USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 972 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 84 SER OG : rot 180:sc= 0.393 USER MOD Set 1.2: A 123 TYR OH : rot 18:sc= 0.43 USER MOD Set 2.1: A 114 THR OG1 : rot 17:sc= 0.00502 USER MOD Set 2.2: A 115 SER OG : rot -150:sc=-0.00377 USER MOD Set 3.1: A 25 ASN : amide:sc= 0.137 K(o=1.5,f=0.86) USER MOD Set 3.2: A 31 SER OG : rot -89:sc= 1.32 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.139 (180deg=0) USER MOD Single : A 2 MET CE :methyl -164:sc=-0.00946 (180deg=-0.279) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot -140:sc= -0.14 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 130:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0363 USER MOD Single : A 18 LYS NZ :NH3+ -174:sc= -0.233 (180deg=-0.286) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -131:sc= -0.262 (180deg=-1.89) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot -33:sc= 0.174 USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0684) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 110:sc= 0.108 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -164:sc=-0.00756 (180deg=-0.24) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 104:sc= 0.454 USER MOD Single : A 51 SER OG : rot 4:sc= 0.387 USER MOD Single : A 57 GLN :FLIP amide:sc= -0.52 F(o=-1.5!,f=-0.52) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc=-0.00352 K(o=-0.0035,f=-4.1!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.627 K(o=0.63,f=0) USER MOD Single : A 71 ASN : amide:sc= -0.351 X(o=-0.35,f=-0.04) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.175 X(o=-0.18,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.153 X(o=-0.15,f=-0.59) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 130:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0906 USER MOD Single : A 101 GLN : amide:sc= 0.458 K(o=0.46,f=-1.6!) USER MOD Single : A 102 MET CE :methyl -163:sc= -0.108 (180deg=-0.607) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -0.257 X(o=-0.26,f=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 167:sc= 1.5 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.762 K(o=-0.76,f=-3.5) USER MOD Single : A 120 HIS : no HD1:sc= -0.132 X(o=-0.13,f=-0.002) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-3.5!) USER MOD Single : A 128 ASN : amide:sc= -0.117 X(o=-0.12,f=-0.6) USER MOD Single : A 135 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.0062) USER MOD Single : A 144 SER OG : rot -30:sc= 0.645 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0.498 (180deg=0.498) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.994 -23.154 -13.395 1.00 74.51 N ATOM 2 CA GLY A 1 -4.641 -22.696 -13.740 1.00 21.42 C ATOM 3 C GLY A 1 -3.958 -22.144 -12.504 1.00 61.21 C ATOM 4 O GLY A 1 -4.593 -22.014 -11.460 1.00 32.24 O ATOM 0 H1 GLY A 1 -6.065 -24.179 -13.555 1.00 74.51 H new ATOM 0 H2 GLY A 1 -6.186 -22.946 -12.394 1.00 74.51 H new ATOM 0 H3 GLY A 1 -6.690 -22.661 -13.991 1.00 74.51 H new ATOM 0 HA2 GLY A 1 -4.060 -23.522 -14.150 1.00 21.42 H new ATOM 0 HA3 GLY A 1 -4.692 -21.929 -14.512 1.00 21.42 H new ATOM 8 N MET A 2 -2.664 -21.827 -12.592 1.00 33.11 N ATOM 9 CA MET A 2 -1.933 -21.184 -11.509 1.00 63.21 C ATOM 10 C MET A 2 -0.724 -20.433 -12.064 1.00 11.03 C ATOM 11 O MET A 2 0.177 -21.022 -12.667 1.00 43.31 O ATOM 12 CB MET A 2 -1.512 -22.196 -10.424 1.00 43.23 C ATOM 13 CG MET A 2 -0.847 -23.476 -10.954 1.00 62.44 C ATOM 14 SD MET A 2 0.172 -24.375 -9.753 1.00 51.35 S ATOM 15 CE MET A 2 1.569 -23.226 -9.615 1.00 32.23 C ATOM 0 H MET A 2 -2.097 -22.011 -13.420 1.00 33.11 H new ATOM 0 HA MET A 2 -2.599 -20.466 -11.031 1.00 63.21 H new ATOM 0 HB2 MET A 2 -0.823 -21.704 -9.737 1.00 43.23 H new ATOM 0 HB3 MET A 2 -2.393 -22.475 -9.846 1.00 43.23 H new ATOM 0 HG2 MET A 2 -1.626 -24.146 -11.319 1.00 62.44 H new ATOM 0 HG3 MET A 2 -0.225 -23.215 -11.810 1.00 62.44 H new ATOM 0 HE1 MET A 2 2.413 -23.734 -9.149 1.00 32.23 H new ATOM 0 HE2 MET A 2 1.856 -22.882 -10.608 1.00 32.23 H new ATOM 0 HE3 MET A 2 1.278 -22.371 -9.005 1.00 32.23 H new ATOM 23 N ALA A 3 -0.671 -19.128 -11.816 1.00 23.13 N ATOM 24 CA ALA A 3 0.524 -18.311 -11.907 1.00 53.11 C ATOM 25 C ALA A 3 0.421 -17.300 -10.779 1.00 61.25 C ATOM 26 O ALA A 3 -0.362 -16.350 -10.860 1.00 11.24 O ATOM 27 CB ALA A 3 0.634 -17.609 -13.258 1.00 61.52 C ATOM 0 H ALA A 3 -1.494 -18.594 -11.536 1.00 23.13 H new ATOM 0 HA ALA A 3 1.420 -18.926 -11.820 1.00 53.11 H new ATOM 0 HB1 ALA A 3 1.543 -17.008 -13.283 1.00 61.52 H new ATOM 0 HB2 ALA A 3 0.669 -18.354 -14.053 1.00 61.52 H new ATOM 0 HB3 ALA A 3 -0.232 -16.963 -13.404 1.00 61.52 H new ATOM 33 N LYS A 4 1.178 -17.537 -9.708 1.00 0.23 N ATOM 34 CA LYS A 4 1.194 -16.631 -8.570 1.00 2.04 C ATOM 35 C LYS A 4 1.962 -15.390 -8.982 1.00 34.44 C ATOM 36 O LYS A 4 3.198 -15.418 -9.000 1.00 31.20 O ATOM 37 CB LYS A 4 1.855 -17.224 -7.328 1.00 53.13 C ATOM 38 CG LYS A 4 1.255 -18.521 -6.773 1.00 1.20 C ATOM 39 CD LYS A 4 1.813 -18.638 -5.354 1.00 12.23 C ATOM 40 CE LYS A 4 1.927 -20.053 -4.794 1.00 54.25 C ATOM 41 NZ LYS A 4 2.652 -20.005 -3.510 1.00 73.55 N ATOM 0 H LYS A 4 1.786 -18.350 -9.609 1.00 0.23 H new ATOM 0 HA LYS A 4 0.160 -16.416 -8.302 1.00 2.04 H new ATOM 0 HB2 LYS A 4 2.905 -17.407 -7.558 1.00 53.13 H new ATOM 0 HB3 LYS A 4 1.828 -16.473 -6.538 1.00 53.13 H new ATOM 0 HG2 LYS A 4 0.166 -18.481 -6.767 1.00 1.20 H new ATOM 0 HG3 LYS A 4 1.539 -19.380 -7.381 1.00 1.20 H new ATOM 0 HD2 LYS A 4 2.802 -18.180 -5.335 1.00 12.23 H new ATOM 0 HD3 LYS A 4 1.179 -18.054 -4.686 1.00 12.23 H new ATOM 0 HE2 LYS A 4 0.935 -20.482 -4.650 1.00 54.25 H new ATOM 0 HE3 LYS A 4 2.453 -20.696 -5.500 1.00 54.25 H new ATOM 0 HZ1 LYS A 4 2.734 -20.966 -3.121 1.00 73.55 H new ATOM 0 HZ2 LYS A 4 3.602 -19.611 -3.662 1.00 73.55 H new ATOM 0 HZ3 LYS A 4 2.131 -19.404 -2.840 1.00 73.55 H new ATOM 51 N LYS A 5 1.273 -14.332 -9.382 1.00 22.24 N ATOM 52 CA LYS A 5 1.957 -13.103 -9.774 1.00 3.13 C ATOM 53 C LYS A 5 2.057 -12.196 -8.585 1.00 32.11 C ATOM 54 O LYS A 5 1.325 -12.348 -7.609 1.00 53.02 O ATOM 55 CB LYS A 5 1.249 -12.375 -10.916 1.00 13.42 C ATOM 56 CG LYS A 5 1.078 -13.355 -12.047 1.00 0.10 C ATOM 57 CD LYS A 5 0.616 -12.758 -13.369 1.00 62.32 C ATOM 58 CE LYS A 5 0.904 -13.831 -14.430 1.00 12.34 C ATOM 59 NZ LYS A 5 -0.294 -14.318 -15.134 1.00 64.15 N ATOM 0 H LYS A 5 0.256 -14.296 -9.444 1.00 22.24 H new ATOM 0 HA LYS A 5 2.948 -13.378 -10.134 1.00 3.13 H new ATOM 0 HB2 LYS A 5 0.281 -11.998 -10.587 1.00 13.42 H new ATOM 0 HB3 LYS A 5 1.833 -11.514 -11.241 1.00 13.42 H new ATOM 0 HG2 LYS A 5 2.028 -13.863 -12.211 1.00 0.10 H new ATOM 0 HG3 LYS A 5 0.359 -14.115 -11.741 1.00 0.10 H new ATOM 0 HD2 LYS A 5 -0.445 -12.512 -13.338 1.00 62.32 H new ATOM 0 HD3 LYS A 5 1.151 -11.834 -13.590 1.00 62.32 H new ATOM 0 HE2 LYS A 5 1.602 -13.425 -15.162 1.00 12.34 H new ATOM 0 HE3 LYS A 5 1.400 -14.676 -13.952 1.00 12.34 H new ATOM 0 HZ1 LYS A 5 -0.018 -15.038 -15.832 1.00 64.15 H new ATOM 0 HZ2 LYS A 5 -0.954 -14.736 -14.448 1.00 64.15 H new ATOM 0 HZ3 LYS A 5 -0.758 -13.524 -15.620 1.00 64.15 H new ATOM 69 N THR A 6 2.888 -11.194 -8.759 1.00 14.03 N ATOM 70 CA THR A 6 3.057 -10.107 -7.818 1.00 12.20 C ATOM 71 C THR A 6 2.806 -8.813 -8.580 1.00 61.13 C ATOM 72 O THR A 6 3.149 -8.719 -9.758 1.00 23.53 O ATOM 73 CB THR A 6 4.457 -10.195 -7.193 1.00 62.22 C ATOM 74 OG1 THR A 6 4.570 -11.388 -6.459 1.00 43.42 O ATOM 75 CG2 THR A 6 4.773 -9.030 -6.253 1.00 4.23 C ATOM 0 H THR A 6 3.483 -11.109 -9.583 1.00 14.03 H new ATOM 0 HA THR A 6 2.353 -10.154 -6.987 1.00 12.20 H new ATOM 0 HB THR A 6 5.165 -10.161 -8.021 1.00 62.22 H new ATOM 0 HG1 THR A 6 5.063 -11.216 -5.630 1.00 43.42 H new ATOM 0 HG21 THR A 6 5.776 -9.153 -5.846 1.00 4.23 H new ATOM 0 HG22 THR A 6 4.718 -8.092 -6.805 1.00 4.23 H new ATOM 0 HG23 THR A 6 4.050 -9.014 -5.438 1.00 4.23 H new ATOM 83 N LEU A 7 2.254 -7.800 -7.918 1.00 24.54 N ATOM 84 CA LEU A 7 2.294 -6.429 -8.395 1.00 73.43 C ATOM 85 C LEU A 7 2.911 -5.597 -7.284 1.00 62.14 C ATOM 86 O LEU A 7 2.547 -5.770 -6.121 1.00 15.21 O ATOM 87 CB LEU A 7 0.886 -5.942 -8.762 1.00 53.15 C ATOM 88 CG LEU A 7 0.897 -4.581 -9.494 1.00 53.05 C ATOM 89 CD1 LEU A 7 1.595 -4.629 -10.857 1.00 10.04 C ATOM 90 CD2 LEU A 7 -0.539 -4.137 -9.741 1.00 33.12 C ATOM 0 H LEU A 7 1.764 -7.912 -7.030 1.00 24.54 H new ATOM 0 HA LEU A 7 2.890 -6.342 -9.303 1.00 73.43 H new ATOM 0 HB2 LEU A 7 0.402 -6.686 -9.395 1.00 53.15 H new ATOM 0 HB3 LEU A 7 0.288 -5.857 -7.855 1.00 53.15 H new ATOM 0 HG LEU A 7 1.446 -3.892 -8.852 1.00 53.05 H new ATOM 0 HD11 LEU A 7 1.566 -3.641 -11.316 1.00 10.04 H new ATOM 0 HD12 LEU A 7 2.632 -4.937 -10.724 1.00 10.04 H new ATOM 0 HD13 LEU A 7 1.084 -5.343 -11.502 1.00 10.04 H new ATOM 0 HD21 LEU A 7 -0.539 -3.177 -10.257 1.00 33.12 H new ATOM 0 HD22 LEU A 7 -1.049 -4.879 -10.355 1.00 33.12 H new ATOM 0 HD23 LEU A 7 -1.058 -4.036 -8.788 1.00 33.12 H new ATOM 101 N ILE A 8 3.850 -4.723 -7.624 1.00 44.35 N ATOM 102 CA ILE A 8 4.452 -3.775 -6.702 1.00 62.34 C ATOM 103 C ILE A 8 3.965 -2.397 -7.162 1.00 53.23 C ATOM 104 O ILE A 8 4.277 -1.964 -8.279 1.00 42.03 O ATOM 105 CB ILE A 8 5.993 -3.953 -6.665 1.00 64.21 C ATOM 106 CG1 ILE A 8 6.459 -5.405 -6.331 1.00 72.42 C ATOM 107 CG2 ILE A 8 6.637 -2.974 -5.678 1.00 42.02 C ATOM 108 CD1 ILE A 8 7.266 -6.127 -7.428 1.00 63.53 C ATOM 0 H ILE A 8 4.221 -4.654 -8.572 1.00 44.35 H new ATOM 0 HA ILE A 8 4.155 -3.926 -5.664 1.00 62.34 H new ATOM 0 HB ILE A 8 6.327 -3.738 -7.680 1.00 64.21 H new ATOM 0 HG12 ILE A 8 7.065 -5.371 -5.425 1.00 72.42 H new ATOM 0 HG13 ILE A 8 5.578 -6.004 -6.103 1.00 72.42 H new ATOM 0 HG21 ILE A 8 7.717 -3.121 -5.672 1.00 42.02 H new ATOM 0 HG22 ILE A 8 6.411 -1.951 -5.980 1.00 42.02 H new ATOM 0 HG23 ILE A 8 6.241 -3.152 -4.678 1.00 42.02 H new ATOM 0 HD11 ILE A 8 7.535 -7.126 -7.084 1.00 63.53 H new ATOM 0 HD12 ILE A 8 6.662 -6.205 -8.332 1.00 63.53 H new ATOM 0 HD13 ILE A 8 8.173 -5.562 -7.644 1.00 63.53 H new ATOM 119 N LEU A 9 3.144 -1.740 -6.333 1.00 12.13 N ATOM 120 CA LEU A 9 2.552 -0.428 -6.580 1.00 54.14 C ATOM 121 C LEU A 9 3.229 0.605 -5.691 1.00 63.11 C ATOM 122 O LEU A 9 3.238 0.487 -4.460 1.00 12.34 O ATOM 123 CB LEU A 9 1.040 -0.429 -6.302 1.00 42.41 C ATOM 124 CG LEU A 9 0.175 -1.120 -7.370 1.00 75.12 C ATOM 125 CD1 LEU A 9 -1.287 -1.059 -6.929 1.00 51.13 C ATOM 126 CD2 LEU A 9 0.303 -0.443 -8.742 1.00 1.32 C ATOM 0 H LEU A 9 2.865 -2.130 -5.433 1.00 12.13 H new ATOM 0 HA LEU A 9 2.702 -0.180 -7.631 1.00 54.14 H new ATOM 0 HB2 LEU A 9 0.864 -0.918 -5.344 1.00 42.41 H new ATOM 0 HB3 LEU A 9 0.706 0.603 -6.200 1.00 42.41 H new ATOM 0 HG LEU A 9 0.519 -2.150 -7.469 1.00 75.12 H new ATOM 0 HD11 LEU A 9 -1.913 -1.545 -7.677 1.00 51.13 H new ATOM 0 HD12 LEU A 9 -1.400 -1.570 -5.973 1.00 51.13 H new ATOM 0 HD13 LEU A 9 -1.592 -0.018 -6.822 1.00 51.13 H new ATOM 0 HD21 LEU A 9 -0.325 -0.964 -9.465 1.00 1.32 H new ATOM 0 HD22 LEU A 9 -0.017 0.596 -8.666 1.00 1.32 H new ATOM 0 HD23 LEU A 9 1.342 -0.480 -9.070 1.00 1.32 H new ATOM 137 N TYR A 10 3.825 1.624 -6.309 1.00 62.51 N ATOM 138 CA TYR A 10 4.716 2.544 -5.624 1.00 21.12 C ATOM 139 C TYR A 10 4.549 3.963 -6.173 1.00 44.03 C ATOM 140 O TYR A 10 4.465 4.154 -7.389 1.00 32.33 O ATOM 141 CB TYR A 10 6.153 1.999 -5.724 1.00 65.43 C ATOM 142 CG TYR A 10 6.770 1.855 -7.113 1.00 10.35 C ATOM 143 CD1 TYR A 10 6.279 0.925 -8.054 1.00 43.33 C ATOM 144 CD2 TYR A 10 7.889 2.632 -7.458 1.00 32.14 C ATOM 145 CE1 TYR A 10 6.830 0.848 -9.347 1.00 45.32 C ATOM 146 CE2 TYR A 10 8.464 2.536 -8.732 1.00 21.53 C ATOM 147 CZ TYR A 10 7.915 1.677 -9.704 1.00 1.01 C ATOM 148 OH TYR A 10 8.431 1.683 -10.967 1.00 33.42 O ATOM 0 H TYR A 10 3.700 1.830 -7.300 1.00 62.51 H new ATOM 0 HA TYR A 10 4.467 2.615 -4.565 1.00 21.12 H new ATOM 0 HB2 TYR A 10 6.799 2.652 -5.138 1.00 65.43 H new ATOM 0 HB3 TYR A 10 6.172 1.019 -5.247 1.00 65.43 H new ATOM 0 HD1 TYR A 10 5.470 0.264 -7.779 1.00 43.33 H new ATOM 0 HD2 TYR A 10 8.311 3.311 -6.732 1.00 32.14 H new ATOM 0 HE1 TYR A 10 6.422 0.154 -10.067 1.00 45.32 H new ATOM 0 HE2 TYR A 10 9.336 3.126 -8.971 1.00 21.53 H new ATOM 0 HH TYR A 10 9.173 2.321 -11.014 1.00 33.42 H new ATOM 157 N TYR A 11 4.506 4.959 -5.280 1.00 22.12 N ATOM 158 CA TYR A 11 4.130 6.336 -5.596 1.00 31.55 C ATOM 159 C TYR A 11 5.166 7.340 -5.064 1.00 22.24 C ATOM 160 O TYR A 11 5.310 7.523 -3.852 1.00 63.14 O ATOM 161 CB TYR A 11 2.717 6.592 -5.045 1.00 41.22 C ATOM 162 CG TYR A 11 2.264 8.036 -5.082 1.00 63.14 C ATOM 163 CD1 TYR A 11 2.554 8.888 -3.998 1.00 42.54 C ATOM 164 CD2 TYR A 11 1.528 8.521 -6.177 1.00 51.42 C ATOM 165 CE1 TYR A 11 2.093 10.212 -3.989 1.00 34.24 C ATOM 166 CE2 TYR A 11 1.075 9.850 -6.178 1.00 3.51 C ATOM 167 CZ TYR A 11 1.356 10.702 -5.086 1.00 34.25 C ATOM 168 OH TYR A 11 0.925 11.992 -5.070 1.00 61.22 O ATOM 0 H TYR A 11 4.738 4.823 -4.296 1.00 22.12 H new ATOM 0 HA TYR A 11 4.116 6.480 -6.676 1.00 31.55 H new ATOM 0 HB2 TYR A 11 2.008 5.991 -5.614 1.00 41.22 H new ATOM 0 HB3 TYR A 11 2.677 6.241 -4.014 1.00 41.22 H new ATOM 0 HD1 TYR A 11 3.136 8.518 -3.167 1.00 42.54 H new ATOM 0 HD2 TYR A 11 1.312 7.874 -7.014 1.00 51.42 H new ATOM 0 HE1 TYR A 11 2.302 10.853 -3.146 1.00 34.24 H new ATOM 0 HE2 TYR A 11 0.508 10.223 -7.018 1.00 3.51 H new ATOM 0 HH TYR A 11 1.173 12.430 -5.911 1.00 61.22 H new ATOM 177 N SER A 12 5.895 7.991 -5.975 1.00 63.24 N ATOM 178 CA SER A 12 6.668 9.209 -5.761 1.00 43.22 C ATOM 179 C SER A 12 7.047 9.830 -7.116 1.00 25.32 C ATOM 180 O SER A 12 6.822 9.232 -8.176 1.00 1.24 O ATOM 181 CB SER A 12 7.935 8.905 -4.938 1.00 14.12 C ATOM 182 OG SER A 12 8.381 10.081 -4.285 1.00 71.54 O ATOM 0 H SER A 12 5.963 7.659 -6.937 1.00 63.24 H new ATOM 0 HA SER A 12 6.059 9.920 -5.203 1.00 43.22 H new ATOM 0 HB2 SER A 12 7.724 8.128 -4.203 1.00 14.12 H new ATOM 0 HB3 SER A 12 8.719 8.521 -5.590 1.00 14.12 H new ATOM 0 HG SER A 12 9.185 9.880 -3.763 1.00 71.54 H new ATOM 187 N TRP A 13 7.650 11.020 -7.075 1.00 2.02 N ATOM 188 CA TRP A 13 8.492 11.550 -8.147 1.00 41.13 C ATOM 189 C TRP A 13 9.975 11.358 -7.815 1.00 4.32 C ATOM 190 O TRP A 13 10.797 11.242 -8.733 1.00 44.32 O ATOM 191 CB TRP A 13 8.188 13.040 -8.376 1.00 5.12 C ATOM 192 CG TRP A 13 7.058 13.328 -9.320 1.00 34.45 C ATOM 193 CD1 TRP A 13 7.096 13.079 -10.646 1.00 32.21 C ATOM 194 CD2 TRP A 13 5.729 13.881 -9.061 1.00 1.45 C ATOM 195 NE1 TRP A 13 5.912 13.473 -11.230 1.00 62.24 N ATOM 196 CE2 TRP A 13 5.002 13.906 -10.290 1.00 51.34 C ATOM 197 CE3 TRP A 13 5.057 14.353 -7.915 1.00 65.22 C ATOM 198 CZ2 TRP A 13 3.656 14.302 -10.363 1.00 70.10 C ATOM 199 CZ3 TRP A 13 3.706 14.750 -7.972 1.00 21.05 C ATOM 200 CH2 TRP A 13 2.999 14.700 -9.186 1.00 12.33 C ATOM 0 H TRP A 13 7.564 11.653 -6.280 1.00 2.02 H new ATOM 0 HA TRP A 13 8.270 11.000 -9.062 1.00 41.13 H new ATOM 0 HB2 TRP A 13 7.961 13.499 -7.414 1.00 5.12 H new ATOM 0 HB3 TRP A 13 9.088 13.523 -8.756 1.00 5.12 H new ATOM 0 HD1 TRP A 13 7.930 12.637 -11.171 1.00 32.21 H new ATOM 0 HE1 TRP A 13 5.731 13.447 -12.234 1.00 62.24 H new ATOM 0 HE3 TRP A 13 5.587 14.411 -6.976 1.00 65.22 H new ATOM 0 HZ2 TRP A 13 3.134 14.301 -11.309 1.00 70.10 H new ATOM 0 HZ3 TRP A 13 3.210 15.095 -7.077 1.00 21.05 H new ATOM 0 HH2 TRP A 13 1.953 14.967 -9.214 1.00 12.33 H new ATOM 210 N SER A 14 10.322 11.328 -6.526 1.00 63.11 N ATOM 211 CA SER A 14 11.696 11.241 -6.065 1.00 21.23 C ATOM 212 C SER A 14 12.170 9.794 -6.042 1.00 13.31 C ATOM 213 O SER A 14 11.368 8.863 -5.987 1.00 1.14 O ATOM 214 CB SER A 14 11.778 11.846 -4.666 1.00 71.22 C ATOM 215 OG SER A 14 11.359 13.197 -4.728 1.00 24.41 O ATOM 0 H SER A 14 9.641 11.364 -5.768 1.00 63.11 H new ATOM 0 HA SER A 14 12.343 11.791 -6.749 1.00 21.23 H new ATOM 0 HB2 SER A 14 11.147 11.287 -3.975 1.00 71.22 H new ATOM 0 HB3 SER A 14 12.798 11.784 -4.287 1.00 71.22 H new ATOM 0 HG SER A 14 11.406 13.595 -3.834 1.00 24.41 H new ATOM 220 N GLY A 15 13.484 9.601 -5.974 1.00 3.45 N ATOM 221 CA GLY A 15 14.123 8.302 -5.889 1.00 72.44 C ATOM 222 C GLY A 15 14.075 7.750 -4.469 1.00 13.43 C ATOM 223 O GLY A 15 15.092 7.255 -3.981 1.00 34.54 O ATOM 0 H GLY A 15 14.151 10.373 -5.977 1.00 3.45 H new ATOM 0 HA2 GLY A 15 13.629 7.607 -6.568 1.00 72.44 H new ATOM 0 HA3 GLY A 15 15.160 8.383 -6.215 1.00 72.44 H new ATOM 227 N GLU A 16 12.927 7.802 -3.795 1.00 64.42 N ATOM 228 CA GLU A 16 12.689 7.045 -2.568 1.00 42.33 C ATOM 229 C GLU A 16 12.325 5.620 -2.981 1.00 22.55 C ATOM 230 O GLU A 16 13.132 4.699 -2.841 1.00 72.52 O ATOM 231 CB GLU A 16 11.584 7.703 -1.715 1.00 52.02 C ATOM 232 CG GLU A 16 11.985 9.060 -1.116 1.00 71.42 C ATOM 233 CD GLU A 16 13.217 8.968 -0.208 1.00 63.53 C ATOM 234 OE1 GLU A 16 14.358 8.962 -0.728 1.00 54.24 O ATOM 235 OE2 GLU A 16 13.087 8.949 1.032 1.00 72.23 O ATOM 0 H GLU A 16 12.133 8.373 -4.086 1.00 64.42 H new ATOM 0 HA GLU A 16 13.580 7.032 -1.940 1.00 42.33 H new ATOM 0 HB2 GLU A 16 10.695 7.837 -2.331 1.00 52.02 H new ATOM 0 HB3 GLU A 16 11.312 7.026 -0.905 1.00 52.02 H new ATOM 0 HG2 GLU A 16 12.187 9.763 -1.924 1.00 71.42 H new ATOM 0 HG3 GLU A 16 11.148 9.462 -0.545 1.00 71.42 H new ATOM 240 N THR A 17 11.143 5.446 -3.562 1.00 43.42 N ATOM 241 CA THR A 17 10.527 4.155 -3.813 1.00 32.52 C ATOM 242 C THR A 17 11.288 3.286 -4.820 1.00 51.24 C ATOM 243 O THR A 17 11.280 2.068 -4.673 1.00 52.21 O ATOM 244 CB THR A 17 9.082 4.396 -4.272 1.00 11.35 C ATOM 245 OG1 THR A 17 9.030 5.432 -5.257 1.00 4.12 O ATOM 246 CG2 THR A 17 8.185 4.803 -3.101 1.00 72.52 C ATOM 0 H THR A 17 10.571 6.228 -3.881 1.00 43.42 H new ATOM 0 HA THR A 17 10.551 3.587 -2.883 1.00 32.52 H new ATOM 0 HB THR A 17 8.723 3.458 -4.695 1.00 11.35 H new ATOM 0 HG1 THR A 17 8.101 5.570 -5.538 1.00 4.12 H new ATOM 0 HG21 THR A 17 7.169 4.966 -3.460 1.00 72.52 H new ATOM 0 HG22 THR A 17 8.182 4.011 -2.352 1.00 72.52 H new ATOM 0 HG23 THR A 17 8.564 5.723 -2.655 1.00 72.52 H new ATOM 254 N LYS A 18 11.966 3.880 -5.812 1.00 44.12 N ATOM 255 CA LYS A 18 12.511 3.196 -6.991 1.00 3.04 C ATOM 256 C LYS A 18 13.269 1.922 -6.641 1.00 2.42 C ATOM 257 O LYS A 18 12.845 0.844 -7.058 1.00 72.51 O ATOM 258 CB LYS A 18 13.398 4.151 -7.825 1.00 54.43 C ATOM 259 CG LYS A 18 13.301 3.863 -9.334 1.00 72.22 C ATOM 260 CD LYS A 18 11.987 4.371 -9.952 1.00 5.24 C ATOM 261 CE LYS A 18 12.085 5.784 -10.539 1.00 63.51 C ATOM 262 NZ LYS A 18 12.488 6.789 -9.535 1.00 63.33 N ATOM 0 H LYS A 18 12.156 4.882 -5.815 1.00 44.12 H new ATOM 0 HA LYS A 18 11.655 2.894 -7.595 1.00 3.04 H new ATOM 0 HB2 LYS A 18 13.100 5.182 -7.633 1.00 54.43 H new ATOM 0 HB3 LYS A 18 14.435 4.054 -7.504 1.00 54.43 H new ATOM 0 HG2 LYS A 18 14.143 4.332 -9.844 1.00 72.22 H new ATOM 0 HG3 LYS A 18 13.385 2.789 -9.501 1.00 72.22 H new ATOM 0 HD2 LYS A 18 11.676 3.682 -10.737 1.00 5.24 H new ATOM 0 HD3 LYS A 18 11.209 4.358 -9.189 1.00 5.24 H new ATOM 0 HE2 LYS A 18 12.805 5.784 -11.357 1.00 63.51 H new ATOM 0 HE3 LYS A 18 11.121 6.065 -10.963 1.00 63.51 H new ATOM 0 HZ1 LYS A 18 12.441 7.739 -9.956 1.00 63.33 H new ATOM 0 HZ2 LYS A 18 11.846 6.740 -8.718 1.00 63.33 H new ATOM 0 HZ3 LYS A 18 13.461 6.597 -9.223 1.00 63.33 H new ATOM 272 N LYS A 19 14.374 2.035 -5.896 1.00 13.20 N ATOM 273 CA LYS A 19 15.170 0.875 -5.501 1.00 43.11 C ATOM 274 C LYS A 19 14.290 -0.184 -4.864 1.00 30.44 C ATOM 275 O LYS A 19 14.342 -1.338 -5.269 1.00 63.23 O ATOM 276 CB LYS A 19 16.363 1.246 -4.592 1.00 50.23 C ATOM 277 CG LYS A 19 16.040 2.261 -3.479 1.00 62.44 C ATOM 278 CD LYS A 19 16.956 2.168 -2.259 1.00 42.15 C ATOM 279 CE LYS A 19 16.538 3.205 -1.206 1.00 74.52 C ATOM 280 NZ LYS A 19 16.995 4.578 -1.514 1.00 31.32 N ATOM 0 H LYS A 19 14.736 2.925 -5.554 1.00 13.20 H new ATOM 0 HA LYS A 19 15.605 0.461 -6.411 1.00 43.11 H new ATOM 0 HB2 LYS A 19 16.748 0.335 -4.133 1.00 50.23 H new ATOM 0 HB3 LYS A 19 17.162 1.652 -5.213 1.00 50.23 H new ATOM 0 HG2 LYS A 19 16.105 3.268 -3.891 1.00 62.44 H new ATOM 0 HG3 LYS A 19 15.009 2.114 -3.157 1.00 62.44 H new ATOM 0 HD2 LYS A 19 16.907 1.166 -1.833 1.00 42.15 H new ATOM 0 HD3 LYS A 19 17.991 2.338 -2.557 1.00 42.15 H new ATOM 0 HE2 LYS A 19 15.452 3.204 -1.118 1.00 74.52 H new ATOM 0 HE3 LYS A 19 16.937 2.907 -0.236 1.00 74.52 H new ATOM 0 HZ1 LYS A 19 16.679 5.225 -0.764 1.00 31.32 H new ATOM 0 HZ2 LYS A 19 18.033 4.594 -1.570 1.00 31.32 H new ATOM 0 HZ3 LYS A 19 16.594 4.881 -2.425 1.00 31.32 H new ATOM 290 N MET A 20 13.474 0.220 -3.898 1.00 10.12 N ATOM 291 CA MET A 20 12.676 -0.669 -3.082 1.00 12.03 C ATOM 292 C MET A 20 11.559 -1.347 -3.881 1.00 73.14 C ATOM 293 O MET A 20 10.911 -2.222 -3.330 1.00 2.32 O ATOM 294 CB MET A 20 12.146 0.143 -1.885 1.00 21.22 C ATOM 295 CG MET A 20 12.464 -0.496 -0.529 1.00 41.34 C ATOM 296 SD MET A 20 14.162 -0.200 0.057 1.00 63.13 S ATOM 297 CE MET A 20 14.947 -1.725 -0.491 1.00 10.44 C ATOM 0 H MET A 20 13.350 1.204 -3.659 1.00 10.12 H new ATOM 0 HA MET A 20 13.291 -1.492 -2.718 1.00 12.03 H new ATOM 0 HB2 MET A 20 12.575 1.145 -1.916 1.00 21.22 H new ATOM 0 HB3 MET A 20 11.066 0.256 -1.981 1.00 21.22 H new ATOM 0 HG2 MET A 20 11.764 -0.113 0.213 1.00 41.34 H new ATOM 0 HG3 MET A 20 12.298 -1.571 -0.599 1.00 41.34 H new ATOM 0 HE1 MET A 20 15.517 -2.157 0.332 1.00 10.44 H new ATOM 0 HE2 MET A 20 14.183 -2.432 -0.813 1.00 10.44 H new ATOM 0 HE3 MET A 20 15.617 -1.511 -1.323 1.00 10.44 H new ATOM 305 N ALA A 21 11.314 -0.975 -5.143 1.00 25.51 N ATOM 306 CA ALA A 21 10.421 -1.691 -6.045 1.00 63.11 C ATOM 307 C ALA A 21 11.233 -2.539 -7.030 1.00 73.45 C ATOM 308 O ALA A 21 10.944 -3.719 -7.215 1.00 23.50 O ATOM 309 CB ALA A 21 9.518 -0.688 -6.778 1.00 12.02 C ATOM 0 H ALA A 21 11.741 -0.152 -5.568 1.00 25.51 H new ATOM 0 HA ALA A 21 9.787 -2.367 -5.472 1.00 63.11 H new ATOM 0 HB1 ALA A 21 8.851 -1.225 -7.452 1.00 12.02 H new ATOM 0 HB2 ALA A 21 8.928 -0.131 -6.051 1.00 12.02 H new ATOM 0 HB3 ALA A 21 10.134 0.004 -7.352 1.00 12.02 H new ATOM 315 N GLU A 22 12.235 -1.939 -7.678 1.00 44.41 N ATOM 316 CA GLU A 22 12.978 -2.560 -8.775 1.00 64.43 C ATOM 317 C GLU A 22 13.846 -3.716 -8.264 1.00 2.03 C ATOM 318 O GLU A 22 14.078 -4.668 -9.005 1.00 61.12 O ATOM 319 CB GLU A 22 13.842 -1.515 -9.500 1.00 63.44 C ATOM 320 CG GLU A 22 13.055 -0.321 -10.083 1.00 23.52 C ATOM 321 CD GLU A 22 13.018 -0.276 -11.618 1.00 73.23 C ATOM 322 OE1 GLU A 22 12.205 -0.979 -12.251 1.00 25.33 O ATOM 323 OE2 GLU A 22 13.815 0.510 -12.193 1.00 13.44 O ATOM 0 H GLU A 22 12.556 -0.998 -7.452 1.00 44.41 H new ATOM 0 HA GLU A 22 12.258 -2.967 -9.485 1.00 64.43 H new ATOM 0 HB2 GLU A 22 14.590 -1.135 -8.804 1.00 63.44 H new ATOM 0 HB3 GLU A 22 14.381 -2.007 -10.309 1.00 63.44 H new ATOM 0 HG2 GLU A 22 12.032 -0.357 -9.708 1.00 23.52 H new ATOM 0 HG3 GLU A 22 13.497 0.605 -9.715 1.00 23.52 H new ATOM 328 N LYS A 23 14.284 -3.678 -6.995 1.00 74.11 N ATOM 329 CA LYS A 23 14.950 -4.794 -6.327 1.00 70.43 C ATOM 330 C LYS A 23 14.035 -6.004 -6.388 1.00 54.05 C ATOM 331 O LYS A 23 14.307 -6.933 -7.144 1.00 65.24 O ATOM 332 CB LYS A 23 15.338 -4.428 -4.887 1.00 30.22 C ATOM 333 CG LYS A 23 16.813 -4.133 -4.719 1.00 64.45 C ATOM 334 CD LYS A 23 17.359 -2.860 -5.332 1.00 52.02 C ATOM 335 CE LYS A 23 17.528 -3.004 -6.846 1.00 51.21 C ATOM 336 NZ LYS A 23 18.264 -1.900 -7.488 1.00 73.35 N ATOM 0 H LYS A 23 14.181 -2.856 -6.400 1.00 74.11 H new ATOM 0 HA LYS A 23 15.883 -5.032 -6.837 1.00 70.43 H new ATOM 0 HB2 LYS A 23 14.763 -3.557 -4.574 1.00 30.22 H new ATOM 0 HB3 LYS A 23 15.061 -5.248 -4.224 1.00 30.22 H new ATOM 0 HG2 LYS A 23 17.029 -4.108 -3.651 1.00 64.45 H new ATOM 0 HG3 LYS A 23 17.371 -4.971 -5.138 1.00 64.45 H new ATOM 0 HD2 LYS A 23 16.685 -2.031 -5.116 1.00 52.02 H new ATOM 0 HD3 LYS A 23 18.319 -2.617 -4.878 1.00 52.02 H new ATOM 0 HE2 LYS A 23 18.048 -3.939 -7.053 1.00 51.21 H new ATOM 0 HE3 LYS A 23 16.541 -3.080 -7.303 1.00 51.21 H new ATOM 0 HZ1 LYS A 23 18.333 -2.077 -8.511 1.00 73.35 H new ATOM 0 HZ2 LYS A 23 17.760 -1.005 -7.325 1.00 73.35 H new ATOM 0 HZ3 LYS A 23 19.220 -1.838 -7.082 1.00 73.35 H new ATOM 346 N ILE A 24 12.937 -5.931 -5.641 1.00 74.13 N ATOM 347 CA ILE A 24 11.910 -6.946 -5.445 1.00 53.43 C ATOM 348 C ILE A 24 11.402 -7.449 -6.798 1.00 42.32 C ATOM 349 O ILE A 24 11.212 -8.651 -6.948 1.00 30.41 O ATOM 350 CB ILE A 24 10.774 -6.319 -4.585 1.00 3.32 C ATOM 351 CG1 ILE A 24 11.323 -5.613 -3.316 1.00 71.12 C ATOM 352 CG2 ILE A 24 9.732 -7.382 -4.217 1.00 20.40 C ATOM 353 CD1 ILE A 24 10.266 -5.122 -2.313 1.00 52.32 C ATOM 0 H ILE A 24 12.726 -5.085 -5.112 1.00 74.13 H new ATOM 0 HA ILE A 24 12.312 -7.813 -4.920 1.00 53.43 H new ATOM 0 HB ILE A 24 10.291 -5.551 -5.189 1.00 3.32 H new ATOM 0 HG12 ILE A 24 11.993 -6.302 -2.801 1.00 71.12 H new ATOM 0 HG13 ILE A 24 11.923 -4.759 -3.629 1.00 71.12 H new ATOM 0 HG21 ILE A 24 8.945 -6.927 -3.616 1.00 20.40 H new ATOM 0 HG22 ILE A 24 9.299 -7.798 -5.127 1.00 20.40 H new ATOM 0 HG23 ILE A 24 10.210 -8.178 -3.646 1.00 20.40 H new ATOM 0 HD11 ILE A 24 10.761 -4.645 -1.467 1.00 52.32 H new ATOM 0 HD12 ILE A 24 9.608 -4.403 -2.801 1.00 52.32 H new ATOM 0 HD13 ILE A 24 9.679 -5.969 -1.959 1.00 52.32 H new ATOM 364 N ASN A 25 11.222 -6.575 -7.799 1.00 25.52 N ATOM 365 CA ASN A 25 10.846 -7.011 -9.142 1.00 23.31 C ATOM 366 C ASN A 25 11.803 -8.096 -9.652 1.00 30.51 C ATOM 367 O ASN A 25 11.365 -9.169 -10.059 1.00 64.24 O ATOM 368 CB ASN A 25 10.856 -5.845 -10.142 1.00 70.54 C ATOM 369 CG ASN A 25 10.499 -6.292 -11.552 1.00 70.41 C ATOM 370 OD1 ASN A 25 11.111 -5.843 -12.514 1.00 65.12 O ATOM 371 ND2 ASN A 25 9.494 -7.131 -11.726 1.00 64.44 N ATOM 0 H ASN A 25 11.332 -5.566 -7.700 1.00 25.52 H new ATOM 0 HA ASN A 25 9.834 -7.410 -9.069 1.00 23.31 H new ATOM 0 HB2 ASN A 25 10.149 -5.082 -9.815 1.00 70.54 H new ATOM 0 HB3 ASN A 25 11.843 -5.383 -10.148 1.00 70.54 H new ATOM 0 HD21 ASN A 25 9.221 -7.411 -12.668 1.00 64.44 H new ATOM 0 HD22 ASN A 25 8.991 -7.499 -10.918 1.00 64.44 H new ATOM 377 N SER A 26 13.108 -7.819 -9.629 1.00 53.31 N ATOM 378 CA SER A 26 14.110 -8.736 -10.140 1.00 33.41 C ATOM 379 C SER A 26 14.285 -9.982 -9.255 1.00 41.21 C ATOM 380 O SER A 26 14.946 -10.921 -9.709 1.00 1.00 O ATOM 381 CB SER A 26 15.426 -7.968 -10.326 1.00 44.02 C ATOM 382 OG SER A 26 16.356 -8.738 -11.071 1.00 33.43 O ATOM 0 H SER A 26 13.493 -6.952 -9.255 1.00 53.31 H new ATOM 0 HA SER A 26 13.775 -9.121 -11.103 1.00 33.41 H new ATOM 0 HB2 SER A 26 15.233 -7.026 -10.839 1.00 44.02 H new ATOM 0 HB3 SER A 26 15.849 -7.720 -9.352 1.00 44.02 H new ATOM 0 HG SER A 26 16.228 -9.689 -10.872 1.00 33.43 H new ATOM 387 N GLU A 27 13.722 -10.028 -8.041 1.00 63.45 N ATOM 388 CA GLU A 27 13.820 -11.154 -7.128 1.00 52.41 C ATOM 389 C GLU A 27 12.515 -11.943 -6.988 1.00 1.13 C ATOM 390 O GLU A 27 12.495 -12.906 -6.217 1.00 52.34 O ATOM 391 CB GLU A 27 14.463 -10.764 -5.797 1.00 54.14 C ATOM 392 CG GLU A 27 13.828 -9.612 -5.130 1.00 23.23 C ATOM 393 CD GLU A 27 14.310 -9.408 -3.688 1.00 5.34 C ATOM 394 OE1 GLU A 27 14.423 -10.384 -2.908 1.00 74.23 O ATOM 395 OE2 GLU A 27 14.708 -8.270 -3.355 1.00 12.34 O ATOM 0 H GLU A 27 13.172 -9.256 -7.664 1.00 63.45 H new ATOM 0 HA GLU A 27 14.508 -11.864 -7.588 1.00 52.41 H new ATOM 0 HB2 GLU A 27 14.429 -11.622 -5.125 1.00 54.14 H new ATOM 0 HB3 GLU A 27 15.515 -10.535 -5.968 1.00 54.14 H new ATOM 0 HG2 GLU A 27 14.032 -8.709 -5.706 1.00 23.23 H new ATOM 0 HG3 GLU A 27 12.747 -9.752 -5.129 1.00 23.23 H new ATOM 400 N ILE A 28 11.444 -11.596 -7.711 1.00 32.54 N ATOM 401 CA ILE A 28 10.184 -12.323 -7.630 1.00 45.23 C ATOM 402 C ILE A 28 9.742 -12.756 -9.019 1.00 10.22 C ATOM 403 O ILE A 28 9.536 -11.939 -9.926 1.00 45.42 O ATOM 404 CB ILE A 28 9.096 -11.527 -6.897 1.00 53.34 C ATOM 405 CG1 ILE A 28 9.527 -11.218 -5.450 1.00 32.32 C ATOM 406 CG2 ILE A 28 7.803 -12.360 -6.892 1.00 20.40 C ATOM 407 CD1 ILE A 28 8.449 -10.480 -4.662 1.00 34.22 C ATOM 0 H ILE A 28 11.431 -10.810 -8.361 1.00 32.54 H new ATOM 0 HA ILE A 28 10.349 -13.218 -7.030 1.00 45.23 H new ATOM 0 HB ILE A 28 8.933 -10.579 -7.409 1.00 53.34 H new ATOM 0 HG12 ILE A 28 9.770 -12.150 -4.940 1.00 32.32 H new ATOM 0 HG13 ILE A 28 10.436 -10.617 -5.466 1.00 32.32 H new ATOM 0 HG21 ILE A 28 7.017 -11.809 -6.374 1.00 20.40 H new ATOM 0 HG22 ILE A 28 7.493 -12.556 -7.918 1.00 20.40 H new ATOM 0 HG23 ILE A 28 7.981 -13.305 -6.380 1.00 20.40 H new ATOM 0 HD11 ILE A 28 8.805 -10.288 -3.650 1.00 34.22 H new ATOM 0 HD12 ILE A 28 8.223 -9.533 -5.153 1.00 34.22 H new ATOM 0 HD13 ILE A 28 7.547 -11.091 -4.619 1.00 34.22 H new ATOM 418 N LYS A 29 9.524 -14.066 -9.141 1.00 31.31 N ATOM 419 CA LYS A 29 8.979 -14.702 -10.318 1.00 11.11 C ATOM 420 C LYS A 29 7.649 -14.080 -10.691 1.00 72.52 C ATOM 421 O LYS A 29 6.766 -13.959 -9.839 1.00 65.53 O ATOM 422 CB LYS A 29 8.795 -16.211 -10.085 1.00 30.20 C ATOM 423 CG LYS A 29 9.550 -17.011 -11.145 1.00 5.40 C ATOM 424 CD LYS A 29 10.962 -17.348 -10.649 1.00 53.31 C ATOM 425 CE LYS A 29 11.974 -17.612 -11.758 1.00 13.04 C ATOM 426 NZ LYS A 29 11.434 -18.422 -12.861 1.00 13.41 N ATOM 0 H LYS A 29 9.732 -14.727 -8.392 1.00 31.31 H new ATOM 0 HA LYS A 29 9.684 -14.554 -11.136 1.00 11.11 H new ATOM 0 HB2 LYS A 29 9.157 -16.479 -9.092 1.00 30.20 H new ATOM 0 HB3 LYS A 29 7.735 -16.463 -10.117 1.00 30.20 H new ATOM 0 HG2 LYS A 29 9.008 -17.929 -11.373 1.00 5.40 H new ATOM 0 HG3 LYS A 29 9.609 -16.438 -12.070 1.00 5.40 H new ATOM 0 HD2 LYS A 29 11.323 -16.525 -10.033 1.00 53.31 H new ATOM 0 HD3 LYS A 29 10.908 -18.227 -10.007 1.00 53.31 H new ATOM 0 HE2 LYS A 29 12.324 -16.659 -12.155 1.00 13.04 H new ATOM 0 HE3 LYS A 29 12.841 -18.119 -11.335 1.00 13.04 H new ATOM 0 HZ1 LYS A 29 12.206 -18.693 -13.503 1.00 13.41 H new ATOM 0 HZ2 LYS A 29 10.987 -19.278 -12.476 1.00 13.41 H new ATOM 0 HZ3 LYS A 29 10.727 -17.868 -13.385 1.00 13.41 H new ATOM 436 N ASP A 30 7.501 -13.745 -11.970 1.00 54.11 N ATOM 437 CA ASP A 30 6.251 -13.264 -12.553 1.00 45.21 C ATOM 438 C ASP A 30 5.658 -12.091 -11.769 1.00 11.13 C ATOM 439 O ASP A 30 4.440 -11.935 -11.667 1.00 32.33 O ATOM 440 CB ASP A 30 5.281 -14.444 -12.752 1.00 73.33 C ATOM 441 CG ASP A 30 4.356 -14.282 -13.959 1.00 22.20 C ATOM 442 OD1 ASP A 30 4.639 -13.468 -14.871 1.00 72.23 O ATOM 443 OD2 ASP A 30 3.480 -15.163 -14.109 1.00 32.31 O ATOM 0 H ASP A 30 8.264 -13.802 -12.645 1.00 54.11 H new ATOM 0 HA ASP A 30 6.455 -12.849 -13.540 1.00 45.21 H new ATOM 0 HB2 ASP A 30 5.858 -15.362 -12.868 1.00 73.33 H new ATOM 0 HB3 ASP A 30 4.675 -14.560 -11.854 1.00 73.33 H new ATOM 447 N SER A 31 6.528 -11.277 -11.162 1.00 30.41 N ATOM 448 CA SER A 31 6.136 -10.001 -10.613 1.00 21.14 C ATOM 449 C SER A 31 5.930 -8.986 -11.737 1.00 73.12 C ATOM 450 O SER A 31 6.374 -9.181 -12.875 1.00 63.25 O ATOM 451 CB SER A 31 7.190 -9.554 -9.594 1.00 41.41 C ATOM 452 OG SER A 31 8.457 -9.348 -10.181 1.00 54.03 O ATOM 0 H SER A 31 7.517 -11.495 -11.044 1.00 30.41 H new ATOM 0 HA SER A 31 5.182 -10.084 -10.091 1.00 21.14 H new ATOM 0 HB2 SER A 31 6.860 -8.631 -9.116 1.00 41.41 H new ATOM 0 HB3 SER A 31 7.275 -10.306 -8.810 1.00 41.41 H new ATOM 0 HG SER A 31 8.966 -10.186 -10.164 1.00 54.03 H new ATOM 457 N GLU A 32 5.307 -7.865 -11.399 1.00 5.21 N ATOM 458 CA GLU A 32 5.125 -6.717 -12.254 1.00 34.52 C ATOM 459 C GLU A 32 5.195 -5.451 -11.420 1.00 71.51 C ATOM 460 O GLU A 32 4.997 -5.484 -10.201 1.00 3.24 O ATOM 461 CB GLU A 32 3.757 -6.822 -12.961 1.00 50.42 C ATOM 462 CG GLU A 32 3.844 -7.140 -14.454 1.00 71.42 C ATOM 463 CD GLU A 32 3.566 -8.589 -14.880 1.00 43.12 C ATOM 464 OE1 GLU A 32 2.495 -9.154 -14.562 1.00 24.31 O ATOM 465 OE2 GLU A 32 4.311 -9.074 -15.769 1.00 4.12 O ATOM 0 H GLU A 32 4.898 -7.733 -10.474 1.00 5.21 H new ATOM 0 HA GLU A 32 5.912 -6.685 -13.008 1.00 34.52 H new ATOM 0 HB2 GLU A 32 3.166 -7.595 -12.470 1.00 50.42 H new ATOM 0 HB3 GLU A 32 3.221 -5.882 -12.832 1.00 50.42 H new ATOM 0 HG2 GLU A 32 3.141 -6.493 -14.979 1.00 71.42 H new ATOM 0 HG3 GLU A 32 4.843 -6.872 -14.799 1.00 71.42 H new ATOM 470 N LEU A 33 5.478 -4.340 -12.101 1.00 25.12 N ATOM 471 CA LEU A 33 5.878 -3.080 -11.504 1.00 70.11 C ATOM 472 C LEU A 33 5.062 -1.975 -12.143 1.00 3.22 C ATOM 473 O LEU A 33 5.168 -1.783 -13.354 1.00 3.02 O ATOM 474 CB LEU A 33 7.402 -2.886 -11.729 1.00 13.21 C ATOM 475 CG LEU A 33 8.125 -2.758 -10.403 1.00 14.01 C ATOM 476 CD1 LEU A 33 7.988 -4.117 -9.753 1.00 64.33 C ATOM 477 CD2 LEU A 33 9.586 -2.357 -10.604 1.00 63.22 C ATOM 0 H LEU A 33 5.431 -4.299 -13.119 1.00 25.12 H new ATOM 0 HA LEU A 33 5.694 -3.064 -10.430 1.00 70.11 H new ATOM 0 HB2 LEU A 33 7.803 -3.731 -12.288 1.00 13.21 H new ATOM 0 HB3 LEU A 33 7.576 -1.994 -12.332 1.00 13.21 H new ATOM 0 HG LEU A 33 7.702 -1.974 -9.775 1.00 14.01 H new ATOM 0 HD11 LEU A 33 8.487 -4.109 -8.784 1.00 64.33 H new ATOM 0 HD12 LEU A 33 6.932 -4.350 -9.616 1.00 64.33 H new ATOM 0 HD13 LEU A 33 8.446 -4.873 -10.391 1.00 64.33 H new ATOM 0 HD21 LEU A 33 10.077 -2.273 -9.634 1.00 63.22 H new ATOM 0 HD22 LEU A 33 10.092 -3.114 -11.203 1.00 63.22 H new ATOM 0 HD23 LEU A 33 9.632 -1.397 -11.118 1.00 63.22 H new ATOM 488 N LYS A 34 4.251 -1.265 -11.361 1.00 53.43 N ATOM 489 CA LYS A 34 3.454 -0.147 -11.850 1.00 54.24 C ATOM 490 C LYS A 34 3.704 1.027 -10.928 1.00 1.11 C ATOM 491 O LYS A 34 3.485 0.933 -9.717 1.00 3.01 O ATOM 492 CB LYS A 34 1.962 -0.496 -11.870 1.00 42.44 C ATOM 493 CG LYS A 34 1.265 -0.389 -13.230 1.00 14.05 C ATOM 494 CD LYS A 34 1.540 -1.535 -14.211 1.00 53.32 C ATOM 495 CE LYS A 34 0.487 -1.473 -15.337 1.00 4.14 C ATOM 496 NZ LYS A 34 0.899 -2.205 -16.557 1.00 25.13 N ATOM 0 H LYS A 34 4.129 -1.452 -10.366 1.00 53.43 H new ATOM 0 HA LYS A 34 3.741 0.094 -12.873 1.00 54.24 H new ATOM 0 HB2 LYS A 34 1.843 -1.515 -11.502 1.00 42.44 H new ATOM 0 HB3 LYS A 34 1.447 0.159 -11.167 1.00 42.44 H new ATOM 0 HG2 LYS A 34 0.190 -0.329 -13.063 1.00 14.05 H new ATOM 0 HG3 LYS A 34 1.567 0.547 -13.700 1.00 14.05 H new ATOM 0 HD2 LYS A 34 2.544 -1.447 -14.625 1.00 53.32 H new ATOM 0 HD3 LYS A 34 1.490 -2.495 -13.697 1.00 53.32 H new ATOM 0 HE2 LYS A 34 -0.452 -1.888 -14.971 1.00 4.14 H new ATOM 0 HE3 LYS A 34 0.297 -0.430 -15.592 1.00 4.14 H new ATOM 0 HZ1 LYS A 34 0.152 -2.128 -17.277 1.00 25.13 H new ATOM 0 HZ2 LYS A 34 1.780 -1.795 -16.927 1.00 25.13 H new ATOM 0 HZ3 LYS A 34 1.054 -3.207 -16.325 1.00 25.13 H new ATOM 506 N GLU A 35 4.140 2.135 -11.502 1.00 10.25 N ATOM 507 CA GLU A 35 4.069 3.398 -10.785 1.00 41.20 C ATOM 508 C GLU A 35 2.620 3.887 -10.839 1.00 73.10 C ATOM 509 O GLU A 35 1.918 3.702 -11.838 1.00 50.22 O ATOM 510 CB GLU A 35 5.077 4.441 -11.286 1.00 25.13 C ATOM 511 CG GLU A 35 4.939 4.868 -12.753 1.00 72.52 C ATOM 512 CD GLU A 35 5.462 6.289 -12.968 1.00 52.40 C ATOM 513 OE1 GLU A 35 6.655 6.572 -12.713 1.00 21.22 O ATOM 514 OE2 GLU A 35 4.659 7.177 -13.336 1.00 63.11 O ATOM 0 H GLU A 35 4.538 2.188 -12.440 1.00 10.25 H new ATOM 0 HA GLU A 35 4.362 3.239 -9.747 1.00 41.20 H new ATOM 0 HB2 GLU A 35 4.989 5.330 -10.661 1.00 25.13 H new ATOM 0 HB3 GLU A 35 6.082 4.045 -11.138 1.00 25.13 H new ATOM 0 HG2 GLU A 35 5.490 4.175 -13.389 1.00 72.52 H new ATOM 0 HG3 GLU A 35 3.893 4.814 -13.053 1.00 72.52 H new ATOM 519 N VAL A 36 2.159 4.483 -9.746 1.00 13.04 N ATOM 520 CA VAL A 36 0.810 5.027 -9.585 1.00 3.32 C ATOM 521 C VAL A 36 0.848 6.518 -9.994 1.00 43.33 C ATOM 522 O VAL A 36 1.934 7.102 -10.030 1.00 70.43 O ATOM 523 CB VAL A 36 0.420 4.810 -8.106 1.00 3.21 C ATOM 524 CG1 VAL A 36 -0.935 5.411 -7.728 1.00 12.43 C ATOM 525 CG2 VAL A 36 0.392 3.314 -7.740 1.00 35.32 C ATOM 0 H VAL A 36 2.735 4.607 -8.913 1.00 13.04 H new ATOM 0 HA VAL A 36 0.063 4.541 -10.212 1.00 3.32 H new ATOM 0 HB VAL A 36 1.195 5.331 -7.544 1.00 3.21 H new ATOM 0 HG11 VAL A 36 -1.138 5.217 -6.675 1.00 12.43 H new ATOM 0 HG12 VAL A 36 -0.917 6.487 -7.902 1.00 12.43 H new ATOM 0 HG13 VAL A 36 -1.717 4.958 -8.337 1.00 12.43 H new ATOM 0 HG21 VAL A 36 0.114 3.201 -6.692 1.00 35.32 H new ATOM 0 HG22 VAL A 36 -0.337 2.800 -8.366 1.00 35.32 H new ATOM 0 HG23 VAL A 36 1.379 2.881 -7.902 1.00 35.32 H new ATOM 535 N LYS A 37 -0.288 7.178 -10.245 1.00 71.00 N ATOM 536 CA LYS A 37 -0.413 8.644 -10.270 1.00 42.23 C ATOM 537 C LYS A 37 -1.529 9.076 -9.323 1.00 13.43 C ATOM 538 O LYS A 37 -2.318 8.246 -8.881 1.00 31.01 O ATOM 539 CB LYS A 37 -0.729 9.124 -11.698 1.00 13.54 C ATOM 540 CG LYS A 37 0.496 9.357 -12.586 1.00 64.12 C ATOM 541 CD LYS A 37 1.306 10.572 -12.116 1.00 61.44 C ATOM 542 CE LYS A 37 2.092 11.223 -13.257 1.00 2.23 C ATOM 543 NZ LYS A 37 3.094 10.338 -13.874 1.00 73.43 N ATOM 0 H LYS A 37 -1.167 6.699 -10.441 1.00 71.00 H new ATOM 0 HA LYS A 37 0.529 9.088 -9.949 1.00 42.23 H new ATOM 0 HB2 LYS A 37 -1.373 8.388 -12.179 1.00 13.54 H new ATOM 0 HB3 LYS A 37 -1.297 10.052 -11.636 1.00 13.54 H new ATOM 0 HG2 LYS A 37 1.129 8.470 -12.575 1.00 64.12 H new ATOM 0 HG3 LYS A 37 0.176 9.508 -13.617 1.00 64.12 H new ATOM 0 HD2 LYS A 37 0.632 11.307 -11.676 1.00 61.44 H new ATOM 0 HD3 LYS A 37 1.997 10.264 -11.331 1.00 61.44 H new ATOM 0 HE2 LYS A 37 1.392 11.553 -14.025 1.00 2.23 H new ATOM 0 HE3 LYS A 37 2.593 12.114 -12.878 1.00 2.23 H new ATOM 0 HZ1 LYS A 37 3.585 10.847 -14.637 1.00 73.43 H new ATOM 0 HZ2 LYS A 37 3.785 10.042 -13.155 1.00 73.43 H new ATOM 0 HZ3 LYS A 37 2.621 9.499 -14.267 1.00 73.43 H new ATOM 553 N VAL A 38 -1.607 10.376 -9.050 1.00 32.31 N ATOM 554 CA VAL A 38 -2.752 11.030 -8.412 1.00 53.40 C ATOM 555 C VAL A 38 -3.605 11.686 -9.497 1.00 42.12 C ATOM 556 O VAL A 38 -3.149 11.837 -10.630 1.00 23.34 O ATOM 557 CB VAL A 38 -2.321 12.077 -7.360 1.00 32.03 C ATOM 558 CG1 VAL A 38 -2.178 11.418 -5.987 1.00 52.52 C ATOM 559 CG2 VAL A 38 -1.056 12.869 -7.741 1.00 5.41 C ATOM 0 H VAL A 38 -0.853 11.026 -9.273 1.00 32.31 H new ATOM 0 HA VAL A 38 -3.328 10.273 -7.879 1.00 53.40 H new ATOM 0 HB VAL A 38 -3.117 12.821 -7.322 1.00 32.03 H new ATOM 0 HG11 VAL A 38 -1.874 12.166 -5.254 1.00 52.52 H new ATOM 0 HG12 VAL A 38 -3.133 10.986 -5.689 1.00 52.52 H new ATOM 0 HG13 VAL A 38 -1.424 10.632 -6.037 1.00 52.52 H new ATOM 0 HG21 VAL A 38 -0.821 13.582 -6.951 1.00 5.41 H new ATOM 0 HG22 VAL A 38 -0.220 12.181 -7.869 1.00 5.41 H new ATOM 0 HG23 VAL A 38 -1.230 13.405 -8.674 1.00 5.41 H new ATOM 569 N SER A 39 -4.821 12.095 -9.152 1.00 3.22 N ATOM 570 CA SER A 39 -5.740 12.873 -9.957 1.00 11.14 C ATOM 571 C SER A 39 -5.742 14.349 -9.529 1.00 55.43 C ATOM 572 O SER A 39 -4.962 14.762 -8.665 1.00 14.44 O ATOM 573 CB SER A 39 -7.088 12.192 -9.790 1.00 55.52 C ATOM 574 OG SER A 39 -7.095 11.001 -10.547 1.00 55.23 O ATOM 0 H SER A 39 -5.213 11.873 -8.237 1.00 3.22 H new ATOM 0 HA SER A 39 -5.457 12.901 -11.009 1.00 11.14 H new ATOM 0 HB2 SER A 39 -7.271 11.971 -8.738 1.00 55.52 H new ATOM 0 HB3 SER A 39 -7.888 12.854 -10.121 1.00 55.52 H new ATOM 0 HG SER A 39 -7.087 10.229 -9.943 1.00 55.23 H new ATOM 579 N GLU A 40 -6.609 15.149 -10.153 1.00 20.02 N ATOM 580 CA GLU A 40 -6.848 16.556 -9.839 1.00 64.43 C ATOM 581 C GLU A 40 -8.292 16.710 -9.345 1.00 22.04 C ATOM 582 O GLU A 40 -8.911 15.729 -8.907 1.00 24.23 O ATOM 583 CB GLU A 40 -6.431 17.460 -11.016 1.00 21.02 C ATOM 584 CG GLU A 40 -7.366 17.446 -12.232 1.00 52.42 C ATOM 585 CD GLU A 40 -6.622 17.803 -13.522 1.00 13.25 C ATOM 586 OE1 GLU A 40 -6.447 18.995 -13.870 1.00 22.23 O ATOM 587 OE2 GLU A 40 -6.241 16.847 -14.243 1.00 5.23 O ATOM 0 H GLU A 40 -7.188 14.818 -10.924 1.00 20.02 H new ATOM 0 HA GLU A 40 -6.215 16.900 -9.021 1.00 64.43 H new ATOM 0 HB2 GLU A 40 -6.353 18.485 -10.653 1.00 21.02 H new ATOM 0 HB3 GLU A 40 -5.435 17.162 -11.344 1.00 21.02 H new ATOM 0 HG2 GLU A 40 -7.817 16.459 -12.333 1.00 52.42 H new ATOM 0 HG3 GLU A 40 -8.180 18.153 -12.074 1.00 52.42 H new ATOM 592 N GLY A 41 -8.813 17.932 -9.307 1.00 51.30 N ATOM 593 CA GLY A 41 -10.228 18.128 -9.054 1.00 60.32 C ATOM 594 C GLY A 41 -10.616 19.583 -9.157 1.00 21.35 C ATOM 595 O GLY A 41 -11.323 19.963 -10.084 1.00 54.32 O ATOM 0 H GLY A 41 -8.280 18.790 -9.447 1.00 51.30 H new ATOM 0 HA2 GLY A 41 -10.810 17.545 -9.768 1.00 60.32 H new ATOM 0 HA3 GLY A 41 -10.475 17.755 -8.060 1.00 60.32 H new ATOM 599 N THR A 42 -10.207 20.369 -8.165 1.00 21.25 N ATOM 600 CA THR A 42 -10.738 21.702 -7.917 1.00 1.14 C ATOM 601 C THR A 42 -9.689 22.534 -7.184 1.00 23.35 C ATOM 602 O THR A 42 -9.283 23.582 -7.681 1.00 34.44 O ATOM 603 CB THR A 42 -12.052 21.599 -7.117 1.00 53.53 C ATOM 604 OG1 THR A 42 -11.981 20.551 -6.160 1.00 33.45 O ATOM 605 CG2 THR A 42 -13.268 21.314 -8.002 1.00 40.41 C ATOM 0 H THR A 42 -9.485 20.091 -7.501 1.00 21.25 H new ATOM 0 HA THR A 42 -10.965 22.199 -8.860 1.00 1.14 H new ATOM 0 HB THR A 42 -12.174 22.570 -6.637 1.00 53.53 H new ATOM 0 HG1 THR A 42 -12.824 20.504 -5.663 1.00 33.45 H new ATOM 0 HG21 THR A 42 -14.163 21.253 -7.382 1.00 40.41 H new ATOM 0 HG22 THR A 42 -13.385 22.117 -8.729 1.00 40.41 H new ATOM 0 HG23 THR A 42 -13.124 20.369 -8.525 1.00 40.41 H new ATOM 613 N PHE A 43 -9.230 22.050 -6.022 1.00 23.31 N ATOM 614 CA PHE A 43 -8.169 22.631 -5.202 1.00 13.42 C ATOM 615 C PHE A 43 -8.351 24.128 -4.906 1.00 41.33 C ATOM 616 O PHE A 43 -7.372 24.856 -4.736 1.00 42.23 O ATOM 617 CB PHE A 43 -6.805 22.306 -5.821 1.00 21.34 C ATOM 618 CG PHE A 43 -6.511 20.829 -6.036 1.00 74.02 C ATOM 619 CD1 PHE A 43 -6.685 19.902 -4.989 1.00 40.54 C ATOM 620 CD2 PHE A 43 -6.000 20.385 -7.268 1.00 55.51 C ATOM 621 CE1 PHE A 43 -6.367 18.545 -5.176 1.00 15.53 C ATOM 622 CE2 PHE A 43 -5.659 19.034 -7.448 1.00 13.52 C ATOM 623 CZ PHE A 43 -5.849 18.108 -6.407 1.00 55.30 C ATOM 0 H PHE A 43 -9.612 21.198 -5.611 1.00 23.31 H new ATOM 0 HA PHE A 43 -8.227 22.166 -4.218 1.00 13.42 H new ATOM 0 HB2 PHE A 43 -6.733 22.815 -6.782 1.00 21.34 H new ATOM 0 HB3 PHE A 43 -6.028 22.722 -5.180 1.00 21.34 H new ATOM 0 HD1 PHE A 43 -7.066 20.236 -4.035 1.00 40.54 H new ATOM 0 HD2 PHE A 43 -5.869 21.085 -8.080 1.00 55.51 H new ATOM 0 HE1 PHE A 43 -6.521 17.839 -4.374 1.00 15.53 H new ATOM 0 HE2 PHE A 43 -5.249 18.705 -8.391 1.00 13.52 H new ATOM 0 HZ PHE A 43 -5.598 17.068 -6.553 1.00 55.30 H new ATOM 632 N ASP A 44 -9.601 24.577 -4.790 1.00 12.53 N ATOM 633 CA ASP A 44 -10.006 25.968 -4.588 1.00 75.43 C ATOM 634 C ASP A 44 -9.577 26.881 -5.744 1.00 24.31 C ATOM 635 O ASP A 44 -9.241 28.048 -5.536 1.00 2.51 O ATOM 636 CB ASP A 44 -9.591 26.462 -3.188 1.00 53.13 C ATOM 637 CG ASP A 44 -10.511 27.562 -2.651 1.00 13.12 C ATOM 638 OD1 ASP A 44 -11.745 27.513 -2.885 1.00 74.43 O ATOM 639 OD2 ASP A 44 -10.046 28.377 -1.820 1.00 75.10 O ATOM 0 H ASP A 44 -10.401 23.946 -4.837 1.00 12.53 H new ATOM 0 HA ASP A 44 -11.095 26.015 -4.610 1.00 75.43 H new ATOM 0 HB2 ASP A 44 -9.595 25.621 -2.495 1.00 53.13 H new ATOM 0 HB3 ASP A 44 -8.568 26.837 -3.228 1.00 53.13 H new ATOM 643 N ALA A 45 -9.633 26.328 -6.959 1.00 3.11 N ATOM 644 CA ALA A 45 -9.182 26.822 -8.256 1.00 74.32 C ATOM 645 C ALA A 45 -7.661 26.737 -8.377 1.00 51.24 C ATOM 646 O ALA A 45 -6.977 27.762 -8.462 1.00 50.24 O ATOM 647 CB ALA A 45 -9.757 28.202 -8.613 1.00 23.31 C ATOM 0 H ALA A 45 -10.051 25.403 -7.065 1.00 3.11 H new ATOM 0 HA ALA A 45 -9.593 26.158 -9.017 1.00 74.32 H new ATOM 0 HB1 ALA A 45 -9.382 28.511 -9.589 1.00 23.31 H new ATOM 0 HB2 ALA A 45 -10.845 28.146 -8.643 1.00 23.31 H new ATOM 0 HB3 ALA A 45 -9.452 28.929 -7.860 1.00 23.31 H new ATOM 653 N ASP A 46 -7.122 25.517 -8.426 1.00 33.21 N ATOM 654 CA ASP A 46 -5.767 25.270 -8.916 1.00 34.34 C ATOM 655 C ASP A 46 -5.718 23.919 -9.634 1.00 34.23 C ATOM 656 O ASP A 46 -6.664 23.132 -9.545 1.00 61.23 O ATOM 657 CB ASP A 46 -4.735 25.355 -7.778 1.00 34.12 C ATOM 658 CG ASP A 46 -3.364 25.866 -8.251 1.00 3.42 C ATOM 659 OD1 ASP A 46 -3.091 25.868 -9.478 1.00 13.43 O ATOM 660 OD2 ASP A 46 -2.588 26.310 -7.369 1.00 13.45 O ATOM 0 H ASP A 46 -7.613 24.674 -8.127 1.00 33.21 H new ATOM 0 HA ASP A 46 -5.502 26.048 -9.632 1.00 34.34 H new ATOM 0 HB2 ASP A 46 -5.114 26.016 -6.999 1.00 34.12 H new ATOM 0 HB3 ASP A 46 -4.615 24.369 -7.329 1.00 34.12 H new ATOM 664 N MET A 47 -4.637 23.645 -10.364 1.00 1.55 N ATOM 665 CA MET A 47 -4.551 22.508 -11.279 1.00 31.42 C ATOM 666 C MET A 47 -3.994 21.284 -10.561 1.00 24.04 C ATOM 667 O MET A 47 -4.702 20.299 -10.377 1.00 24.21 O ATOM 668 CB MET A 47 -3.734 22.896 -12.519 1.00 2.32 C ATOM 669 CG MET A 47 -3.885 21.867 -13.643 1.00 23.23 C ATOM 670 SD MET A 47 -3.336 22.472 -15.262 1.00 2.24 S ATOM 671 CE MET A 47 -4.692 23.620 -15.635 1.00 12.14 C ATOM 0 H MET A 47 -3.789 24.211 -10.336 1.00 1.55 H new ATOM 0 HA MET A 47 -5.549 22.237 -11.623 1.00 31.42 H new ATOM 0 HB2 MET A 47 -4.057 23.874 -12.876 1.00 2.32 H new ATOM 0 HB3 MET A 47 -2.682 22.987 -12.248 1.00 2.32 H new ATOM 0 HG2 MET A 47 -3.315 20.974 -13.386 1.00 23.23 H new ATOM 0 HG3 MET A 47 -4.931 21.568 -13.712 1.00 23.23 H new ATOM 0 HE1 MET A 47 -4.677 23.868 -16.696 1.00 12.14 H new ATOM 0 HE2 MET A 47 -5.644 23.152 -15.385 1.00 12.14 H new ATOM 0 HE3 MET A 47 -4.570 24.530 -15.048 1.00 12.14 H new ATOM 679 N TYR A 48 -2.741 21.352 -10.115 1.00 31.13 N ATOM 680 CA TYR A 48 -2.186 20.418 -9.145 1.00 64.01 C ATOM 681 C TYR A 48 -2.136 21.149 -7.814 1.00 5.53 C ATOM 682 O TYR A 48 -1.959 22.371 -7.802 1.00 34.41 O ATOM 683 CB TYR A 48 -0.780 19.977 -9.571 1.00 65.13 C ATOM 684 CG TYR A 48 -0.797 18.889 -10.621 1.00 61.21 C ATOM 685 CD1 TYR A 48 -0.942 19.223 -11.980 1.00 1.42 C ATOM 686 CD2 TYR A 48 -0.725 17.539 -10.221 1.00 14.35 C ATOM 687 CE1 TYR A 48 -1.015 18.209 -12.949 1.00 61.20 C ATOM 688 CE2 TYR A 48 -0.811 16.517 -11.178 1.00 22.21 C ATOM 689 CZ TYR A 48 -0.957 16.857 -12.539 1.00 54.14 C ATOM 690 OH TYR A 48 -1.038 15.867 -13.459 1.00 33.25 O ATOM 0 H TYR A 48 -2.079 22.065 -10.421 1.00 31.13 H new ATOM 0 HA TYR A 48 -2.798 19.519 -9.072 1.00 64.01 H new ATOM 0 HB2 TYR A 48 -0.236 20.839 -9.957 1.00 65.13 H new ATOM 0 HB3 TYR A 48 -0.235 19.622 -8.696 1.00 65.13 H new ATOM 0 HD1 TYR A 48 -0.997 20.260 -12.278 1.00 1.42 H new ATOM 0 HD2 TYR A 48 -0.604 17.291 -9.177 1.00 14.35 H new ATOM 0 HE1 TYR A 48 -1.114 18.459 -13.995 1.00 61.20 H new ATOM 0 HE2 TYR A 48 -0.766 15.481 -10.876 1.00 22.21 H new ATOM 0 HH TYR A 48 -0.981 14.998 -13.010 1.00 33.25 H new ATOM 699 N LYS A 49 -2.248 20.426 -6.696 1.00 34.13 N ATOM 700 CA LYS A 49 -2.084 21.056 -5.391 1.00 52.43 C ATOM 701 C LYS A 49 -1.623 20.085 -4.312 1.00 1.32 C ATOM 702 O LYS A 49 -1.080 20.535 -3.302 1.00 35.32 O ATOM 703 CB LYS A 49 -3.406 21.754 -5.012 1.00 44.50 C ATOM 704 CG LYS A 49 -3.237 22.913 -4.028 1.00 40.51 C ATOM 705 CD LYS A 49 -2.479 24.114 -4.618 1.00 24.35 C ATOM 706 CE LYS A 49 -2.091 25.094 -3.512 1.00 74.03 C ATOM 707 NZ LYS A 49 -3.227 25.921 -3.069 1.00 32.22 N ATOM 0 H LYS A 49 -2.447 19.426 -6.670 1.00 34.13 H new ATOM 0 HA LYS A 49 -1.286 21.795 -5.462 1.00 52.43 H new ATOM 0 HB2 LYS A 49 -3.881 22.127 -5.919 1.00 44.50 H new ATOM 0 HB3 LYS A 49 -4.082 21.018 -4.578 1.00 44.50 H new ATOM 0 HG2 LYS A 49 -4.221 23.243 -3.695 1.00 40.51 H new ATOM 0 HG3 LYS A 49 -2.705 22.556 -3.146 1.00 40.51 H new ATOM 0 HD2 LYS A 49 -1.585 23.769 -5.137 1.00 24.35 H new ATOM 0 HD3 LYS A 49 -3.102 24.618 -5.357 1.00 24.35 H new ATOM 0 HE2 LYS A 49 -1.696 24.539 -2.661 1.00 74.03 H new ATOM 0 HE3 LYS A 49 -1.291 25.742 -3.869 1.00 74.03 H new ATOM 0 HZ1 LYS A 49 -2.913 26.569 -2.319 1.00 32.22 H new ATOM 0 HZ2 LYS A 49 -3.589 26.472 -3.873 1.00 32.22 H new ATOM 0 HZ3 LYS A 49 -3.982 25.306 -2.702 1.00 32.22 H new ATOM 717 N THR A 50 -1.752 18.782 -4.526 1.00 51.21 N ATOM 718 CA THR A 50 -1.532 17.766 -3.516 1.00 31.41 C ATOM 719 C THR A 50 -0.100 17.221 -3.621 1.00 3.12 C ATOM 720 O THR A 50 0.121 16.088 -4.064 1.00 71.30 O ATOM 721 CB THR A 50 -2.672 16.749 -3.698 1.00 22.11 C ATOM 722 OG1 THR A 50 -3.902 17.386 -3.402 1.00 35.22 O ATOM 723 CG2 THR A 50 -2.577 15.520 -2.789 1.00 13.21 C ATOM 0 H THR A 50 -2.020 18.397 -5.432 1.00 51.21 H new ATOM 0 HA THR A 50 -1.578 18.132 -2.490 1.00 31.41 H new ATOM 0 HB THR A 50 -2.599 16.404 -4.729 1.00 22.11 H new ATOM 0 HG1 THR A 50 -4.374 17.590 -4.236 1.00 35.22 H new ATOM 0 HG21 THR A 50 -3.420 14.857 -2.984 1.00 13.21 H new ATOM 0 HG22 THR A 50 -1.645 14.991 -2.989 1.00 13.21 H new ATOM 0 HG23 THR A 50 -2.598 15.836 -1.746 1.00 13.21 H new ATOM 731 N SER A 51 0.887 18.026 -3.220 1.00 55.12 N ATOM 732 CA SER A 51 2.272 17.611 -3.023 1.00 65.20 C ATOM 733 C SER A 51 2.921 18.462 -1.934 1.00 34.24 C ATOM 734 O SER A 51 2.380 19.497 -1.529 1.00 41.34 O ATOM 735 CB SER A 51 3.096 17.772 -4.307 1.00 25.15 C ATOM 736 OG SER A 51 2.666 16.896 -5.324 1.00 34.11 O ATOM 0 H SER A 51 0.736 19.014 -3.018 1.00 55.12 H new ATOM 0 HA SER A 51 2.258 16.560 -2.736 1.00 65.20 H new ATOM 0 HB2 SER A 51 3.021 18.801 -4.659 1.00 25.15 H new ATOM 0 HB3 SER A 51 4.148 17.586 -4.089 1.00 25.15 H new ATOM 0 HG SER A 51 1.877 16.402 -5.018 1.00 34.11 H new ATOM 741 N ASP A 52 4.128 18.051 -1.533 1.00 11.25 N ATOM 742 CA ASP A 52 4.942 18.628 -0.466 1.00 50.53 C ATOM 743 C ASP A 52 4.168 18.640 0.868 1.00 53.24 C ATOM 744 O ASP A 52 3.129 17.982 0.966 1.00 21.01 O ATOM 745 CB ASP A 52 5.529 19.971 -0.942 1.00 50.10 C ATOM 746 CG ASP A 52 6.808 20.407 -0.228 1.00 11.24 C ATOM 747 OD1 ASP A 52 7.201 19.829 0.813 1.00 32.01 O ATOM 748 OD2 ASP A 52 7.429 21.371 -0.734 1.00 62.42 O ATOM 0 H ASP A 52 4.589 17.256 -1.975 1.00 11.25 H new ATOM 0 HA ASP A 52 5.810 18.008 -0.243 1.00 50.53 H new ATOM 0 HB2 ASP A 52 5.733 19.903 -2.011 1.00 50.10 H new ATOM 0 HB3 ASP A 52 4.775 20.747 -0.810 1.00 50.10 H new ATOM 752 N ILE A 53 4.695 19.302 1.900 1.00 11.43 N ATOM 753 CA ILE A 53 4.306 19.281 3.312 1.00 41.13 C ATOM 754 C ILE A 53 4.185 17.842 3.865 1.00 71.14 C ATOM 755 O ILE A 53 4.651 16.892 3.234 1.00 55.33 O ATOM 756 CB ILE A 53 3.148 20.291 3.577 1.00 12.51 C ATOM 757 CG1 ILE A 53 3.060 20.814 5.028 1.00 34.14 C ATOM 758 CG2 ILE A 53 1.751 19.777 3.184 1.00 23.13 C ATOM 759 CD1 ILE A 53 4.369 21.414 5.548 1.00 14.22 C ATOM 0 H ILE A 53 5.485 19.930 1.752 1.00 11.43 H new ATOM 0 HA ILE A 53 5.107 19.668 3.942 1.00 41.13 H new ATOM 0 HB ILE A 53 3.431 21.113 2.920 1.00 12.51 H new ATOM 0 HG12 ILE A 53 2.277 21.570 5.085 1.00 34.14 H new ATOM 0 HG13 ILE A 53 2.761 19.995 5.682 1.00 34.14 H new ATOM 0 HG21 ILE A 53 1.007 20.543 3.402 1.00 23.13 H new ATOM 0 HG22 ILE A 53 1.734 19.548 2.118 1.00 23.13 H new ATOM 0 HG23 ILE A 53 1.522 18.876 3.753 1.00 23.13 H new ATOM 0 HD11 ILE A 53 4.229 21.759 6.572 1.00 14.22 H new ATOM 0 HD12 ILE A 53 5.152 20.656 5.524 1.00 14.22 H new ATOM 0 HD13 ILE A 53 4.659 22.255 4.918 1.00 14.22 H new ATOM 770 N ALA A 54 3.755 17.670 5.116 1.00 34.35 N ATOM 771 CA ALA A 54 3.619 16.379 5.803 1.00 12.33 C ATOM 772 C ALA A 54 2.566 16.456 6.918 1.00 71.43 C ATOM 773 O ALA A 54 2.573 15.654 7.854 1.00 13.41 O ATOM 774 CB ALA A 54 4.988 15.956 6.367 1.00 40.50 C ATOM 0 H ALA A 54 3.480 18.457 5.704 1.00 34.35 H new ATOM 0 HA ALA A 54 3.280 15.630 5.088 1.00 12.33 H new ATOM 0 HB1 ALA A 54 4.891 14.998 6.878 1.00 40.50 H new ATOM 0 HB2 ALA A 54 5.704 15.861 5.551 1.00 40.50 H new ATOM 0 HB3 ALA A 54 5.339 16.709 7.072 1.00 40.50 H new ATOM 780 N LEU A 55 1.729 17.493 6.883 1.00 71.42 N ATOM 781 CA LEU A 55 0.714 17.842 7.864 1.00 20.31 C ATOM 782 C LEU A 55 -0.593 18.184 7.147 1.00 4.23 C ATOM 783 O LEU A 55 -1.484 18.781 7.747 1.00 15.25 O ATOM 784 CB LEU A 55 1.230 18.988 8.765 1.00 33.41 C ATOM 785 CG LEU A 55 2.303 18.474 9.748 1.00 52.40 C ATOM 786 CD1 LEU A 55 3.755 18.718 9.319 1.00 51.40 C ATOM 787 CD2 LEU A 55 2.105 19.044 11.153 1.00 75.40 C ATOM 0 H LEU A 55 1.748 18.157 6.109 1.00 71.42 H new ATOM 0 HA LEU A 55 0.507 16.996 8.519 1.00 20.31 H new ATOM 0 HB2 LEU A 55 1.648 19.782 8.147 1.00 33.41 H new ATOM 0 HB3 LEU A 55 0.399 19.421 9.321 1.00 33.41 H new ATOM 0 HG LEU A 55 2.151 17.395 9.745 1.00 52.40 H new ATOM 0 HD11 LEU A 55 4.430 18.320 10.077 1.00 51.40 H new ATOM 0 HD12 LEU A 55 3.942 18.219 8.368 1.00 51.40 H new ATOM 0 HD13 LEU A 55 3.926 19.789 9.207 1.00 51.40 H new ATOM 0 HD21 LEU A 55 2.880 18.658 11.815 1.00 75.40 H new ATOM 0 HD22 LEU A 55 2.167 20.132 11.117 1.00 75.40 H new ATOM 0 HD23 LEU A 55 1.126 18.749 11.531 1.00 75.40 H new ATOM 798 N ASP A 56 -0.714 17.879 5.856 1.00 44.12 N ATOM 799 CA ASP A 56 -1.990 17.720 5.169 1.00 34.02 C ATOM 800 C ASP A 56 -2.625 16.387 5.581 1.00 23.12 C ATOM 801 O ASP A 56 -2.023 15.616 6.325 1.00 61.32 O ATOM 802 CB ASP A 56 -1.779 17.796 3.649 1.00 73.11 C ATOM 803 CG ASP A 56 -0.921 16.662 3.076 1.00 0.22 C ATOM 804 OD1 ASP A 56 0.245 16.542 3.510 1.00 72.14 O ATOM 805 OD2 ASP A 56 -1.390 15.966 2.139 1.00 53.20 O ATOM 0 H ASP A 56 0.091 17.733 5.247 1.00 44.12 H new ATOM 0 HA ASP A 56 -2.668 18.526 5.451 1.00 34.02 H new ATOM 0 HB2 ASP A 56 -2.752 17.784 3.157 1.00 73.11 H new ATOM 0 HB3 ASP A 56 -1.310 18.750 3.406 1.00 73.11 H new ATOM 809 N GLN A 57 -3.863 16.151 5.136 1.00 75.23 N ATOM 810 CA GLN A 57 -4.699 14.959 5.309 1.00 3.54 C ATOM 811 C GLN A 57 -4.763 14.312 6.709 1.00 1.35 C ATOM 812 O GLN A 57 -5.206 13.172 6.834 1.00 43.50 O ATOM 813 CB GLN A 57 -4.409 13.940 4.184 1.00 13.45 C ATOM 814 CG GLN A 57 -5.686 13.544 3.426 1.00 11.45 C ATOM 815 CD GLN A 57 -6.784 12.949 4.314 1.00 44.31 C ATOM 816 OE1 GLN A 57 -6.805 11.635 4.471 1.00 51.32 O flip ATOM 817 NE2 GLN A 57 -7.623 13.654 4.874 1.00 44.10 N flip ATOM 0 H GLN A 57 -4.353 16.861 4.592 1.00 75.23 H new ATOM 0 HA GLN A 57 -5.718 15.337 5.222 1.00 3.54 H new ATOM 0 HB2 GLN A 57 -3.689 14.366 3.485 1.00 13.45 H new ATOM 0 HB3 GLN A 57 -3.949 13.049 4.611 1.00 13.45 H new ATOM 0 HG2 GLN A 57 -6.082 14.424 2.919 1.00 11.45 H new ATOM 0 HG3 GLN A 57 -5.427 12.820 2.653 1.00 11.45 H new ATOM 0 HE21 GLN A 57 -7.603 14.666 4.750 1.00 44.10 H new ATOM 0 HE22 GLN A 57 -8.338 13.226 5.462 1.00 44.10 H new ATOM 824 N ILE A 58 -4.334 14.987 7.776 1.00 33.13 N ATOM 825 CA ILE A 58 -4.255 14.422 9.123 1.00 14.32 C ATOM 826 C ILE A 58 -5.188 15.231 10.022 1.00 43.22 C ATOM 827 O ILE A 58 -6.130 14.684 10.597 1.00 13.33 O ATOM 828 CB ILE A 58 -2.787 14.398 9.619 1.00 42.34 C ATOM 829 CG1 ILE A 58 -1.911 13.397 8.828 1.00 62.04 C ATOM 830 CG2 ILE A 58 -2.707 14.059 11.121 1.00 63.13 C ATOM 831 CD1 ILE A 58 -0.431 13.749 8.937 1.00 31.41 C ATOM 0 H ILE A 58 -4.026 15.958 7.727 1.00 33.13 H new ATOM 0 HA ILE A 58 -4.581 13.382 9.137 1.00 14.32 H new ATOM 0 HB ILE A 58 -2.398 15.402 9.450 1.00 42.34 H new ATOM 0 HG12 ILE A 58 -2.076 12.388 9.206 1.00 62.04 H new ATOM 0 HG13 ILE A 58 -2.211 13.397 7.780 1.00 62.04 H new ATOM 0 HG21 ILE A 58 -1.664 14.050 11.437 1.00 63.13 H new ATOM 0 HG22 ILE A 58 -3.253 14.809 11.693 1.00 63.13 H new ATOM 0 HG23 ILE A 58 -3.147 13.077 11.296 1.00 63.13 H new ATOM 0 HD11 ILE A 58 0.157 13.027 8.371 1.00 31.41 H new ATOM 0 HD12 ILE A 58 -0.264 14.748 8.535 1.00 31.41 H new ATOM 0 HD13 ILE A 58 -0.127 13.724 9.983 1.00 31.41 H new ATOM 842 N GLN A 59 -4.896 16.524 10.175 1.00 40.32 N ATOM 843 CA GLN A 59 -5.315 17.365 11.270 1.00 55.51 C ATOM 844 C GLN A 59 -5.830 18.695 10.734 1.00 51.10 C ATOM 845 O GLN A 59 -5.060 19.630 10.492 1.00 11.13 O ATOM 846 CB GLN A 59 -4.163 17.523 12.275 1.00 2.11 C ATOM 847 CG GLN A 59 -2.770 17.854 11.701 1.00 4.24 C ATOM 848 CD GLN A 59 -1.636 17.589 12.694 1.00 0.55 C ATOM 849 OE1 GLN A 59 -1.630 18.084 13.817 1.00 53.32 O ATOM 850 NE2 GLN A 59 -0.634 16.810 12.304 1.00 33.02 N ATOM 0 H GLN A 59 -4.329 17.029 9.494 1.00 40.32 H new ATOM 0 HA GLN A 59 -6.142 16.902 11.808 1.00 55.51 H new ATOM 0 HB2 GLN A 59 -4.434 18.309 12.979 1.00 2.11 H new ATOM 0 HB3 GLN A 59 -4.083 16.598 12.846 1.00 2.11 H new ATOM 0 HG2 GLN A 59 -2.604 17.262 10.801 1.00 4.24 H new ATOM 0 HG3 GLN A 59 -2.746 18.902 11.402 1.00 4.24 H new ATOM 0 HE21 GLN A 59 -0.641 16.399 11.370 1.00 33.02 H new ATOM 0 HE22 GLN A 59 0.142 16.622 12.938 1.00 33.02 H new ATOM 857 N GLY A 60 -7.135 18.771 10.498 1.00 33.13 N ATOM 858 CA GLY A 60 -7.805 19.919 9.909 1.00 24.41 C ATOM 859 C GLY A 60 -8.017 19.708 8.420 1.00 1.42 C ATOM 860 O GLY A 60 -9.099 20.004 7.911 1.00 1.33 O ATOM 0 H GLY A 60 -7.775 18.008 10.720 1.00 33.13 H new ATOM 0 HA2 GLY A 60 -8.765 20.078 10.400 1.00 24.41 H new ATOM 0 HA3 GLY A 60 -7.211 20.818 10.073 1.00 24.41 H new ATOM 864 N ASN A 61 -7.000 19.189 7.727 1.00 20.22 N ATOM 865 CA ASN A 61 -7.047 19.099 6.269 1.00 63.13 C ATOM 866 C ASN A 61 -7.703 17.784 5.867 1.00 20.41 C ATOM 867 O ASN A 61 -7.400 16.745 6.463 1.00 73.13 O ATOM 868 CB ASN A 61 -5.660 19.290 5.656 1.00 21.42 C ATOM 869 CG ASN A 61 -5.737 19.763 4.207 1.00 71.34 C ATOM 870 OD1 ASN A 61 -6.760 19.677 3.531 1.00 44.54 O ATOM 871 ND2 ASN A 61 -4.651 20.322 3.713 1.00 3.21 N ATOM 0 H ASN A 61 -6.144 18.829 8.148 1.00 20.22 H new ATOM 0 HA ASN A 61 -7.657 19.910 5.870 1.00 63.13 H new ATOM 0 HB2 ASN A 61 -5.100 20.016 6.245 1.00 21.42 H new ATOM 0 HB3 ASN A 61 -5.110 18.350 5.702 1.00 21.42 H new ATOM 0 HD21 ASN A 61 -4.654 20.688 2.761 1.00 3.21 H new ATOM 0 HD22 ASN A 61 -3.807 20.388 4.282 1.00 3.21 H new ATOM 877 N LYS A 62 -8.654 17.828 4.933 1.00 1.23 N ATOM 878 CA LYS A 62 -9.642 16.775 4.701 1.00 40.32 C ATOM 879 C LYS A 62 -9.808 16.523 3.204 1.00 51.51 C ATOM 880 O LYS A 62 -9.481 17.396 2.401 1.00 3.32 O ATOM 881 CB LYS A 62 -10.973 17.203 5.356 1.00 41.13 C ATOM 882 CG LYS A 62 -10.949 16.982 6.878 1.00 34.12 C ATOM 883 CD LYS A 62 -12.159 17.574 7.611 1.00 31.05 C ATOM 884 CE LYS A 62 -12.174 17.054 9.054 1.00 71.40 C ATOM 885 NZ LYS A 62 -13.197 17.709 9.895 1.00 0.15 N ATOM 0 H LYS A 62 -8.761 18.620 4.299 1.00 1.23 H new ATOM 0 HA LYS A 62 -9.310 15.838 5.148 1.00 40.32 H new ATOM 0 HB2 LYS A 62 -11.163 18.255 5.143 1.00 41.13 H new ATOM 0 HB3 LYS A 62 -11.794 16.636 4.918 1.00 41.13 H new ATOM 0 HG2 LYS A 62 -10.903 15.912 7.079 1.00 34.12 H new ATOM 0 HG3 LYS A 62 -10.039 17.423 7.285 1.00 34.12 H new ATOM 0 HD2 LYS A 62 -12.107 18.663 7.604 1.00 31.05 H new ATOM 0 HD3 LYS A 62 -13.081 17.295 7.101 1.00 31.05 H new ATOM 0 HE2 LYS A 62 -12.354 15.979 9.045 1.00 71.40 H new ATOM 0 HE3 LYS A 62 -11.192 17.209 9.500 1.00 71.40 H new ATOM 0 HZ1 LYS A 62 -13.159 17.316 10.857 1.00 0.15 H new ATOM 0 HZ2 LYS A 62 -13.014 18.732 9.931 1.00 0.15 H new ATOM 0 HZ3 LYS A 62 -14.140 17.540 9.490 1.00 0.15 H new ATOM 895 N ASP A 63 -10.354 15.349 2.865 1.00 23.43 N ATOM 896 CA ASP A 63 -10.411 14.730 1.528 1.00 55.13 C ATOM 897 C ASP A 63 -9.020 14.572 0.905 1.00 20.31 C ATOM 898 O ASP A 63 -8.019 15.026 1.463 1.00 75.33 O ATOM 899 CB ASP A 63 -11.394 15.447 0.575 1.00 60.13 C ATOM 900 CG ASP A 63 -12.851 15.038 0.773 1.00 54.31 C ATOM 901 OD1 ASP A 63 -13.319 15.013 1.937 1.00 60.02 O ATOM 902 OD2 ASP A 63 -13.555 14.873 -0.250 1.00 35.41 O ATOM 0 H ASP A 63 -10.802 14.760 3.568 1.00 23.43 H new ATOM 0 HA ASP A 63 -10.810 13.727 1.678 1.00 55.13 H new ATOM 0 HB2 ASP A 63 -11.306 16.524 0.719 1.00 60.13 H new ATOM 0 HB3 ASP A 63 -11.104 15.239 -0.455 1.00 60.13 H new ATOM 906 N PHE A 64 -8.948 13.891 -0.239 1.00 62.43 N ATOM 907 CA PHE A 64 -7.768 13.750 -1.084 1.00 15.25 C ATOM 908 C PHE A 64 -8.238 13.569 -2.540 1.00 55.30 C ATOM 909 O PHE A 64 -9.427 13.310 -2.773 1.00 60.14 O ATOM 910 CB PHE A 64 -6.909 12.567 -0.588 1.00 13.35 C ATOM 911 CG PHE A 64 -7.676 11.329 -0.155 1.00 35.22 C ATOM 912 CD1 PHE A 64 -8.312 10.512 -1.102 1.00 54.54 C ATOM 913 CD2 PHE A 64 -7.755 10.999 1.209 1.00 52.31 C ATOM 914 CE1 PHE A 64 -9.025 9.374 -0.686 1.00 11.24 C ATOM 915 CE2 PHE A 64 -8.454 9.855 1.629 1.00 13.25 C ATOM 916 CZ PHE A 64 -9.104 9.048 0.678 1.00 63.40 C ATOM 0 H PHE A 64 -9.756 13.398 -0.619 1.00 62.43 H new ATOM 0 HA PHE A 64 -7.138 14.638 -1.034 1.00 15.25 H new ATOM 0 HB2 PHE A 64 -6.220 12.284 -1.384 1.00 13.35 H new ATOM 0 HB3 PHE A 64 -6.304 12.909 0.252 1.00 13.35 H new ATOM 0 HD1 PHE A 64 -8.254 10.758 -2.152 1.00 54.54 H new ATOM 0 HD2 PHE A 64 -7.274 11.631 1.941 1.00 52.31 H new ATOM 0 HE1 PHE A 64 -9.514 8.748 -1.418 1.00 11.24 H new ATOM 0 HE2 PHE A 64 -8.492 9.597 2.677 1.00 13.25 H new ATOM 0 HZ PHE A 64 -9.662 8.180 0.996 1.00 63.40 H new ATOM 925 N PRO A 65 -7.356 13.719 -3.544 1.00 31.35 N ATOM 926 CA PRO A 65 -7.655 13.342 -4.918 1.00 33.11 C ATOM 927 C PRO A 65 -7.702 11.819 -5.051 1.00 24.04 C ATOM 928 O PRO A 65 -7.095 11.093 -4.264 1.00 20.31 O ATOM 929 CB PRO A 65 -6.531 13.947 -5.763 1.00 34.24 C ATOM 930 CG PRO A 65 -5.344 13.974 -4.803 1.00 53.14 C ATOM 931 CD PRO A 65 -5.998 14.232 -3.444 1.00 73.32 C ATOM 0 HA PRO A 65 -8.628 13.708 -5.245 1.00 33.11 H new ATOM 0 HB2 PRO A 65 -6.321 13.342 -6.645 1.00 34.24 H new ATOM 0 HB3 PRO A 65 -6.786 14.946 -6.115 1.00 34.24 H new ATOM 0 HG2 PRO A 65 -4.796 13.032 -4.814 1.00 53.14 H new ATOM 0 HG3 PRO A 65 -4.634 14.759 -5.063 1.00 53.14 H new ATOM 0 HD2 PRO A 65 -5.450 13.730 -2.647 1.00 73.32 H new ATOM 0 HD3 PRO A 65 -6.000 15.296 -3.209 1.00 73.32 H new ATOM 936 N GLU A 66 -8.366 11.332 -6.095 1.00 55.13 N ATOM 937 CA GLU A 66 -8.279 9.977 -6.600 1.00 43.34 C ATOM 938 C GLU A 66 -6.862 9.667 -7.124 1.00 32.02 C ATOM 939 O GLU A 66 -5.916 10.451 -6.949 1.00 4.21 O ATOM 940 CB GLU A 66 -9.383 9.822 -7.666 1.00 71.41 C ATOM 941 CG GLU A 66 -10.313 8.639 -7.378 1.00 44.50 C ATOM 942 CD GLU A 66 -9.680 7.274 -7.688 1.00 41.24 C ATOM 943 OE1 GLU A 66 -9.178 7.112 -8.821 1.00 71.32 O ATOM 944 OE2 GLU A 66 -9.623 6.400 -6.794 1.00 61.24 O ATOM 0 H GLU A 66 -9.012 11.907 -6.636 1.00 55.13 H new ATOM 0 HA GLU A 66 -8.444 9.244 -5.811 1.00 43.34 H new ATOM 0 HB2 GLU A 66 -9.970 10.739 -7.712 1.00 71.41 H new ATOM 0 HB3 GLU A 66 -8.923 9.688 -8.645 1.00 71.41 H new ATOM 0 HG2 GLU A 66 -10.607 8.665 -6.329 1.00 44.50 H new ATOM 0 HG3 GLU A 66 -11.223 8.751 -7.967 1.00 44.50 H new ATOM 949 N ILE A 67 -6.700 8.503 -7.747 1.00 62.44 N ATOM 950 CA ILE A 67 -5.470 8.050 -8.386 1.00 33.25 C ATOM 951 C ILE A 67 -5.671 7.991 -9.898 1.00 54.14 C ATOM 952 O ILE A 67 -6.792 8.089 -10.389 1.00 42.43 O ATOM 953 CB ILE A 67 -5.007 6.691 -7.808 1.00 15.53 C ATOM 954 CG1 ILE A 67 -6.152 5.652 -7.804 1.00 32.44 C ATOM 955 CG2 ILE A 67 -4.383 6.911 -6.420 1.00 2.43 C ATOM 956 CD1 ILE A 67 -5.693 4.256 -7.392 1.00 71.30 C ATOM 0 H ILE A 67 -7.455 7.821 -7.823 1.00 62.44 H new ATOM 0 HA ILE A 67 -4.674 8.764 -8.175 1.00 33.25 H new ATOM 0 HB ILE A 67 -4.238 6.267 -8.453 1.00 15.53 H new ATOM 0 HG12 ILE A 67 -6.935 5.986 -7.123 1.00 32.44 H new ATOM 0 HG13 ILE A 67 -6.594 5.604 -8.799 1.00 32.44 H new ATOM 0 HG21 ILE A 67 -4.057 5.954 -6.012 1.00 2.43 H new ATOM 0 HG22 ILE A 67 -3.526 7.579 -6.508 1.00 2.43 H new ATOM 0 HG23 ILE A 67 -5.123 7.356 -5.755 1.00 2.43 H new ATOM 0 HD11 ILE A 67 -6.543 3.574 -7.409 1.00 71.30 H new ATOM 0 HD12 ILE A 67 -4.931 3.904 -8.087 1.00 71.30 H new ATOM 0 HD13 ILE A 67 -5.277 4.292 -6.385 1.00 71.30 H new ATOM 967 N GLN A 68 -4.585 7.791 -10.634 1.00 41.20 N ATOM 968 CA GLN A 68 -4.617 7.416 -12.033 1.00 41.43 C ATOM 969 C GLN A 68 -3.742 6.188 -12.192 1.00 2.45 C ATOM 970 O GLN A 68 -2.663 6.106 -11.594 1.00 33.03 O ATOM 971 CB GLN A 68 -4.180 8.582 -12.926 1.00 22.03 C ATOM 972 CG GLN A 68 -5.389 9.433 -13.326 1.00 2.42 C ATOM 973 CD GLN A 68 -5.012 10.796 -13.889 1.00 72.12 C ATOM 974 OE1 GLN A 68 -5.210 11.086 -15.064 1.00 21.14 O ATOM 975 NE2 GLN A 68 -4.470 11.689 -13.083 1.00 14.33 N ATOM 0 H GLN A 68 -3.640 7.888 -10.263 1.00 41.20 H new ATOM 0 HA GLN A 68 -5.631 7.175 -12.352 1.00 41.43 H new ATOM 0 HB2 GLN A 68 -3.452 9.199 -12.399 1.00 22.03 H new ATOM 0 HB3 GLN A 68 -3.686 8.199 -13.819 1.00 22.03 H new ATOM 0 HG2 GLN A 68 -5.975 8.891 -14.069 1.00 2.42 H new ATOM 0 HG3 GLN A 68 -6.029 9.573 -12.455 1.00 2.42 H new ATOM 0 HE21 GLN A 68 -4.302 11.457 -12.104 1.00 14.33 H new ATOM 0 HE22 GLN A 68 -4.219 12.612 -13.439 1.00 14.33 H new ATOM 982 N LEU A 69 -4.251 5.230 -12.959 1.00 71.00 N ATOM 983 CA LEU A 69 -3.605 3.985 -13.339 1.00 70.50 C ATOM 984 C LEU A 69 -4.365 3.359 -14.515 1.00 62.13 C ATOM 985 O LEU A 69 -5.315 3.942 -15.049 1.00 65.32 O ATOM 986 CB LEU A 69 -3.443 3.031 -12.130 1.00 75.21 C ATOM 987 CG LEU A 69 -4.654 2.208 -11.649 1.00 72.44 C ATOM 988 CD1 LEU A 69 -4.270 1.513 -10.334 1.00 52.01 C ATOM 989 CD2 LEU A 69 -5.928 3.030 -11.418 1.00 21.25 C ATOM 0 H LEU A 69 -5.187 5.311 -13.356 1.00 71.00 H new ATOM 0 HA LEU A 69 -2.588 4.189 -13.674 1.00 70.50 H new ATOM 0 HB2 LEU A 69 -2.645 2.329 -12.372 1.00 75.21 H new ATOM 0 HB3 LEU A 69 -3.097 3.628 -11.286 1.00 75.21 H new ATOM 0 HG LEU A 69 -4.889 1.501 -12.444 1.00 72.44 H new ATOM 0 HD11 LEU A 69 -5.113 0.924 -9.974 1.00 52.01 H new ATOM 0 HD12 LEU A 69 -3.416 0.858 -10.505 1.00 52.01 H new ATOM 0 HD13 LEU A 69 -4.008 2.264 -9.589 1.00 52.01 H new ATOM 0 HD21 LEU A 69 -6.729 2.372 -11.081 1.00 21.25 H new ATOM 0 HD22 LEU A 69 -5.739 3.789 -10.659 1.00 21.25 H new ATOM 0 HD23 LEU A 69 -6.223 3.514 -12.349 1.00 21.25 H new ATOM 1000 N ASP A 70 -3.892 2.190 -14.942 1.00 45.22 N ATOM 1001 CA ASP A 70 -4.471 1.358 -16.003 1.00 65.54 C ATOM 1002 C ASP A 70 -5.769 0.686 -15.528 1.00 11.34 C ATOM 1003 O ASP A 70 -6.161 0.857 -14.377 1.00 4.04 O ATOM 1004 CB ASP A 70 -3.441 0.295 -16.380 1.00 5.11 C ATOM 1005 CG ASP A 70 -3.477 -0.091 -17.855 1.00 70.12 C ATOM 1006 OD1 ASP A 70 -4.447 -0.739 -18.311 1.00 2.25 O ATOM 1007 OD2 ASP A 70 -2.451 0.144 -18.527 1.00 22.44 O ATOM 0 H ASP A 70 -3.052 1.774 -14.539 1.00 45.22 H new ATOM 0 HA ASP A 70 -4.717 1.979 -16.864 1.00 65.54 H new ATOM 0 HB2 ASP A 70 -2.445 0.662 -16.133 1.00 5.11 H new ATOM 0 HB3 ASP A 70 -3.612 -0.596 -15.775 1.00 5.11 H new ATOM 1011 N ASN A 71 -6.413 -0.146 -16.354 1.00 73.21 N ATOM 1012 CA ASN A 71 -7.329 -1.145 -15.809 1.00 44.23 C ATOM 1013 C ASN A 71 -6.493 -2.335 -15.343 1.00 75.40 C ATOM 1014 O ASN A 71 -6.252 -3.296 -16.081 1.00 4.43 O ATOM 1015 CB ASN A 71 -8.382 -1.598 -16.811 1.00 0.33 C ATOM 1016 CG ASN A 71 -9.443 -2.417 -16.083 1.00 0.34 C ATOM 1017 OD1 ASN A 71 -10.518 -1.910 -15.805 1.00 3.31 O ATOM 1018 ND2 ASN A 71 -9.174 -3.662 -15.737 1.00 60.52 N ATOM 0 H ASN A 71 -6.320 -0.148 -17.370 1.00 73.21 H new ATOM 0 HA ASN A 71 -7.879 -0.697 -14.982 1.00 44.23 H new ATOM 0 HB2 ASN A 71 -8.839 -0.734 -17.293 1.00 0.33 H new ATOM 0 HB3 ASN A 71 -7.920 -2.195 -17.598 1.00 0.33 H new ATOM 0 HD21 ASN A 71 -9.868 -4.212 -15.231 1.00 60.52 H new ATOM 0 HD22 ASN A 71 -8.272 -4.074 -15.975 1.00 60.52 H new ATOM 1024 N ILE A 72 -6.023 -2.261 -14.112 1.00 72.32 N ATOM 1025 CA ILE A 72 -5.341 -3.359 -13.449 1.00 21.55 C ATOM 1026 C ILE A 72 -6.419 -4.126 -12.710 1.00 44.40 C ATOM 1027 O ILE A 72 -7.112 -3.562 -11.866 1.00 74.24 O ATOM 1028 CB ILE A 72 -4.224 -2.873 -12.510 1.00 34.45 C ATOM 1029 CG1 ILE A 72 -3.325 -1.814 -13.180 1.00 23.24 C ATOM 1030 CG2 ILE A 72 -3.410 -4.079 -12.019 1.00 21.30 C ATOM 1031 CD1 ILE A 72 -2.245 -1.276 -12.244 1.00 51.04 C ATOM 0 H ILE A 72 -6.105 -1.424 -13.535 1.00 72.32 H new ATOM 0 HA ILE A 72 -4.830 -3.995 -14.171 1.00 21.55 H new ATOM 0 HB ILE A 72 -4.682 -2.382 -11.651 1.00 34.45 H new ATOM 0 HG12 ILE A 72 -2.852 -2.250 -14.060 1.00 23.24 H new ATOM 0 HG13 ILE A 72 -3.943 -0.986 -13.527 1.00 23.24 H new ATOM 0 HG21 ILE A 72 -2.618 -3.737 -11.353 1.00 21.30 H new ATOM 0 HG22 ILE A 72 -4.064 -4.765 -11.481 1.00 21.30 H new ATOM 0 HG23 ILE A 72 -2.969 -4.593 -12.873 1.00 21.30 H new ATOM 0 HD11 ILE A 72 -1.644 -0.535 -12.770 1.00 51.04 H new ATOM 0 HD12 ILE A 72 -2.714 -0.813 -11.376 1.00 51.04 H new ATOM 0 HD13 ILE A 72 -1.606 -2.096 -11.917 1.00 51.04 H new ATOM 1042 N ASP A 73 -6.554 -5.405 -13.040 1.00 55.34 N ATOM 1043 CA ASP A 73 -7.490 -6.275 -12.351 1.00 31.33 C ATOM 1044 C ASP A 73 -6.722 -7.077 -11.317 1.00 71.12 C ATOM 1045 O ASP A 73 -5.821 -7.841 -11.671 1.00 31.34 O ATOM 1046 CB ASP A 73 -8.239 -7.178 -13.316 1.00 13.11 C ATOM 1047 CG ASP A 73 -9.364 -7.847 -12.537 1.00 43.01 C ATOM 1048 OD1 ASP A 73 -10.386 -7.152 -12.315 1.00 41.21 O ATOM 1049 OD2 ASP A 73 -9.173 -8.988 -12.070 1.00 1.03 O ATOM 0 H ASP A 73 -6.024 -5.860 -13.783 1.00 55.34 H new ATOM 0 HA ASP A 73 -8.250 -5.670 -11.856 1.00 31.33 H new ATOM 0 HB2 ASP A 73 -8.640 -6.600 -14.149 1.00 13.11 H new ATOM 0 HB3 ASP A 73 -7.569 -7.926 -13.740 1.00 13.11 H new ATOM 1053 N TYR A 74 -6.990 -6.827 -10.039 1.00 42.05 N ATOM 1054 CA TYR A 74 -6.118 -7.283 -8.969 1.00 11.12 C ATOM 1055 C TYR A 74 -6.177 -8.801 -8.794 1.00 35.22 C ATOM 1056 O TYR A 74 -5.189 -9.394 -8.361 1.00 13.21 O ATOM 1057 CB TYR A 74 -6.473 -6.559 -7.669 1.00 55.02 C ATOM 1058 CG TYR A 74 -6.499 -5.043 -7.764 1.00 55.13 C ATOM 1059 CD1 TYR A 74 -5.346 -4.350 -8.170 1.00 0.11 C ATOM 1060 CD2 TYR A 74 -7.679 -4.324 -7.479 1.00 4.34 C ATOM 1061 CE1 TYR A 74 -5.369 -2.952 -8.321 1.00 71.31 C ATOM 1062 CE2 TYR A 74 -7.713 -2.926 -7.627 1.00 42.30 C ATOM 1063 CZ TYR A 74 -6.560 -2.237 -8.063 1.00 2.25 C ATOM 1064 OH TYR A 74 -6.603 -0.895 -8.274 1.00 60.21 O ATOM 0 H TYR A 74 -7.809 -6.308 -9.721 1.00 42.05 H new ATOM 0 HA TYR A 74 -5.090 -7.040 -9.238 1.00 11.12 H new ATOM 0 HB2 TYR A 74 -7.451 -6.904 -7.334 1.00 55.02 H new ATOM 0 HB3 TYR A 74 -5.754 -6.848 -6.902 1.00 55.02 H new ATOM 0 HD1 TYR A 74 -4.435 -4.895 -8.368 1.00 0.11 H new ATOM 0 HD2 TYR A 74 -8.561 -4.850 -7.145 1.00 4.34 H new ATOM 0 HE1 TYR A 74 -4.479 -2.426 -8.633 1.00 71.31 H new ATOM 0 HE2 TYR A 74 -8.619 -2.380 -7.408 1.00 42.30 H new ATOM 0 HH TYR A 74 -7.495 -0.557 -8.049 1.00 60.21 H new ATOM 1073 N ASN A 75 -7.295 -9.439 -9.166 1.00 3.42 N ATOM 1074 CA ASN A 75 -7.475 -10.884 -9.062 1.00 72.35 C ATOM 1075 C ASN A 75 -6.460 -11.632 -9.934 1.00 23.22 C ATOM 1076 O ASN A 75 -6.091 -12.762 -9.612 1.00 60.41 O ATOM 1077 CB ASN A 75 -8.878 -11.325 -9.504 1.00 54.25 C ATOM 1078 CG ASN A 75 -10.084 -10.636 -8.886 1.00 22.32 C ATOM 1079 OD1 ASN A 75 -11.044 -10.308 -9.576 1.00 75.51 O ATOM 1080 ND2 ASN A 75 -10.114 -10.454 -7.585 1.00 15.10 N ATOM 0 H ASN A 75 -8.106 -8.956 -9.552 1.00 3.42 H new ATOM 0 HA ASN A 75 -7.330 -11.128 -8.010 1.00 72.35 H new ATOM 0 HB2 ASN A 75 -8.941 -11.196 -10.585 1.00 54.25 H new ATOM 0 HB3 ASN A 75 -8.968 -12.393 -9.304 1.00 54.25 H new ATOM 0 HD21 ASN A 75 -10.937 -10.039 -7.147 1.00 15.10 H new ATOM 0 HD22 ASN A 75 -9.315 -10.727 -7.013 1.00 15.10 H new ATOM 1086 N ASN A 76 -5.973 -11.013 -11.022 1.00 23.10 N ATOM 1087 CA ASN A 76 -4.963 -11.609 -11.904 1.00 71.53 C ATOM 1088 C ASN A 76 -3.626 -11.844 -11.190 1.00 0.20 C ATOM 1089 O ASN A 76 -2.761 -12.526 -11.749 1.00 20.54 O ATOM 1090 CB ASN A 76 -4.697 -10.719 -13.133 1.00 12.23 C ATOM 1091 CG ASN A 76 -5.823 -10.694 -14.156 1.00 2.33 C ATOM 1092 OD1 ASN A 76 -6.540 -11.675 -14.352 1.00 34.30 O ATOM 1093 ND2 ASN A 76 -5.957 -9.601 -14.889 1.00 22.30 N ATOM 0 H ASN A 76 -6.271 -10.082 -11.313 1.00 23.10 H new ATOM 0 HA ASN A 76 -5.375 -12.569 -12.215 1.00 71.53 H new ATOM 0 HB2 ASN A 76 -4.511 -9.700 -12.793 1.00 12.23 H new ATOM 0 HB3 ASN A 76 -3.786 -11.063 -13.623 1.00 12.23 H new ATOM 0 HD21 ASN A 76 -6.661 -9.565 -15.626 1.00 22.30 H new ATOM 0 HD22 ASN A 76 -5.357 -8.795 -14.717 1.00 22.30 H new ATOM 1099 N TYR A 77 -3.436 -11.293 -9.988 1.00 22.54 N ATOM 1100 CA TYR A 77 -2.213 -11.395 -9.211 1.00 60.13 C ATOM 1101 C TYR A 77 -2.524 -12.071 -7.877 1.00 53.02 C ATOM 1102 O TYR A 77 -3.677 -12.105 -7.445 1.00 40.02 O ATOM 1103 CB TYR A 77 -1.602 -9.998 -9.006 1.00 40.04 C ATOM 1104 CG TYR A 77 -1.411 -9.190 -10.279 1.00 41.45 C ATOM 1105 CD1 TYR A 77 -2.487 -8.461 -10.821 1.00 61.34 C ATOM 1106 CD2 TYR A 77 -0.174 -9.188 -10.946 1.00 23.10 C ATOM 1107 CE1 TYR A 77 -2.336 -7.755 -12.022 1.00 41.22 C ATOM 1108 CE2 TYR A 77 -0.014 -8.495 -12.158 1.00 75.14 C ATOM 1109 CZ TYR A 77 -1.101 -7.776 -12.705 1.00 2.21 C ATOM 1110 OH TYR A 77 -0.983 -7.131 -13.897 1.00 52.14 O ATOM 0 H TYR A 77 -4.159 -10.746 -9.519 1.00 22.54 H new ATOM 0 HA TYR A 77 -1.480 -12.001 -9.744 1.00 60.13 H new ATOM 0 HB2 TYR A 77 -2.242 -9.434 -8.327 1.00 40.04 H new ATOM 0 HB3 TYR A 77 -0.635 -10.109 -8.515 1.00 40.04 H new ATOM 0 HD1 TYR A 77 -3.437 -8.446 -10.307 1.00 61.34 H new ATOM 0 HD2 TYR A 77 0.662 -9.725 -10.523 1.00 23.10 H new ATOM 0 HE1 TYR A 77 -3.166 -7.194 -12.426 1.00 41.22 H new ATOM 0 HE2 TYR A 77 0.937 -8.512 -12.670 1.00 75.14 H new ATOM 0 HH TYR A 77 -0.071 -7.239 -14.238 1.00 52.14 H new ATOM 1119 N ASP A 78 -1.496 -12.594 -7.212 1.00 20.53 N ATOM 1120 CA ASP A 78 -1.636 -13.342 -5.952 1.00 73.14 C ATOM 1121 C ASP A 78 -0.943 -12.614 -4.787 1.00 53.43 C ATOM 1122 O ASP A 78 -1.284 -12.815 -3.622 1.00 1.23 O ATOM 1123 CB ASP A 78 -1.077 -14.754 -6.179 1.00 2.11 C ATOM 1124 CG ASP A 78 -1.810 -15.861 -5.397 1.00 31.14 C ATOM 1125 OD1 ASP A 78 -2.220 -15.697 -4.231 1.00 13.04 O ATOM 1126 OD2 ASP A 78 -1.993 -16.952 -5.995 1.00 44.24 O ATOM 0 H ASP A 78 -0.531 -12.513 -7.531 1.00 20.53 H new ATOM 0 HA ASP A 78 -2.686 -13.413 -5.667 1.00 73.14 H new ATOM 0 HB2 ASP A 78 -1.126 -14.984 -7.243 1.00 2.11 H new ATOM 0 HB3 ASP A 78 -0.024 -14.764 -5.899 1.00 2.11 H new ATOM 1130 N LEU A 79 -0.024 -11.695 -5.103 1.00 62.12 N ATOM 1131 CA LEU A 79 0.776 -10.893 -4.182 1.00 40.01 C ATOM 1132 C LEU A 79 0.630 -9.424 -4.575 1.00 2.12 C ATOM 1133 O LEU A 79 0.674 -9.101 -5.768 1.00 64.45 O ATOM 1134 CB LEU A 79 2.252 -11.318 -4.293 1.00 0.34 C ATOM 1135 CG LEU A 79 2.719 -12.328 -3.241 1.00 31.13 C ATOM 1136 CD1 LEU A 79 4.078 -12.917 -3.598 1.00 74.53 C ATOM 1137 CD2 LEU A 79 2.916 -11.658 -1.890 1.00 51.25 C ATOM 0 H LEU A 79 0.192 -11.480 -6.076 1.00 62.12 H new ATOM 0 HA LEU A 79 0.439 -11.039 -3.156 1.00 40.01 H new ATOM 0 HB2 LEU A 79 2.417 -11.745 -5.282 1.00 0.34 H new ATOM 0 HB3 LEU A 79 2.877 -10.428 -4.221 1.00 0.34 H new ATOM 0 HG LEU A 79 1.947 -13.097 -3.205 1.00 31.13 H new ATOM 0 HD11 LEU A 79 4.379 -13.630 -2.830 1.00 74.53 H new ATOM 0 HD12 LEU A 79 4.013 -13.426 -4.560 1.00 74.53 H new ATOM 0 HD13 LEU A 79 4.816 -12.117 -3.660 1.00 74.53 H new ATOM 0 HD21 LEU A 79 3.248 -12.398 -1.162 1.00 51.25 H new ATOM 0 HD22 LEU A 79 3.668 -10.874 -1.979 1.00 51.25 H new ATOM 0 HD23 LEU A 79 1.974 -11.221 -1.560 1.00 51.25 H new ATOM 1148 N ILE A 80 0.467 -8.526 -3.600 1.00 24.12 N ATOM 1149 CA ILE A 80 0.301 -7.092 -3.832 1.00 33.53 C ATOM 1150 C ILE A 80 1.175 -6.351 -2.813 1.00 53.42 C ATOM 1151 O ILE A 80 0.863 -6.320 -1.621 1.00 2.12 O ATOM 1152 CB ILE A 80 -1.200 -6.693 -3.815 1.00 2.01 C ATOM 1153 CG1 ILE A 80 -1.940 -7.393 -4.988 1.00 75.51 C ATOM 1154 CG2 ILE A 80 -1.337 -5.161 -3.924 1.00 1.13 C ATOM 1155 CD1 ILE A 80 -3.447 -7.127 -5.104 1.00 0.42 C ATOM 0 H ILE A 80 0.447 -8.781 -2.612 1.00 24.12 H new ATOM 0 HA ILE A 80 0.639 -6.805 -4.828 1.00 33.53 H new ATOM 0 HB ILE A 80 -1.650 -7.014 -2.876 1.00 2.01 H new ATOM 0 HG12 ILE A 80 -1.467 -7.087 -5.921 1.00 75.51 H new ATOM 0 HG13 ILE A 80 -1.790 -8.468 -4.893 1.00 75.51 H new ATOM 0 HG21 ILE A 80 -2.392 -4.888 -3.912 1.00 1.13 H new ATOM 0 HG22 ILE A 80 -0.830 -4.690 -3.082 1.00 1.13 H new ATOM 0 HG23 ILE A 80 -0.885 -4.821 -4.856 1.00 1.13 H new ATOM 0 HD11 ILE A 80 -3.848 -7.670 -5.960 1.00 0.42 H new ATOM 0 HD12 ILE A 80 -3.947 -7.462 -4.195 1.00 0.42 H new ATOM 0 HD13 ILE A 80 -3.619 -6.059 -5.240 1.00 0.42 H new ATOM 1166 N LEU A 81 2.292 -5.790 -3.283 1.00 54.13 N ATOM 1167 CA LEU A 81 3.228 -4.977 -2.517 1.00 31.51 C ATOM 1168 C LEU A 81 2.855 -3.515 -2.688 1.00 51.13 C ATOM 1169 O LEU A 81 2.618 -3.058 -3.810 1.00 61.22 O ATOM 1170 CB LEU A 81 4.666 -5.187 -3.038 1.00 74.52 C ATOM 1171 CG LEU A 81 5.455 -6.345 -2.416 1.00 43.03 C ATOM 1172 CD1 LEU A 81 5.920 -5.938 -1.020 1.00 22.10 C ATOM 1173 CD2 LEU A 81 4.659 -7.647 -2.370 1.00 72.31 C ATOM 0 H LEU A 81 2.578 -5.898 -4.256 1.00 54.13 H new ATOM 0 HA LEU A 81 3.181 -5.266 -1.467 1.00 31.51 H new ATOM 0 HB2 LEU A 81 4.619 -5.346 -4.115 1.00 74.52 H new ATOM 0 HB3 LEU A 81 5.226 -4.266 -2.875 1.00 74.52 H new ATOM 0 HG LEU A 81 6.318 -6.545 -3.052 1.00 43.03 H new ATOM 0 HD11 LEU A 81 6.482 -6.757 -0.571 1.00 22.10 H new ATOM 0 HD12 LEU A 81 6.557 -5.056 -1.091 1.00 22.10 H new ATOM 0 HD13 LEU A 81 5.053 -5.710 -0.400 1.00 22.10 H new ATOM 0 HD21 LEU A 81 5.269 -8.430 -1.920 1.00 72.31 H new ATOM 0 HD22 LEU A 81 3.758 -7.501 -1.775 1.00 72.31 H new ATOM 0 HD23 LEU A 81 4.382 -7.940 -3.383 1.00 72.31 H new ATOM 1184 N ILE A 82 2.870 -2.759 -1.593 1.00 52.14 N ATOM 1185 CA ILE A 82 2.478 -1.356 -1.571 1.00 3.23 C ATOM 1186 C ILE A 82 3.599 -0.540 -0.922 1.00 53.44 C ATOM 1187 O ILE A 82 4.058 -0.871 0.170 1.00 32.53 O ATOM 1188 CB ILE A 82 1.119 -1.220 -0.850 1.00 32.13 C ATOM 1189 CG1 ILE A 82 0.033 -2.075 -1.549 1.00 31.10 C ATOM 1190 CG2 ILE A 82 0.712 0.256 -0.842 1.00 33.33 C ATOM 1191 CD1 ILE A 82 -1.379 -1.922 -0.974 1.00 14.04 C ATOM 0 H ILE A 82 3.160 -3.112 -0.681 1.00 52.14 H new ATOM 0 HA ILE A 82 2.338 -0.963 -2.578 1.00 3.23 H new ATOM 0 HB ILE A 82 1.217 -1.583 0.173 1.00 32.13 H new ATOM 0 HG12 ILE A 82 0.009 -1.812 -2.606 1.00 31.10 H new ATOM 0 HG13 ILE A 82 0.322 -3.124 -1.488 1.00 31.10 H new ATOM 0 HG21 ILE A 82 -0.247 0.366 -0.335 1.00 33.33 H new ATOM 0 HG22 ILE A 82 1.469 0.839 -0.317 1.00 33.33 H new ATOM 0 HG23 ILE A 82 0.624 0.615 -1.868 1.00 33.33 H new ATOM 0 HD11 ILE A 82 -2.069 -2.559 -1.528 1.00 14.04 H new ATOM 0 HD12 ILE A 82 -1.378 -2.215 0.076 1.00 14.04 H new ATOM 0 HD13 ILE A 82 -1.696 -0.883 -1.060 1.00 14.04 H new ATOM 1202 N GLY A 83 4.040 0.530 -1.593 1.00 40.11 N ATOM 1203 CA GLY A 83 5.147 1.362 -1.141 1.00 75.41 C ATOM 1204 C GLY A 83 4.767 2.834 -1.037 1.00 44.33 C ATOM 1205 O GLY A 83 4.208 3.392 -1.986 1.00 23.15 O ATOM 0 H GLY A 83 3.630 0.841 -2.474 1.00 40.11 H new ATOM 0 HA2 GLY A 83 5.489 1.009 -0.168 1.00 75.41 H new ATOM 0 HA3 GLY A 83 5.984 1.254 -1.831 1.00 75.41 H new ATOM 1209 N SER A 84 5.088 3.468 0.097 1.00 40.12 N ATOM 1210 CA SER A 84 4.864 4.892 0.359 1.00 20.31 C ATOM 1211 C SER A 84 5.953 5.466 1.286 1.00 0.44 C ATOM 1212 O SER A 84 6.661 4.683 1.929 1.00 74.22 O ATOM 1213 CB SER A 84 3.471 5.068 0.978 1.00 0.41 C ATOM 1214 OG SER A 84 3.227 4.157 2.038 1.00 23.01 O ATOM 0 H SER A 84 5.525 2.987 0.883 1.00 40.12 H new ATOM 0 HA SER A 84 4.919 5.443 -0.580 1.00 20.31 H new ATOM 0 HB2 SER A 84 3.368 6.088 1.349 1.00 0.41 H new ATOM 0 HB3 SER A 84 2.714 4.932 0.205 1.00 0.41 H new ATOM 0 HG SER A 84 2.329 4.309 2.400 1.00 23.01 H new ATOM 1219 N PRO A 85 6.128 6.801 1.354 1.00 24.25 N ATOM 1220 CA PRO A 85 7.022 7.457 2.309 1.00 11.15 C ATOM 1221 C PRO A 85 6.326 7.732 3.655 1.00 44.20 C ATOM 1222 O PRO A 85 5.098 7.642 3.768 1.00 24.05 O ATOM 1223 CB PRO A 85 7.431 8.762 1.619 1.00 52.13 C ATOM 1224 CG PRO A 85 6.165 9.137 0.850 1.00 1.35 C ATOM 1225 CD PRO A 85 5.576 7.788 0.432 1.00 24.12 C ATOM 0 HA PRO A 85 7.879 6.830 2.556 1.00 11.15 H new ATOM 0 HB2 PRO A 85 7.712 9.531 2.338 1.00 52.13 H new ATOM 0 HB3 PRO A 85 8.283 8.620 0.954 1.00 52.13 H new ATOM 0 HG2 PRO A 85 5.471 9.700 1.474 1.00 1.35 H new ATOM 0 HG3 PRO A 85 6.393 9.759 -0.016 1.00 1.35 H new ATOM 0 HD2 PRO A 85 4.487 7.805 0.485 1.00 24.12 H new ATOM 0 HD3 PRO A 85 5.841 7.550 -0.598 1.00 24.12 H new ATOM 1230 N VAL A 86 7.113 8.097 4.675 1.00 62.03 N ATOM 1231 CA VAL A 86 6.684 8.351 6.055 1.00 51.21 C ATOM 1232 C VAL A 86 7.632 9.389 6.642 1.00 44.23 C ATOM 1233 O VAL A 86 8.798 9.426 6.249 1.00 31.21 O ATOM 1234 CB VAL A 86 6.781 7.079 6.931 1.00 14.55 C ATOM 1235 CG1 VAL A 86 5.933 7.207 8.208 1.00 20.41 C ATOM 1236 CG2 VAL A 86 6.367 5.822 6.176 1.00 13.33 C ATOM 0 H VAL A 86 8.117 8.230 4.553 1.00 62.03 H new ATOM 0 HA VAL A 86 5.646 8.684 6.043 1.00 51.21 H new ATOM 0 HB VAL A 86 7.832 6.984 7.206 1.00 14.55 H new ATOM 0 HG11 VAL A 86 6.025 6.296 8.799 1.00 20.41 H new ATOM 0 HG12 VAL A 86 6.284 8.056 8.794 1.00 20.41 H new ATOM 0 HG13 VAL A 86 4.888 7.360 7.937 1.00 20.41 H new ATOM 0 HG21 VAL A 86 6.453 4.957 6.834 1.00 13.33 H new ATOM 0 HG22 VAL A 86 5.335 5.922 5.841 1.00 13.33 H new ATOM 0 HG23 VAL A 86 7.017 5.686 5.312 1.00 13.33 H new ATOM 1246 N TRP A 87 7.186 10.181 7.626 1.00 23.05 N ATOM 1247 CA TRP A 87 8.109 11.103 8.280 1.00 1.52 C ATOM 1248 C TRP A 87 7.753 11.560 9.677 1.00 23.34 C ATOM 1249 O TRP A 87 8.656 11.901 10.452 1.00 24.35 O ATOM 1250 CB TRP A 87 8.388 12.283 7.342 1.00 73.34 C ATOM 1251 CG TRP A 87 9.796 12.769 7.435 1.00 52.11 C ATOM 1252 CD1 TRP A 87 10.836 12.260 6.740 1.00 74.12 C ATOM 1253 CD2 TRP A 87 10.353 13.808 8.290 1.00 1.42 C ATOM 1254 NE1 TRP A 87 12.001 12.891 7.125 1.00 73.43 N ATOM 1255 CE2 TRP A 87 11.767 13.831 8.106 1.00 52.52 C ATOM 1256 CE3 TRP A 87 9.808 14.719 9.218 1.00 44.24 C ATOM 1257 CZ2 TRP A 87 12.601 14.681 8.843 1.00 52.24 C ATOM 1258 CZ3 TRP A 87 10.632 15.595 9.946 1.00 4.53 C ATOM 1259 CH2 TRP A 87 12.025 15.567 9.767 1.00 35.25 C ATOM 0 H TRP A 87 6.227 10.201 7.973 1.00 23.05 H new ATOM 0 HA TRP A 87 9.014 10.522 8.460 1.00 1.52 H new ATOM 0 HB2 TRP A 87 8.178 11.984 6.315 1.00 73.34 H new ATOM 0 HB3 TRP A 87 7.709 13.101 7.581 1.00 73.34 H new ATOM 0 HD1 TRP A 87 10.766 11.479 5.997 1.00 74.12 H new ATOM 0 HE1 TRP A 87 12.920 12.687 6.733 1.00 73.43 H new ATOM 0 HE3 TRP A 87 8.739 14.744 9.372 1.00 44.24 H new ATOM 0 HZ2 TRP A 87 13.672 14.655 8.703 1.00 52.24 H new ATOM 0 HZ3 TRP A 87 10.193 16.291 10.645 1.00 4.53 H new ATOM 0 HH2 TRP A 87 12.655 16.229 10.342 1.00 35.25 H new ATOM 1269 N SER A 88 6.472 11.523 10.003 1.00 60.04 N ATOM 1270 CA SER A 88 5.970 12.038 11.267 1.00 41.40 C ATOM 1271 C SER A 88 4.831 11.193 11.863 1.00 14.34 C ATOM 1272 O SER A 88 4.157 11.640 12.798 1.00 34.21 O ATOM 1273 CB SER A 88 5.583 13.507 11.047 1.00 72.34 C ATOM 1274 OG SER A 88 4.866 13.694 9.839 1.00 60.14 O ATOM 0 H SER A 88 5.749 11.134 9.398 1.00 60.04 H new ATOM 0 HA SER A 88 6.753 11.973 12.023 1.00 41.40 H new ATOM 0 HB2 SER A 88 4.977 13.851 11.885 1.00 72.34 H new ATOM 0 HB3 SER A 88 6.484 14.120 11.032 1.00 72.34 H new ATOM 0 HG SER A 88 4.637 14.642 9.738 1.00 60.14 H new ATOM 1279 N GLY A 89 4.594 9.995 11.320 1.00 52.41 N ATOM 1280 CA GLY A 89 3.458 9.144 11.619 1.00 41.20 C ATOM 1281 C GLY A 89 2.849 8.576 10.342 1.00 1.11 C ATOM 1282 O GLY A 89 3.034 7.391 10.076 1.00 1.35 O ATOM 0 H GLY A 89 5.222 9.581 10.631 1.00 52.41 H new ATOM 0 HA2 GLY A 89 3.772 8.328 12.270 1.00 41.20 H new ATOM 0 HA3 GLY A 89 2.705 9.714 12.163 1.00 41.20 H new ATOM 1286 N TYR A 90 2.119 9.395 9.586 1.00 12.24 N ATOM 1287 CA TYR A 90 1.298 9.028 8.435 1.00 60.21 C ATOM 1288 C TYR A 90 1.119 10.237 7.489 1.00 31.13 C ATOM 1289 O TYR A 90 -0.011 10.647 7.245 1.00 22.42 O ATOM 1290 CB TYR A 90 -0.055 8.476 8.950 1.00 34.24 C ATOM 1291 CG TYR A 90 -0.795 9.220 10.072 1.00 14.35 C ATOM 1292 CD1 TYR A 90 -0.461 10.531 10.468 1.00 64.22 C ATOM 1293 CD2 TYR A 90 -1.804 8.551 10.789 1.00 44.34 C ATOM 1294 CE1 TYR A 90 -0.998 11.090 11.636 1.00 34.41 C ATOM 1295 CE2 TYR A 90 -2.344 9.095 11.965 1.00 63.04 C ATOM 1296 CZ TYR A 90 -1.908 10.354 12.420 1.00 54.32 C ATOM 1297 OH TYR A 90 -2.381 10.878 13.584 1.00 41.40 O ATOM 0 H TYR A 90 2.084 10.397 9.774 1.00 12.24 H new ATOM 0 HA TYR A 90 1.789 8.250 7.851 1.00 60.21 H new ATOM 0 HB2 TYR A 90 -0.730 8.416 8.096 1.00 34.24 H new ATOM 0 HB3 TYR A 90 0.117 7.456 9.292 1.00 34.24 H new ATOM 0 HD1 TYR A 90 0.218 11.113 9.863 1.00 64.22 H new ATOM 0 HD2 TYR A 90 -2.170 7.601 10.428 1.00 44.34 H new ATOM 0 HE1 TYR A 90 -0.713 12.088 11.936 1.00 34.41 H new ATOM 0 HE2 TYR A 90 -3.093 8.549 12.520 1.00 63.04 H new ATOM 0 HH TYR A 90 -2.999 10.243 14.001 1.00 41.40 H new ATOM 1306 N PRO A 91 2.200 10.874 6.993 1.00 54.22 N ATOM 1307 CA PRO A 91 2.082 12.130 6.256 1.00 33.25 C ATOM 1308 C PRO A 91 1.406 11.966 4.896 1.00 13.21 C ATOM 1309 O PRO A 91 0.576 12.787 4.518 1.00 20.35 O ATOM 1310 CB PRO A 91 3.509 12.655 6.113 1.00 64.34 C ATOM 1311 CG PRO A 91 4.359 11.391 6.148 1.00 75.13 C ATOM 1312 CD PRO A 91 3.599 10.508 7.140 1.00 73.21 C ATOM 0 HA PRO A 91 1.440 12.828 6.793 1.00 33.25 H new ATOM 0 HB2 PRO A 91 3.643 13.203 5.180 1.00 64.34 H new ATOM 0 HB3 PRO A 91 3.769 13.336 6.923 1.00 64.34 H new ATOM 0 HG2 PRO A 91 4.434 10.925 5.165 1.00 75.13 H new ATOM 0 HG3 PRO A 91 5.376 11.595 6.483 1.00 75.13 H new ATOM 0 HD2 PRO A 91 3.753 9.451 6.923 1.00 73.21 H new ATOM 0 HD3 PRO A 91 3.944 10.677 8.160 1.00 73.21 H new ATOM 1317 N ALA A 92 1.801 10.949 4.130 1.00 40.43 N ATOM 1318 CA ALA A 92 1.341 10.796 2.768 1.00 0.45 C ATOM 1319 C ALA A 92 -0.007 10.076 2.785 1.00 33.42 C ATOM 1320 O ALA A 92 -0.207 9.184 3.616 1.00 0.52 O ATOM 1321 CB ALA A 92 2.405 9.998 1.999 1.00 63.40 C ATOM 0 H ALA A 92 2.443 10.220 4.441 1.00 40.43 H new ATOM 0 HA ALA A 92 1.201 11.758 2.276 1.00 0.45 H new ATOM 0 HB1 ALA A 92 2.085 9.866 0.965 1.00 63.40 H new ATOM 0 HB2 ALA A 92 3.351 10.539 2.020 1.00 63.40 H new ATOM 0 HB3 ALA A 92 2.535 9.022 2.466 1.00 63.40 H new ATOM 1327 N THR A 93 -0.835 10.270 1.758 1.00 61.04 N ATOM 1328 CA THR A 93 -2.042 9.460 1.557 1.00 2.51 C ATOM 1329 C THR A 93 -2.161 8.981 0.096 1.00 13.15 C ATOM 1330 O THR A 93 -3.244 8.994 -0.478 1.00 71.04 O ATOM 1331 CB THR A 93 -3.283 10.257 2.031 1.00 35.32 C ATOM 1332 OG1 THR A 93 -3.163 11.643 1.773 1.00 24.14 O ATOM 1333 CG2 THR A 93 -3.526 10.105 3.529 1.00 21.33 C ATOM 0 H THR A 93 -0.692 10.986 1.046 1.00 61.04 H new ATOM 0 HA THR A 93 -1.975 8.555 2.161 1.00 2.51 H new ATOM 0 HB THR A 93 -4.115 9.838 1.465 1.00 35.32 H new ATOM 0 HG1 THR A 93 -3.971 11.962 1.319 1.00 24.14 H new ATOM 0 HG21 THR A 93 -4.406 10.681 3.815 1.00 21.33 H new ATOM 0 HG22 THR A 93 -3.688 9.054 3.767 1.00 21.33 H new ATOM 0 HG23 THR A 93 -2.658 10.472 4.077 1.00 21.33 H new ATOM 1341 N PRO A 94 -1.111 8.340 -0.460 1.00 12.44 N ATOM 1342 CA PRO A 94 -1.259 7.479 -1.622 1.00 63.34 C ATOM 1343 C PRO A 94 -1.788 6.096 -1.230 1.00 60.20 C ATOM 1344 O PRO A 94 -2.193 5.334 -2.109 1.00 51.53 O ATOM 1345 CB PRO A 94 0.145 7.386 -2.217 1.00 63.10 C ATOM 1346 CG PRO A 94 1.056 7.488 -1.000 1.00 60.00 C ATOM 1347 CD PRO A 94 0.304 8.481 -0.136 1.00 53.31 C ATOM 0 HA PRO A 94 -1.982 7.877 -2.334 1.00 63.34 H new ATOM 0 HB2 PRO A 94 0.293 6.447 -2.751 1.00 63.10 H new ATOM 0 HB3 PRO A 94 0.334 8.191 -2.928 1.00 63.10 H new ATOM 0 HG2 PRO A 94 1.184 6.527 -0.502 1.00 60.00 H new ATOM 0 HG3 PRO A 94 2.052 7.846 -1.263 1.00 60.00 H new ATOM 0 HD2 PRO A 94 0.479 8.283 0.921 1.00 53.31 H new ATOM 0 HD3 PRO A 94 0.645 9.498 -0.331 1.00 53.31 H new ATOM 1352 N ILE A 95 -1.756 5.714 0.055 1.00 21.43 N ATOM 1353 CA ILE A 95 -2.249 4.421 0.523 1.00 34.15 C ATOM 1354 C ILE A 95 -3.483 4.711 1.393 1.00 22.23 C ATOM 1355 O ILE A 95 -3.544 4.437 2.594 1.00 2.24 O ATOM 1356 CB ILE A 95 -1.173 3.602 1.264 1.00 23.35 C ATOM 1357 CG1 ILE A 95 0.263 3.730 0.714 1.00 22.34 C ATOM 1358 CG2 ILE A 95 -1.613 2.131 1.360 1.00 75.22 C ATOM 1359 CD1 ILE A 95 0.460 3.540 -0.796 1.00 74.44 C ATOM 0 H ILE A 95 -1.383 6.302 0.800 1.00 21.43 H new ATOM 0 HA ILE A 95 -2.520 3.789 -0.323 1.00 34.15 H new ATOM 0 HB ILE A 95 -1.105 4.041 2.259 1.00 23.35 H new ATOM 0 HG12 ILE A 95 0.639 4.717 0.981 1.00 22.34 H new ATOM 0 HG13 ILE A 95 0.888 3.001 1.230 1.00 22.34 H new ATOM 0 HG21 ILE A 95 -0.850 1.556 1.884 1.00 75.22 H new ATOM 0 HG22 ILE A 95 -2.554 2.068 1.906 1.00 75.22 H new ATOM 0 HG23 ILE A 95 -1.748 1.725 0.357 1.00 75.22 H new ATOM 0 HD11 ILE A 95 1.515 3.657 -1.043 1.00 74.44 H new ATOM 0 HD12 ILE A 95 0.128 2.542 -1.083 1.00 74.44 H new ATOM 0 HD13 ILE A 95 -0.124 4.286 -1.336 1.00 74.44 H new ATOM 1370 N LYS A 96 -4.478 5.279 0.727 1.00 3.14 N ATOM 1371 CA LYS A 96 -5.874 5.392 1.137 1.00 60.41 C ATOM 1372 C LYS A 96 -6.725 4.961 -0.056 1.00 52.42 C ATOM 1373 O LYS A 96 -7.591 4.098 0.048 1.00 23.13 O ATOM 1374 CB LYS A 96 -6.167 6.850 1.553 1.00 1.52 C ATOM 1375 CG LYS A 96 -6.438 7.006 3.055 1.00 60.44 C ATOM 1376 CD LYS A 96 -7.850 6.536 3.432 1.00 21.11 C ATOM 1377 CE LYS A 96 -8.124 6.880 4.898 1.00 75.30 C ATOM 1378 NZ LYS A 96 -9.555 6.796 5.243 1.00 60.22 N ATOM 0 H LYS A 96 -4.320 5.707 -0.185 1.00 3.14 H new ATOM 0 HA LYS A 96 -6.101 4.759 1.995 1.00 60.41 H new ATOM 0 HB2 LYS A 96 -5.320 7.477 1.276 1.00 1.52 H new ATOM 0 HB3 LYS A 96 -7.029 7.214 0.995 1.00 1.52 H new ATOM 0 HG2 LYS A 96 -5.702 6.433 3.619 1.00 60.44 H new ATOM 0 HG3 LYS A 96 -6.315 8.051 3.340 1.00 60.44 H new ATOM 0 HD2 LYS A 96 -8.589 7.016 2.790 1.00 21.11 H new ATOM 0 HD3 LYS A 96 -7.942 5.461 3.276 1.00 21.11 H new ATOM 0 HE2 LYS A 96 -7.560 6.202 5.538 1.00 75.30 H new ATOM 0 HE3 LYS A 96 -7.763 7.888 5.104 1.00 75.30 H new ATOM 0 HZ1 LYS A 96 -9.685 7.038 6.246 1.00 60.22 H new ATOM 0 HZ2 LYS A 96 -10.094 7.462 4.653 1.00 60.22 H new ATOM 0 HZ3 LYS A 96 -9.897 5.829 5.073 1.00 60.22 H new ATOM 1388 N THR A 97 -6.442 5.538 -1.210 1.00 0.44 N ATOM 1389 CA THR A 97 -7.209 5.470 -2.435 1.00 40.42 C ATOM 1390 C THR A 97 -7.234 4.074 -3.062 1.00 33.34 C ATOM 1391 O THR A 97 -8.288 3.626 -3.505 1.00 35.12 O ATOM 1392 CB THR A 97 -6.580 6.523 -3.378 1.00 52.42 C ATOM 1393 OG1 THR A 97 -5.957 7.574 -2.646 1.00 12.22 O ATOM 1394 CG2 THR A 97 -7.615 7.118 -4.315 1.00 23.13 C ATOM 0 H THR A 97 -5.605 6.110 -1.320 1.00 0.44 H new ATOM 0 HA THR A 97 -8.260 5.681 -2.238 1.00 40.42 H new ATOM 0 HB THR A 97 -5.824 6.001 -3.965 1.00 52.42 H new ATOM 0 HG1 THR A 97 -5.568 8.222 -3.270 1.00 12.22 H new ATOM 0 HG21 THR A 97 -7.139 7.854 -4.963 1.00 23.13 H new ATOM 0 HG22 THR A 97 -8.052 6.327 -4.924 1.00 23.13 H new ATOM 0 HG23 THR A 97 -8.399 7.602 -3.732 1.00 23.13 H new ATOM 1402 N LEU A 98 -6.101 3.365 -3.073 1.00 42.23 N ATOM 1403 CA LEU A 98 -5.975 2.001 -3.589 1.00 64.03 C ATOM 1404 C LEU A 98 -6.849 1.044 -2.777 1.00 15.45 C ATOM 1405 O LEU A 98 -7.559 0.223 -3.342 1.00 21.32 O ATOM 1406 CB LEU A 98 -4.493 1.537 -3.518 1.00 60.40 C ATOM 1407 CG LEU A 98 -3.986 0.807 -4.779 1.00 14.23 C ATOM 1408 CD1 LEU A 98 -4.755 -0.481 -5.077 1.00 23.21 C ATOM 1409 CD2 LEU A 98 -3.992 1.716 -6.007 1.00 52.22 C ATOM 0 H LEU A 98 -5.222 3.736 -2.713 1.00 42.23 H new ATOM 0 HA LEU A 98 -6.306 1.992 -4.628 1.00 64.03 H new ATOM 0 HB2 LEU A 98 -3.862 2.408 -3.340 1.00 60.40 H new ATOM 0 HB3 LEU A 98 -4.374 0.876 -2.659 1.00 60.40 H new ATOM 0 HG LEU A 98 -2.956 0.528 -4.556 1.00 14.23 H new ATOM 0 HD11 LEU A 98 -4.350 -0.947 -5.976 1.00 23.21 H new ATOM 0 HD12 LEU A 98 -4.655 -1.167 -4.236 1.00 23.21 H new ATOM 0 HD13 LEU A 98 -5.809 -0.248 -5.232 1.00 23.21 H new ATOM 0 HD21 LEU A 98 -3.628 1.162 -6.872 1.00 52.22 H new ATOM 0 HD22 LEU A 98 -5.008 2.061 -6.199 1.00 52.22 H new ATOM 0 HD23 LEU A 98 -3.345 2.574 -5.827 1.00 52.22 H new ATOM 1420 N LEU A 99 -6.824 1.155 -1.445 1.00 32.34 N ATOM 1421 CA LEU A 99 -7.609 0.328 -0.545 1.00 41.30 C ATOM 1422 C LEU A 99 -9.087 0.432 -0.883 1.00 15.32 C ATOM 1423 O LEU A 99 -9.775 -0.584 -0.919 1.00 40.11 O ATOM 1424 CB LEU A 99 -7.371 0.753 0.903 1.00 62.30 C ATOM 1425 CG LEU A 99 -5.998 0.361 1.488 1.00 35.13 C ATOM 1426 CD1 LEU A 99 -5.250 -0.793 0.819 1.00 53.10 C ATOM 1427 CD2 LEU A 99 -5.044 1.521 1.736 1.00 51.32 C ATOM 0 H LEU A 99 -6.243 1.839 -0.960 1.00 32.34 H new ATOM 0 HA LEU A 99 -7.296 -0.709 -0.665 1.00 41.30 H new ATOM 0 HB2 LEU A 99 -7.480 1.836 0.969 1.00 62.30 H new ATOM 0 HB3 LEU A 99 -8.151 0.315 1.526 1.00 62.30 H new ATOM 0 HG LEU A 99 -6.331 -0.024 2.452 1.00 35.13 H new ATOM 0 HD11 LEU A 99 -4.303 -0.959 1.332 1.00 53.10 H new ATOM 0 HD12 LEU A 99 -5.855 -1.698 0.872 1.00 53.10 H new ATOM 0 HD13 LEU A 99 -5.058 -0.546 -0.225 1.00 53.10 H new ATOM 0 HD21 LEU A 99 -4.109 1.141 2.147 1.00 51.32 H new ATOM 0 HD22 LEU A 99 -4.845 2.036 0.796 1.00 51.32 H new ATOM 0 HD23 LEU A 99 -5.494 2.218 2.443 1.00 51.32 H new ATOM 1438 N ASP A 100 -9.549 1.641 -1.205 1.00 61.41 N ATOM 1439 CA ASP A 100 -10.930 1.911 -1.589 1.00 63.11 C ATOM 1440 C ASP A 100 -11.351 1.152 -2.852 1.00 72.34 C ATOM 1441 O ASP A 100 -12.530 0.870 -3.068 1.00 51.44 O ATOM 1442 CB ASP A 100 -11.133 3.408 -1.778 1.00 63.34 C ATOM 1443 CG ASP A 100 -12.583 3.758 -1.468 1.00 40.34 C ATOM 1444 OD1 ASP A 100 -13.486 3.517 -2.301 1.00 40.33 O ATOM 1445 OD2 ASP A 100 -12.822 4.202 -0.324 1.00 33.23 O ATOM 0 H ASP A 100 -8.960 2.474 -1.205 1.00 61.41 H new ATOM 0 HA ASP A 100 -11.566 1.553 -0.780 1.00 63.11 H new ATOM 0 HB2 ASP A 100 -10.463 3.964 -1.122 1.00 63.34 H new ATOM 0 HB3 ASP A 100 -10.887 3.695 -2.801 1.00 63.34 H new ATOM 1449 N GLN A 101 -10.370 0.784 -3.674 1.00 12.42 N ATOM 1450 CA GLN A 101 -10.556 0.062 -4.921 1.00 24.04 C ATOM 1451 C GLN A 101 -10.397 -1.451 -4.702 1.00 54.24 C ATOM 1452 O GLN A 101 -10.819 -2.216 -5.568 1.00 61.02 O ATOM 1453 CB GLN A 101 -9.587 0.593 -6.002 1.00 12.44 C ATOM 1454 CG GLN A 101 -9.761 2.106 -6.300 1.00 54.41 C ATOM 1455 CD GLN A 101 -9.498 2.522 -7.755 1.00 14.32 C ATOM 1456 OE1 GLN A 101 -9.537 1.702 -8.668 1.00 21.03 O ATOM 1457 NE2 GLN A 101 -9.268 3.798 -8.035 1.00 32.04 N ATOM 0 H GLN A 101 -9.390 0.990 -3.478 1.00 12.42 H new ATOM 0 HA GLN A 101 -11.572 0.232 -5.278 1.00 24.04 H new ATOM 0 HB2 GLN A 101 -8.562 0.410 -5.681 1.00 12.44 H new ATOM 0 HB3 GLN A 101 -9.738 0.030 -6.923 1.00 12.44 H new ATOM 0 HG2 GLN A 101 -10.777 2.398 -6.034 1.00 54.41 H new ATOM 0 HG3 GLN A 101 -9.088 2.667 -5.652 1.00 54.41 H new ATOM 0 HE21 GLN A 101 -9.234 4.487 -7.284 1.00 32.04 H new ATOM 0 HE22 GLN A 101 -9.125 4.090 -9.002 1.00 32.04 H new ATOM 1464 N MET A 102 -9.879 -1.918 -3.553 1.00 72.33 N ATOM 1465 CA MET A 102 -9.644 -3.341 -3.292 1.00 75.41 C ATOM 1466 C MET A 102 -10.521 -3.902 -2.151 1.00 1.54 C ATOM 1467 O MET A 102 -10.076 -4.738 -1.376 1.00 75.45 O ATOM 1468 CB MET A 102 -8.160 -3.706 -3.064 1.00 52.44 C ATOM 1469 CG MET A 102 -7.100 -3.021 -3.930 1.00 54.33 C ATOM 1470 SD MET A 102 -5.648 -4.040 -4.358 1.00 24.22 S ATOM 1471 CE MET A 102 -5.342 -4.994 -2.835 1.00 73.34 C ATOM 0 H MET A 102 -9.611 -1.312 -2.777 1.00 72.33 H new ATOM 0 HA MET A 102 -9.948 -3.827 -4.219 1.00 75.41 H new ATOM 0 HB2 MET A 102 -7.923 -3.496 -2.021 1.00 52.44 H new ATOM 0 HB3 MET A 102 -8.058 -4.782 -3.203 1.00 52.44 H new ATOM 0 HG2 MET A 102 -7.572 -2.688 -4.854 1.00 54.33 H new ATOM 0 HG3 MET A 102 -6.754 -2.128 -3.409 1.00 54.33 H new ATOM 0 HE1 MET A 102 -4.335 -5.409 -2.862 1.00 73.34 H new ATOM 0 HE2 MET A 102 -5.441 -4.339 -1.969 1.00 73.34 H new ATOM 0 HE3 MET A 102 -6.067 -5.805 -2.762 1.00 73.34 H new ATOM 1479 N LYS A 103 -11.793 -3.550 -2.024 1.00 54.21 N ATOM 1480 CA LYS A 103 -12.576 -3.948 -0.841 1.00 2.51 C ATOM 1481 C LYS A 103 -13.013 -5.408 -0.783 1.00 20.42 C ATOM 1482 O LYS A 103 -13.414 -5.824 0.304 1.00 11.12 O ATOM 1483 CB LYS A 103 -13.843 -3.093 -0.677 1.00 62.21 C ATOM 1484 CG LYS A 103 -13.642 -1.589 -0.809 1.00 73.14 C ATOM 1485 CD LYS A 103 -12.663 -1.011 0.217 1.00 12.14 C ATOM 1486 CE LYS A 103 -13.311 -0.689 1.555 1.00 42.44 C ATOM 1487 NZ LYS A 103 -14.006 0.617 1.563 1.00 13.11 N ATOM 0 H LYS A 103 -12.307 -2.997 -2.710 1.00 54.21 H new ATOM 0 HA LYS A 103 -11.864 -3.787 -0.032 1.00 2.51 H new ATOM 0 HB2 LYS A 103 -14.573 -3.411 -1.421 1.00 62.21 H new ATOM 0 HB3 LYS A 103 -14.275 -3.299 0.302 1.00 62.21 H new ATOM 0 HG2 LYS A 103 -13.279 -1.366 -1.812 1.00 73.14 H new ATOM 0 HG3 LYS A 103 -14.605 -1.091 -0.701 1.00 73.14 H new ATOM 0 HD2 LYS A 103 -11.853 -1.722 0.376 1.00 12.14 H new ATOM 0 HD3 LYS A 103 -12.216 -0.104 -0.189 1.00 12.14 H new ATOM 0 HE2 LYS A 103 -14.024 -1.475 1.805 1.00 42.44 H new ATOM 0 HE3 LYS A 103 -12.547 -0.692 2.332 1.00 42.44 H new ATOM 0 HZ1 LYS A 103 -14.427 0.781 2.500 1.00 13.11 H new ATOM 0 HZ2 LYS A 103 -13.325 1.374 1.353 1.00 13.11 H new ATOM 0 HZ3 LYS A 103 -14.756 0.616 0.842 1.00 13.11 H new ATOM 1497 N ASN A 104 -13.016 -6.183 -1.875 1.00 32.31 N ATOM 1498 CA ASN A 104 -13.494 -7.581 -1.869 1.00 61.13 C ATOM 1499 C ASN A 104 -12.471 -8.519 -2.525 1.00 12.13 C ATOM 1500 O ASN A 104 -12.805 -9.441 -3.272 1.00 23.40 O ATOM 1501 CB ASN A 104 -14.925 -7.692 -2.451 1.00 73.04 C ATOM 1502 CG ASN A 104 -16.045 -7.610 -1.410 1.00 61.22 C ATOM 1503 OD1 ASN A 104 -17.033 -8.337 -1.507 1.00 71.03 O ATOM 1504 ND2 ASN A 104 -15.974 -6.728 -0.428 1.00 74.03 N ATOM 0 H ASN A 104 -12.689 -5.865 -2.787 1.00 32.31 H new ATOM 0 HA ASN A 104 -13.578 -7.918 -0.836 1.00 61.13 H new ATOM 0 HB2 ASN A 104 -15.068 -6.897 -3.183 1.00 73.04 H new ATOM 0 HB3 ASN A 104 -15.013 -8.637 -2.986 1.00 73.04 H new ATOM 0 HD21 ASN A 104 -16.736 -6.652 0.245 1.00 74.03 H new ATOM 0 HD22 ASN A 104 -15.157 -6.123 -0.344 1.00 74.03 H new ATOM 1510 N TYR A 105 -11.188 -8.252 -2.299 1.00 53.11 N ATOM 1511 CA TYR A 105 -10.045 -9.001 -2.830 1.00 74.32 C ATOM 1512 C TYR A 105 -9.477 -10.011 -1.836 1.00 11.04 C ATOM 1513 O TYR A 105 -9.813 -10.050 -0.648 1.00 0.33 O ATOM 1514 CB TYR A 105 -8.991 -7.995 -3.312 1.00 23.44 C ATOM 1515 CG TYR A 105 -9.517 -7.332 -4.555 1.00 4.30 C ATOM 1516 CD1 TYR A 105 -10.418 -6.285 -4.378 1.00 41.21 C ATOM 1517 CD2 TYR A 105 -9.305 -7.877 -5.830 1.00 75.14 C ATOM 1518 CE1 TYR A 105 -11.103 -5.729 -5.471 1.00 23.04 C ATOM 1519 CE2 TYR A 105 -9.965 -7.317 -6.940 1.00 13.04 C ATOM 1520 CZ TYR A 105 -10.849 -6.229 -6.765 1.00 4.44 C ATOM 1521 OH TYR A 105 -11.472 -5.685 -7.838 1.00 33.52 O ATOM 0 H TYR A 105 -10.899 -7.469 -1.712 1.00 53.11 H new ATOM 0 HA TYR A 105 -10.381 -9.608 -3.671 1.00 74.32 H new ATOM 0 HB2 TYR A 105 -8.791 -7.253 -2.539 1.00 23.44 H new ATOM 0 HB3 TYR A 105 -8.048 -8.501 -3.520 1.00 23.44 H new ATOM 0 HD1 TYR A 105 -10.593 -5.895 -3.386 1.00 41.21 H new ATOM 0 HD2 TYR A 105 -8.641 -8.719 -5.959 1.00 75.14 H new ATOM 0 HE1 TYR A 105 -11.814 -4.930 -5.323 1.00 23.04 H new ATOM 0 HE2 TYR A 105 -9.795 -7.720 -7.928 1.00 13.04 H new ATOM 0 HH TYR A 105 -11.183 -6.147 -8.653 1.00 33.52 H new ATOM 1530 N ARG A 106 -8.597 -10.852 -2.364 1.00 24.12 N ATOM 1531 CA ARG A 106 -7.786 -11.834 -1.660 1.00 40.32 C ATOM 1532 C ARG A 106 -6.331 -11.593 -2.073 1.00 73.52 C ATOM 1533 O ARG A 106 -6.012 -10.511 -2.568 1.00 23.51 O ATOM 1534 CB ARG A 106 -8.293 -13.249 -1.958 1.00 71.12 C ATOM 1535 CG ARG A 106 -9.738 -13.469 -1.472 1.00 35.20 C ATOM 1536 CD ARG A 106 -9.909 -14.938 -1.078 1.00 61.41 C ATOM 1537 NE ARG A 106 -11.278 -15.431 -1.306 1.00 32.54 N ATOM 1538 CZ ARG A 106 -12.184 -15.792 -0.391 1.00 33.42 C ATOM 1539 NH1 ARG A 106 -11.953 -15.689 0.917 1.00 33.50 N ATOM 1540 NH2 ARG A 106 -13.342 -16.275 -0.812 1.00 43.35 N ATOM 0 H ARG A 106 -8.419 -10.866 -3.368 1.00 24.12 H new ATOM 0 HA ARG A 106 -7.857 -11.730 -0.577 1.00 40.32 H new ATOM 0 HB2 ARG A 106 -8.242 -13.432 -3.031 1.00 71.12 H new ATOM 0 HB3 ARG A 106 -7.637 -13.976 -1.479 1.00 71.12 H new ATOM 0 HG2 ARG A 106 -9.952 -12.823 -0.621 1.00 35.20 H new ATOM 0 HG3 ARG A 106 -10.445 -13.205 -2.259 1.00 35.20 H new ATOM 0 HD2 ARG A 106 -9.208 -15.547 -1.649 1.00 61.41 H new ATOM 0 HD3 ARG A 106 -9.654 -15.060 -0.025 1.00 61.41 H new ATOM 0 HE ARG A 106 -11.571 -15.506 -2.280 1.00 32.54 H new ATOM 0 HH11 ARG A 106 -11.060 -15.325 1.250 1.00 33.50 H new ATOM 0 HH12 ARG A 106 -12.669 -15.975 1.585 1.00 33.50 H new ATOM 0 HH21 ARG A 106 -13.524 -16.364 -1.812 1.00 43.35 H new ATOM 0 HH22 ARG A 106 -14.052 -16.559 -0.137 1.00 43.35 H new ATOM 1551 N GLY A 107 -5.450 -12.564 -1.848 1.00 41.13 N ATOM 1552 CA GLY A 107 -4.028 -12.444 -2.116 1.00 34.22 C ATOM 1553 C GLY A 107 -3.268 -12.232 -0.812 1.00 24.11 C ATOM 1554 O GLY A 107 -3.797 -12.412 0.289 1.00 61.44 O ATOM 0 H GLY A 107 -5.714 -13.472 -1.467 1.00 41.13 H new ATOM 0 HA2 GLY A 107 -3.666 -13.343 -2.615 1.00 34.22 H new ATOM 0 HA3 GLY A 107 -3.846 -11.609 -2.792 1.00 34.22 H new ATOM 1558 N GLU A 108 -1.990 -11.915 -0.918 1.00 42.32 N ATOM 1559 CA GLU A 108 -1.038 -11.801 0.150 1.00 44.25 C ATOM 1560 C GLU A 108 -0.519 -10.373 0.042 1.00 54.22 C ATOM 1561 O GLU A 108 0.040 -10.006 -0.994 1.00 3.23 O ATOM 1562 CB GLU A 108 -0.042 -12.938 -0.107 1.00 51.13 C ATOM 1563 CG GLU A 108 1.198 -12.922 0.750 1.00 21.51 C ATOM 1564 CD GLU A 108 2.166 -14.083 0.481 1.00 43.34 C ATOM 1565 OE1 GLU A 108 1.880 -14.962 -0.368 1.00 32.43 O ATOM 1566 OE2 GLU A 108 3.204 -14.167 1.166 1.00 73.12 O ATOM 0 H GLU A 108 -1.568 -11.717 -1.825 1.00 42.32 H new ATOM 0 HA GLU A 108 -1.380 -11.923 1.178 1.00 44.25 H new ATOM 0 HB2 GLU A 108 -0.555 -13.888 0.045 1.00 51.13 H new ATOM 0 HB3 GLU A 108 0.261 -12.903 -1.154 1.00 51.13 H new ATOM 0 HG2 GLU A 108 1.724 -11.981 0.590 1.00 21.51 H new ATOM 0 HG3 GLU A 108 0.901 -12.947 1.799 1.00 21.51 H new ATOM 1571 N VAL A 109 -0.810 -9.519 1.028 1.00 53.25 N ATOM 1572 CA VAL A 109 -0.623 -8.076 0.876 1.00 21.41 C ATOM 1573 C VAL A 109 0.444 -7.549 1.845 1.00 53.34 C ATOM 1574 O VAL A 109 0.279 -7.598 3.070 1.00 61.52 O ATOM 1575 CB VAL A 109 -1.978 -7.368 1.031 1.00 51.33 C ATOM 1576 CG1 VAL A 109 -1.861 -5.902 0.605 1.00 1.14 C ATOM 1577 CG2 VAL A 109 -3.073 -8.023 0.163 1.00 63.25 C ATOM 0 H VAL A 109 -1.175 -9.803 1.937 1.00 53.25 H new ATOM 0 HA VAL A 109 -0.247 -7.858 -0.124 1.00 21.41 H new ATOM 0 HB VAL A 109 -2.256 -7.449 2.082 1.00 51.33 H new ATOM 0 HG11 VAL A 109 -2.828 -5.412 0.720 1.00 1.14 H new ATOM 0 HG12 VAL A 109 -1.123 -5.399 1.230 1.00 1.14 H new ATOM 0 HG13 VAL A 109 -1.549 -5.850 -0.438 1.00 1.14 H new ATOM 0 HG21 VAL A 109 -4.014 -7.492 0.303 1.00 63.25 H new ATOM 0 HG22 VAL A 109 -2.782 -7.976 -0.886 1.00 63.25 H new ATOM 0 HG23 VAL A 109 -3.197 -9.065 0.459 1.00 63.25 H new ATOM 1587 N ALA A 110 1.547 -7.022 1.315 1.00 15.23 N ATOM 1588 CA ALA A 110 2.684 -6.535 2.084 1.00 63.55 C ATOM 1589 C ALA A 110 2.925 -5.056 1.809 1.00 51.34 C ATOM 1590 O ALA A 110 2.548 -4.523 0.763 1.00 33.33 O ATOM 1591 CB ALA A 110 3.930 -7.362 1.777 1.00 72.42 C ATOM 0 H ALA A 110 1.675 -6.921 0.308 1.00 15.23 H new ATOM 0 HA ALA A 110 2.458 -6.645 3.145 1.00 63.55 H new ATOM 0 HB1 ALA A 110 4.770 -6.984 2.360 1.00 72.42 H new ATOM 0 HB2 ALA A 110 3.748 -8.405 2.037 1.00 72.42 H new ATOM 0 HB3 ALA A 110 4.163 -7.288 0.715 1.00 72.42 H new ATOM 1597 N SER A 111 3.588 -4.391 2.751 1.00 32.50 N ATOM 1598 CA SER A 111 3.828 -2.961 2.713 1.00 0.20 C ATOM 1599 C SER A 111 5.285 -2.702 3.056 1.00 12.41 C ATOM 1600 O SER A 111 5.754 -3.145 4.109 1.00 52.15 O ATOM 1601 CB SER A 111 2.880 -2.256 3.680 1.00 54.43 C ATOM 1602 OG SER A 111 1.549 -2.400 3.226 1.00 71.45 O ATOM 0 H SER A 111 3.979 -4.845 3.576 1.00 32.50 H new ATOM 0 HA SER A 111 3.634 -2.563 1.717 1.00 0.20 H new ATOM 0 HB2 SER A 111 2.982 -2.679 4.679 1.00 54.43 H new ATOM 0 HB3 SER A 111 3.138 -1.200 3.753 1.00 54.43 H new ATOM 0 HG SER A 111 0.930 -2.138 3.939 1.00 71.45 H new ATOM 1607 N PHE A 112 5.987 -1.980 2.184 1.00 20.12 N ATOM 1608 CA PHE A 112 7.423 -1.744 2.249 1.00 23.50 C ATOM 1609 C PHE A 112 7.661 -0.231 2.281 1.00 23.12 C ATOM 1610 O PHE A 112 7.116 0.487 1.441 1.00 15.01 O ATOM 1611 CB PHE A 112 8.110 -2.452 1.061 1.00 1.10 C ATOM 1612 CG PHE A 112 7.777 -1.935 -0.337 1.00 34.21 C ATOM 1613 CD1 PHE A 112 6.577 -2.291 -0.985 1.00 55.12 C ATOM 1614 CD2 PHE A 112 8.699 -1.113 -1.015 1.00 55.15 C ATOM 1615 CE1 PHE A 112 6.288 -1.786 -2.265 1.00 44.41 C ATOM 1616 CE2 PHE A 112 8.413 -0.626 -2.305 1.00 1.21 C ATOM 1617 CZ PHE A 112 7.204 -0.960 -2.929 1.00 63.51 C ATOM 0 H PHE A 112 5.550 -1.526 1.382 1.00 20.12 H new ATOM 0 HA PHE A 112 7.863 -2.163 3.154 1.00 23.50 H new ATOM 0 HB2 PHE A 112 9.189 -2.381 1.201 1.00 1.10 H new ATOM 0 HB3 PHE A 112 7.852 -3.510 1.102 1.00 1.10 H new ATOM 0 HD1 PHE A 112 5.878 -2.954 -0.497 1.00 55.12 H new ATOM 0 HD2 PHE A 112 9.634 -0.854 -0.541 1.00 55.15 H new ATOM 0 HE1 PHE A 112 5.351 -2.037 -2.741 1.00 44.41 H new ATOM 0 HE2 PHE A 112 9.126 0.006 -2.814 1.00 1.21 H new ATOM 0 HZ PHE A 112 6.980 -0.583 -3.916 1.00 63.51 H new ATOM 1626 N PHE A 113 8.461 0.292 3.218 1.00 11.04 N ATOM 1627 CA PHE A 113 8.766 1.731 3.276 1.00 24.14 C ATOM 1628 C PHE A 113 10.265 1.989 3.430 1.00 72.53 C ATOM 1629 O PHE A 113 11.017 1.090 3.798 1.00 4.31 O ATOM 1630 CB PHE A 113 7.920 2.452 4.342 1.00 64.34 C ATOM 1631 CG PHE A 113 8.428 2.388 5.773 1.00 72.11 C ATOM 1632 CD1 PHE A 113 8.438 1.169 6.468 1.00 24.14 C ATOM 1633 CD2 PHE A 113 8.846 3.556 6.437 1.00 13.14 C ATOM 1634 CE1 PHE A 113 8.888 1.096 7.796 1.00 74.23 C ATOM 1635 CE2 PHE A 113 9.232 3.501 7.785 1.00 74.31 C ATOM 1636 CZ PHE A 113 9.277 2.270 8.461 1.00 35.20 C ATOM 0 H PHE A 113 8.911 -0.259 3.949 1.00 11.04 H new ATOM 0 HA PHE A 113 8.481 2.164 2.317 1.00 24.14 H new ATOM 0 HB2 PHE A 113 7.835 3.501 4.057 1.00 64.34 H new ATOM 0 HB3 PHE A 113 6.914 2.033 4.319 1.00 64.34 H new ATOM 0 HD1 PHE A 113 8.094 0.273 5.973 1.00 24.14 H new ATOM 0 HD2 PHE A 113 8.870 4.497 5.908 1.00 13.14 H new ATOM 0 HE1 PHE A 113 8.935 0.143 8.303 1.00 74.23 H new ATOM 0 HE2 PHE A 113 9.496 4.410 8.306 1.00 74.31 H new ATOM 0 HZ PHE A 113 9.609 2.227 9.488 1.00 35.20 H new ATOM 1645 N THR A 114 10.699 3.223 3.161 1.00 60.14 N ATOM 1646 CA THR A 114 12.107 3.596 3.019 1.00 63.53 C ATOM 1647 C THR A 114 12.525 4.713 3.984 1.00 20.42 C ATOM 1648 O THR A 114 13.646 5.218 3.903 1.00 44.33 O ATOM 1649 CB THR A 114 12.373 3.996 1.554 1.00 65.14 C ATOM 1650 OG1 THR A 114 11.525 5.040 1.110 1.00 25.35 O ATOM 1651 CG2 THR A 114 12.217 2.816 0.597 1.00 70.11 C ATOM 0 H THR A 114 10.063 4.010 3.033 1.00 60.14 H new ATOM 0 HA THR A 114 12.717 2.732 3.283 1.00 63.53 H new ATOM 0 HB THR A 114 13.406 4.345 1.542 1.00 65.14 H new ATOM 0 HG1 THR A 114 11.123 5.487 1.884 1.00 25.35 H new ATOM 0 HG21 THR A 114 12.414 3.146 -0.423 1.00 70.11 H new ATOM 0 HG22 THR A 114 12.924 2.032 0.868 1.00 70.11 H new ATOM 0 HG23 THR A 114 11.201 2.426 0.662 1.00 70.11 H new ATOM 1659 N SER A 115 11.632 5.128 4.885 1.00 12.32 N ATOM 1660 CA SER A 115 11.598 6.489 5.416 1.00 73.10 C ATOM 1661 C SER A 115 11.563 6.534 6.949 1.00 14.32 C ATOM 1662 O SER A 115 10.933 7.392 7.568 1.00 64.03 O ATOM 1663 CB SER A 115 10.384 7.190 4.827 1.00 3.23 C ATOM 1664 OG SER A 115 10.236 6.973 3.433 1.00 0.43 O ATOM 0 H SER A 115 10.907 4.522 5.269 1.00 12.32 H new ATOM 0 HA SER A 115 12.518 6.998 5.129 1.00 73.10 H new ATOM 0 HB2 SER A 115 9.487 6.842 5.340 1.00 3.23 H new ATOM 0 HB3 SER A 115 10.464 8.261 5.015 1.00 3.23 H new ATOM 0 HG SER A 115 9.799 7.750 3.026 1.00 0.43 H new ATOM 1669 N ALA A 116 12.207 5.557 7.566 1.00 72.52 N ATOM 1670 CA ALA A 116 12.106 5.252 8.988 1.00 52.13 C ATOM 1671 C ALA A 116 12.982 6.131 9.897 1.00 32.51 C ATOM 1672 O ALA A 116 13.434 5.667 10.946 1.00 71.50 O ATOM 1673 CB ALA A 116 12.382 3.765 9.199 1.00 43.14 C ATOM 0 H ALA A 116 12.840 4.928 7.072 1.00 72.52 H new ATOM 0 HA ALA A 116 11.088 5.492 9.294 1.00 52.13 H new ATOM 0 HB1 ALA A 116 12.308 3.528 10.260 1.00 43.14 H new ATOM 0 HB2 ALA A 116 11.651 3.177 8.645 1.00 43.14 H new ATOM 0 HB3 ALA A 116 13.384 3.527 8.843 1.00 43.14 H new ATOM 1679 N GLY A 117 13.243 7.384 9.511 1.00 54.22 N ATOM 1680 CA GLY A 117 14.039 8.331 10.289 1.00 13.01 C ATOM 1681 C GLY A 117 13.468 8.514 11.685 1.00 61.04 C ATOM 1682 O GLY A 117 14.193 8.372 12.670 1.00 55.51 O ATOM 0 H GLY A 117 12.899 7.773 8.633 1.00 54.22 H new ATOM 0 HA2 GLY A 117 15.067 7.975 10.358 1.00 13.01 H new ATOM 0 HA3 GLY A 117 14.068 9.293 9.776 1.00 13.01 H new ATOM 1686 N THR A 118 12.164 8.782 11.778 1.00 64.03 N ATOM 1687 CA THR A 118 11.500 9.079 13.044 1.00 14.22 C ATOM 1688 C THR A 118 10.280 8.173 13.281 1.00 74.13 C ATOM 1689 O THR A 118 9.588 8.344 14.284 1.00 73.32 O ATOM 1690 CB THR A 118 11.140 10.584 13.098 1.00 23.34 C ATOM 1691 OG1 THR A 118 12.064 11.399 12.389 1.00 12.42 O ATOM 1692 CG2 THR A 118 11.165 11.104 14.533 1.00 71.21 C ATOM 0 H THR A 118 11.538 8.799 10.973 1.00 64.03 H new ATOM 0 HA THR A 118 12.188 8.863 13.861 1.00 14.22 H new ATOM 0 HB THR A 118 10.149 10.648 12.650 1.00 23.34 H new ATOM 0 HG1 THR A 118 11.789 12.337 12.454 1.00 12.42 H new ATOM 0 HG21 THR A 118 10.908 12.163 14.541 1.00 71.21 H new ATOM 0 HG22 THR A 118 10.442 10.551 15.133 1.00 71.21 H new ATOM 0 HG23 THR A 118 12.162 10.969 14.951 1.00 71.21 H new ATOM 1700 N ASN A 119 9.982 7.211 12.395 1.00 14.12 N ATOM 1701 CA ASN A 119 8.769 6.395 12.482 1.00 44.32 C ATOM 1702 C ASN A 119 9.048 4.958 12.091 1.00 32.42 C ATOM 1703 O ASN A 119 9.681 4.712 11.069 1.00 1.45 O ATOM 1704 CB ASN A 119 7.657 6.962 11.601 1.00 72.24 C ATOM 1705 CG ASN A 119 7.031 8.137 12.323 1.00 20.42 C ATOM 1706 OD1 ASN A 119 7.212 9.270 11.901 1.00 11.14 O ATOM 1707 ND2 ASN A 119 6.330 7.884 13.420 1.00 54.52 N ATOM 0 H ASN A 119 10.577 6.979 11.600 1.00 14.12 H new ATOM 0 HA ASN A 119 8.439 6.418 13.520 1.00 44.32 H new ATOM 0 HB2 ASN A 119 8.059 7.278 10.638 1.00 72.24 H new ATOM 0 HB3 ASN A 119 6.907 6.198 11.398 1.00 72.24 H new ATOM 0 HD21 ASN A 119 5.916 8.652 13.949 1.00 54.52 H new ATOM 0 HD22 ASN A 119 6.205 6.922 13.735 1.00 54.52 H new ATOM 1713 N HIS A 120 8.492 4.023 12.857 1.00 73.13 N ATOM 1714 CA HIS A 120 8.259 2.649 12.446 1.00 23.00 C ATOM 1715 C HIS A 120 6.972 2.224 13.142 1.00 41.32 C ATOM 1716 O HIS A 120 5.925 2.190 12.503 1.00 44.13 O ATOM 1717 CB HIS A 120 9.469 1.754 12.772 1.00 43.01 C ATOM 1718 CG HIS A 120 9.421 0.365 12.173 1.00 13.33 C ATOM 1719 ND1 HIS A 120 10.229 -0.692 12.534 1.00 20.53 N ATOM 1720 CD2 HIS A 120 8.689 -0.043 11.088 1.00 0.13 C ATOM 1721 CE1 HIS A 120 10.003 -1.701 11.682 1.00 23.12 C ATOM 1722 NE2 HIS A 120 9.086 -1.345 10.773 1.00 44.31 N ATOM 0 H HIS A 120 8.183 4.211 13.811 1.00 73.13 H new ATOM 0 HA HIS A 120 8.144 2.552 11.366 1.00 23.00 H new ATOM 0 HB2 HIS A 120 10.374 2.252 12.423 1.00 43.01 H new ATOM 0 HB3 HIS A 120 9.552 1.663 13.855 1.00 43.01 H new ATOM 0 HD2 HIS A 120 7.940 0.538 10.570 1.00 0.13 H new ATOM 0 HE1 HIS A 120 10.491 -2.664 11.722 1.00 23.12 H new ATOM 0 HE2 HIS A 120 8.743 -1.915 10.000 1.00 44.31 H new ATOM 1729 N LYS A 121 7.025 2.042 14.467 1.00 72.03 N ATOM 1730 CA LYS A 121 5.920 1.589 15.308 1.00 20.43 C ATOM 1731 C LYS A 121 4.603 2.296 14.992 1.00 64.10 C ATOM 1732 O LYS A 121 3.602 1.608 14.782 1.00 73.00 O ATOM 1733 CB LYS A 121 6.295 1.764 16.792 1.00 15.54 C ATOM 1734 CG LYS A 121 7.313 0.712 17.243 1.00 22.43 C ATOM 1735 CD LYS A 121 7.647 0.843 18.732 1.00 2.44 C ATOM 1736 CE LYS A 121 8.621 -0.264 19.159 1.00 22.10 C ATOM 1737 NZ LYS A 121 9.327 0.071 20.413 1.00 14.32 N ATOM 0 H LYS A 121 7.877 2.215 15.001 1.00 72.03 H new ATOM 0 HA LYS A 121 5.756 0.533 15.093 1.00 20.43 H new ATOM 0 HB2 LYS A 121 6.707 2.761 16.949 1.00 15.54 H new ATOM 0 HB3 LYS A 121 5.398 1.690 17.406 1.00 15.54 H new ATOM 0 HG2 LYS A 121 6.917 -0.284 17.046 1.00 22.43 H new ATOM 0 HG3 LYS A 121 8.226 0.814 16.656 1.00 22.43 H new ATOM 0 HD2 LYS A 121 8.088 1.820 18.928 1.00 2.44 H new ATOM 0 HD3 LYS A 121 6.733 0.781 19.323 1.00 2.44 H new ATOM 0 HE2 LYS A 121 8.074 -1.197 19.290 1.00 22.10 H new ATOM 0 HE3 LYS A 121 9.350 -0.431 18.366 1.00 22.10 H new ATOM 0 HZ1 LYS A 121 9.974 -0.703 20.665 1.00 14.32 H new ATOM 0 HZ2 LYS A 121 9.871 0.948 20.282 1.00 14.32 H new ATOM 0 HZ3 LYS A 121 8.634 0.205 21.177 1.00 14.32 H new ATOM 1747 N ALA A 122 4.599 3.631 14.922 1.00 71.34 N ATOM 1748 CA ALA A 122 3.377 4.378 14.672 1.00 21.34 C ATOM 1749 C ALA A 122 2.773 4.014 13.315 1.00 21.35 C ATOM 1750 O ALA A 122 1.572 3.785 13.215 1.00 21.14 O ATOM 1751 CB ALA A 122 3.684 5.874 14.737 1.00 55.43 C ATOM 0 H ALA A 122 5.431 4.210 15.036 1.00 71.34 H new ATOM 0 HA ALA A 122 2.643 4.120 15.436 1.00 21.34 H new ATOM 0 HB1 ALA A 122 2.772 6.441 14.550 1.00 55.43 H new ATOM 0 HB2 ALA A 122 4.071 6.123 15.725 1.00 55.43 H new ATOM 0 HB3 ALA A 122 4.429 6.126 13.982 1.00 55.43 H new ATOM 1757 N TYR A 123 3.602 3.969 12.268 1.00 71.10 N ATOM 1758 CA TYR A 123 3.157 3.759 10.898 1.00 1.15 C ATOM 1759 C TYR A 123 2.441 2.419 10.730 1.00 1.25 C ATOM 1760 O TYR A 123 1.497 2.356 9.952 1.00 72.41 O ATOM 1761 CB TYR A 123 4.349 3.879 9.943 1.00 41.10 C ATOM 1762 CG TYR A 123 4.037 3.549 8.495 1.00 2.33 C ATOM 1763 CD1 TYR A 123 3.567 4.538 7.610 1.00 62.33 C ATOM 1764 CD2 TYR A 123 4.216 2.231 8.031 1.00 35.14 C ATOM 1765 CE1 TYR A 123 3.341 4.226 6.256 1.00 13.45 C ATOM 1766 CE2 TYR A 123 3.992 1.913 6.681 1.00 31.44 C ATOM 1767 CZ TYR A 123 3.568 2.913 5.783 1.00 14.44 C ATOM 1768 OH TYR A 123 3.395 2.603 4.470 1.00 13.33 O ATOM 0 H TYR A 123 4.612 4.079 12.355 1.00 71.10 H new ATOM 0 HA TYR A 123 2.429 4.532 10.652 1.00 1.15 H new ATOM 0 HB2 TYR A 123 4.737 4.896 9.994 1.00 41.10 H new ATOM 0 HB3 TYR A 123 5.143 3.217 10.289 1.00 41.10 H new ATOM 0 HD1 TYR A 123 3.379 5.539 7.971 1.00 62.33 H new ATOM 0 HD2 TYR A 123 4.528 1.459 8.719 1.00 35.14 H new ATOM 0 HE1 TYR A 123 2.994 4.991 5.577 1.00 13.45 H new ATOM 0 HE2 TYR A 123 4.145 0.903 6.332 1.00 31.44 H new ATOM 0 HH TYR A 123 3.392 3.426 3.937 1.00 13.33 H new ATOM 1777 N VAL A 124 2.844 1.374 11.457 1.00 42.13 N ATOM 1778 CA VAL A 124 2.159 0.082 11.453 1.00 14.53 C ATOM 1779 C VAL A 124 0.692 0.297 11.820 1.00 71.24 C ATOM 1780 O VAL A 124 -0.207 -0.053 11.056 1.00 0.22 O ATOM 1781 CB VAL A 124 2.853 -0.879 12.438 1.00 4.21 C ATOM 1782 CG1 VAL A 124 2.239 -2.287 12.449 1.00 72.33 C ATOM 1783 CG2 VAL A 124 4.340 -1.019 12.079 1.00 72.12 C ATOM 0 H VAL A 124 3.660 1.402 12.068 1.00 42.13 H new ATOM 0 HA VAL A 124 2.206 -0.368 10.462 1.00 14.53 H new ATOM 0 HB VAL A 124 2.718 -0.440 13.427 1.00 4.21 H new ATOM 0 HG11 VAL A 124 2.775 -2.912 13.164 1.00 72.33 H new ATOM 0 HG12 VAL A 124 1.190 -2.224 12.737 1.00 72.33 H new ATOM 0 HG13 VAL A 124 2.316 -2.725 11.454 1.00 72.33 H new ATOM 0 HG21 VAL A 124 4.821 -1.700 12.781 1.00 72.12 H new ATOM 0 HG22 VAL A 124 4.434 -1.414 11.067 1.00 72.12 H new ATOM 0 HG23 VAL A 124 4.821 -0.042 12.133 1.00 72.12 H new ATOM 1793 N SER A 125 0.450 0.869 12.992 1.00 73.40 N ATOM 1794 CA SER A 125 -0.874 1.074 13.528 1.00 74.41 C ATOM 1795 C SER A 125 -1.666 1.999 12.614 1.00 52.24 C ATOM 1796 O SER A 125 -2.802 1.679 12.266 1.00 2.13 O ATOM 1797 CB SER A 125 -0.678 1.646 14.922 1.00 21.02 C ATOM 1798 OG SER A 125 -0.456 0.559 15.807 1.00 13.12 O ATOM 0 H SER A 125 1.191 1.209 13.605 1.00 73.40 H new ATOM 0 HA SER A 125 -1.451 0.151 13.588 1.00 74.41 H new ATOM 0 HB2 SER A 125 0.169 2.332 14.938 1.00 21.02 H new ATOM 0 HB3 SER A 125 -1.555 2.216 15.228 1.00 21.02 H new ATOM 0 HG SER A 125 -0.324 0.899 16.717 1.00 13.12 H new ATOM 1803 N HIS A 126 -1.039 3.081 12.153 1.00 31.01 N ATOM 1804 CA HIS A 126 -1.661 4.018 11.244 1.00 35.11 C ATOM 1805 C HIS A 126 -2.081 3.342 9.936 1.00 4.25 C ATOM 1806 O HIS A 126 -3.165 3.605 9.427 1.00 0.43 O ATOM 1807 CB HIS A 126 -0.678 5.141 10.917 1.00 23.31 C ATOM 1808 CG HIS A 126 -0.269 6.029 12.066 1.00 33.25 C ATOM 1809 ND1 HIS A 126 0.855 6.822 12.064 1.00 1.11 N ATOM 1810 CD2 HIS A 126 -0.952 6.270 13.233 1.00 15.55 C ATOM 1811 CE1 HIS A 126 0.832 7.549 13.192 1.00 51.41 C ATOM 1812 NE2 HIS A 126 -0.230 7.237 13.948 1.00 73.11 N ATOM 0 H HIS A 126 -0.082 3.325 12.406 1.00 31.01 H new ATOM 0 HA HIS A 126 -2.551 4.413 11.734 1.00 35.11 H new ATOM 0 HB2 HIS A 126 0.222 4.695 10.493 1.00 23.31 H new ATOM 0 HB3 HIS A 126 -1.120 5.767 10.142 1.00 23.31 H new ATOM 0 HD2 HIS A 126 -1.874 5.802 13.543 1.00 15.55 H new ATOM 0 HE1 HIS A 126 1.573 8.289 13.456 1.00 51.41 H new ATOM 0 HE2 HIS A 126 -0.466 7.625 14.861 1.00 73.11 H new ATOM 1819 N PHE A 127 -1.216 2.498 9.364 1.00 62.13 N ATOM 1820 CA PHE A 127 -1.498 1.774 8.137 1.00 24.42 C ATOM 1821 C PHE A 127 -2.637 0.789 8.355 1.00 71.12 C ATOM 1822 O PHE A 127 -3.515 0.719 7.505 1.00 12.43 O ATOM 1823 CB PHE A 127 -0.244 1.053 7.626 1.00 75.22 C ATOM 1824 CG PHE A 127 -0.531 0.126 6.462 1.00 35.31 C ATOM 1825 CD1 PHE A 127 -1.025 0.645 5.253 1.00 15.12 C ATOM 1826 CD2 PHE A 127 -0.388 -1.265 6.615 1.00 33.11 C ATOM 1827 CE1 PHE A 127 -1.328 -0.216 4.186 1.00 12.54 C ATOM 1828 CE2 PHE A 127 -0.706 -2.130 5.555 1.00 35.52 C ATOM 1829 CZ PHE A 127 -1.166 -1.601 4.338 1.00 54.11 C ATOM 0 H PHE A 127 -0.293 2.302 9.750 1.00 62.13 H new ATOM 0 HA PHE A 127 -1.803 2.493 7.376 1.00 24.42 H new ATOM 0 HB2 PHE A 127 0.496 1.793 7.321 1.00 75.22 H new ATOM 0 HB3 PHE A 127 0.197 0.479 8.441 1.00 75.22 H new ATOM 0 HD1 PHE A 127 -1.172 1.709 5.144 1.00 15.12 H new ATOM 0 HD2 PHE A 127 -0.032 -1.669 7.551 1.00 33.11 H new ATOM 0 HE1 PHE A 127 -1.685 0.187 3.250 1.00 12.54 H new ATOM 0 HE2 PHE A 127 -0.597 -3.198 5.675 1.00 35.52 H new ATOM 0 HZ PHE A 127 -1.396 -2.263 3.516 1.00 54.11 H new ATOM 1838 N ASN A 128 -2.659 0.071 9.485 1.00 23.34 N ATOM 1839 CA ASN A 128 -3.757 -0.834 9.812 1.00 63.33 C ATOM 1840 C ASN A 128 -5.066 -0.053 9.764 1.00 31.34 C ATOM 1841 O ASN A 128 -5.985 -0.455 9.060 1.00 52.33 O ATOM 1842 CB ASN A 128 -3.575 -1.507 11.188 1.00 44.41 C ATOM 1843 CG ASN A 128 -2.877 -2.860 11.109 1.00 55.13 C ATOM 1844 OD1 ASN A 128 -3.159 -3.679 10.236 1.00 55.35 O ATOM 1845 ND2 ASN A 128 -1.956 -3.152 12.012 1.00 60.33 N ATOM 0 H ASN A 128 -1.922 0.103 10.189 1.00 23.34 H new ATOM 0 HA ASN A 128 -3.771 -1.638 9.076 1.00 63.33 H new ATOM 0 HB2 ASN A 128 -2.999 -0.846 11.835 1.00 44.41 H new ATOM 0 HB3 ASN A 128 -4.552 -1.636 11.654 1.00 44.41 H new ATOM 0 HD21 ASN A 128 -1.482 -4.055 11.983 1.00 60.33 H new ATOM 0 HD22 ASN A 128 -1.720 -2.475 12.737 1.00 60.33 H new ATOM 1851 N GLU A 129 -5.137 1.098 10.436 1.00 54.50 N ATOM 1852 CA GLU A 129 -6.327 1.946 10.440 1.00 72.04 C ATOM 1853 C GLU A 129 -6.763 2.367 9.035 1.00 13.34 C ATOM 1854 O GLU A 129 -7.935 2.679 8.804 1.00 11.14 O ATOM 1855 CB GLU A 129 -6.048 3.216 11.257 1.00 31.23 C ATOM 1856 CG GLU A 129 -5.863 2.986 12.761 1.00 44.31 C ATOM 1857 CD GLU A 129 -5.232 4.212 13.425 1.00 13.52 C ATOM 1858 OE1 GLU A 129 -5.825 5.315 13.311 1.00 22.34 O ATOM 1859 OE2 GLU A 129 -4.130 4.107 14.003 1.00 14.14 O ATOM 0 H GLU A 129 -4.367 1.468 10.994 1.00 54.50 H new ATOM 0 HA GLU A 129 -7.131 1.356 10.880 1.00 72.04 H new ATOM 0 HB2 GLU A 129 -5.151 3.694 10.864 1.00 31.23 H new ATOM 0 HB3 GLU A 129 -6.872 3.914 11.109 1.00 31.23 H new ATOM 0 HG2 GLU A 129 -6.827 2.773 13.222 1.00 44.31 H new ATOM 0 HG3 GLU A 129 -5.232 2.113 12.925 1.00 44.31 H new ATOM 1864 N TRP A 130 -5.831 2.434 8.085 1.00 43.24 N ATOM 1865 CA TRP A 130 -6.095 2.907 6.738 1.00 35.22 C ATOM 1866 C TRP A 130 -6.248 1.735 5.758 1.00 21.15 C ATOM 1867 O TRP A 130 -6.527 1.983 4.583 1.00 31.24 O ATOM 1868 CB TRP A 130 -5.041 3.964 6.358 1.00 71.14 C ATOM 1869 CG TRP A 130 -5.033 5.245 7.171 1.00 13.45 C ATOM 1870 CD1 TRP A 130 -5.723 5.494 8.315 1.00 74.04 C ATOM 1871 CD2 TRP A 130 -4.263 6.470 6.927 1.00 41.33 C ATOM 1872 NE1 TRP A 130 -5.423 6.749 8.790 1.00 61.41 N ATOM 1873 CE2 TRP A 130 -4.515 7.387 7.988 1.00 71.30 C ATOM 1874 CE3 TRP A 130 -3.352 6.902 5.940 1.00 14.24 C ATOM 1875 CZ2 TRP A 130 -3.896 8.640 8.078 1.00 24.31 C ATOM 1876 CZ3 TRP A 130 -2.718 8.158 6.022 1.00 75.01 C ATOM 1877 CH2 TRP A 130 -3.011 9.047 7.073 1.00 43.42 C ATOM 0 H TRP A 130 -4.861 2.157 8.237 1.00 43.24 H new ATOM 0 HA TRP A 130 -7.059 3.414 6.684 1.00 35.22 H new ATOM 0 HB2 TRP A 130 -4.056 3.505 6.438 1.00 71.14 H new ATOM 0 HB3 TRP A 130 -5.186 4.227 5.310 1.00 71.14 H new ATOM 0 HD1 TRP A 130 -6.409 4.804 8.784 1.00 74.04 H new ATOM 0 HE1 TRP A 130 -5.827 7.154 9.635 1.00 61.41 H new ATOM 0 HE3 TRP A 130 -3.136 6.255 5.102 1.00 14.24 H new ATOM 0 HZ2 TRP A 130 -4.100 9.288 8.917 1.00 24.31 H new ATOM 0 HZ3 TRP A 130 -1.998 8.442 5.269 1.00 75.01 H new ATOM 0 HH2 TRP A 130 -2.560 10.028 7.104 1.00 43.42 H new ATOM 1887 N ALA A 131 -6.137 0.474 6.208 1.00 53.14 N ATOM 1888 CA ALA A 131 -6.066 -0.692 5.320 1.00 21.22 C ATOM 1889 C ALA A 131 -6.692 -1.980 5.874 1.00 42.21 C ATOM 1890 O ALA A 131 -6.529 -3.050 5.278 1.00 23.14 O ATOM 1891 CB ALA A 131 -4.602 -0.938 4.937 1.00 54.41 C ATOM 0 H ALA A 131 -6.094 0.237 7.199 1.00 53.14 H new ATOM 0 HA ALA A 131 -6.673 -0.443 4.449 1.00 21.22 H new ATOM 0 HB1 ALA A 131 -4.539 -1.803 4.277 1.00 54.41 H new ATOM 0 HB2 ALA A 131 -4.208 -0.061 4.424 1.00 54.41 H new ATOM 0 HB3 ALA A 131 -4.017 -1.125 5.837 1.00 54.41 H new ATOM 1897 N ASP A 132 -7.373 -1.927 7.016 1.00 12.53 N ATOM 1898 CA ASP A 132 -7.944 -3.077 7.712 1.00 43.52 C ATOM 1899 C ASP A 132 -9.141 -3.667 6.961 1.00 63.32 C ATOM 1900 O ASP A 132 -10.312 -3.418 7.263 1.00 34.31 O ATOM 1901 CB ASP A 132 -8.386 -2.667 9.103 1.00 35.32 C ATOM 1902 CG ASP A 132 -8.899 -3.842 9.926 1.00 62.31 C ATOM 1903 OD1 ASP A 132 -8.104 -4.777 10.187 1.00 72.21 O ATOM 1904 OD2 ASP A 132 -10.028 -3.757 10.463 1.00 23.44 O ATOM 0 H ASP A 132 -7.549 -1.047 7.501 1.00 12.53 H new ATOM 0 HA ASP A 132 -7.169 -3.841 7.768 1.00 43.52 H new ATOM 0 HB2 ASP A 132 -7.549 -2.202 9.624 1.00 35.32 H new ATOM 0 HB3 ASP A 132 -9.170 -1.914 9.024 1.00 35.32 H new ATOM 1908 N GLY A 133 -8.823 -4.465 5.959 1.00 11.53 N ATOM 1909 CA GLY A 133 -9.681 -5.490 5.384 1.00 11.10 C ATOM 1910 C GLY A 133 -8.835 -6.509 4.632 1.00 14.12 C ATOM 1911 O GLY A 133 -9.093 -7.710 4.694 1.00 3.53 O ATOM 0 H GLY A 133 -7.914 -4.415 5.499 1.00 11.53 H new ATOM 0 HA2 GLY A 133 -10.249 -5.986 6.171 1.00 11.10 H new ATOM 0 HA3 GLY A 133 -10.404 -5.034 4.708 1.00 11.10 H new ATOM 1915 N LEU A 134 -7.799 -6.037 3.935 1.00 13.21 N ATOM 1916 CA LEU A 134 -7.000 -6.873 3.059 1.00 61.35 C ATOM 1917 C LEU A 134 -6.025 -7.705 3.892 1.00 31.33 C ATOM 1918 O LEU A 134 -5.482 -7.205 4.883 1.00 13.14 O ATOM 1919 CB LEU A 134 -6.224 -6.001 2.065 1.00 63.55 C ATOM 1920 CG LEU A 134 -7.037 -5.103 1.120 1.00 4.23 C ATOM 1921 CD1 LEU A 134 -7.939 -5.903 0.167 1.00 11.21 C ATOM 1922 CD2 LEU A 134 -7.825 -3.970 1.792 1.00 63.15 C ATOM 0 H LEU A 134 -7.497 -5.063 3.967 1.00 13.21 H new ATOM 0 HA LEU A 134 -7.659 -7.540 2.503 1.00 61.35 H new ATOM 0 HB2 LEU A 134 -5.547 -5.364 2.634 1.00 63.55 H new ATOM 0 HB3 LEU A 134 -5.605 -6.658 1.454 1.00 63.55 H new ATOM 0 HG LEU A 134 -6.264 -4.606 0.534 1.00 4.23 H new ATOM 0 HD11 LEU A 134 -8.489 -5.216 -0.476 1.00 11.21 H new ATOM 0 HD12 LEU A 134 -7.325 -6.562 -0.447 1.00 11.21 H new ATOM 0 HD13 LEU A 134 -8.643 -6.499 0.747 1.00 11.21 H new ATOM 0 HD21 LEU A 134 -8.361 -3.400 1.033 1.00 63.15 H new ATOM 0 HD22 LEU A 134 -8.538 -4.393 2.500 1.00 63.15 H new ATOM 0 HD23 LEU A 134 -7.136 -3.312 2.321 1.00 63.15 H new ATOM 1933 N ASN A 135 -5.776 -8.935 3.444 1.00 62.53 N ATOM 1934 CA ASN A 135 -4.927 -9.938 4.102 1.00 14.04 C ATOM 1935 C ASN A 135 -3.469 -9.489 4.197 1.00 0.34 C ATOM 1936 O ASN A 135 -2.697 -9.666 3.250 1.00 23.33 O ATOM 1937 CB ASN A 135 -4.988 -11.271 3.347 1.00 35.43 C ATOM 1938 CG ASN A 135 -4.014 -12.306 3.909 1.00 11.34 C ATOM 1939 OD1 ASN A 135 -4.131 -12.752 5.053 1.00 60.24 O ATOM 1940 ND2 ASN A 135 -3.032 -12.679 3.112 1.00 42.22 N ATOM 0 H ASN A 135 -6.178 -9.279 2.572 1.00 62.53 H new ATOM 0 HA ASN A 135 -5.314 -10.061 5.113 1.00 14.04 H new ATOM 0 HB2 ASN A 135 -6.002 -11.667 3.396 1.00 35.43 H new ATOM 0 HB3 ASN A 135 -4.764 -11.099 2.294 1.00 35.43 H new ATOM 0 HD21 ASN A 135 -2.341 -13.355 3.436 1.00 42.22 H new ATOM 0 HD22 ASN A 135 -2.964 -12.291 2.171 1.00 42.22 H new ATOM 1946 N VAL A 136 -3.066 -8.946 5.342 1.00 35.33 N ATOM 1947 CA VAL A 136 -1.679 -8.573 5.574 1.00 55.31 C ATOM 1948 C VAL A 136 -0.857 -9.812 5.924 1.00 75.21 C ATOM 1949 O VAL A 136 -1.304 -10.649 6.715 1.00 31.50 O ATOM 1950 CB VAL A 136 -1.585 -7.511 6.691 1.00 74.44 C ATOM 1951 CG1 VAL A 136 -0.137 -7.100 6.982 1.00 55.31 C ATOM 1952 CG2 VAL A 136 -2.363 -6.243 6.325 1.00 22.40 C ATOM 0 H VAL A 136 -3.688 -8.754 6.128 1.00 35.33 H new ATOM 0 HA VAL A 136 -1.272 -8.136 4.662 1.00 55.31 H new ATOM 0 HB VAL A 136 -2.016 -7.979 7.576 1.00 74.44 H new ATOM 0 HG11 VAL A 136 -0.123 -6.352 7.774 1.00 55.31 H new ATOM 0 HG12 VAL A 136 0.433 -7.974 7.298 1.00 55.31 H new ATOM 0 HG13 VAL A 136 0.311 -6.682 6.080 1.00 55.31 H new ATOM 0 HG21 VAL A 136 -2.276 -5.517 7.133 1.00 22.40 H new ATOM 0 HG22 VAL A 136 -1.954 -5.817 5.409 1.00 22.40 H new ATOM 0 HG23 VAL A 136 -3.413 -6.492 6.173 1.00 22.40 H new ATOM 1962 N ILE A 137 0.380 -9.874 5.425 1.00 2.03 N ATOM 1963 CA ILE A 137 1.426 -10.764 5.951 1.00 54.34 C ATOM 1964 C ILE A 137 2.720 -10.013 6.332 1.00 44.21 C ATOM 1965 O ILE A 137 3.668 -10.617 6.842 1.00 72.54 O ATOM 1966 CB ILE A 137 1.676 -11.962 5.009 1.00 43.25 C ATOM 1967 CG1 ILE A 137 2.532 -11.614 3.782 1.00 14.22 C ATOM 1968 CG2 ILE A 137 0.389 -12.697 4.595 1.00 40.25 C ATOM 1969 CD1 ILE A 137 1.963 -10.578 2.818 1.00 23.44 C ATOM 0 H ILE A 137 0.690 -9.304 4.638 1.00 2.03 H new ATOM 0 HA ILE A 137 1.051 -11.175 6.888 1.00 54.34 H new ATOM 0 HB ILE A 137 2.259 -12.656 5.615 1.00 43.25 H new ATOM 0 HG12 ILE A 137 3.500 -11.256 4.133 1.00 14.22 H new ATOM 0 HG13 ILE A 137 2.716 -12.532 3.224 1.00 14.22 H new ATOM 0 HG21 ILE A 137 0.640 -13.526 3.934 1.00 40.25 H new ATOM 0 HG22 ILE A 137 -0.113 -13.080 5.483 1.00 40.25 H new ATOM 0 HG23 ILE A 137 -0.273 -12.006 4.074 1.00 40.25 H new ATOM 0 HD11 ILE A 137 2.662 -10.423 1.997 1.00 23.44 H new ATOM 0 HD12 ILE A 137 1.012 -10.933 2.422 1.00 23.44 H new ATOM 0 HD13 ILE A 137 1.808 -9.637 3.345 1.00 23.44 H new ATOM 1980 N GLY A 138 2.795 -8.696 6.126 1.00 0.13 N ATOM 1981 CA GLY A 138 3.878 -7.902 6.682 1.00 74.31 C ATOM 1982 C GLY A 138 3.720 -6.421 6.389 1.00 21.11 C ATOM 1983 O GLY A 138 3.024 -6.021 5.450 1.00 4.33 O ATOM 0 H GLY A 138 2.118 -8.164 5.579 1.00 0.13 H new ATOM 0 HA2 GLY A 138 3.919 -8.054 7.761 1.00 74.31 H new ATOM 0 HA3 GLY A 138 4.827 -8.251 6.274 1.00 74.31 H new ATOM 1987 N VAL A 139 4.375 -5.618 7.221 1.00 51.02 N ATOM 1988 CA VAL A 139 4.442 -4.166 7.213 1.00 24.20 C ATOM 1989 C VAL A 139 5.844 -3.877 7.759 1.00 44.05 C ATOM 1990 O VAL A 139 6.046 -3.771 8.972 1.00 31.12 O ATOM 1991 CB VAL A 139 3.279 -3.566 8.046 1.00 14.00 C ATOM 1992 CG1 VAL A 139 3.273 -2.032 8.041 1.00 64.13 C ATOM 1993 CG2 VAL A 139 1.916 -4.023 7.511 1.00 1.00 C ATOM 0 H VAL A 139 4.923 -6.007 7.989 1.00 51.02 H new ATOM 0 HA VAL A 139 4.312 -3.705 6.234 1.00 24.20 H new ATOM 0 HB VAL A 139 3.442 -3.926 9.062 1.00 14.00 H new ATOM 0 HG11 VAL A 139 2.437 -1.669 8.640 1.00 64.13 H new ATOM 0 HG12 VAL A 139 4.208 -1.663 8.462 1.00 64.13 H new ATOM 0 HG13 VAL A 139 3.169 -1.672 7.017 1.00 64.13 H new ATOM 0 HG21 VAL A 139 1.122 -3.585 8.116 1.00 1.00 H new ATOM 0 HG22 VAL A 139 1.804 -3.699 6.476 1.00 1.00 H new ATOM 0 HG23 VAL A 139 1.852 -5.110 7.560 1.00 1.00 H new ATOM 2003 N ALA A 140 6.838 -3.870 6.865 1.00 51.31 N ATOM 2004 CA ALA A 140 8.257 -3.807 7.198 1.00 35.54 C ATOM 2005 C ALA A 140 8.895 -2.597 6.522 1.00 32.52 C ATOM 2006 O ALA A 140 8.352 -2.069 5.548 1.00 53.12 O ATOM 2007 CB ALA A 140 8.933 -5.101 6.734 1.00 2.24 C ATOM 0 H ALA A 140 6.668 -3.909 5.860 1.00 51.31 H new ATOM 0 HA ALA A 140 8.382 -3.702 8.276 1.00 35.54 H new ATOM 0 HB1 ALA A 140 9.995 -5.065 6.978 1.00 2.24 H new ATOM 0 HB2 ALA A 140 8.474 -5.952 7.237 1.00 2.24 H new ATOM 0 HB3 ALA A 140 8.812 -5.208 5.656 1.00 2.24 H new ATOM 2013 N ARG A 141 10.054 -2.158 7.004 1.00 35.31 N ATOM 2014 CA ARG A 141 10.936 -1.302 6.229 1.00 43.14 C ATOM 2015 C ARG A 141 11.630 -2.185 5.201 1.00 33.52 C ATOM 2016 O ARG A 141 11.872 -3.365 5.472 1.00 32.40 O ATOM 2017 CB ARG A 141 11.962 -0.675 7.173 1.00 11.44 C ATOM 2018 CG ARG A 141 12.774 0.463 6.541 1.00 3.11 C ATOM 2019 CD ARG A 141 13.866 0.832 7.536 1.00 63.41 C ATOM 2020 NE ARG A 141 14.707 1.962 7.137 1.00 31.10 N ATOM 2021 CZ ARG A 141 15.550 2.577 7.974 1.00 54.24 C ATOM 2022 NH1 ARG A 141 15.714 2.123 9.215 1.00 1.11 N ATOM 2023 NH2 ARG A 141 16.188 3.671 7.585 1.00 40.15 N ATOM 0 H ARG A 141 10.403 -2.385 7.935 1.00 35.31 H new ATOM 0 HA ARG A 141 10.389 -0.503 5.728 1.00 43.14 H new ATOM 0 HB2 ARG A 141 11.445 -0.294 8.054 1.00 11.44 H new ATOM 0 HB3 ARG A 141 12.647 -1.450 7.516 1.00 11.44 H new ATOM 0 HG2 ARG A 141 13.207 0.148 5.592 1.00 3.11 H new ATOM 0 HG3 ARG A 141 12.137 1.322 6.331 1.00 3.11 H new ATOM 0 HD2 ARG A 141 13.401 1.064 8.494 1.00 63.41 H new ATOM 0 HD3 ARG A 141 14.503 -0.038 7.694 1.00 63.41 H new ATOM 0 HE ARG A 141 14.647 2.296 6.175 1.00 31.10 H new ATOM 0 HH11 ARG A 141 15.196 1.303 9.531 1.00 1.11 H new ATOM 0 HH12 ARG A 141 16.358 2.595 9.850 1.00 1.11 H new ATOM 0 HH21 ARG A 141 16.036 4.044 6.648 1.00 40.15 H new ATOM 0 HH22 ARG A 141 16.831 4.140 8.223 1.00 40.15 H new ATOM 2034 N ASP A 142 12.041 -1.564 4.100 1.00 13.40 N ATOM 2035 CA ASP A 142 12.947 -2.132 3.111 1.00 33.11 C ATOM 2036 C ASP A 142 12.475 -3.504 2.616 1.00 34.24 C ATOM 2037 O ASP A 142 11.269 -3.758 2.561 1.00 12.44 O ATOM 2038 CB ASP A 142 14.415 -2.025 3.580 1.00 40.23 C ATOM 2039 CG ASP A 142 14.786 -2.862 4.806 1.00 40.22 C ATOM 2040 OD1 ASP A 142 14.757 -2.322 5.939 1.00 23.31 O ATOM 2041 OD2 ASP A 142 15.327 -3.973 4.639 1.00 75.12 O ATOM 0 H ASP A 142 11.741 -0.618 3.865 1.00 13.40 H new ATOM 0 HA ASP A 142 12.919 -1.531 2.202 1.00 33.11 H new ATOM 0 HB2 ASP A 142 15.063 -2.318 2.754 1.00 40.23 H new ATOM 0 HB3 ASP A 142 14.631 -0.979 3.799 1.00 40.23 H new ATOM 2045 N ASP A 143 13.399 -4.327 2.133 1.00 24.12 N ATOM 2046 CA ASP A 143 13.181 -5.573 1.400 1.00 4.03 C ATOM 2047 C ASP A 143 13.609 -6.796 2.233 1.00 12.31 C ATOM 2048 O ASP A 143 13.628 -7.922 1.733 1.00 41.32 O ATOM 2049 CB ASP A 143 13.857 -5.495 0.014 1.00 21.32 C ATOM 2050 CG ASP A 143 15.320 -5.023 0.002 1.00 44.22 C ATOM 2051 OD1 ASP A 143 15.971 -4.965 1.071 1.00 74.41 O ATOM 2052 OD2 ASP A 143 15.805 -4.612 -1.071 1.00 41.22 O ATOM 0 H ASP A 143 14.392 -4.128 2.251 1.00 24.12 H new ATOM 0 HA ASP A 143 12.114 -5.707 1.222 1.00 4.03 H new ATOM 0 HB2 ASP A 143 13.811 -6.482 -0.446 1.00 21.32 H new ATOM 0 HB3 ASP A 143 13.274 -4.822 -0.615 1.00 21.32 H new ATOM 2056 N SER A 144 13.892 -6.598 3.525 1.00 43.45 N ATOM 2057 CA SER A 144 14.254 -7.624 4.495 1.00 62.52 C ATOM 2058 C SER A 144 13.114 -8.601 4.861 1.00 35.53 C ATOM 2059 O SER A 144 13.340 -9.472 5.706 1.00 55.05 O ATOM 2060 CB SER A 144 14.804 -6.904 5.738 1.00 22.12 C ATOM 2061 OG SER A 144 15.320 -7.803 6.701 1.00 53.43 O ATOM 0 H SER A 144 13.872 -5.666 3.939 1.00 43.45 H new ATOM 0 HA SER A 144 15.006 -8.270 4.041 1.00 62.52 H new ATOM 0 HB2 SER A 144 15.589 -6.211 5.435 1.00 22.12 H new ATOM 0 HB3 SER A 144 14.011 -6.309 6.190 1.00 22.12 H new ATOM 0 HG SER A 144 14.837 -8.654 6.647 1.00 53.43 H new ATOM 2066 N GLU A 145 11.908 -8.497 4.299 1.00 61.55 N ATOM 2067 CA GLU A 145 10.835 -9.479 4.490 1.00 71.14 C ATOM 2068 C GLU A 145 10.341 -10.060 3.153 1.00 61.32 C ATOM 2069 O GLU A 145 9.398 -10.849 3.140 1.00 61.35 O ATOM 2070 CB GLU A 145 9.684 -8.900 5.344 1.00 4.44 C ATOM 2071 CG GLU A 145 10.126 -8.402 6.734 1.00 44.02 C ATOM 2072 CD GLU A 145 9.044 -8.410 7.834 1.00 23.31 C ATOM 2073 OE1 GLU A 145 8.068 -9.196 7.832 1.00 3.33 O ATOM 2074 OE2 GLU A 145 9.206 -7.680 8.839 1.00 64.44 O ATOM 0 H GLU A 145 11.645 -7.721 3.692 1.00 61.55 H new ATOM 0 HA GLU A 145 11.254 -10.315 5.050 1.00 71.14 H new ATOM 0 HB2 GLU A 145 9.223 -8.074 4.803 1.00 4.44 H new ATOM 0 HB3 GLU A 145 8.918 -9.665 5.470 1.00 4.44 H new ATOM 0 HG2 GLU A 145 10.961 -9.018 7.069 1.00 44.02 H new ATOM 0 HG3 GLU A 145 10.502 -7.384 6.630 1.00 44.02 H new ATOM 2079 N VAL A 146 10.980 -9.749 2.023 1.00 15.22 N ATOM 2080 CA VAL A 146 10.610 -10.357 0.745 1.00 60.11 C ATOM 2081 C VAL A 146 10.757 -11.885 0.810 1.00 53.02 C ATOM 2082 O VAL A 146 9.902 -12.586 0.276 1.00 60.23 O ATOM 2083 CB VAL A 146 11.418 -9.726 -0.401 1.00 60.11 C ATOM 2084 CG1 VAL A 146 11.095 -10.381 -1.752 1.00 35.53 C ATOM 2085 CG2 VAL A 146 11.099 -8.229 -0.513 1.00 20.10 C ATOM 0 H VAL A 146 11.751 -9.084 1.968 1.00 15.22 H new ATOM 0 HA VAL A 146 9.559 -10.154 0.540 1.00 60.11 H new ATOM 0 HB VAL A 146 12.472 -9.881 -0.169 1.00 60.11 H new ATOM 0 HG11 VAL A 146 11.686 -9.908 -2.536 1.00 35.53 H new ATOM 0 HG12 VAL A 146 11.335 -11.443 -1.708 1.00 35.53 H new ATOM 0 HG13 VAL A 146 10.035 -10.257 -1.972 1.00 35.53 H new ATOM 0 HG21 VAL A 146 11.677 -7.794 -1.328 1.00 20.10 H new ATOM 0 HG22 VAL A 146 10.035 -8.098 -0.712 1.00 20.10 H new ATOM 0 HG23 VAL A 146 11.357 -7.731 0.422 1.00 20.10 H new ATOM 2095 N ASP A 147 11.751 -12.403 1.539 1.00 21.43 N ATOM 2096 CA ASP A 147 12.001 -13.839 1.738 1.00 64.14 C ATOM 2097 C ASP A 147 10.873 -14.577 2.470 1.00 15.30 C ATOM 2098 O ASP A 147 10.931 -15.796 2.633 1.00 40.32 O ATOM 2099 CB ASP A 147 13.292 -14.040 2.546 1.00 11.40 C ATOM 2100 CG ASP A 147 14.532 -14.329 1.708 1.00 24.10 C ATOM 2101 OD1 ASP A 147 14.453 -14.897 0.590 1.00 12.10 O ATOM 2102 OD2 ASP A 147 15.635 -14.018 2.202 1.00 64.33 O ATOM 0 H ASP A 147 12.429 -11.815 2.025 1.00 21.43 H new ATOM 0 HA ASP A 147 12.076 -14.260 0.735 1.00 64.14 H new ATOM 0 HB2 ASP A 147 13.474 -13.146 3.142 1.00 11.40 H new ATOM 0 HB3 ASP A 147 13.142 -14.864 3.244 1.00 11.40 H new ATOM 2106 N LYS A 148 9.843 -13.875 2.934 1.00 35.41 N ATOM 2107 CA LYS A 148 8.627 -14.442 3.503 1.00 52.12 C ATOM 2108 C LYS A 148 7.374 -13.965 2.780 1.00 15.44 C ATOM 2109 O LYS A 148 6.309 -14.503 3.071 1.00 14.41 O ATOM 2110 CB LYS A 148 8.546 -14.172 5.010 1.00 64.54 C ATOM 2111 CG LYS A 148 8.483 -12.686 5.363 1.00 1.30 C ATOM 2112 CD LYS A 148 8.236 -12.399 6.843 1.00 72.55 C ATOM 2113 CE LYS A 148 9.560 -12.049 7.526 1.00 71.25 C ATOM 2114 NZ LYS A 148 9.365 -11.570 8.904 1.00 52.22 N ATOM 0 H LYS A 148 9.834 -12.855 2.923 1.00 35.41 H new ATOM 0 HA LYS A 148 8.677 -15.521 3.358 1.00 52.12 H new ATOM 0 HB2 LYS A 148 7.664 -14.670 5.413 1.00 64.54 H new ATOM 0 HB3 LYS A 148 9.414 -14.616 5.497 1.00 64.54 H new ATOM 0 HG2 LYS A 148 9.419 -12.214 5.065 1.00 1.30 H new ATOM 0 HG3 LYS A 148 7.691 -12.219 4.778 1.00 1.30 H new ATOM 0 HD2 LYS A 148 7.530 -11.575 6.951 1.00 72.55 H new ATOM 0 HD3 LYS A 148 7.787 -13.269 7.322 1.00 72.55 H new ATOM 0 HE2 LYS A 148 10.205 -12.928 7.536 1.00 71.25 H new ATOM 0 HE3 LYS A 148 10.075 -11.283 6.946 1.00 71.25 H new ATOM 0 HZ1 LYS A 148 10.288 -11.345 9.327 1.00 52.22 H new ATOM 0 HZ2 LYS A 148 8.771 -10.716 8.894 1.00 52.22 H new ATOM 0 HZ3 LYS A 148 8.898 -12.310 9.466 1.00 52.22 H new ATOM 2124 N TRP A 149 7.464 -13.010 1.856 1.00 23.13 N ATOM 2125 CA TRP A 149 6.344 -12.540 1.047 1.00 4.42 C ATOM 2126 C TRP A 149 6.439 -13.056 -0.382 1.00 71.43 C ATOM 2127 O TRP A 149 6.173 -12.334 -1.345 1.00 13.31 O ATOM 2128 CB TRP A 149 6.283 -11.015 1.023 1.00 31.40 C ATOM 2129 CG TRP A 149 6.333 -10.264 2.311 1.00 24.42 C ATOM 2130 CD1 TRP A 149 5.926 -10.704 3.517 1.00 64.43 C ATOM 2131 CD2 TRP A 149 6.801 -8.904 2.521 1.00 43.11 C ATOM 2132 NE1 TRP A 149 6.059 -9.696 4.446 1.00 22.10 N ATOM 2133 CE2 TRP A 149 6.545 -8.534 3.872 1.00 51.41 C ATOM 2134 CE3 TRP A 149 7.388 -7.938 1.683 1.00 35.20 C ATOM 2135 CZ2 TRP A 149 6.791 -7.229 4.340 1.00 51.41 C ATOM 2136 CZ3 TRP A 149 7.638 -6.630 2.134 1.00 61.51 C ATOM 2137 CH2 TRP A 149 7.325 -6.268 3.458 1.00 61.33 C ATOM 0 H TRP A 149 8.339 -12.531 1.645 1.00 23.13 H new ATOM 0 HA TRP A 149 5.436 -12.929 1.507 1.00 4.42 H new ATOM 0 HB2 TRP A 149 7.110 -10.663 0.406 1.00 31.40 H new ATOM 0 HB3 TRP A 149 5.362 -10.732 0.514 1.00 31.40 H new ATOM 0 HD1 TRP A 149 5.552 -11.696 3.724 1.00 64.43 H new ATOM 0 HE1 TRP A 149 5.828 -9.794 5.435 1.00 22.10 H new ATOM 0 HE3 TRP A 149 7.652 -8.207 0.671 1.00 35.20 H new ATOM 0 HZ2 TRP A 149 6.573 -6.967 5.365 1.00 51.41 H new ATOM 0 HZ3 TRP A 149 8.071 -5.902 1.464 1.00 61.51 H new ATOM 0 HH2 TRP A 149 7.494 -5.257 3.797 1.00 61.33 H new ATOM 2147 N SER A 150 6.868 -14.294 -0.535 1.00 2.00 N ATOM 2148 CA SER A 150 6.807 -15.003 -1.790 1.00 24.13 C ATOM 2149 C SER A 150 6.562 -16.448 -1.404 1.00 40.21 C ATOM 2150 O SER A 150 5.477 -16.970 -1.684 1.00 24.54 O ATOM 2151 CB SER A 150 8.068 -14.688 -2.613 1.00 72.55 C ATOM 2152 OG SER A 150 8.121 -15.384 -3.849 1.00 60.34 O ATOM 0 H SER A 150 7.275 -14.841 0.224 1.00 2.00 H new ATOM 0 HA SER A 150 6.004 -14.708 -2.466 1.00 24.13 H new ATOM 0 HB2 SER A 150 8.109 -13.616 -2.806 1.00 72.55 H new ATOM 0 HB3 SER A 150 8.950 -14.940 -2.024 1.00 72.55 H new ATOM 0 HG SER A 150 8.942 -15.142 -4.326 1.00 60.34 H new ATOM 2157 N LYS A 151 7.515 -17.042 -0.687 1.00 52.41 N ATOM 2158 CA LYS A 151 7.490 -18.423 -0.213 1.00 63.15 C ATOM 2159 C LYS A 151 6.973 -19.357 -1.308 1.00 35.30 C ATOM 2160 O LYS A 151 6.073 -20.180 -1.008 1.00 13.32 O ATOM 2161 CB LYS A 151 6.739 -18.536 1.120 1.00 22.53 C ATOM 2162 CG LYS A 151 7.454 -17.898 2.311 1.00 0.42 C ATOM 2163 CD LYS A 151 6.806 -18.420 3.597 1.00 21.30 C ATOM 2164 CE LYS A 151 7.335 -17.719 4.847 1.00 63.33 C ATOM 2165 NZ LYS A 151 6.683 -18.238 6.067 1.00 24.31 N ATOM 0 H LYS A 151 8.364 -16.550 -0.409 1.00 52.41 H new ATOM 0 HA LYS A 151 8.507 -18.751 0.002 1.00 63.15 H new ATOM 0 HB2 LYS A 151 5.759 -18.071 1.010 1.00 22.53 H new ATOM 0 HB3 LYS A 151 6.569 -19.590 1.338 1.00 22.53 H new ATOM 0 HG2 LYS A 151 8.515 -18.145 2.293 1.00 0.42 H new ATOM 0 HG3 LYS A 151 7.379 -16.812 2.262 1.00 0.42 H new ATOM 0 HD2 LYS A 151 5.726 -18.283 3.537 1.00 21.30 H new ATOM 0 HD3 LYS A 151 6.987 -19.492 3.682 1.00 21.30 H new ATOM 0 HE2 LYS A 151 8.413 -17.862 4.919 1.00 63.33 H new ATOM 0 HE3 LYS A 151 7.161 -16.646 4.767 1.00 63.33 H new ATOM 0 HZ1 LYS A 151 7.062 -17.744 6.900 1.00 24.31 H new ATOM 0 HZ2 LYS A 151 5.657 -18.079 6.007 1.00 24.31 H new ATOM 0 HZ3 LYS A 151 6.871 -19.257 6.154 1.00 24.31 H new TER 2175 LYS A 151