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.930 5.873 6.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.030 5.905 6.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.312 4.618 7.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.984 4.305 5.609 1.00 0.00 H new ATOM 1452 N LEU A 95 8.215 0.185 10.779 1.00 0.00 N ATOM 1453 CA LEU A 95 7.407 -0.414 11.846 1.00 0.00 C ATOM 1454 C LEU A 95 8.208 -0.573 13.135 1.00 0.00 C ATOM 1455 O LEU A 95 9.397 -0.901 13.105 1.00 0.00 O ATOM 1456 CB LEU A 95 6.862 -1.776 11.413 1.00 0.00 C ATOM 1457 CG LEU A 95 5.736 -1.736 10.379 1.00 0.00 C ATOM 1458 CD1 LEU A 95 5.307 -3.148 10.017 1.00 0.00 C ATOM 1459 CD2 LEU A 95 4.549 -0.943 10.906 1.00 0.00 C ATOM 0 H LEU A 95 8.351 -0.417 9.967 1.00 0.00 H new ATOM 0 HA LEU A 95 6.575 0.264 12.038 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.685 -2.364 11.006 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.501 -2.301 12.297 1.00 0.00 H new ATOM 0 HG LEU A 95 6.109 -1.240 9.483 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.505 -3.107 9.280 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.155 -3.690 9.600 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.952 -3.661 10.911 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.760 -0.927 10.155 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.174 -1.411 11.816 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.862 0.078 11.125 1.00 0.00 H new ATOM 1471 N GLY A 96 7.544 -0.356 14.265 1.00 0.00 N ATOM 1472 CA GLY A 96 8.212 -0.438 15.549 1.00 0.00 C ATOM 1473 C GLY A 96 8.191 -1.834 16.149 1.00 0.00 C ATOM 1474 O GLY A 96 7.502 -2.072 17.138 1.00 0.00 O ATOM 0 H GLY A 96 6.552 -0.124 14.314 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.247 -0.115 15.434 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.737 0.255 16.243 1.00 0.00 H new ATOM 1478 N ASN A 97 8.936 -2.750 15.523 1.00 0.00 N ATOM 1479 CA ASN A 97 9.164 -4.116 16.033 1.00 0.00 C ATOM 1480 C ASN A 97 7.869 -4.923 16.224 1.00 0.00 C ATOM 1481 O ASN A 97 7.535 -5.746 15.374 1.00 0.00 O ATOM 1482 CB ASN A 97 9.987 -4.084 17.327 1.00 0.00 C ATOM 1483 CG ASN A 97 10.373 -5.474 17.805 1.00 0.00 C ATOM 1484 OD1 ASN A 97 11.343 -6.061 17.320 1.00 0.00 O ATOM 1485 ND2 ASN A 97 9.647 -5.989 18.785 1.00 0.00 N ATOM 0 H ASN A 97 9.406 -2.567 14.636 1.00 0.00 H new ATOM 0 HA ASN A 97 9.733 -4.638 15.263 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.890 -3.495 17.165 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.414 -3.581 18.106 1.00 0.00 H new ATOM 0 HD21 ASN A 97 9.883 -6.905 19.167 1.00 0.00 H new ATOM 0 HD22 ASN A 97 8.852 -5.470 19.158 1.00 0.00 H new ATOM 1492 N GLU A 98 7.145 -4.687 17.323 1.00 0.00 N ATOM 1493 CA GLU A 98 5.911 -5.434 17.617 1.00 0.00 C ATOM 1494 C GLU A 98 4.935 -5.325 16.455 1.00 0.00 C ATOM 1495 O GLU A 98 4.241 -6.285 16.110 1.00 0.00 O ATOM 1496 CB GLU A 98 5.213 -4.918 18.888 1.00 0.00 C ATOM 1497 CG GLU A 98 6.071 -4.919 20.142 1.00 0.00 C ATOM 1498 CD GLU A 98 7.028 -3.751 20.186 1.00 0.00 C ATOM 1499 OE1 GLU A 98 6.598 -2.637 20.557 1.00 0.00 O ATOM 1500 OE2 GLU A 98 8.203 -3.934 19.831 1.00 0.00 O ATOM 0 H GLU A 98 7.389 -3.987 18.024 1.00 0.00 H new ATOM 0 HA GLU A 98 6.203 -6.473 17.773 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.866 -3.901 18.705 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.329 -5.529 19.071 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.426 -4.890 21.020 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.636 -5.850 20.192 1.00 0.00 H new ATOM 1507 N GLU A 99 4.903 -4.148 15.849 1.00 0.00 N ATOM 1508 CA GLU A 99 4.007 -3.878 14.737 1.00 0.00 C ATOM 1509 C GLU A 99 4.366 -4.735 13.528 1.00 0.00 C ATOM 1510 O GLU A 99 3.504 -5.072 12.722 1.00 0.00 O ATOM 1511 CB GLU A 99 4.064 -2.402 14.370 1.00 0.00 C ATOM 1512 CG GLU A 99 3.806 -1.487 15.549 1.00 0.00 C ATOM 1513 CD GLU A 99 3.850 -0.029 15.165 1.00 0.00 C ATOM 1514 OE1 GLU A 99 4.894 0.417 14.646 1.00 0.00 O ATOM 1515 OE2 GLU A 99 2.839 0.675 15.381 1.00 0.00 O ATOM 0 H GLU A 99 5.493 -3.359 16.112 1.00 0.00 H new ATOM 0 HA GLU A 99 2.992 -4.131 15.044 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.044 -2.176 13.950 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.328 -2.198 13.592 1.00 0.00 H new ATOM 0 HG2 GLU A 99 2.831 -1.718 15.978 1.00 0.00 H new ATOM 0 HG3 GLU A 99 4.549 -1.679 16.324 1.00 0.00 H new ATOM 1522 N GLN A 100 5.634 -5.101 13.412 1.00 0.00 N ATOM 1523 CA GLN A 100 6.082 -5.929 12.303 1.00 0.00 C ATOM 1524 C GLN A 100 5.555 -7.351 12.475 1.00 0.00 C ATOM 1525 O GLN A 100 5.165 -8.006 11.508 1.00 0.00 O ATOM 1526 CB GLN A 100 7.608 -5.925 12.209 1.00 0.00 C ATOM 1527 CG GLN A 100 8.136 -6.592 10.952 1.00 0.00 C ATOM 1528 CD GLN A 100 9.634 -6.452 10.796 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.402 -7.304 11.239 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.053 -5.372 10.161 1.00 0.00 N ATOM 0 H GLN A 100 6.368 -4.839 14.070 1.00 0.00 H new ATOM 0 HA GLN A 100 5.688 -5.518 11.374 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.964 -4.895 12.242 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.020 -6.433 13.081 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.875 -7.650 10.971 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.643 -6.158 10.082 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.378 -4.692 9.811 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.052 -5.218 10.021 1.00 0.00 H new ATOM 1539 N ALA A 101 5.521 -7.812 13.719 1.00 0.00 N ATOM 1540 CA ALA A 101 4.948 -9.113 14.039 1.00 0.00 C ATOM 1541 C ALA A 101 3.439 -9.090 13.822 1.00 0.00 C ATOM 1542 O ALA A 101 2.846 -10.074 13.375 1.00 0.00 O ATOM 1543 CB ALA A 101 5.276 -9.505 15.472 1.00 0.00 C ATOM 0 H ALA A 101 5.884 -7.303 14.525 1.00 0.00 H new ATOM 0 HA ALA A 101 5.385 -9.858 13.374 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.839 -10.479 15.692 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.358 -9.556 15.597 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.866 -8.761 16.156 1.00 0.00 H new ATOM 1549 N LEU A 102 2.825 -7.956 14.140 1.00 0.00 N ATOM 1550 CA LEU A 102 1.402 -7.757 13.897 1.00 0.00 C ATOM 1551 C LEU A 102 1.137 -7.793 12.390 1.00 0.00 C ATOM 1552 O LEU A 102 0.222 -8.471 11.924 1.00 0.00 O ATOM 1553 CB LEU A 102 0.959 -6.413 14.501 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.537 -6.256 14.807 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.370 -6.206 13.537 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.016 -7.378 15.715 1.00 0.00 C ATOM 0 H LEU A 102 3.293 -7.158 14.568 1.00 0.00 H new ATOM 0 HA LEU A 102 0.827 -8.553 14.371 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.514 -6.256 15.426 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.251 -5.618 13.815 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.668 -5.305 15.323 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.423 -6.094 13.797 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.055 -5.359 12.928 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.231 -7.129 12.974 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.079 -7.250 15.921 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.854 -8.338 15.224 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.459 -7.351 16.651 1.00 0.00 H new ATOM 1568 N LEU A 103 1.955 -7.060 11.644 1.00 0.00 N ATOM 1569 CA LEU A 103 1.888 -7.045 10.184 1.00 0.00 C ATOM 1570 C LEU A 103 2.001 -8.468 9.632 1.00 0.00 C ATOM 1571 O LEU A 103 1.234 -8.863 8.750 1.00 0.00 O ATOM 1572 CB LEU A 103 3.012 -6.145 9.638 1.00 0.00 C ATOM 1573 CG LEU A 103 2.944 -5.766 8.150 1.00 0.00 C ATOM 1574 CD1 LEU A 103 3.404 -6.911 7.259 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.538 -5.327 7.771 1.00 0.00 C ATOM 0 H LEU A 103 2.683 -6.460 12.031 1.00 0.00 H new ATOM 0 HA LEU A 103 0.927 -6.643 9.863 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.022 -5.224 10.222 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.963 -6.646 9.817 1.00 0.00 H new ATOM 0 HG LEU A 103 3.625 -4.929 7.993 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.342 -6.606 6.214 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.435 -7.169 7.501 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.765 -7.779 7.422 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.512 -5.063 6.714 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.839 -6.142 7.959 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.254 -4.461 8.368 1.00 0.00 H new ATOM 1587 N PHE A 104 2.956 -9.228 10.160 1.00 0.00 N ATOM 1588 CA PHE A 104 3.121 -10.634 9.793 1.00 0.00 C ATOM 1589 C PHE A 104 1.831 -11.410 10.015 1.00 0.00 C ATOM 1590 O PHE A 104 1.402 -12.188 9.160 1.00 0.00 O ATOM 1591 CB PHE A 104 4.250 -11.263 10.612 1.00 0.00 C ATOM 1592 CG PHE A 104 4.393 -12.745 10.409 1.00 0.00 C ATOM 1593 CD1 PHE A 104 4.802 -13.259 9.189 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.116 -13.626 11.441 1.00 0.00 C ATOM 1595 CE1 PHE A 104 4.929 -14.621 9.002 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.242 -14.989 11.262 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.649 -15.488 10.042 1.00 0.00 C ATOM 0 H PHE A 104 3.631 -8.893 10.847 1.00 0.00 H new ATOM 0 HA PHE A 104 3.374 -10.680 8.734 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.190 -10.777 10.350 1.00 0.00 H new ATOM 0 HB3 PHE A 104 4.073 -11.066 11.669 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.024 -12.586 8.374 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.797 -13.242 12.399 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.246 -15.008 8.045 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.022 -15.664 12.076 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.749 -16.554 9.900 1.00 0.00 H new ATOM 1607 N SER A 105 1.223 -11.184 11.167 1.00 0.00 N ATOM 1608 CA SER A 105 -0.026 -11.822 11.524 1.00 0.00 C ATOM 1609 C SER A 105 -1.124 -11.485 10.515 1.00 0.00 C ATOM 1610 O SER A 105 -1.951 -12.330 10.181 1.00 0.00 O ATOM 1611 CB SER A 105 -0.430 -11.371 12.923 1.00 0.00 C ATOM 1612 OG SER A 105 0.605 -11.634 13.860 1.00 0.00 O ATOM 0 H SER A 105 1.585 -10.551 11.880 1.00 0.00 H new ATOM 0 HA SER A 105 0.110 -12.903 11.511 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.656 -10.305 12.914 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.341 -11.887 13.227 1.00 0.00 H new ATOM 0 HG SER A 105 1.335 -10.993 13.730 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.114 -10.251 10.024 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.065 -9.821 9.005 1.00 0.00 C ATOM 1620 C ILE A 106 -1.884 -10.634 7.725 1.00 0.00 C ATOM 1621 O ILE A 106 -2.853 -11.137 7.153 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.913 -8.317 8.692 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.154 -7.484 9.954 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.874 -7.899 7.587 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -1.956 -5.996 9.752 1.00 0.00 C ATOM 0 H ILE A 106 -0.456 -9.529 10.316 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.067 -9.991 9.400 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.895 -8.138 8.346 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.170 -7.661 10.306 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.480 -7.827 10.739 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.751 -6.836 7.381 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.661 -8.470 6.684 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.899 -8.091 7.904 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.145 -5.473 10.690 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.932 -5.806 9.430 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.649 -5.637 8.991 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.636 -10.776 7.293 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.321 -11.567 6.106 1.00 0.00 C ATOM 1639 C PHE A 107 -0.749 -13.017 6.290 1.00 0.00 C ATOM 1640 O PHE A 107 -1.314 -13.626 5.379 1.00 0.00 O ATOM 1641 CB PHE A 107 1.174 -11.500 5.795 1.00 0.00 C ATOM 1642 CG PHE A 107 1.539 -10.442 4.793 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.585 -9.105 5.154 1.00 0.00 C ATOM 1644 CD2 PHE A 107 1.840 -10.789 3.486 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.923 -8.135 4.229 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.179 -9.824 2.557 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.220 -8.494 2.929 1.00 0.00 C ATOM 0 H PHE A 107 0.175 -10.354 7.746 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.874 -11.145 5.267 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.720 -11.315 6.720 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.501 -12.470 5.421 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.354 -8.818 6.169 1.00 0.00 H new ATOM 0 HD2 PHE A 107 1.809 -11.827 3.189 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.955 -7.096 4.523 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.412 -10.109 1.542 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.484 -7.737 2.205 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.481 -13.560 7.471 1.00 0.00 N ATOM 1658 CA ASN A 108 -0.863 -14.931 7.795 1.00 0.00 C ATOM 1659 C ASN A 108 -2.379 -15.075 7.783 1.00 0.00 C ATOM 1660 O ASN A 108 -2.910 -16.050 7.265 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.296 -15.334 9.161 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.499 -16.806 9.462 1.00 0.00 C ATOM 1663 OD1 ASN A 108 0.297 -17.646 9.048 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -1.546 -17.126 10.205 1.00 0.00 N ATOM 0 H ASN A 108 0.002 -13.070 8.224 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.447 -15.596 7.039 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.769 -15.104 9.191 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -0.773 -14.738 9.939 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.716 -18.100 10.454 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.183 -16.398 10.529 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.063 -14.078 8.335 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.523 -14.054 8.377 1.00 0.00 C ATOM 1673 C ARG A 109 -5.108 -14.078 6.966 1.00 0.00 C ATOM 1674 O ARG A 109 -6.106 -14.747 6.708 1.00 0.00 O ATOM 1675 CB ARG A 109 -4.978 -12.803 9.150 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.487 -12.638 9.328 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.129 -11.914 8.152 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.369 -11.234 8.529 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.228 -10.705 7.655 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.033 -10.861 6.352 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.283 -10.029 8.090 1.00 0.00 N ATOM 0 H ARG A 109 -2.623 -13.265 8.765 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.889 -14.943 8.890 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.516 -12.822 10.137 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.594 -11.922 8.635 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.947 -13.619 9.443 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.684 -12.084 10.245 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.426 -11.185 7.749 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.337 -12.630 7.357 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.591 -11.160 9.522 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.225 -11.386 6.016 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.691 -10.456 5.686 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.437 -9.914 9.092 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.940 -9.624 7.423 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.473 -13.352 6.054 1.00 0.00 N ATOM 1696 CA PHE A 110 -4.942 -13.272 4.677 1.00 0.00 C ATOM 1697 C PHE A 110 -4.689 -14.577 3.927 1.00 0.00 C ATOM 1698 O PHE A 110 -5.611 -15.182 3.380 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.248 -12.124 3.942 1.00 0.00 C ATOM 1700 CG PHE A 110 -4.675 -10.749 4.385 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -5.714 -10.580 5.285 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.042 -9.624 3.883 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.109 -9.318 5.680 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -4.436 -8.360 4.273 1.00 0.00 C ATOM 1705 CZ PHE A 110 -5.472 -8.207 5.173 1.00 0.00 C ATOM 0 H PHE A 110 -3.630 -12.809 6.244 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.016 -13.090 4.707 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.171 -12.219 4.081 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.441 -12.224 2.874 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.221 -11.447 5.683 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.231 -9.737 3.179 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -6.917 -9.202 6.387 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.934 -7.491 3.874 1.00 0.00 H new ATOM 0 HZ PHE A 110 -5.782 -7.219 5.479 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.437 -15.014 3.924 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.030 -16.182 3.150 1.00 0.00 C ATOM 1717 C ARG A 111 -3.623 -17.468 3.721 1.00 0.00 C ATOM 1718 O ARG A 111 -3.686 -18.486 3.035 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.503 -16.281 3.106 1.00 0.00 C ATOM 1720 CG ARG A 111 -0.826 -15.133 2.377 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.036 -15.208 0.872 1.00 0.00 C ATOM 1722 NE ARG A 111 -2.396 -14.848 0.463 1.00 0.00 N ATOM 1723 CZ ARG A 111 -3.009 -15.356 -0.610 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -2.436 -16.330 -1.309 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -4.210 -14.910 -0.963 1.00 0.00 N ATOM 0 H ARG A 111 -2.682 -14.576 4.451 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.412 -16.059 2.137 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.123 -16.323 4.127 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.224 -17.218 2.623 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -1.217 -14.186 2.750 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.242 -15.145 2.595 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -0.327 -14.543 0.379 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -0.816 -16.219 0.530 1.00 0.00 H new ATOM 0 HE ARG A 111 -2.905 -14.170 1.031 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.525 -16.692 -1.027 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -2.907 -16.715 -2.128 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -4.664 -14.180 -0.415 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -4.678 -15.298 -1.782 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.056 -17.410 4.974 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.621 -18.575 5.646 1.00 0.00 C ATOM 1741 C ASN A 112 -5.956 -18.969 5.024 1.00 0.00 C ATOM 1742 O ASN A 112 -6.248 -20.152 4.852 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.826 -18.281 7.132 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.412 -19.431 8.024 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -5.211 -20.315 8.338 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.160 -19.412 8.451 1.00 0.00 N ATOM 0 H ASN A 112 -4.027 -16.567 5.547 1.00 0.00 H new ATOM 0 HA ASN A 112 -3.919 -19.401 5.529 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.254 -17.394 7.404 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.876 -18.050 7.310 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.820 -20.150 9.067 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.535 -18.659 8.164 1.00 0.00 H new ATOM 1753 N SER A 113 -6.768 -17.971 4.703 1.00 0.00 N ATOM 1754 CA SER A 113 -8.076 -18.208 4.118 1.00 0.00 C ATOM 1755 C SER A 113 -8.020 -18.102 2.596 1.00 0.00 C ATOM 1756 O SER A 113 -8.742 -18.800 1.879 1.00 0.00 O ATOM 1757 CB SER A 113 -9.077 -17.199 4.683 1.00 0.00 C ATOM 1758 OG SER A 113 -8.600 -15.870 4.537 1.00 0.00 O ATOM 0 H SER A 113 -6.540 -16.986 4.840 1.00 0.00 H new ATOM 0 HA SER A 113 -8.396 -19.218 4.372 1.00 0.00 H new ATOM 0 HB2 SER A 113 -10.033 -17.304 4.170 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.256 -17.411 5.737 1.00 0.00 H new ATOM 0 HG SER A 113 -9.258 -15.244 4.904 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.163 -17.217 2.106 1.00 0.00 N ATOM 1765 CA GLY A 114 -7.055 -16.997 0.681 1.00 0.00 C ATOM 1766 C GLY A 114 -7.577 -15.632 0.309 1.00 0.00 C ATOM 1767 O GLY A 114 -7.471 -15.197 -0.837 1.00 0.00 O ATOM 0 H GLY A 114 -6.538 -16.646 2.675 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.014 -17.090 0.372 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.616 -17.764 0.147 1.00 0.00 H new ATOM 1771 N LYS A 115 -8.148 -14.964 1.297 1.00 0.00 N ATOM 1772 CA LYS A 115 -8.647 -13.617 1.136 1.00 0.00 C ATOM 1773 C LYS A 115 -7.560 -12.603 1.447 1.00 0.00 C ATOM 1774 O LYS A 115 -6.371 -12.930 1.485 1.00 0.00 O ATOM 1775 CB LYS A 115 -9.835 -13.385 2.071 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.185 -13.675 1.444 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.307 -12.989 2.208 1.00 0.00 C ATOM 1778 CE LYS A 115 -12.324 -13.381 3.675 1.00 0.00 C ATOM 1779 NZ LYS A 115 -13.347 -12.613 4.429 1.00 0.00 N ATOM 0 H LYS A 115 -8.277 -15.345 2.234 1.00 0.00 H new ATOM 0 HA LYS A 115 -8.964 -13.491 0.101 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -9.715 -14.012 2.955 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.819 -12.349 2.410 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.188 -13.337 0.408 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.358 -14.751 1.428 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -12.194 -11.908 2.124 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.264 -13.246 1.754 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -12.528 -14.448 3.766 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -11.341 -13.206 4.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -13.576 -13.113 5.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -12.976 -11.668 4.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.207 -12.520 3.851 1.00 0.00 H new ATOM 1793 N GLY A 116 -7.979 -11.368 1.646 1.00 0.00 N ATOM 1794 CA GLY A 116 -7.068 -10.343 2.080 1.00 0.00 C ATOM 1795 C GLY A 116 -6.710 -9.370 0.990 1.00 0.00 C ATOM 1796 O GLY A 116 -6.203 -9.755 -0.066 1.00 0.00 O ATOM 0 H GLY A 116 -8.941 -11.057 1.513 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.513 -9.799 2.913 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -6.157 -10.810 2.455 1.00 0.00 H new ATOM 1800 N PHE A 117 -6.989 -8.110 1.245 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.593 -7.041 0.352 1.00 0.00 C ATOM 1802 C PHE A 117 -5.532 -6.199 1.041 1.00 0.00 C ATOM 1803 O PHE A 117 -5.806 -5.534 2.040 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.801 -6.186 -0.032 1.00 0.00 C ATOM 1805 CG PHE A 117 -8.837 -6.924 -0.834 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -9.778 -7.727 -0.208 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.874 -6.806 -2.214 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.735 -8.399 -0.946 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.828 -7.476 -2.955 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.760 -8.273 -2.322 1.00 0.00 C ATOM 0 H PHE A 117 -7.495 -7.798 2.074 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.183 -7.462 -0.566 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.265 -5.800 0.876 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.457 -5.325 -0.605 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.763 -7.829 0.867 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.149 -6.183 -2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.463 -9.022 -0.447 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.845 -7.376 -4.030 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.507 -8.797 -2.900 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.318 -6.245 0.523 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.191 -5.622 1.189 1.00 0.00 C ATOM 1822 C LEU A 118 -2.422 -4.743 0.216 1.00 0.00 C ATOM 1823 O LEU A 118 -1.952 -5.201 -0.826 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.264 -6.693 1.762 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.439 -6.296 2.996 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -0.362 -5.294 2.634 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -2.333 -5.731 4.090 1.00 0.00 C ATOM 0 H LEU A 118 -4.088 -6.707 -0.357 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.567 -5.002 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.867 -7.564 2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.575 -7.004 0.977 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.957 -7.198 3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.206 -5.032 3.527 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.308 -5.731 1.894 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.824 -4.397 2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.725 -5.458 4.952 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.851 -4.847 3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.065 -6.482 4.386 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.283 -3.494 0.584 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.579 -2.525 -0.234 1.00 0.00 C ATOM 1841 C LEU A 119 -0.414 -1.939 0.555 1.00 0.00 C ATOM 1842 O LEU A 119 -0.613 -1.264 1.566 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.533 -1.414 -0.687 1.00 0.00 C ATOM 1844 CG LEU A 119 -1.941 -0.406 -1.673 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.519 -1.097 -2.961 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -2.945 0.699 -1.968 1.00 0.00 C ATOM 0 H LEU A 119 -2.652 -3.116 1.456 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.191 -3.024 -1.122 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.409 -1.874 -1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.880 -0.874 0.194 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.056 0.039 -1.218 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.101 -0.362 -3.648 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.767 -1.854 -2.738 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.386 -1.571 -3.421 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.509 1.409 -2.671 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.846 0.266 -2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.200 1.215 -1.043 1.00 0.00 H new ATOM 1858 N LEU A 120 0.795 -2.222 0.107 1.00 0.00 N ATOM 1859 CA LEU A 120 1.990 -1.750 0.790 1.00 0.00 C ATOM 1860 C LEU A 120 2.576 -0.543 0.079 1.00 0.00 C ATOM 1861 O LEU A 120 2.733 -0.554 -1.142 1.00 0.00 O ATOM 1862 CB LEU A 120 3.044 -2.856 0.859 1.00 0.00 C ATOM 1863 CG LEU A 120 2.678 -4.070 1.709 1.00 0.00 C ATOM 1864 CD1 LEU A 120 3.724 -5.161 1.550 1.00 0.00 C ATOM 1865 CD2 LEU A 120 2.540 -3.676 3.170 1.00 0.00 C ATOM 0 H LEU A 120 0.978 -2.778 -0.729 1.00 0.00 H new ATOM 0 HA LEU A 120 1.702 -1.464 1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.254 -3.196 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.968 -2.428 1.249 1.00 0.00 H new ATOM 0 HG LEU A 120 1.718 -4.456 1.365 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.450 -6.020 2.162 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.779 -5.463 0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.695 -4.783 1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.279 -4.554 3.761 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.485 -3.266 3.527 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.757 -2.924 3.272 1.00 0.00 H new ATOM 1877 N GLY A 121 2.883 0.494 0.844 1.00 0.00 N ATOM 1878 CA GLY A 121 3.554 1.652 0.290 1.00 0.00 C ATOM 1879 C GLY A 121 5.058 1.527 0.406 1.00 0.00 C ATOM 1880 O GLY A 121 5.674 0.741 -0.314 1.00 0.00 O ATOM 0 H GLY A 121 2.679 0.554 1.842 1.00 0.00 H new ATOM 0 HA2 GLY A 121 3.277 1.768 -0.758 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.221 2.551 0.809 1.00 0.00 H new ATOM 1884 N SER A 122 5.639 2.293 1.329 1.00 0.00 N ATOM 1885 CA SER A 122 7.077 2.244 1.613 1.00 0.00 C ATOM 1886 C SER A 122 7.880 2.861 0.461 1.00 0.00 C ATOM 1887 O SER A 122 7.301 3.392 -0.491 1.00 0.00 O ATOM 1888 CB SER A 122 7.525 0.805 1.901 1.00 0.00 C ATOM 1889 OG SER A 122 6.712 0.213 2.906 1.00 0.00 O ATOM 0 H SER A 122 5.128 2.965 1.902 1.00 0.00 H new ATOM 0 HA SER A 122 7.272 2.837 2.507 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.470 0.213 0.987 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.567 0.801 2.221 1.00 0.00 H new ATOM 0 HG SER A 122 7.014 -0.704 3.073 1.00 0.00 H new ATOM 1895 N GLU A 123 9.206 2.814 0.549 1.00 0.00 N ATOM 1896 CA GLU A 123 10.039 3.560 -0.387 1.00 0.00 C ATOM 1897 C GLU A 123 10.890 2.662 -1.297 1.00 0.00 C ATOM 1898 O GLU A 123 11.351 3.111 -2.346 1.00 0.00 O ATOM 1899 CB GLU A 123 10.935 4.525 0.400 1.00 0.00 C ATOM 1900 CG GLU A 123 11.696 5.524 -0.462 1.00 0.00 C ATOM 1901 CD GLU A 123 12.428 6.564 0.362 1.00 0.00 C ATOM 1902 OE1 GLU A 123 13.592 6.320 0.747 1.00 0.00 O ATOM 1903 OE2 GLU A 123 11.841 7.633 0.634 1.00 0.00 O ATOM 0 H GLU A 123 9.720 2.276 1.247 1.00 0.00 H new ATOM 0 HA GLU A 123 9.371 4.110 -1.050 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.319 5.074 1.112 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.652 3.944 0.980 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.413 4.989 -1.085 1.00 0.00 H new ATOM 0 HG3 GLU A 123 10.999 6.023 -1.135 1.00 0.00 H new ATOM 1910 N TYR A 124 11.106 1.402 -0.927 1.00 0.00 N ATOM 1911 CA TYR A 124 12.040 0.574 -1.695 1.00 0.00 C ATOM 1912 C TYR A 124 11.377 -0.656 -2.319 1.00 0.00 C ATOM 1913 O TYR A 124 10.927 -0.603 -3.459 1.00 0.00 O ATOM 1914 CB TYR A 124 13.226 0.169 -0.814 1.00 0.00 C ATOM 1915 CG TYR A 124 13.877 1.356 -0.142 1.00 0.00 C ATOM 1916 CD1 TYR A 124 14.474 2.358 -0.895 1.00 0.00 C ATOM 1917 CD2 TYR A 124 13.865 1.493 1.240 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.036 3.464 -0.292 1.00 0.00 C ATOM 1919 CE2 TYR A 124 14.433 2.595 1.851 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.013 3.578 1.080 1.00 0.00 C ATOM 1921 OH TYR A 124 15.555 4.693 1.678 1.00 0.00 O ATOM 0 H TYR A 124 10.666 0.942 -0.130 1.00 0.00 H new ATOM 0 HA TYR A 124 12.397 1.180 -2.528 1.00 0.00 H new ATOM 0 HB2 TYR A 124 12.887 -0.534 -0.054 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.966 -0.351 -1.422 1.00 0.00 H new ATOM 0 HD1 TYR A 124 14.499 2.270 -1.971 1.00 0.00 H new ATOM 0 HD2 TYR A 124 13.405 0.727 1.846 1.00 0.00 H new ATOM 0 HE1 TYR A 124 15.492 4.237 -0.893 1.00 0.00 H new ATOM 0 HE2 TYR A 124 14.422 2.685 2.927 1.00 0.00 H new ATOM 0 HH TYR A 124 15.005 5.477 1.468 1.00 0.00 H new ATOM 1931 N THR A 125 11.307 -1.752 -1.575 1.00 0.00 N ATOM 1932 CA THR A 125 10.718 -2.993 -2.081 1.00 0.00 C ATOM 1933 C THR A 125 10.297 -3.889 -0.922 1.00 0.00 C ATOM 1934 O THR A 125 10.910 -3.852 0.140 1.00 0.00 O ATOM 1935 CB THR A 125 11.706 -3.770 -2.981 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.052 -3.524 -2.559 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.544 -3.397 -4.448 1.00 0.00 C ATOM 0 H THR A 125 11.651 -1.811 -0.616 1.00 0.00 H new ATOM 0 HA THR A 125 9.848 -2.717 -2.677 1.00 0.00 H new ATOM 0 HB THR A 125 11.481 -4.832 -2.881 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.671 -4.021 -3.133 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.256 -3.964 -5.048 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.530 -3.629 -4.773 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.731 -2.331 -4.575 1.00 0.00 H new ATOM 1945 N PRO A 126 9.283 -4.749 -1.128 1.00 0.00 N ATOM 1946 CA PRO A 126 8.688 -5.540 -0.043 1.00 0.00 C ATOM 1947 C PRO A 126 9.646 -6.571 0.542 1.00 0.00 C ATOM 1948 O PRO A 126 9.656 -6.811 1.746 1.00 0.00 O ATOM 1949 CB PRO A 126 7.502 -6.240 -0.715 1.00 0.00 C ATOM 1950 CG PRO A 126 7.833 -6.261 -2.168 1.00 0.00 C ATOM 1951 CD PRO A 126 8.643 -5.023 -2.429 1.00 0.00 C ATOM 0 HA PRO A 126 8.412 -4.908 0.801 1.00 0.00 H new ATOM 0 HB2 PRO A 126 7.369 -7.250 -0.327 1.00 0.00 H new ATOM 0 HB3 PRO A 126 6.572 -5.703 -0.531 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.397 -7.157 -2.426 1.00 0.00 H new ATOM 0 HG3 PRO A 126 6.927 -6.269 -2.774 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.382 -5.185 -3.214 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.014 -4.192 -2.750 1.00 0.00 H new ATOM 1959 N GLN A 127 10.470 -7.160 -0.310 1.00 0.00 N ATOM 1960 CA GLN A 127 11.346 -8.244 0.106 1.00 0.00 C ATOM 1961 C GLN A 127 12.701 -7.713 0.554 1.00 0.00 C ATOM 1962 O GLN A 127 13.514 -8.454 1.104 1.00 0.00 O ATOM 1963 CB GLN A 127 11.519 -9.247 -1.035 1.00 0.00 C ATOM 1964 CG GLN A 127 10.213 -9.890 -1.485 1.00 0.00 C ATOM 1965 CD GLN A 127 10.398 -10.854 -2.640 1.00 0.00 C ATOM 1966 OE1 GLN A 127 11.450 -11.476 -2.783 1.00 0.00 O ATOM 1967 NE2 GLN A 127 9.380 -10.985 -3.474 1.00 0.00 N ATOM 0 H GLN A 127 10.551 -6.906 -1.294 1.00 0.00 H new ATOM 0 HA GLN A 127 10.885 -8.748 0.955 1.00 0.00 H new ATOM 0 HB2 GLN A 127 11.977 -8.742 -1.885 1.00 0.00 H new ATOM 0 HB3 GLN A 127 12.209 -10.029 -0.719 1.00 0.00 H new ATOM 0 HG2 GLN A 127 9.766 -10.420 -0.644 1.00 0.00 H new ATOM 0 HG3 GLN A 127 9.512 -9.109 -1.779 1.00 0.00 H new ATOM 0 HE21 GLN A 127 8.524 -10.452 -3.322 1.00 0.00 H new ATOM 0 HE22 GLN A 127 9.451 -11.619 -4.270 1.00 0.00 H new ATOM 1976 N GLN A 128 12.941 -6.427 0.331 1.00 0.00 N ATOM 1977 CA GLN A 128 14.227 -5.835 0.676 1.00 0.00 C ATOM 1978 C GLN A 128 14.091 -4.919 1.891 1.00 0.00 C ATOM 1979 O GLN A 128 15.080 -4.368 2.380 1.00 0.00 O ATOM 1980 CB GLN A 128 14.804 -5.071 -0.520 1.00 0.00 C ATOM 1981 CG GLN A 128 16.258 -4.657 -0.345 1.00 0.00 C ATOM 1982 CD GLN A 128 16.826 -3.962 -1.569 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.369 -4.606 -2.467 1.00 0.00 O ATOM 1984 NE2 GLN A 128 16.709 -2.644 -1.610 1.00 0.00 N ATOM 0 H GLN A 128 12.270 -5.780 -0.083 1.00 0.00 H new ATOM 0 HA GLN A 128 14.917 -6.638 0.934 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.718 -5.693 -1.411 1.00 0.00 H new ATOM 0 HB3 GLN A 128 14.201 -4.180 -0.694 1.00 0.00 H new ATOM 0 HG2 GLN A 128 16.340 -3.992 0.515 1.00 0.00 H new ATOM 0 HG3 GLN A 128 16.858 -5.540 -0.124 1.00 0.00 H new ATOM 0 HE21 GLN A 128 16.252 -2.149 -0.845 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.076 -2.124 -2.407 1.00 0.00 H new ATOM 1993 N LEU A 129 12.865 -4.767 2.385 1.00 0.00 N ATOM 1994 CA LEU A 129 12.624 -3.987 3.590 1.00 0.00 C ATOM 1995 C LEU A 129 13.309 -4.634 4.790 1.00 0.00 C ATOM 1996 O LEU A 129 13.745 -5.787 4.723 1.00 0.00 O ATOM 1997 CB LEU A 129 11.121 -3.847 3.863 1.00 0.00 C ATOM 1998 CG LEU A 129 10.330 -3.048 2.826 1.00 0.00 C ATOM 1999 CD1 LEU A 129 8.869 -2.939 3.240 1.00 0.00 C ATOM 2000 CD2 LEU A 129 10.938 -1.667 2.629 1.00 0.00 C ATOM 0 H LEU A 129 12.027 -5.173 1.969 1.00 0.00 H new ATOM 0 HA LEU A 129 13.042 -2.993 3.434 1.00 0.00 H new ATOM 0 HB2 LEU A 129 10.689 -4.845 3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 129 10.990 -3.374 4.836 1.00 0.00 H new ATOM 0 HG LEU A 129 10.380 -3.578 1.875 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.320 -2.368 2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.439 -3.937 3.322 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.801 -2.434 4.204 1.00 0.00 H new ATOM 0 HD21 LEU A 129 10.359 -1.117 1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.924 -1.125 3.575 1.00 0.00 H new ATOM 0 HD23 LEU A 129 11.967 -1.768 2.284 1.00 0.00 H new ATOM 2012 N VAL A 130 13.416 -3.891 5.882 1.00 0.00 N ATOM 2013 CA VAL A 130 14.017 -4.411 7.098 1.00 0.00 C ATOM 2014 C VAL A 130 13.028 -5.330 7.809 1.00 0.00 C ATOM 2015 O VAL A 130 12.315 -4.917 8.722 1.00 0.00 O ATOM 2016 CB VAL A 130 14.459 -3.277 8.050 1.00 0.00 C ATOM 2017 CG1 VAL A 130 15.230 -3.836 9.236 1.00 0.00 C ATOM 2018 CG2 VAL A 130 15.295 -2.247 7.304 1.00 0.00 C ATOM 0 H VAL A 130 13.094 -2.926 5.949 1.00 0.00 H new ATOM 0 HA VAL A 130 14.908 -4.973 6.817 1.00 0.00 H new ATOM 0 HB VAL A 130 13.564 -2.784 8.429 1.00 0.00 H new ATOM 0 HG11 VAL A 130 15.531 -3.019 9.892 1.00 0.00 H new ATOM 0 HG12 VAL A 130 14.596 -4.530 9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 130 16.117 -4.360 8.879 1.00 0.00 H new ATOM 0 HG21 VAL A 130 15.597 -1.457 7.991 1.00 0.00 H new ATOM 0 HG22 VAL A 130 16.182 -2.728 6.892 1.00 0.00 H new ATOM 0 HG23 VAL A 130 14.706 -1.818 6.494 1.00 0.00 H new ATOM 2028 N ILE A 131 12.958 -6.566 7.336 1.00 0.00 N ATOM 2029 CA ILE A 131 12.033 -7.550 7.872 1.00 0.00 C ATOM 2030 C ILE A 131 12.736 -8.887 8.069 1.00 0.00 C ATOM 2031 O ILE A 131 13.854 -9.092 7.586 1.00 0.00 O ATOM 2032 CB ILE A 131 10.818 -7.760 6.939 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.288 -8.162 5.537 1.00 0.00 C ATOM 2034 CG2 ILE A 131 9.962 -6.500 6.879 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.158 -8.443 4.571 1.00 0.00 C ATOM 0 H ILE A 131 13.539 -6.913 6.573 1.00 0.00 H new ATOM 0 HA ILE A 131 11.678 -7.168 8.829 1.00 0.00 H new ATOM 0 HB ILE A 131 10.206 -8.566 7.343 1.00 0.00 H new ATOM 0 HG12 ILE A 131 11.911 -7.365 5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.916 -9.050 5.615 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.112 -6.669 6.217 1.00 0.00 H new ATOM 0 HG22 ILE A 131 9.601 -6.257 7.878 1.00 0.00 H new ATOM 0 HG23 ILE A 131 10.560 -5.672 6.498 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.569 -8.721 3.601 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.547 -9.260 4.954 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.542 -7.550 4.462 1.00 0.00 H new ATOM 2047 N ARG A 132 12.077 -9.795 8.768 1.00 0.00 N ATOM 2048 CA ARG A 132 12.624 -11.127 9.000 1.00 0.00 C ATOM 2049 C ARG A 132 12.149 -12.090 7.913 1.00 0.00 C ATOM 2050 O ARG A 132 11.271 -11.747 7.118 1.00 0.00 O ATOM 2051 CB ARG A 132 12.212 -11.627 10.387 1.00 0.00 C ATOM 2052 CG ARG A 132 12.663 -10.702 11.509 1.00 0.00 C ATOM 2053 CD ARG A 132 12.189 -11.185 12.869 1.00 0.00 C ATOM 2054 NE ARG A 132 12.536 -10.238 13.928 1.00 0.00 N ATOM 2055 CZ ARG A 132 11.972 -10.235 15.135 1.00 0.00 C ATOM 2056 NH1 ARG A 132 11.057 -11.145 15.443 1.00 0.00 N ATOM 2057 NH2 ARG A 132 12.324 -9.322 16.034 1.00 0.00 N ATOM 0 H ARG A 132 11.160 -9.637 9.187 1.00 0.00 H new ATOM 0 HA ARG A 132 13.712 -11.077 8.960 1.00 0.00 H new ATOM 0 HB2 ARG A 132 11.128 -11.731 10.423 1.00 0.00 H new ATOM 0 HB3 ARG A 132 12.633 -12.619 10.550 1.00 0.00 H new ATOM 0 HG2 ARG A 132 13.751 -10.634 11.507 1.00 0.00 H new ATOM 0 HG3 ARG A 132 12.280 -9.698 11.327 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.109 -11.329 12.848 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.636 -12.155 13.087 1.00 0.00 H new ATOM 0 HE ARG A 132 13.252 -9.539 13.731 1.00 0.00 H new ATOM 0 HH11 ARG A 132 10.785 -11.848 14.755 1.00 0.00 H new ATOM 0 HH12 ARG A 132 10.626 -11.142 16.367 1.00 0.00 H new ATOM 0 HH21 ARG A 132 13.028 -8.621 15.801 1.00 0.00 H new ATOM 0 HH22 ARG A 132 11.891 -9.322 16.957 1.00 0.00 H new ATOM 2071 N GLU A 133 12.715 -13.297 7.898 1.00 0.00 N ATOM 2072 CA GLU A 133 12.453 -14.267 6.832 1.00 0.00 C ATOM 2073 C GLU A 133 10.980 -14.646 6.762 1.00 0.00 C ATOM 2074 O GLU A 133 10.451 -14.918 5.679 1.00 0.00 O ATOM 2075 CB GLU A 133 13.290 -15.528 7.035 1.00 0.00 C ATOM 2076 CG GLU A 133 14.786 -15.278 7.041 1.00 0.00 C ATOM 2077 CD GLU A 133 15.580 -16.565 7.025 1.00 0.00 C ATOM 2078 OE1 GLU A 133 15.883 -17.100 8.109 1.00 0.00 O ATOM 2079 OE2 GLU A 133 15.907 -17.048 5.924 1.00 0.00 O ATOM 0 H GLU A 133 13.361 -13.628 8.615 1.00 0.00 H new ATOM 0 HA GLU A 133 12.731 -13.791 5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.005 -15.993 7.979 1.00 0.00 H new ATOM 0 HB3 GLU A 133 13.054 -16.240 6.245 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.056 -14.676 6.173 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.053 -14.700 7.926 1.00 0.00 H new ATOM 2086 N ASP A 134 10.327 -14.661 7.917 1.00 0.00 N ATOM 2087 CA ASP A 134 8.909 -14.998 8.003 1.00 0.00 C ATOM 2088 C ASP A 134 8.081 -14.075 7.119 1.00 0.00 C ATOM 2089 O ASP A 134 7.126 -14.503 6.479 1.00 0.00 O ATOM 2090 CB ASP A 134 8.423 -14.901 9.451 1.00 0.00 C ATOM 2091 CG ASP A 134 9.155 -15.848 10.377 1.00 0.00 C ATOM 2092 OD1 ASP A 134 8.759 -17.027 10.472 1.00 0.00 O ATOM 2093 OD2 ASP A 134 10.134 -15.420 11.016 1.00 0.00 O ATOM 0 H ASP A 134 10.760 -14.442 8.814 1.00 0.00 H new ATOM 0 HA ASP A 134 8.784 -16.023 7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.553 -13.879 9.806 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.355 -15.117 9.487 1.00 0.00 H new ATOM 2098 N LEU A 135 8.455 -12.805 7.085 1.00 0.00 N ATOM 2099 CA LEU A 135 7.773 -11.842 6.235 1.00 0.00 C ATOM 2100 C LEU A 135 8.286 -11.907 4.805 1.00 0.00 C ATOM 2101 O LEU A 135 7.505 -11.830 3.862 1.00 0.00 O ATOM 2102 CB LEU A 135 7.929 -10.424 6.781 1.00 0.00 C ATOM 2103 CG LEU A 135 6.911 -10.031 7.848 1.00 0.00 C ATOM 2104 CD1 LEU A 135 7.208 -8.637 8.373 1.00 0.00 C ATOM 2105 CD2 LEU A 135 5.506 -10.092 7.273 1.00 0.00 C ATOM 0 H LEU A 135 9.223 -12.419 7.633 1.00 0.00 H new ATOM 0 HA LEU A 135 6.715 -12.102 6.233 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.930 -10.319 7.199 1.00 0.00 H new ATOM 0 HB3 LEU A 135 7.854 -9.721 5.952 1.00 0.00 H new ATOM 0 HG LEU A 135 6.982 -10.734 8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 135 6.474 -8.370 9.133 1.00 0.00 H new ATOM 0 HD12 LEU A 135 8.206 -8.618 8.810 1.00 0.00 H new ATOM 0 HD13 LEU A 135 7.157 -7.921 7.553 1.00 0.00 H new ATOM 0 HD21 LEU A 135 4.786 -9.810 8.041 1.00 0.00 H new ATOM 0 HD22 LEU A 135 5.427 -9.404 6.431 1.00 0.00 H new ATOM 0 HD23 LEU A 135 5.296 -11.106 6.933 1.00 0.00 H new ATOM 2117 N ARG A 136 9.598 -12.066 4.650 1.00 0.00 N ATOM 2118 CA ARG A 136 10.227 -12.052 3.328 1.00 0.00 C ATOM 2119 C ARG A 136 9.619 -13.117 2.415 1.00 0.00 C ATOM 2120 O ARG A 136 9.454 -12.899 1.214 1.00 0.00 O ATOM 2121 CB ARG A 136 11.740 -12.264 3.451 1.00 0.00 C ATOM 2122 CG ARG A 136 12.486 -12.067 2.139 1.00 0.00 C ATOM 2123 CD ARG A 136 13.994 -12.146 2.325 1.00 0.00 C ATOM 2124 NE ARG A 136 14.455 -13.500 2.631 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.686 -13.942 2.359 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.583 -13.132 1.812 1.00 0.00 N ATOM 2127 NH2 ARG A 136 16.024 -15.193 2.645 1.00 0.00 N ATOM 0 H ARG A 136 10.248 -12.206 5.423 1.00 0.00 H new ATOM 0 HA ARG A 136 10.042 -11.075 2.881 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.137 -11.572 4.194 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.929 -13.272 3.820 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.168 -12.826 1.424 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.223 -11.098 1.714 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.487 -11.795 1.418 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.292 -11.474 3.130 1.00 0.00 H new ATOM 0 HE ARG A 136 13.800 -14.142 3.077 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.334 -12.166 1.597 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.521 -13.475 1.606 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.343 -15.820 3.074 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.965 -15.528 2.436 1.00 0.00 H new ATOM 2141 N THR A 137 9.271 -14.255 2.997 1.00 0.00 N ATOM 2142 CA THR A 137 8.660 -15.340 2.246 1.00 0.00 C ATOM 2143 C THR A 137 7.232 -14.986 1.822 1.00 0.00 C ATOM 2144 O THR A 137 6.826 -15.256 0.692 1.00 0.00 O ATOM 2145 CB THR A 137 8.653 -16.641 3.071 1.00 0.00 C ATOM 2146 OG1 THR A 137 8.251 -16.355 4.416 1.00 0.00 O ATOM 2147 CG2 THR A 137 10.028 -17.291 3.075 1.00 0.00 C ATOM 0 H THR A 137 9.402 -14.451 3.989 1.00 0.00 H new ATOM 0 HA THR A 137 9.259 -15.494 1.348 1.00 0.00 H new ATOM 0 HB THR A 137 7.947 -17.335 2.615 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.015 -16.002 4.918 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.996 -18.207 3.664 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.322 -17.527 2.052 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.754 -16.605 3.511 1.00 0.00 H new ATOM 2155 N ARG A 138 6.481 -14.355 2.724 1.00 0.00 N ATOM 2156 CA ARG A 138 5.095 -13.991 2.449 1.00 0.00 C ATOM 2157 C ARG A 138 5.010 -12.807 1.487 1.00 0.00 C ATOM 2158 O ARG A 138 4.014 -12.635 0.787 1.00 0.00 O ATOM 2159 CB ARG A 138 4.377 -13.660 3.755 1.00 0.00 C ATOM 2160 CG ARG A 138 4.593 -14.706 4.833 1.00 0.00 C ATOM 2161 CD ARG A 138 4.046 -16.066 4.425 1.00 0.00 C ATOM 2162 NE ARG A 138 4.507 -17.122 5.322 1.00 0.00 N ATOM 2163 CZ ARG A 138 4.432 -18.425 5.054 1.00 0.00 C ATOM 2164 NH1 ARG A 138 3.844 -18.854 3.942 1.00 0.00 N ATOM 2165 NH2 ARG A 138 4.934 -19.296 5.917 1.00 0.00 N ATOM 0 H ARG A 138 6.811 -14.086 3.651 1.00 0.00 H new ATOM 0 HA ARG A 138 4.609 -14.843 1.974 1.00 0.00 H new ATOM 0 HB2 ARG A 138 4.725 -12.694 4.120 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.309 -13.562 3.561 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.659 -14.793 5.046 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.109 -14.382 5.755 1.00 0.00 H new ATOM 0 HD2 ARG A 138 2.956 -16.036 4.427 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.357 -16.293 3.405 1.00 0.00 H new ATOM 0 HE ARG A 138 4.914 -16.843 6.215 1.00 0.00 H new ATOM 0 HH11 ARG A 138 3.445 -18.184 3.285 1.00 0.00 H new ATOM 0 HH12 ARG A 138 3.792 -19.854 3.746 1.00 0.00 H new ATOM 0 HH21 ARG A 138 5.373 -18.967 6.777 1.00 0.00 H new ATOM 0 HH22 ARG A 138 4.882 -20.296 5.721 1.00 0.00 H new ATOM 2179 N MET A 139 6.065 -12.000 1.450 1.00 0.00 N ATOM 2180 CA MET A 139 6.133 -10.850 0.549 1.00 0.00 C ATOM 2181 C MET A 139 6.166 -11.295 -0.909 1.00 0.00 C ATOM 2182 O MET A 139 5.898 -10.514 -1.817 1.00 0.00 O ATOM 2183 CB MET A 139 7.369 -10.004 0.854 1.00 0.00 C ATOM 2184 CG MET A 139 7.304 -9.274 2.182 1.00 0.00 C ATOM 2185 SD MET A 139 6.002 -8.029 2.236 1.00 0.00 S ATOM 2186 CE MET A 139 6.236 -7.374 3.888 1.00 0.00 C ATOM 0 H MET A 139 6.891 -12.121 2.037 1.00 0.00 H new ATOM 0 HA MET A 139 5.237 -10.250 0.710 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.248 -10.648 0.848 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.503 -9.274 0.056 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.141 -9.998 2.981 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.264 -8.796 2.376 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.419 -6.694 4.129 1.00 0.00 H new ATOM 0 HE2 MET A 139 6.249 -8.194 4.606 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.183 -6.836 3.935 1.00 0.00 H new ATOM 2196 N ALA A 140 6.501 -12.556 -1.128 1.00 0.00 N ATOM 2197 CA ALA A 140 6.556 -13.108 -2.473 1.00 0.00 C ATOM 2198 C ALA A 140 5.154 -13.385 -3.022 1.00 0.00 C ATOM 2199 O ALA A 140 5.000 -13.807 -4.168 1.00 0.00 O ATOM 2200 CB ALA A 140 7.389 -14.381 -2.486 1.00 0.00 C ATOM 0 H ALA A 140 6.740 -13.219 -0.390 1.00 0.00 H new ATOM 0 HA ALA A 140 7.027 -12.368 -3.120 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.422 -14.784 -3.498 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.402 -14.156 -2.151 1.00 0.00 H new ATOM 0 HB3 ALA A 140 6.941 -15.116 -1.818 1.00 0.00 H new ATOM 2206 N TYR A 141 4.133 -13.149 -2.204 1.00 0.00 N ATOM 2207 CA TYR A 141 2.756 -13.398 -2.608 1.00 0.00 C ATOM 2208 C TYR A 141 2.050 -12.110 -3.026 1.00 0.00 C ATOM 2209 O TYR A 141 0.832 -12.094 -3.197 1.00 0.00 O ATOM 2210 CB TYR A 141 1.980 -14.060 -1.469 1.00 0.00 C ATOM 2211 CG TYR A 141 2.491 -15.435 -1.100 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.293 -16.522 -1.942 1.00 0.00 C ATOM 2213 CD2 TYR A 141 3.172 -15.645 0.090 1.00 0.00 C ATOM 2214 CE1 TYR A 141 2.762 -17.777 -1.607 1.00 0.00 C ATOM 2215 CE2 TYR A 141 3.644 -16.896 0.432 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.438 -17.957 -0.419 1.00 0.00 C ATOM 2217 OH TYR A 141 3.910 -19.205 -0.081 1.00 0.00 O ATOM 0 H TYR A 141 4.235 -12.785 -1.257 1.00 0.00 H new ATOM 0 HA TYR A 141 2.784 -14.066 -3.469 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.026 -13.418 -0.590 1.00 0.00 H new ATOM 0 HB3 TYR A 141 0.931 -14.137 -1.754 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.764 -16.383 -2.873 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.336 -14.815 0.761 1.00 0.00 H new ATOM 0 HE1 TYR A 141 2.600 -18.613 -2.272 1.00 0.00 H new ATOM 0 HE2 TYR A 141 4.172 -17.041 1.363 1.00 0.00 H new ATOM 0 HH TYR A 141 4.364 -19.159 0.787 1.00 0.00 H new ATOM 2227 N CYS A 142 2.804 -11.035 -3.200 1.00 0.00 N ATOM 2228 CA CYS A 142 2.223 -9.772 -3.609 1.00 0.00 C ATOM 2229 C CYS A 142 2.870 -9.293 -4.895 1.00 0.00 C ATOM 2230 O CYS A 142 4.003 -9.666 -5.212 1.00 0.00 O ATOM 2231 CB CYS A 142 2.373 -8.716 -2.508 1.00 0.00 C ATOM 2232 SG CYS A 142 4.080 -8.252 -2.129 1.00 0.00 S ATOM 0 H CYS A 142 3.815 -11.015 -3.064 1.00 0.00 H new ATOM 0 HA CYS A 142 1.158 -9.925 -3.785 1.00 0.00 H new ATOM 0 HB2 CYS A 142 1.826 -7.821 -2.805 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.903 -9.090 -1.599 1.00 0.00 H new ATOM 0 HG CYS A 142 4.860 -9.274 -2.320 1.00 0.00 H new ATOM 2238 N LEU A 143 2.136 -8.500 -5.646 1.00 0.00 N ATOM 2239 CA LEU A 143 2.650 -7.928 -6.879 1.00 0.00 C ATOM 2240 C LEU A 143 3.421 -6.651 -6.569 1.00 0.00 C ATOM 2241 O LEU A 143 3.154 -5.984 -5.569 1.00 0.00 O ATOM 2242 CB LEU A 143 1.513 -7.622 -7.866 1.00 0.00 C ATOM 2243 CG LEU A 143 0.768 -8.830 -8.439 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.200 -9.419 -7.422 1.00 0.00 C ATOM 2245 CD2 LEU A 143 0.030 -8.449 -9.715 1.00 0.00 C ATOM 0 H LEU A 143 1.176 -8.234 -5.426 1.00 0.00 H new ATOM 0 HA LEU A 143 3.315 -8.657 -7.343 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.789 -6.980 -7.365 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.926 -7.049 -8.697 1.00 0.00 H new ATOM 0 HG LEU A 143 1.509 -9.593 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -0.713 -10.275 -7.861 1.00 0.00 H new ATOM 0 HD12 LEU A 143 0.352 -9.740 -6.538 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -0.933 -8.664 -7.138 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.493 -9.321 -10.107 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.691 -7.661 -9.497 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.745 -8.092 -10.456 1.00 0.00 H new ATOM 2257 N VAL A 144 4.361 -6.305 -7.428 1.00 0.00 N ATOM 2258 CA VAL A 144 5.179 -5.124 -7.220 1.00 0.00 C ATOM 2259 C VAL A 144 4.960 -4.139 -8.360 1.00 0.00 C ATOM 2260 O VAL A 144 5.244 -4.436 -9.520 1.00 0.00 O ATOM 2261 CB VAL A 144 6.679 -5.475 -7.117 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.498 -4.235 -6.787 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.909 -6.561 -6.072 1.00 0.00 C ATOM 0 H VAL A 144 4.578 -6.826 -8.278 1.00 0.00 H new ATOM 0 HA VAL A 144 4.877 -4.673 -6.275 1.00 0.00 H new ATOM 0 HB VAL A 144 7.006 -5.857 -8.084 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.552 -4.503 -6.719 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.363 -3.490 -7.571 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.166 -3.823 -5.834 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.973 -6.793 -6.016 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.563 -6.210 -5.100 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.356 -7.458 -6.352 1.00 0.00 H new ATOM 2273 N TYR A 145 4.434 -2.979 -8.025 1.00 0.00 N ATOM 2274 CA TYR A 145 4.126 -1.961 -9.017 1.00 0.00 C ATOM 2275 C TYR A 145 5.009 -0.733 -8.857 1.00 0.00 C ATOM 2276 O TYR A 145 5.000 -0.073 -7.815 1.00 0.00 O ATOM 2277 CB TYR A 145 2.657 -1.545 -8.920 1.00 0.00 C ATOM 2278 CG TYR A 145 1.692 -2.528 -9.545 1.00 0.00 C ATOM 2279 CD1 TYR A 145 1.483 -3.783 -8.992 1.00 0.00 C ATOM 2280 CD2 TYR A 145 0.983 -2.189 -10.690 1.00 0.00 C ATOM 2281 CE1 TYR A 145 0.597 -4.676 -9.565 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.095 -3.074 -11.267 1.00 0.00 C ATOM 2283 CZ TYR A 145 -0.095 -4.316 -10.701 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.981 -5.200 -11.273 1.00 0.00 O ATOM 0 H TYR A 145 4.208 -2.713 -7.066 1.00 0.00 H new ATOM 0 HA TYR A 145 4.319 -2.398 -9.997 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.396 -1.415 -7.870 1.00 0.00 H new ATOM 0 HB3 TYR A 145 2.533 -0.575 -9.402 1.00 0.00 H new ATOM 0 HD1 TYR A 145 2.021 -4.067 -8.100 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.129 -1.216 -11.136 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.448 -5.651 -9.125 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.448 -2.795 -12.158 1.00 0.00 H new ATOM 0 HH TYR A 145 -1.386 -4.790 -12.066 1.00 0.00 H new ATOM 2294 N GLU A 146 5.777 -0.441 -9.892 1.00 0.00 N ATOM 2295 CA GLU A 146 6.492 0.818 -9.969 1.00 0.00 C ATOM 2296 C GLU A 146 5.606 1.834 -10.676 1.00 0.00 C ATOM 2297 O GLU A 146 5.286 1.683 -11.855 1.00 0.00 O ATOM 2298 CB GLU A 146 7.832 0.648 -10.702 1.00 0.00 C ATOM 2299 CG GLU A 146 7.723 -0.040 -12.057 1.00 0.00 C ATOM 2300 CD GLU A 146 9.046 -0.096 -12.792 1.00 0.00 C ATOM 2301 OE1 GLU A 146 9.940 -0.848 -12.354 1.00 0.00 O ATOM 2302 OE2 GLU A 146 9.193 0.591 -13.823 1.00 0.00 O ATOM 0 H GLU A 146 5.921 -1.060 -10.690 1.00 0.00 H new ATOM 0 HA GLU A 146 6.722 1.171 -8.964 1.00 0.00 H new ATOM 0 HB2 GLU A 146 8.283 1.630 -10.842 1.00 0.00 H new ATOM 0 HB3 GLU A 146 8.508 0.073 -10.069 1.00 0.00 H new ATOM 0 HG2 GLU A 146 7.347 -1.053 -11.916 1.00 0.00 H new ATOM 0 HG3 GLU A 146 6.993 0.488 -12.671 1.00 0.00 H new ATOM 2309 N VAL A 147 5.175 2.846 -9.945 1.00 0.00 N ATOM 2310 CA VAL A 147 4.245 3.821 -10.488 1.00 0.00 C ATOM 2311 C VAL A 147 4.964 5.118 -10.835 1.00 0.00 C ATOM 2312 O VAL A 147 5.627 5.715 -9.987 1.00 0.00 O ATOM 2313 CB VAL A 147 3.097 4.116 -9.497 1.00 0.00 C ATOM 2314 CG1 VAL A 147 2.100 5.094 -10.099 1.00 0.00 C ATOM 2315 CG2 VAL A 147 2.405 2.825 -9.083 1.00 0.00 C ATOM 0 H VAL A 147 5.452 3.014 -8.978 1.00 0.00 H new ATOM 0 HA VAL A 147 3.819 3.393 -11.396 1.00 0.00 H new ATOM 0 HB VAL A 147 3.524 4.577 -8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.301 5.286 -9.383 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.606 6.029 -10.337 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.677 4.668 -11.009 1.00 0.00 H new ATOM 0 HG21 VAL A 147 1.599 3.052 -8.385 1.00 0.00 H new ATOM 0 HG22 VAL A 147 1.994 2.334 -9.965 1.00 0.00 H new ATOM 0 HG23 VAL A 147 3.126 2.164 -8.602 1.00 0.00 H new ATOM 2325 N LYS A 148 4.856 5.524 -12.088 1.00 0.00 N ATOM 2326 CA LYS A 148 5.396 6.797 -12.531 1.00 0.00 C ATOM 2327 C LYS A 148 4.359 7.550 -13.367 1.00 0.00 C ATOM 2328 O LYS A 148 4.262 7.369 -14.581 1.00 0.00 O ATOM 2329 CB LYS A 148 6.706 6.589 -13.303 1.00 0.00 C ATOM 2330 CG LYS A 148 6.640 5.503 -14.373 1.00 0.00 C ATOM 2331 CD LYS A 148 7.998 5.274 -15.021 1.00 0.00 C ATOM 2332 CE LYS A 148 9.029 4.783 -14.014 1.00 0.00 C ATOM 2333 NZ LYS A 148 10.366 4.601 -14.637 1.00 0.00 N ATOM 0 H LYS A 148 4.395 4.985 -12.822 1.00 0.00 H new ATOM 0 HA LYS A 148 5.626 7.407 -11.658 1.00 0.00 H new ATOM 0 HB2 LYS A 148 6.989 7.530 -13.774 1.00 0.00 H new ATOM 0 HB3 LYS A 148 7.495 6.337 -12.595 1.00 0.00 H new ATOM 0 HG2 LYS A 148 6.287 4.573 -13.927 1.00 0.00 H new ATOM 0 HG3 LYS A 148 5.915 5.786 -15.136 1.00 0.00 H new ATOM 0 HD2 LYS A 148 7.899 4.545 -15.825 1.00 0.00 H new ATOM 0 HD3 LYS A 148 8.346 6.202 -15.474 1.00 0.00 H new ATOM 0 HE2 LYS A 148 9.104 5.497 -13.194 1.00 0.00 H new ATOM 0 HE3 LYS A 148 8.696 3.838 -13.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 11.077 4.448 -13.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 10.345 3.776 -15.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 10.613 5.451 -15.183 1.00 0.00 H new ATOM 2347 N PRO A 149 3.531 8.371 -12.700 1.00 0.00 N ATOM 2348 CA PRO A 149 2.460 9.119 -13.353 1.00 0.00 C ATOM 2349 C PRO A 149 2.968 10.378 -14.052 1.00 0.00 C ATOM 2350 O PRO A 149 3.223 10.319 -15.273 1.00 0.00 O ATOM 2351 CB PRO A 149 1.525 9.470 -12.196 1.00 0.00 C ATOM 2352 CG PRO A 149 2.396 9.522 -10.985 1.00 0.00 C ATOM 2353 CD PRO A 149 3.578 8.622 -11.250 1.00 0.00 C ATOM 2354 OXT PRO A 149 3.103 11.426 -13.383 1.00 0.00 O ATOM 0 HA PRO A 149 1.978 8.544 -14.144 1.00 0.00 H new ATOM 0 HB2 PRO A 149 1.031 10.427 -12.366 1.00 0.00 H new ATOM 0 HB3 PRO A 149 0.740 8.722 -12.084 1.00 0.00 H new ATOM 0 HG2 PRO A 149 2.725 10.543 -10.791 1.00 0.00 H new ATOM 0 HG3 PRO A 149 1.849 9.190 -10.103 1.00 0.00 H new ATOM 0 HD2 PRO A 149 4.514 9.100 -10.960 1.00 0.00 H new ATOM 0 HD3 PRO A 149 3.505 7.694 -10.684 1.00 0.00 H new TER 2362 PRO A 149