USER MOD reduce.3.24.130724 H: found=0, std=0, add=1369, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1366 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 169 SER OG : rot 180:sc= -0.153 USER MOD Set 1.2: A 174 LYS NZ :NH3+ -136:sc= 1.01 (180deg=0.608) USER MOD Set 2.1: A 140 TYR OH : rot 47:sc= 0.967 USER MOD Set 2.2: A 165 SER OG : rot 158:sc= 2.12 USER MOD Set 3.1: A 86 GLN : amide:sc= 0.0104 K(o=0.36,f=-1.1) USER MOD Set 3.2: A 89 LYS NZ :NH3+ -164:sc= 0.351 (180deg=0) USER MOD Set 4.1: A 60 GLN : amide:sc= 0.0335! C(o=2.2!,f=-11!) USER MOD Set 4.2: A 64 LYS NZ :NH3+ -138:sc= 2.16 (180deg=1.19) USER MOD Set 5.1: A 52 MET CE :methyl -176:sc= 0 (180deg=-0.0168) USER MOD Set 5.2: A 94 TYR OH : rot -7:sc= 0.805 USER MOD Set 6.1: A 19 GLN : amide:sc= 1.09 K(o=2,f=0) USER MOD Set 6.2: A 25 ASN : amide:sc= 0.933 K(o=2,f=-0.5) USER MOD Set 7.1: A 17 THR OG1 : rot -79:sc= 1.21 USER MOD Set 7.2: A 27 SER OG : rot 180:sc= 0.975 USER MOD Single : A 1 HIS : no HD1:sc= -0.0205 X(o=-0.02,f=-0.02) USER MOD Single : A 1 HIS N :NH3+ 175:sc= 0 (180deg=-0.0208) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0446) USER MOD Single : A 10 ASN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0.778 K(o=0.78,f=-14!) USER MOD Single : A 21 GLN : amide:sc= -0.925 K(o=-0.93,f=-3.8) USER MOD Single : A 24 LYS NZ :NH3+ 133:sc= 1.27 (180deg=0.505) USER MOD Single : A 30 SER OG : rot -150:sc= 0.546 USER MOD Single : A 32 LYS NZ :NH3+ 159:sc= 1.08 (180deg=-0.586!) USER MOD Single : A 43 THR OG1 : rot -34:sc= 0.388 USER MOD Single : A 44 ASN : amide:sc= -0.0264 X(o=-0.026,f=-0.51) USER MOD Single : A 45 CYS SG : rot 180:sc=-0.000573 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.137 USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -160:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.134 X(o=-0.13,f=-0.55) USER MOD Single : A 56 MET CE :methyl -163:sc=-0.00613 (180deg=-0.268) USER MOD Single : A 57 THR OG1 : rot -29:sc= 1.24 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -165:sc= 0.989 (180deg=0.733) USER MOD Single : A 67 ASN : amide:sc= -0.99 K(o=-0.99,f=-0.16) USER MOD Single : A 74 SER OG : rot -140:sc= 0.941 USER MOD Single : A 76 SER OG : rot 180:sc= -0.193 USER MOD Single : A 81 ASN : amide:sc= 2.29 K(o=2.3,f=-0.29) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ -160:sc= 1.26 (180deg=1.14) USER MOD Single : A 88 LYS NZ :NH3+ -160:sc= 1.12 (180deg=0.83) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 97 SER OG : rot -127:sc= 1.23 USER MOD Single : A 100 ASN : amide:sc= -1.07! X(o=-1.1!,f=-0.67) USER MOD Single : A 105 THR OG1 : rot -79:sc= 1.06 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 98:sc= 1.34 USER MOD Single : A 109 GLN : amide:sc= -1.32 K(o=-1.3,f=-4.3!) USER MOD Single : A 110 SER OG : rot 180:sc=0.000247 USER MOD Single : A 118 LYS NZ :NH3+ -147:sc= 2.23 (180deg=1.1) USER MOD Single : A 119 SER OG : rot 78:sc= 0.901 USER MOD Single : A 121 LYS NZ :NH3+ 166:sc= 0.136 (180deg=-1.18!) USER MOD Single : A 125 LYS NZ :NH3+ -165:sc= -1.05! (180deg=-1.09!) USER MOD Single : A 126 LYS NZ :NH3+ 162:sc= 0.512 (180deg=-1.26) USER MOD Single : A 132 GLN : amide:sc= -0.426 K(o=-0.43,f=-3.7!) USER MOD Single : A 135 HIS : no HD1:sc= -1.12 X(o=-1.1,f=-0.99) USER MOD Single : A 136 GLN : amide:sc= -0.578 K(o=-0.58,f=-5.3!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot -139:sc= 0.945 USER MOD Single : A 147 LYS NZ :NH3+ -157:sc= 1.18 (180deg=0.647) USER MOD Single : A 150 LYS NZ :NH3+ -176:sc= 0.701 (180deg=0.0459) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 ASN : amide:sc= 1.14 K(o=1.1,f=-6.1!) USER MOD Single : A 157 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 158 THR OG1 : rot -120:sc= 0.0408 USER MOD Single : A 160 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 SER OG : rot 180:sc= 0 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 -24.837 -10.043 17.962 1.00 6.20 N ATOM 2 CA HIS A 1 -25.153 -8.676 17.502 1.00 5.82 C ATOM 3 C HIS A 1 -23.909 -8.037 16.878 1.00 5.76 C ATOM 4 O HIS A 1 -23.448 -6.993 17.324 1.00 7.13 O ATOM 5 CB HIS A 1 -25.763 -7.842 18.646 1.00 6.62 C ATOM 6 CG HIS A 1 -25.057 -7.965 19.979 1.00 7.15 C ATOM 7 ND1 HIS A 1 -25.476 -8.735 21.046 1.00 7.65 N ATOM 8 CD2 HIS A 1 -23.911 -7.318 20.368 1.00 7.83 C ATOM 9 CE1 HIS A 1 -24.587 -8.572 22.040 1.00 8.31 C ATOM 10 NE2 HIS A 1 -23.613 -7.727 21.669 1.00 8.52 N ATOM 0 H1 HIS A 1 -25.659 -10.440 18.460 1.00 6.20 H new ATOM 0 H2 HIS A 1 -24.606 -10.640 17.143 1.00 6.20 H new ATOM 0 H3 HIS A 1 -24.023 -10.012 18.608 1.00 6.20 H new ATOM 0 HA HIS A 1 -25.914 -8.715 16.722 1.00 5.82 H new ATOM 0 HB2 HIS A 1 -25.765 -6.793 18.349 1.00 6.62 H new ATOM 0 HB3 HIS A 1 -26.804 -8.138 18.775 1.00 6.62 H new ATOM 0 HD2 HIS A 1 -23.342 -6.618 19.774 1.00 7.83 H new ATOM 0 HE1 HIS A 1 -24.648 -9.054 23.004 1.00 8.31 H new ATOM 0 HE2 HIS A 1 -22.810 -7.439 22.229 1.00 8.52 H new ATOM 20 N MET A 2 -23.338 -8.700 15.869 1.00 4.73 N ATOM 21 CA MET A 2 -22.070 -8.335 15.260 1.00 4.90 C ATOM 22 C MET A 2 -22.002 -9.113 13.945 1.00 4.10 C ATOM 23 O MET A 2 -22.662 -10.149 13.844 1.00 4.61 O ATOM 24 CB MET A 2 -20.931 -8.725 16.217 1.00 6.21 C ATOM 25 CG MET A 2 -19.617 -8.013 15.893 1.00 7.40 C ATOM 26 SD MET A 2 -18.270 -8.415 17.035 1.00 9.53 S ATOM 27 CE MET A 2 -16.972 -7.372 16.344 1.00 10.84 C ATOM 0 H MET A 2 -23.761 -9.526 15.447 1.00 4.73 H new ATOM 0 HA MET A 2 -21.978 -7.266 15.069 1.00 4.90 H new ATOM 0 HB2 MET A 2 -21.225 -8.489 17.240 1.00 6.21 H new ATOM 0 HB3 MET A 2 -20.776 -9.803 16.171 1.00 6.21 H new ATOM 0 HG2 MET A 2 -19.313 -8.275 14.880 1.00 7.40 H new ATOM 0 HG3 MET A 2 -19.784 -6.936 15.907 1.00 7.40 H new ATOM 0 HE1 MET A 2 -16.059 -7.492 16.928 1.00 10.84 H new ATOM 0 HE2 MET A 2 -16.783 -7.663 15.311 1.00 10.84 H new ATOM 0 HE3 MET A 2 -17.288 -6.329 16.376 1.00 10.84 H new ATOM 37 N LEU A 3 -21.260 -8.620 12.949 1.00 3.66 N ATOM 38 CA LEU A 3 -21.097 -9.282 11.661 1.00 3.65 C ATOM 39 C LEU A 3 -19.685 -9.863 11.632 1.00 3.55 C ATOM 40 O LEU A 3 -18.728 -9.156 11.323 1.00 3.73 O ATOM 41 CB LEU A 3 -21.367 -8.277 10.529 1.00 4.32 C ATOM 42 CG LEU A 3 -21.687 -8.938 9.176 1.00 5.26 C ATOM 43 CD1 LEU A 3 -22.082 -7.852 8.171 1.00 6.20 C ATOM 44 CD2 LEU A 3 -20.515 -9.746 8.604 1.00 5.74 C ATOM 0 H LEU A 3 -20.751 -7.739 13.020 1.00 3.66 H new ATOM 0 HA LEU A 3 -21.809 -10.095 11.517 1.00 3.65 H new ATOM 0 HB2 LEU A 3 -22.200 -7.636 10.816 1.00 4.32 H new ATOM 0 HB3 LEU A 3 -20.495 -7.633 10.411 1.00 4.32 H new ATOM 0 HG LEU A 3 -22.504 -9.638 9.348 1.00 5.26 H new ATOM 0 HD11 LEU A 3 -22.310 -8.312 7.209 1.00 6.20 H new ATOM 0 HD12 LEU A 3 -22.960 -7.320 8.537 1.00 6.20 H new ATOM 0 HD13 LEU A 3 -21.257 -7.150 8.051 1.00 6.20 H new ATOM 0 HD21 LEU A 3 -20.807 -10.185 7.650 1.00 5.74 H new ATOM 0 HD22 LEU A 3 -19.659 -9.088 8.454 1.00 5.74 H new ATOM 0 HD23 LEU A 3 -20.245 -10.539 9.301 1.00 5.74 H new ATOM 56 N GLU A 4 -19.563 -11.144 11.994 1.00 4.34 N ATOM 57 CA GLU A 4 -18.306 -11.822 12.204 1.00 5.52 C ATOM 58 C GLU A 4 -17.569 -11.194 13.392 1.00 4.87 C ATOM 59 O GLU A 4 -18.010 -10.219 13.998 1.00 4.73 O ATOM 60 CB GLU A 4 -17.493 -11.882 10.895 1.00 6.69 C ATOM 61 CG GLU A 4 -17.227 -13.328 10.444 1.00 8.47 C ATOM 62 CD GLU A 4 -16.292 -14.083 11.380 1.00 9.68 C ATOM 63 OE1 GLU A 4 -15.388 -13.415 11.930 1.00 10.03 O ATOM 64 OE2 GLU A 4 -16.518 -15.294 11.569 1.00 10.58 O ATOM 0 H GLU A 4 -20.371 -11.746 12.151 1.00 4.34 H new ATOM 0 HA GLU A 4 -18.476 -12.864 12.476 1.00 5.52 H new ATOM 0 HB2 GLU A 4 -18.031 -11.351 10.110 1.00 6.69 H new ATOM 0 HB3 GLU A 4 -16.543 -11.366 11.035 1.00 6.69 H new ATOM 0 HG2 GLU A 4 -18.175 -13.862 10.378 1.00 8.47 H new ATOM 0 HG3 GLU A 4 -16.797 -13.317 9.442 1.00 8.47 H new ATOM 71 N ILE A 5 -16.452 -11.805 13.750 1.00 5.24 N ATOM 72 CA ILE A 5 -15.588 -11.385 14.837 1.00 5.21 C ATOM 73 C ILE A 5 -14.902 -10.071 14.472 1.00 4.11 C ATOM 74 O ILE A 5 -14.712 -9.216 15.332 1.00 4.82 O ATOM 75 CB ILE A 5 -14.577 -12.501 15.175 1.00 6.99 C ATOM 76 CG1 ILE A 5 -15.235 -13.881 15.382 1.00 8.67 C ATOM 77 CG2 ILE A 5 -13.739 -12.129 16.408 1.00 7.42 C ATOM 78 CD1 ILE A 5 -16.307 -13.919 16.477 1.00 9.27 C ATOM 0 H ILE A 5 -16.110 -12.639 13.272 1.00 5.24 H new ATOM 0 HA ILE A 5 -16.181 -11.208 15.734 1.00 5.21 H new ATOM 0 HB ILE A 5 -13.927 -12.587 14.305 1.00 6.99 H new ATOM 0 HG12 ILE A 5 -15.684 -14.200 14.441 1.00 8.67 H new ATOM 0 HG13 ILE A 5 -14.459 -14.606 15.627 1.00 8.67 H new ATOM 0 HG21 ILE A 5 -13.035 -12.932 16.625 1.00 7.42 H new ATOM 0 HG22 ILE A 5 -13.190 -11.208 16.211 1.00 7.42 H new ATOM 0 HG23 ILE A 5 -14.397 -11.983 17.264 1.00 7.42 H new ATOM 0 HD11 ILE A 5 -16.714 -14.927 16.552 1.00 9.27 H new ATOM 0 HD12 ILE A 5 -15.863 -13.635 17.431 1.00 9.27 H new ATOM 0 HD13 ILE A 5 -17.107 -13.222 16.227 1.00 9.27 H new ATOM 90 N LYS A 6 -14.504 -9.942 13.202 1.00 3.36 N ATOM 91 CA LYS A 6 -13.827 -8.777 12.626 1.00 3.46 C ATOM 92 C LYS A 6 -13.473 -9.037 11.154 1.00 3.43 C ATOM 93 O LYS A 6 -12.301 -9.257 10.855 1.00 5.19 O ATOM 94 CB LYS A 6 -12.583 -8.374 13.454 1.00 5.35 C ATOM 95 CG LYS A 6 -11.614 -9.533 13.747 1.00 5.83 C ATOM 96 CD LYS A 6 -10.660 -9.154 14.888 1.00 7.53 C ATOM 97 CE LYS A 6 -9.582 -10.222 15.121 1.00 8.33 C ATOM 98 NZ LYS A 6 -10.155 -11.549 15.434 1.00 8.12 N ATOM 0 H LYS A 6 -14.652 -10.682 12.516 1.00 3.36 H new ATOM 0 HA LYS A 6 -14.514 -7.932 12.662 1.00 3.46 H new ATOM 0 HB2 LYS A 6 -12.044 -7.591 12.920 1.00 5.35 H new ATOM 0 HB3 LYS A 6 -12.914 -7.945 14.400 1.00 5.35 H new ATOM 0 HG2 LYS A 6 -12.176 -10.427 14.016 1.00 5.83 H new ATOM 0 HG3 LYS A 6 -11.042 -9.774 12.851 1.00 5.83 H new ATOM 0 HD2 LYS A 6 -10.182 -8.202 14.659 1.00 7.53 H new ATOM 0 HD3 LYS A 6 -11.232 -9.011 15.805 1.00 7.53 H new ATOM 0 HE2 LYS A 6 -8.956 -10.301 14.232 1.00 8.33 H new ATOM 0 HE3 LYS A 6 -8.935 -9.907 15.940 1.00 8.33 H new ATOM 0 HZ1 LYS A 6 -9.387 -12.217 15.649 1.00 8.12 H new ATOM 0 HZ2 LYS A 6 -10.785 -11.470 16.257 1.00 8.12 H new ATOM 0 HZ3 LYS A 6 -10.696 -11.895 14.616 1.00 8.12 H new ATOM 112 N ASP A 7 -14.481 -9.033 10.268 1.00 1.61 N ATOM 113 CA ASP A 7 -14.362 -9.190 8.810 1.00 1.28 C ATOM 114 C ASP A 7 -13.094 -9.956 8.363 1.00 1.05 C ATOM 115 O ASP A 7 -12.173 -9.370 7.802 1.00 1.23 O ATOM 116 CB ASP A 7 -14.529 -7.833 8.089 1.00 1.47 C ATOM 117 CG ASP A 7 -13.473 -6.803 8.451 1.00 2.78 C ATOM 118 OD1 ASP A 7 -13.523 -6.238 9.571 1.00 2.90 O ATOM 119 OD2 ASP A 7 -12.621 -6.502 7.589 1.00 4.33 O ATOM 0 H ASP A 7 -15.450 -8.914 10.564 1.00 1.61 H new ATOM 0 HA ASP A 7 -15.188 -9.831 8.501 1.00 1.28 H new ATOM 0 HB2 ASP A 7 -14.503 -8.001 7.012 1.00 1.47 H new ATOM 0 HB3 ASP A 7 -15.513 -7.427 8.325 1.00 1.47 H new ATOM 124 N PRO A 8 -13.010 -11.272 8.624 1.00 1.04 N ATOM 125 CA PRO A 8 -11.802 -12.045 8.381 1.00 1.21 C ATOM 126 C PRO A 8 -11.632 -12.365 6.892 1.00 1.22 C ATOM 127 O PRO A 8 -12.425 -13.104 6.308 1.00 1.59 O ATOM 128 CB PRO A 8 -11.964 -13.315 9.217 1.00 1.52 C ATOM 129 CG PRO A 8 -13.478 -13.519 9.241 1.00 1.59 C ATOM 130 CD PRO A 8 -14.013 -12.085 9.289 1.00 1.33 C ATOM 0 HA PRO A 8 -10.905 -11.493 8.661 1.00 1.21 H new ATOM 0 HB2 PRO A 8 -11.449 -14.164 8.766 1.00 1.52 H new ATOM 0 HB3 PRO A 8 -11.557 -13.192 10.221 1.00 1.52 H new ATOM 0 HG2 PRO A 8 -13.828 -14.052 8.357 1.00 1.59 H new ATOM 0 HG3 PRO A 8 -13.794 -14.098 10.109 1.00 1.59 H new ATOM 0 HD2 PRO A 8 -14.976 -12.009 8.785 1.00 1.33 H new ATOM 0 HD3 PRO A 8 -14.164 -11.757 10.317 1.00 1.33 H new ATOM 138 N LEU A 9 -10.564 -11.839 6.292 1.00 1.01 N ATOM 139 CA LEU A 9 -10.170 -12.107 4.912 1.00 1.01 C ATOM 140 C LEU A 9 -8.941 -13.038 4.933 1.00 1.03 C ATOM 141 O LEU A 9 -8.400 -13.316 6.003 1.00 1.02 O ATOM 142 CB LEU A 9 -10.020 -10.803 4.093 1.00 0.97 C ATOM 143 CG LEU A 9 -10.467 -9.516 4.824 1.00 1.05 C ATOM 144 CD1 LEU A 9 -9.673 -8.318 4.312 1.00 1.15 C ATOM 145 CD2 LEU A 9 -11.986 -9.318 4.721 1.00 1.32 C ATOM 0 H LEU A 9 -9.932 -11.196 6.768 1.00 1.01 H new ATOM 0 HA LEU A 9 -10.954 -12.638 4.372 1.00 1.01 H new ATOM 0 HB2 LEU A 9 -8.975 -10.693 3.802 1.00 0.97 H new ATOM 0 HB3 LEU A 9 -10.598 -10.900 3.174 1.00 0.97 H new ATOM 0 HG LEU A 9 -10.249 -9.615 5.887 1.00 1.05 H new ATOM 0 HD11 LEU A 9 -9.996 -7.417 4.834 1.00 1.15 H new ATOM 0 HD12 LEU A 9 -8.611 -8.481 4.494 1.00 1.15 H new ATOM 0 HD13 LEU A 9 -9.844 -8.199 3.242 1.00 1.15 H new ATOM 0 HD21 LEU A 9 -12.270 -8.405 5.244 1.00 1.32 H new ATOM 0 HD22 LEU A 9 -12.272 -9.239 3.672 1.00 1.32 H new ATOM 0 HD23 LEU A 9 -12.495 -10.169 5.173 1.00 1.32 H new ATOM 157 N ASN A 10 -8.516 -13.573 3.786 1.00 1.15 N ATOM 158 CA ASN A 10 -7.255 -14.299 3.615 1.00 1.23 C ATOM 159 C ASN A 10 -6.746 -13.970 2.213 1.00 1.27 C ATOM 160 O ASN A 10 -6.472 -14.852 1.401 1.00 1.50 O ATOM 161 CB ASN A 10 -7.455 -15.814 3.775 1.00 1.43 C ATOM 162 CG ASN A 10 -7.697 -16.248 5.215 1.00 1.70 C ATOM 163 OD1 ASN A 10 -6.763 -16.608 5.929 1.00 2.32 O ATOM 164 ND2 ASN A 10 -8.955 -16.262 5.649 1.00 1.71 N ATOM 0 H ASN A 10 -9.057 -13.511 2.923 1.00 1.15 H new ATOM 0 HA ASN A 10 -6.536 -13.998 4.377 1.00 1.23 H new ATOM 0 HB2 ASN A 10 -8.301 -16.127 3.163 1.00 1.43 H new ATOM 0 HB3 ASN A 10 -6.575 -16.331 3.391 1.00 1.43 H new ATOM 0 HD21 ASN A 10 -9.164 -16.577 6.596 1.00 1.71 H new ATOM 0 HD22 ASN A 10 -9.710 -15.958 5.034 1.00 1.71 H new ATOM 171 N TYR A 11 -6.582 -12.674 1.957 1.00 1.13 N ATOM 172 CA TYR A 11 -6.377 -12.166 0.608 1.00 1.13 C ATOM 173 C TYR A 11 -4.904 -12.371 0.244 1.00 1.10 C ATOM 174 O TYR A 11 -4.062 -11.533 0.568 1.00 0.91 O ATOM 175 CB TYR A 11 -6.864 -10.708 0.545 1.00 1.10 C ATOM 176 CG TYR A 11 -7.932 -10.409 -0.485 1.00 1.44 C ATOM 177 CD1 TYR A 11 -9.228 -10.920 -0.309 1.00 3.04 C ATOM 178 CD2 TYR A 11 -7.686 -9.494 -1.521 1.00 1.64 C ATOM 179 CE1 TYR A 11 -10.237 -10.631 -1.240 1.00 3.51 C ATOM 180 CE2 TYR A 11 -8.715 -9.148 -2.413 1.00 1.76 C ATOM 181 CZ TYR A 11 -9.992 -9.704 -2.264 1.00 2.38 C ATOM 182 OH TYR A 11 -11.026 -9.227 -3.013 1.00 2.78 O ATOM 0 H TYR A 11 -6.588 -11.952 2.677 1.00 1.13 H new ATOM 0 HA TYR A 11 -6.960 -12.703 -0.140 1.00 1.13 H new ATOM 0 HB2 TYR A 11 -7.247 -10.431 1.527 1.00 1.10 H new ATOM 0 HB3 TYR A 11 -6.005 -10.067 0.345 1.00 1.10 H new ATOM 0 HD1 TYR A 11 -9.449 -11.539 0.548 1.00 3.04 H new ATOM 0 HD2 TYR A 11 -6.705 -9.056 -1.632 1.00 1.64 H new ATOM 0 HE1 TYR A 11 -11.197 -11.120 -1.169 1.00 3.51 H new ATOM 0 HE2 TYR A 11 -8.521 -8.452 -3.215 1.00 1.76 H new ATOM 0 HH TYR A 11 -10.684 -8.593 -3.678 1.00 2.78 H new ATOM 192 N GLU A 12 -4.595 -13.543 -0.318 1.00 1.37 N ATOM 193 CA GLU A 12 -3.249 -14.076 -0.488 1.00 1.39 C ATOM 194 C GLU A 12 -2.532 -13.443 -1.683 1.00 1.29 C ATOM 195 O GLU A 12 -2.758 -13.826 -2.830 1.00 1.63 O ATOM 196 CB GLU A 12 -3.334 -15.612 -0.515 1.00 1.91 C ATOM 197 CG GLU A 12 -2.035 -16.282 -0.044 1.00 2.65 C ATOM 198 CD GLU A 12 -2.288 -17.699 0.459 1.00 3.38 C ATOM 199 OE1 GLU A 12 -2.725 -17.820 1.627 1.00 4.31 O ATOM 200 OE2 GLU A 12 -2.058 -18.636 -0.336 1.00 3.71 O ATOM 0 H GLU A 12 -5.312 -14.171 -0.682 1.00 1.37 H new ATOM 0 HA GLU A 12 -2.616 -13.804 0.357 1.00 1.39 H new ATOM 0 HB2 GLU A 12 -4.158 -15.938 0.120 1.00 1.91 H new ATOM 0 HB3 GLU A 12 -3.562 -15.942 -1.528 1.00 1.91 H new ATOM 0 HG2 GLU A 12 -1.319 -16.309 -0.866 1.00 2.65 H new ATOM 0 HG3 GLU A 12 -1.585 -15.687 0.751 1.00 2.65 H new ATOM 207 N VAL A 13 -1.659 -12.465 -1.410 1.00 0.94 N ATOM 208 CA VAL A 13 -0.888 -11.770 -2.429 1.00 0.90 C ATOM 209 C VAL A 13 0.295 -12.654 -2.848 1.00 1.01 C ATOM 210 O VAL A 13 0.937 -13.272 -1.997 1.00 1.08 O ATOM 211 CB VAL A 13 -0.469 -10.370 -1.932 1.00 0.73 C ATOM 212 CG1 VAL A 13 -1.577 -9.644 -1.154 1.00 1.79 C ATOM 213 CG2 VAL A 13 0.811 -10.329 -1.102 1.00 1.55 C ATOM 0 H VAL A 13 -1.472 -12.136 -0.463 1.00 0.94 H new ATOM 0 HA VAL A 13 -1.495 -11.596 -3.318 1.00 0.90 H new ATOM 0 HB VAL A 13 -0.271 -9.847 -2.867 1.00 0.73 H new ATOM 0 HG11 VAL A 13 -1.216 -8.667 -0.834 1.00 1.79 H new ATOM 0 HG12 VAL A 13 -2.449 -9.517 -1.796 1.00 1.79 H new ATOM 0 HG13 VAL A 13 -1.853 -10.233 -0.280 1.00 1.79 H new ATOM 0 HG21 VAL A 13 1.018 -9.302 -0.802 1.00 1.55 H new ATOM 0 HG22 VAL A 13 0.689 -10.949 -0.214 1.00 1.55 H new ATOM 0 HG23 VAL A 13 1.642 -10.708 -1.697 1.00 1.55 H new ATOM 223 N GLU A 14 0.569 -12.765 -4.153 1.00 1.25 N ATOM 224 CA GLU A 14 1.527 -13.750 -4.645 1.00 1.47 C ATOM 225 C GLU A 14 2.983 -13.338 -4.369 1.00 1.25 C ATOM 226 O GLU A 14 3.283 -12.144 -4.297 1.00 1.24 O ATOM 227 CB GLU A 14 1.306 -14.027 -6.137 1.00 1.93 C ATOM 228 CG GLU A 14 1.661 -12.836 -7.040 1.00 1.74 C ATOM 229 CD GLU A 14 1.605 -13.202 -8.514 1.00 2.34 C ATOM 230 OE1 GLU A 14 1.428 -14.399 -8.832 1.00 2.61 O ATOM 231 OE2 GLU A 14 1.629 -12.270 -9.339 1.00 3.65 O ATOM 0 H GLU A 14 0.143 -12.188 -4.878 1.00 1.25 H new ATOM 0 HA GLU A 14 1.350 -14.673 -4.092 1.00 1.47 H new ATOM 0 HB2 GLU A 14 1.906 -14.888 -6.432 1.00 1.93 H new ATOM 0 HB3 GLU A 14 0.262 -14.296 -6.298 1.00 1.93 H new ATOM 0 HG2 GLU A 14 0.972 -12.015 -6.844 1.00 1.74 H new ATOM 0 HG3 GLU A 14 2.661 -12.479 -6.793 1.00 1.74 H new ATOM 238 N PRO A 15 3.908 -14.306 -4.240 1.00 1.15 N ATOM 239 CA PRO A 15 5.339 -14.045 -4.226 1.00 0.99 C ATOM 240 C PRO A 15 5.797 -13.254 -5.450 1.00 0.77 C ATOM 241 O PRO A 15 5.361 -13.527 -6.566 1.00 0.72 O ATOM 242 CB PRO A 15 6.014 -15.417 -4.158 1.00 1.07 C ATOM 243 CG PRO A 15 4.966 -16.258 -3.435 1.00 1.30 C ATOM 244 CD PRO A 15 3.658 -15.720 -4.012 1.00 1.30 C ATOM 0 HA PRO A 15 5.610 -13.424 -3.372 1.00 0.99 H new ATOM 0 HB2 PRO A 15 6.238 -15.810 -5.150 1.00 1.07 H new ATOM 0 HB3 PRO A 15 6.955 -15.381 -3.610 1.00 1.07 H new ATOM 0 HG2 PRO A 15 5.091 -17.322 -3.635 1.00 1.30 H new ATOM 0 HG3 PRO A 15 5.017 -16.129 -2.354 1.00 1.30 H new ATOM 0 HD2 PRO A 15 3.395 -16.230 -4.939 1.00 1.30 H new ATOM 0 HD3 PRO A 15 2.829 -15.869 -3.320 1.00 1.30 H new ATOM 252 N PHE A 16 6.695 -12.287 -5.246 1.00 0.70 N ATOM 253 CA PHE A 16 7.271 -11.456 -6.284 1.00 0.61 C ATOM 254 C PHE A 16 8.448 -10.735 -5.627 1.00 0.58 C ATOM 255 O PHE A 16 8.556 -10.761 -4.393 1.00 0.68 O ATOM 256 CB PHE A 16 6.222 -10.475 -6.830 1.00 0.78 C ATOM 257 CG PHE A 16 6.645 -9.760 -8.098 1.00 0.90 C ATOM 258 CD1 PHE A 16 6.520 -10.413 -9.339 1.00 1.83 C ATOM 259 CD2 PHE A 16 7.193 -8.466 -8.042 1.00 1.95 C ATOM 260 CE1 PHE A 16 6.944 -9.774 -10.517 1.00 1.98 C ATOM 261 CE2 PHE A 16 7.624 -7.832 -9.220 1.00 2.18 C ATOM 262 CZ PHE A 16 7.501 -8.485 -10.458 1.00 1.52 C ATOM 0 H PHE A 16 7.048 -12.060 -4.316 1.00 0.70 H new ATOM 0 HA PHE A 16 7.608 -12.038 -7.142 1.00 0.61 H new ATOM 0 HB2 PHE A 16 5.297 -11.019 -7.023 1.00 0.78 H new ATOM 0 HB3 PHE A 16 6.001 -9.732 -6.063 1.00 0.78 H new ATOM 0 HD1 PHE A 16 6.098 -11.406 -9.386 1.00 1.83 H new ATOM 0 HD2 PHE A 16 7.283 -7.959 -7.093 1.00 1.95 H new ATOM 0 HE1 PHE A 16 6.842 -10.274 -11.469 1.00 1.98 H new ATOM 0 HE2 PHE A 16 8.051 -6.841 -9.174 1.00 2.18 H new ATOM 0 HZ PHE A 16 7.834 -7.997 -11.362 1.00 1.52 H new ATOM 272 N THR A 17 9.308 -10.114 -6.439 1.00 0.55 N ATOM 273 CA THR A 17 10.454 -9.341 -5.995 1.00 0.52 C ATOM 274 C THR A 17 10.359 -7.936 -6.575 1.00 0.50 C ATOM 275 O THR A 17 10.413 -7.760 -7.789 1.00 0.68 O ATOM 276 CB THR A 17 11.759 -10.044 -6.379 1.00 0.58 C ATOM 277 OG1 THR A 17 11.757 -11.348 -5.833 1.00 0.70 O ATOM 278 CG2 THR A 17 12.958 -9.286 -5.804 1.00 0.54 C ATOM 0 H THR A 17 9.216 -10.141 -7.455 1.00 0.55 H new ATOM 0 HA THR A 17 10.453 -9.261 -4.908 1.00 0.52 H new ATOM 0 HB THR A 17 11.834 -10.078 -7.466 1.00 0.58 H new ATOM 0 HG1 THR A 17 11.985 -11.304 -4.881 1.00 0.70 H new ATOM 0 HG21 THR A 17 13.879 -9.796 -6.084 1.00 0.54 H new ATOM 0 HG22 THR A 17 12.971 -8.271 -6.200 1.00 0.54 H new ATOM 0 HG23 THR A 17 12.879 -9.251 -4.717 1.00 0.54 H new ATOM 286 N PHE A 18 10.208 -6.946 -5.698 1.00 0.42 N ATOM 287 CA PHE A 18 10.056 -5.547 -6.051 1.00 0.42 C ATOM 288 C PHE A 18 11.365 -4.829 -5.751 1.00 0.40 C ATOM 289 O PHE A 18 12.197 -5.339 -4.994 1.00 0.40 O ATOM 290 CB PHE A 18 8.942 -4.912 -5.208 1.00 0.38 C ATOM 291 CG PHE A 18 7.702 -5.769 -5.023 1.00 0.40 C ATOM 292 CD1 PHE A 18 7.652 -6.722 -3.986 1.00 1.57 C ATOM 293 CD2 PHE A 18 6.596 -5.608 -5.877 1.00 1.55 C ATOM 294 CE1 PHE A 18 6.518 -7.538 -3.832 1.00 1.60 C ATOM 295 CE2 PHE A 18 5.452 -6.405 -5.704 1.00 1.57 C ATOM 296 CZ PHE A 18 5.416 -7.375 -4.687 1.00 0.57 C ATOM 0 H PHE A 18 10.188 -7.107 -4.691 1.00 0.42 H new ATOM 0 HA PHE A 18 9.801 -5.463 -7.108 1.00 0.42 H new ATOM 0 HB2 PHE A 18 9.346 -4.669 -4.225 1.00 0.38 H new ATOM 0 HB3 PHE A 18 8.648 -3.971 -5.673 1.00 0.38 H new ATOM 0 HD1 PHE A 18 8.487 -6.826 -3.308 1.00 1.57 H new ATOM 0 HD2 PHE A 18 6.626 -4.871 -6.666 1.00 1.55 H new ATOM 0 HE1 PHE A 18 6.494 -8.290 -3.057 1.00 1.60 H new ATOM 0 HE2 PHE A 18 4.599 -6.272 -6.353 1.00 1.57 H new ATOM 0 HZ PHE A 18 4.540 -7.995 -4.563 1.00 0.57 H new ATOM 306 N GLN A 19 11.502 -3.614 -6.285 1.00 0.49 N ATOM 307 CA GLN A 19 12.515 -2.674 -5.848 1.00 0.49 C ATOM 308 C GLN A 19 11.824 -1.509 -5.148 1.00 0.53 C ATOM 309 O GLN A 19 10.812 -0.994 -5.639 1.00 0.56 O ATOM 310 CB GLN A 19 13.354 -2.176 -7.025 1.00 0.55 C ATOM 311 CG GLN A 19 13.851 -3.328 -7.905 1.00 0.71 C ATOM 312 CD GLN A 19 14.952 -2.855 -8.845 1.00 1.13 C ATOM 313 OE1 GLN A 19 14.676 -2.325 -9.917 1.00 1.47 O ATOM 314 NE2 GLN A 19 16.209 -3.030 -8.452 1.00 1.76 N ATOM 0 H GLN A 19 10.907 -3.261 -7.035 1.00 0.49 H new ATOM 0 HA GLN A 19 13.196 -3.172 -5.157 1.00 0.49 H new ATOM 0 HB2 GLN A 19 12.760 -1.489 -7.628 1.00 0.55 H new ATOM 0 HB3 GLN A 19 14.208 -1.613 -6.649 1.00 0.55 H new ATOM 0 HG2 GLN A 19 14.226 -4.136 -7.277 1.00 0.71 H new ATOM 0 HG3 GLN A 19 13.021 -3.733 -8.484 1.00 0.71 H new ATOM 0 HE21 GLN A 19 16.406 -3.474 -7.555 1.00 1.76 H new ATOM 0 HE22 GLN A 19 16.977 -2.720 -9.047 1.00 1.76 H new ATOM 323 N ASN A 20 12.362 -1.104 -4.002 1.00 0.54 N ATOM 324 CA ASN A 20 11.914 0.083 -3.299 1.00 0.61 C ATOM 325 C ASN A 20 12.478 1.362 -3.924 1.00 0.81 C ATOM 326 O ASN A 20 13.287 1.317 -4.851 1.00 0.92 O ATOM 327 CB ASN A 20 12.123 -0.055 -1.782 1.00 0.59 C ATOM 328 CG ASN A 20 13.520 0.298 -1.298 1.00 0.76 C ATOM 329 OD1 ASN A 20 14.388 0.674 -2.081 1.00 1.13 O ATOM 330 ND2 ASN A 20 13.742 0.194 0.004 1.00 0.76 N ATOM 0 H ASN A 20 13.125 -1.596 -3.536 1.00 0.54 H new ATOM 0 HA ASN A 20 10.835 0.180 -3.423 1.00 0.61 H new ATOM 0 HB2 ASN A 20 11.404 0.584 -1.270 1.00 0.59 H new ATOM 0 HB3 ASN A 20 11.901 -1.082 -1.490 1.00 0.59 H new ATOM 0 HD21 ASN A 20 14.658 0.430 0.386 1.00 0.76 H new ATOM 0 HD22 ASN A 20 12.997 -0.122 0.625 1.00 0.76 H new ATOM 337 N GLN A 21 12.051 2.518 -3.415 1.00 0.90 N ATOM 338 CA GLN A 21 12.439 3.831 -3.920 1.00 1.14 C ATOM 339 C GLN A 21 13.954 4.080 -3.826 1.00 1.28 C ATOM 340 O GLN A 21 14.483 4.948 -4.529 1.00 1.59 O ATOM 341 CB GLN A 21 11.600 4.919 -3.223 1.00 1.26 C ATOM 342 CG GLN A 21 11.783 5.006 -1.697 1.00 1.30 C ATOM 343 CD GLN A 21 13.158 5.531 -1.306 1.00 1.81 C ATOM 344 OE1 GLN A 21 13.692 6.413 -1.973 1.00 2.72 O ATOM 345 NE2 GLN A 21 13.744 4.987 -0.248 1.00 1.87 N ATOM 0 H GLN A 21 11.411 2.566 -2.622 1.00 0.90 H new ATOM 0 HA GLN A 21 12.222 3.870 -4.988 1.00 1.14 H new ATOM 0 HB2 GLN A 21 11.852 5.886 -3.659 1.00 1.26 H new ATOM 0 HB3 GLN A 21 10.547 4.737 -3.437 1.00 1.26 H new ATOM 0 HG2 GLN A 21 11.016 5.657 -1.278 1.00 1.30 H new ATOM 0 HG3 GLN A 21 11.636 4.019 -1.259 1.00 1.30 H new ATOM 0 HE21 GLN A 21 13.267 4.256 0.280 1.00 1.87 H new ATOM 0 HE22 GLN A 21 14.672 5.299 0.038 1.00 1.87 H new ATOM 354 N ASP A 22 14.615 3.317 -2.949 1.00 1.13 N ATOM 355 CA ASP A 22 16.045 3.290 -2.677 1.00 1.16 C ATOM 356 C ASP A 22 16.771 2.359 -3.660 1.00 1.04 C ATOM 357 O ASP A 22 17.978 2.161 -3.558 1.00 1.08 O ATOM 358 CB ASP A 22 16.239 2.895 -1.200 1.00 1.24 C ATOM 359 CG ASP A 22 17.025 3.943 -0.423 1.00 2.02 C ATOM 360 OD1 ASP A 22 16.417 5.003 -0.144 1.00 3.13 O ATOM 361 OD2 ASP A 22 18.197 3.665 -0.104 1.00 2.43 O ATOM 0 H ASP A 22 14.115 2.647 -2.364 1.00 1.13 H new ATOM 0 HA ASP A 22 16.492 4.272 -2.830 1.00 1.16 H new ATOM 0 HB2 ASP A 22 15.265 2.754 -0.732 1.00 1.24 H new ATOM 0 HB3 ASP A 22 16.760 1.939 -1.147 1.00 1.24 H new ATOM 366 N GLY A 23 16.044 1.781 -4.626 1.00 0.99 N ATOM 367 CA GLY A 23 16.579 0.808 -5.567 1.00 0.99 C ATOM 368 C GLY A 23 16.879 -0.517 -4.870 1.00 0.91 C ATOM 369 O GLY A 23 17.640 -1.334 -5.385 1.00 1.09 O ATOM 0 H GLY A 23 15.055 1.984 -4.771 1.00 0.99 H new ATOM 0 HA2 GLY A 23 15.864 0.645 -6.374 1.00 0.99 H new ATOM 0 HA3 GLY A 23 17.489 1.199 -6.022 1.00 0.99 H new ATOM 373 N LYS A 24 16.291 -0.733 -3.691 1.00 0.77 N ATOM 374 CA LYS A 24 16.620 -1.845 -2.830 1.00 0.72 C ATOM 375 C LYS A 24 15.646 -2.981 -3.130 1.00 0.59 C ATOM 376 O LYS A 24 14.432 -2.802 -3.052 1.00 0.59 O ATOM 377 CB LYS A 24 16.539 -1.356 -1.378 1.00 0.90 C ATOM 378 CG LYS A 24 17.452 -2.060 -0.378 1.00 0.95 C ATOM 379 CD LYS A 24 16.897 -3.471 -0.138 1.00 1.66 C ATOM 380 CE LYS A 24 17.719 -4.415 0.737 1.00 2.10 C ATOM 381 NZ LYS A 24 17.074 -5.750 0.758 1.00 3.23 N ATOM 0 H LYS A 24 15.564 -0.125 -3.313 1.00 0.77 H new ATOM 0 HA LYS A 24 17.628 -2.223 -2.999 1.00 0.72 H new ATOM 0 HB2 LYS A 24 16.770 -0.291 -1.362 1.00 0.90 H new ATOM 0 HB3 LYS A 24 15.509 -1.464 -1.037 1.00 0.90 H new ATOM 0 HG2 LYS A 24 18.470 -2.112 -0.763 1.00 0.95 H new ATOM 0 HG3 LYS A 24 17.493 -1.503 0.558 1.00 0.95 H new ATOM 0 HD2 LYS A 24 15.909 -3.371 0.311 1.00 1.66 H new ATOM 0 HD3 LYS A 24 16.759 -3.947 -1.109 1.00 1.66 H new ATOM 0 HE2 LYS A 24 18.735 -4.495 0.351 1.00 2.10 H new ATOM 0 HE3 LYS A 24 17.794 -4.018 1.750 1.00 2.10 H new ATOM 0 HZ1 LYS A 24 17.791 -6.485 0.593 1.00 3.23 H new ATOM 0 HZ2 LYS A 24 16.626 -5.905 1.684 1.00 3.23 H new ATOM 0 HZ3 LYS A 24 16.351 -5.798 0.012 1.00 3.23 H new ATOM 395 N ASN A 25 16.192 -4.158 -3.439 1.00 0.53 N ATOM 396 CA ASN A 25 15.415 -5.340 -3.780 1.00 0.47 C ATOM 397 C ASN A 25 14.833 -5.959 -2.509 1.00 0.45 C ATOM 398 O ASN A 25 15.547 -6.121 -1.506 1.00 0.51 O ATOM 399 CB ASN A 25 16.280 -6.375 -4.512 1.00 0.51 C ATOM 400 CG ASN A 25 16.801 -5.898 -5.866 1.00 1.90 C ATOM 401 OD1 ASN A 25 16.540 -4.780 -6.296 1.00 2.93 O ATOM 402 ND2 ASN A 25 17.559 -6.745 -6.556 1.00 2.69 N ATOM 0 H ASN A 25 17.200 -4.314 -3.458 1.00 0.53 H new ATOM 0 HA ASN A 25 14.605 -5.039 -4.445 1.00 0.47 H new ATOM 0 HB2 ASN A 25 17.128 -6.638 -3.880 1.00 0.51 H new ATOM 0 HB3 ASN A 25 15.697 -7.284 -4.658 1.00 0.51 H new ATOM 0 HD21 ASN A 25 17.936 -6.469 -7.463 1.00 2.69 H new ATOM 0 HD22 ASN A 25 17.763 -7.670 -6.179 1.00 2.69 H new ATOM 409 N VAL A 26 13.539 -6.288 -2.561 1.00 0.44 N ATOM 410 CA VAL A 26 12.757 -6.850 -1.469 1.00 0.41 C ATOM 411 C VAL A 26 11.725 -7.813 -2.071 1.00 0.45 C ATOM 412 O VAL A 26 11.107 -7.477 -3.082 1.00 0.52 O ATOM 413 CB VAL A 26 12.086 -5.713 -0.669 1.00 0.40 C ATOM 414 CG1 VAL A 26 13.103 -4.969 0.207 1.00 0.90 C ATOM 415 CG2 VAL A 26 11.380 -4.681 -1.556 1.00 0.91 C ATOM 0 H VAL A 26 12.987 -6.161 -3.409 1.00 0.44 H new ATOM 0 HA VAL A 26 13.391 -7.401 -0.775 1.00 0.41 H new ATOM 0 HB VAL A 26 11.337 -6.208 -0.051 1.00 0.40 H new ATOM 0 HG11 VAL A 26 12.598 -4.175 0.757 1.00 0.90 H new ATOM 0 HG12 VAL A 26 13.556 -5.667 0.911 1.00 0.90 H new ATOM 0 HG13 VAL A 26 13.879 -4.536 -0.424 1.00 0.90 H new ATOM 0 HG21 VAL A 26 10.930 -3.910 -0.930 1.00 0.91 H new ATOM 0 HG22 VAL A 26 12.105 -4.224 -2.230 1.00 0.91 H new ATOM 0 HG23 VAL A 26 10.602 -5.174 -2.140 1.00 0.91 H new ATOM 425 N SER A 27 11.547 -9.003 -1.481 1.00 0.53 N ATOM 426 CA SER A 27 10.608 -10.004 -1.977 1.00 0.55 C ATOM 427 C SER A 27 9.483 -10.213 -0.976 1.00 0.57 C ATOM 428 O SER A 27 9.656 -9.914 0.205 1.00 0.61 O ATOM 429 CB SER A 27 11.339 -11.327 -2.234 1.00 0.57 C ATOM 430 OG SER A 27 12.404 -11.140 -3.147 1.00 1.60 O ATOM 0 H SER A 27 12.054 -9.294 -0.645 1.00 0.53 H new ATOM 0 HA SER A 27 10.179 -9.649 -2.914 1.00 0.55 H new ATOM 0 HB2 SER A 27 11.724 -11.724 -1.295 1.00 0.57 H new ATOM 0 HB3 SER A 27 10.640 -12.064 -2.629 1.00 0.57 H new ATOM 0 HG SER A 27 12.860 -11.994 -3.298 1.00 1.60 H new ATOM 436 N LEU A 28 8.349 -10.775 -1.415 1.00 0.59 N ATOM 437 CA LEU A 28 7.290 -11.147 -0.494 1.00 0.58 C ATOM 438 C LEU A 28 7.849 -11.964 0.667 1.00 0.53 C ATOM 439 O LEU A 28 7.554 -11.672 1.819 1.00 0.49 O ATOM 440 CB LEU A 28 6.230 -11.965 -1.222 1.00 0.70 C ATOM 441 CG LEU A 28 4.979 -12.119 -0.350 1.00 1.20 C ATOM 442 CD1 LEU A 28 4.156 -10.836 -0.407 1.00 1.50 C ATOM 443 CD2 LEU A 28 4.140 -13.276 -0.874 1.00 1.55 C ATOM 0 H LEU A 28 8.151 -10.977 -2.395 1.00 0.59 H new ATOM 0 HA LEU A 28 6.842 -10.234 -0.101 1.00 0.58 H new ATOM 0 HB2 LEU A 28 5.968 -11.478 -2.161 1.00 0.70 H new ATOM 0 HB3 LEU A 28 6.629 -12.948 -1.473 1.00 0.70 H new ATOM 0 HG LEU A 28 5.276 -12.316 0.680 1.00 1.20 H new ATOM 0 HD11 LEU A 28 3.267 -10.946 0.213 1.00 1.50 H new ATOM 0 HD12 LEU A 28 4.755 -10.003 -0.038 1.00 1.50 H new ATOM 0 HD13 LEU A 28 3.858 -10.640 -1.437 1.00 1.50 H new ATOM 0 HD21 LEU A 28 3.249 -13.389 -0.256 1.00 1.55 H new ATOM 0 HD22 LEU A 28 3.844 -13.074 -1.904 1.00 1.55 H new ATOM 0 HD23 LEU A 28 4.725 -14.195 -0.838 1.00 1.55 H new ATOM 455 N GLU A 29 8.673 -12.968 0.366 1.00 0.67 N ATOM 456 CA GLU A 29 9.280 -13.834 1.358 1.00 0.81 C ATOM 457 C GLU A 29 10.076 -13.069 2.422 1.00 0.68 C ATOM 458 O GLU A 29 10.199 -13.516 3.556 1.00 0.70 O ATOM 459 CB GLU A 29 10.135 -14.875 0.655 1.00 1.17 C ATOM 460 CG GLU A 29 9.368 -15.724 -0.378 1.00 1.45 C ATOM 461 CD GLU A 29 8.116 -16.401 0.170 1.00 3.54 C ATOM 462 OE1 GLU A 29 8.115 -16.858 1.335 1.00 4.81 O ATOM 463 OE2 GLU A 29 7.115 -16.494 -0.575 1.00 4.47 O ATOM 0 H GLU A 29 8.937 -13.200 -0.591 1.00 0.67 H new ATOM 0 HA GLU A 29 8.479 -14.331 1.905 1.00 0.81 H new ATOM 0 HB2 GLU A 29 10.962 -14.372 0.154 1.00 1.17 H new ATOM 0 HB3 GLU A 29 10.570 -15.538 1.403 1.00 1.17 H new ATOM 0 HG2 GLU A 29 9.085 -15.087 -1.216 1.00 1.45 H new ATOM 0 HG3 GLU A 29 10.038 -16.489 -0.771 1.00 1.45 H new ATOM 470 N SER A 30 10.601 -11.894 2.065 1.00 0.62 N ATOM 471 CA SER A 30 11.262 -10.987 2.993 1.00 0.60 C ATOM 472 C SER A 30 10.318 -10.405 4.067 1.00 0.50 C ATOM 473 O SER A 30 10.779 -9.678 4.948 1.00 0.58 O ATOM 474 CB SER A 30 11.966 -9.884 2.210 1.00 0.71 C ATOM 475 OG SER A 30 12.495 -10.340 0.974 1.00 1.54 O ATOM 0 H SER A 30 10.576 -11.545 1.107 1.00 0.62 H new ATOM 0 HA SER A 30 11.998 -11.569 3.548 1.00 0.60 H new ATOM 0 HB2 SER A 30 11.263 -9.072 2.022 1.00 0.71 H new ATOM 0 HB3 SER A 30 12.773 -9.473 2.816 1.00 0.71 H new ATOM 0 HG SER A 30 13.289 -9.814 0.744 1.00 1.54 H new ATOM 481 N LEU A 31 9.008 -10.632 3.935 1.00 0.45 N ATOM 482 CA LEU A 31 7.940 -10.183 4.825 1.00 0.47 C ATOM 483 C LEU A 31 7.103 -11.373 5.319 1.00 0.53 C ATOM 484 O LEU A 31 6.724 -11.439 6.485 1.00 0.77 O ATOM 485 CB LEU A 31 7.034 -9.221 4.044 1.00 0.50 C ATOM 486 CG LEU A 31 7.782 -8.013 3.462 1.00 0.47 C ATOM 487 CD1 LEU A 31 6.929 -7.324 2.395 1.00 0.53 C ATOM 488 CD2 LEU A 31 8.113 -7.037 4.590 1.00 0.48 C ATOM 0 H LEU A 31 8.644 -11.171 3.149 1.00 0.45 H new ATOM 0 HA LEU A 31 8.379 -9.688 5.691 1.00 0.47 H new ATOM 0 HB2 LEU A 31 6.553 -9.766 3.232 1.00 0.50 H new ATOM 0 HB3 LEU A 31 6.242 -8.865 4.703 1.00 0.50 H new ATOM 0 HG LEU A 31 8.706 -8.351 2.993 1.00 0.47 H new ATOM 0 HD11 LEU A 31 7.472 -6.469 1.991 1.00 0.53 H new ATOM 0 HD12 LEU A 31 6.712 -8.028 1.592 1.00 0.53 H new ATOM 0 HD13 LEU A 31 5.995 -6.983 2.841 1.00 0.53 H new ATOM 0 HD21 LEU A 31 8.644 -6.177 4.183 1.00 0.48 H new ATOM 0 HD22 LEU A 31 7.190 -6.702 5.064 1.00 0.48 H new ATOM 0 HD23 LEU A 31 8.741 -7.535 5.329 1.00 0.48 H new ATOM 500 N LYS A 32 6.766 -12.290 4.411 1.00 0.55 N ATOM 501 CA LYS A 32 5.962 -13.472 4.655 1.00 0.57 C ATOM 502 C LYS A 32 6.431 -14.203 5.914 1.00 0.57 C ATOM 503 O LYS A 32 7.620 -14.450 6.093 1.00 0.75 O ATOM 504 CB LYS A 32 6.068 -14.355 3.417 1.00 0.65 C ATOM 505 CG LYS A 32 5.018 -15.466 3.345 1.00 0.79 C ATOM 506 CD LYS A 32 4.678 -15.735 1.876 1.00 1.69 C ATOM 507 CE LYS A 32 4.478 -17.228 1.590 1.00 1.68 C ATOM 508 NZ LYS A 32 5.750 -17.852 1.173 1.00 2.72 N ATOM 0 H LYS A 32 7.065 -12.218 3.439 1.00 0.55 H new ATOM 0 HA LYS A 32 4.921 -13.201 4.831 1.00 0.57 H new ATOM 0 HB2 LYS A 32 5.979 -13.729 2.529 1.00 0.65 H new ATOM 0 HB3 LYS A 32 7.060 -14.806 3.390 1.00 0.65 H new ATOM 0 HG2 LYS A 32 5.397 -16.373 3.816 1.00 0.79 H new ATOM 0 HG3 LYS A 32 4.122 -15.173 3.892 1.00 0.79 H new ATOM 0 HD2 LYS A 32 3.771 -15.192 1.610 1.00 1.69 H new ATOM 0 HD3 LYS A 32 5.478 -15.350 1.244 1.00 1.69 H new ATOM 0 HE2 LYS A 32 4.097 -17.727 2.481 1.00 1.68 H new ATOM 0 HE3 LYS A 32 3.730 -17.357 0.808 1.00 1.68 H new ATOM 0 HZ1 LYS A 32 5.699 -18.880 1.325 1.00 2.72 H new ATOM 0 HZ2 LYS A 32 5.917 -17.659 0.165 1.00 2.72 H new ATOM 0 HZ3 LYS A 32 6.531 -17.457 1.735 1.00 2.72 H new ATOM 522 N GLY A 33 5.482 -14.517 6.793 1.00 0.51 N ATOM 523 CA GLY A 33 5.732 -14.942 8.158 1.00 0.53 C ATOM 524 C GLY A 33 5.223 -13.865 9.111 1.00 0.52 C ATOM 525 O GLY A 33 4.574 -14.188 10.103 1.00 0.60 O ATOM 0 H GLY A 33 4.489 -14.480 6.563 1.00 0.51 H new ATOM 0 HA2 GLY A 33 5.230 -15.889 8.356 1.00 0.53 H new ATOM 0 HA3 GLY A 33 6.798 -15.108 8.312 1.00 0.53 H new ATOM 529 N GLU A 34 5.486 -12.595 8.787 1.00 0.50 N ATOM 530 CA GLU A 34 5.128 -11.454 9.618 1.00 0.52 C ATOM 531 C GLU A 34 3.851 -10.763 9.126 1.00 0.40 C ATOM 532 O GLU A 34 3.400 -10.978 8.003 1.00 0.41 O ATOM 533 CB GLU A 34 6.322 -10.489 9.659 1.00 0.65 C ATOM 534 CG GLU A 34 7.388 -10.969 10.652 1.00 1.02 C ATOM 535 CD GLU A 34 7.022 -10.601 12.084 1.00 2.36 C ATOM 536 OE1 GLU A 34 6.261 -11.374 12.702 1.00 3.32 O ATOM 537 OE2 GLU A 34 7.487 -9.529 12.526 1.00 3.43 O ATOM 0 H GLU A 34 5.962 -12.333 7.924 1.00 0.50 H new ATOM 0 HA GLU A 34 4.906 -11.799 10.628 1.00 0.52 H new ATOM 0 HB2 GLU A 34 6.759 -10.405 8.664 1.00 0.65 H new ATOM 0 HB3 GLU A 34 5.979 -9.494 9.942 1.00 0.65 H new ATOM 0 HG2 GLU A 34 7.502 -12.050 10.571 1.00 1.02 H new ATOM 0 HG3 GLU A 34 8.351 -10.527 10.396 1.00 1.02 H new ATOM 544 N VAL A 35 3.264 -9.932 9.992 1.00 0.35 N ATOM 545 CA VAL A 35 2.060 -9.150 9.728 1.00 0.30 C ATOM 546 C VAL A 35 2.460 -7.756 9.269 1.00 0.27 C ATOM 547 O VAL A 35 2.641 -6.850 10.077 1.00 0.38 O ATOM 548 CB VAL A 35 1.144 -9.159 10.962 1.00 0.36 C ATOM 549 CG1 VAL A 35 1.786 -8.748 12.298 1.00 0.39 C ATOM 550 CG2 VAL A 35 -0.126 -8.342 10.712 1.00 0.41 C ATOM 0 H VAL A 35 3.631 -9.782 10.932 1.00 0.35 H new ATOM 0 HA VAL A 35 1.478 -9.594 8.920 1.00 0.30 H new ATOM 0 HB VAL A 35 0.904 -10.214 11.090 1.00 0.36 H new ATOM 0 HG11 VAL A 35 1.039 -8.795 13.090 1.00 0.39 H new ATOM 0 HG12 VAL A 35 2.606 -9.427 12.532 1.00 0.39 H new ATOM 0 HG13 VAL A 35 2.169 -7.730 12.220 1.00 0.39 H new ATOM 0 HG21 VAL A 35 -0.755 -8.366 11.602 1.00 0.41 H new ATOM 0 HG22 VAL A 35 0.144 -7.310 10.486 1.00 0.41 H new ATOM 0 HG23 VAL A 35 -0.672 -8.767 9.870 1.00 0.41 H new ATOM 560 N TRP A 36 2.617 -7.593 7.959 1.00 0.39 N ATOM 561 CA TRP A 36 3.146 -6.380 7.374 1.00 0.33 C ATOM 562 C TRP A 36 2.009 -5.560 6.771 1.00 0.31 C ATOM 563 O TRP A 36 1.028 -6.102 6.262 1.00 0.34 O ATOM 564 CB TRP A 36 4.241 -6.746 6.371 1.00 0.33 C ATOM 565 CG TRP A 36 3.820 -7.584 5.210 1.00 0.32 C ATOM 566 CD1 TRP A 36 3.664 -8.924 5.173 1.00 0.36 C ATOM 567 CD2 TRP A 36 3.499 -7.109 3.883 1.00 0.32 C ATOM 568 NE1 TRP A 36 3.314 -9.309 3.894 1.00 0.36 N ATOM 569 CE2 TRP A 36 3.217 -8.222 3.042 1.00 0.35 C ATOM 570 CE3 TRP A 36 3.420 -5.827 3.321 1.00 0.34 C ATOM 571 CZ2 TRP A 36 2.890 -8.057 1.685 1.00 0.40 C ATOM 572 CZ3 TRP A 36 3.020 -5.648 1.988 1.00 0.41 C ATOM 573 CH2 TRP A 36 2.788 -6.755 1.164 1.00 0.43 C ATOM 0 H TRP A 36 2.377 -8.309 7.274 1.00 0.39 H new ATOM 0 HA TRP A 36 3.608 -5.747 8.131 1.00 0.33 H new ATOM 0 HB2 TRP A 36 4.676 -5.823 5.987 1.00 0.33 H new ATOM 0 HB3 TRP A 36 5.032 -7.273 6.905 1.00 0.33 H new ATOM 0 HD1 TRP A 36 3.793 -9.591 6.013 1.00 0.36 H new ATOM 0 HE1 TRP A 36 3.147 -10.275 3.612 1.00 0.36 H new ATOM 0 HE3 TRP A 36 3.670 -4.965 3.922 1.00 0.34 H new ATOM 0 HZ2 TRP A 36 2.720 -8.916 1.053 1.00 0.40 H new ATOM 0 HZ3 TRP A 36 2.890 -4.650 1.596 1.00 0.41 H new ATOM 0 HH2 TRP A 36 2.530 -6.609 0.125 1.00 0.43 H new ATOM 584 N LEU A 37 2.107 -4.237 6.875 1.00 0.34 N ATOM 585 CA LEU A 37 1.041 -3.363 6.434 1.00 0.35 C ATOM 586 C LEU A 37 1.294 -3.007 4.976 1.00 0.37 C ATOM 587 O LEU A 37 2.449 -2.899 4.569 1.00 0.36 O ATOM 588 CB LEU A 37 1.021 -2.096 7.283 1.00 0.37 C ATOM 589 CG LEU A 37 1.118 -2.293 8.801 1.00 0.42 C ATOM 590 CD1 LEU A 37 0.761 -0.975 9.495 1.00 0.64 C ATOM 591 CD2 LEU A 37 0.186 -3.396 9.324 1.00 0.58 C ATOM 0 H LEU A 37 2.917 -3.753 7.262 1.00 0.34 H new ATOM 0 HA LEU A 37 0.078 -3.862 6.539 1.00 0.35 H new ATOM 0 HB2 LEU A 37 1.848 -1.460 6.967 1.00 0.37 H new ATOM 0 HB3 LEU A 37 0.101 -1.554 7.067 1.00 0.37 H new ATOM 0 HG LEU A 37 2.140 -2.599 9.023 1.00 0.42 H new ATOM 0 HD11 LEU A 37 0.827 -1.103 10.575 1.00 0.64 H new ATOM 0 HD12 LEU A 37 1.456 -0.197 9.179 1.00 0.64 H new ATOM 0 HD13 LEU A 37 -0.254 -0.685 9.225 1.00 0.64 H new ATOM 0 HD21 LEU A 37 0.301 -3.487 10.404 1.00 0.58 H new ATOM 0 HD22 LEU A 37 -0.847 -3.141 9.089 1.00 0.58 H new ATOM 0 HD23 LEU A 37 0.442 -4.344 8.851 1.00 0.58 H new ATOM 603 N ALA A 38 0.236 -2.810 4.196 1.00 0.48 N ATOM 604 CA ALA A 38 0.330 -2.398 2.813 1.00 0.51 C ATOM 605 C ALA A 38 -0.620 -1.233 2.577 1.00 0.60 C ATOM 606 O ALA A 38 -1.792 -1.297 2.953 1.00 0.94 O ATOM 607 CB ALA A 38 -0.024 -3.585 1.915 1.00 0.61 C ATOM 0 H ALA A 38 -0.723 -2.936 4.519 1.00 0.48 H new ATOM 0 HA ALA A 38 1.343 -2.073 2.577 1.00 0.51 H new ATOM 0 HB1 ALA A 38 0.044 -3.284 0.870 1.00 0.61 H new ATOM 0 HB2 ALA A 38 0.671 -4.403 2.103 1.00 0.61 H new ATOM 0 HB3 ALA A 38 -1.040 -3.915 2.132 1.00 0.61 H new ATOM 613 N ASP A 39 -0.096 -0.193 1.931 1.00 0.51 N ATOM 614 CA ASP A 39 -0.848 0.956 1.457 1.00 0.60 C ATOM 615 C ASP A 39 -0.460 1.197 0.001 1.00 0.75 C ATOM 616 O ASP A 39 0.455 0.559 -0.524 1.00 1.56 O ATOM 617 CB ASP A 39 -0.556 2.169 2.351 1.00 0.82 C ATOM 618 CG ASP A 39 -1.242 2.024 3.698 1.00 2.00 C ATOM 619 OD1 ASP A 39 -2.443 2.354 3.738 1.00 3.47 O ATOM 620 OD2 ASP A 39 -0.558 1.607 4.658 1.00 2.55 O ATOM 0 H ASP A 39 0.900 -0.130 1.718 1.00 0.51 H new ATOM 0 HA ASP A 39 -1.923 0.780 1.508 1.00 0.60 H new ATOM 0 HB2 ASP A 39 0.520 2.270 2.495 1.00 0.82 H new ATOM 0 HB3 ASP A 39 -0.899 3.080 1.859 1.00 0.82 H new ATOM 625 N PHE A 40 -1.188 2.068 -0.691 1.00 0.68 N ATOM 626 CA PHE A 40 -0.887 2.423 -2.068 1.00 0.74 C ATOM 627 C PHE A 40 -1.544 3.766 -2.368 1.00 0.81 C ATOM 628 O PHE A 40 -2.761 3.881 -2.267 1.00 1.05 O ATOM 629 CB PHE A 40 -1.301 1.294 -3.032 1.00 0.87 C ATOM 630 CG PHE A 40 -2.615 0.600 -2.718 1.00 0.86 C ATOM 631 CD1 PHE A 40 -2.637 -0.447 -1.776 1.00 2.24 C ATOM 632 CD2 PHE A 40 -3.815 1.015 -3.322 1.00 1.75 C ATOM 633 CE1 PHE A 40 -3.862 -0.962 -1.324 1.00 2.63 C ATOM 634 CE2 PHE A 40 -5.029 0.409 -2.951 1.00 1.77 C ATOM 635 CZ PHE A 40 -5.061 -0.536 -1.917 1.00 1.65 C ATOM 0 H PHE A 40 -2.004 2.547 -0.309 1.00 0.68 H new ATOM 0 HA PHE A 40 0.187 2.537 -2.216 1.00 0.74 H new ATOM 0 HB2 PHE A 40 -1.362 1.707 -4.039 1.00 0.87 H new ATOM 0 HB3 PHE A 40 -0.510 0.544 -3.043 1.00 0.87 H new ATOM 0 HD1 PHE A 40 -1.710 -0.854 -1.401 1.00 2.24 H new ATOM 0 HD2 PHE A 40 -3.805 1.796 -4.068 1.00 1.75 H new ATOM 0 HE1 PHE A 40 -3.882 -1.685 -0.522 1.00 2.63 H new ATOM 0 HE2 PHE A 40 -5.941 0.673 -3.466 1.00 1.77 H new ATOM 0 HZ PHE A 40 -6.005 -0.935 -1.577 1.00 1.65 H new ATOM 645 N ILE A 41 -0.743 4.781 -2.704 1.00 0.77 N ATOM 646 CA ILE A 41 -1.210 6.110 -3.073 1.00 0.88 C ATOM 647 C ILE A 41 -0.348 6.651 -4.220 1.00 0.70 C ATOM 648 O ILE A 41 0.679 6.058 -4.567 1.00 0.67 O ATOM 649 CB ILE A 41 -1.265 7.058 -1.852 1.00 1.28 C ATOM 650 CG1 ILE A 41 -0.039 7.011 -0.920 1.00 1.62 C ATOM 651 CG2 ILE A 41 -2.513 6.768 -1.004 1.00 1.75 C ATOM 652 CD1 ILE A 41 1.274 7.416 -1.594 1.00 1.46 C ATOM 0 H ILE A 41 0.273 4.694 -2.726 1.00 0.77 H new ATOM 0 HA ILE A 41 -2.238 6.046 -3.431 1.00 0.88 H new ATOM 0 HB ILE A 41 -1.288 8.055 -2.292 1.00 1.28 H new ATOM 0 HG12 ILE A 41 -0.217 7.670 -0.070 1.00 1.62 H new ATOM 0 HG13 ILE A 41 0.065 6.001 -0.524 1.00 1.62 H new ATOM 0 HG21 ILE A 41 -2.537 7.443 -0.149 1.00 1.75 H new ATOM 0 HG22 ILE A 41 -3.407 6.917 -1.609 1.00 1.75 H new ATOM 0 HG23 ILE A 41 -2.482 5.737 -0.651 1.00 1.75 H new ATOM 0 HD11 ILE A 41 2.088 7.356 -0.871 1.00 1.46 H new ATOM 0 HD12 ILE A 41 1.478 6.743 -2.427 1.00 1.46 H new ATOM 0 HD13 ILE A 41 1.192 8.438 -1.965 1.00 1.46 H new ATOM 664 N PHE A 42 -0.810 7.745 -4.830 1.00 0.71 N ATOM 665 CA PHE A 42 -0.145 8.474 -5.906 1.00 0.64 C ATOM 666 C PHE A 42 0.448 9.762 -5.325 1.00 0.68 C ATOM 667 O PHE A 42 0.228 10.074 -4.153 1.00 1.26 O ATOM 668 CB PHE A 42 -1.148 8.767 -7.041 1.00 0.78 C ATOM 669 CG PHE A 42 -2.495 9.294 -6.568 1.00 1.09 C ATOM 670 CD1 PHE A 42 -3.509 8.395 -6.182 1.00 1.48 C ATOM 671 CD2 PHE A 42 -2.713 10.680 -6.440 1.00 2.49 C ATOM 672 CE1 PHE A 42 -4.721 8.874 -5.653 1.00 1.57 C ATOM 673 CE2 PHE A 42 -3.932 11.159 -5.927 1.00 2.92 C ATOM 674 CZ PHE A 42 -4.934 10.258 -5.528 1.00 1.94 C ATOM 0 H PHE A 42 -1.703 8.165 -4.572 1.00 0.71 H new ATOM 0 HA PHE A 42 0.662 7.878 -6.333 1.00 0.64 H new ATOM 0 HB2 PHE A 42 -0.706 9.494 -7.722 1.00 0.78 H new ATOM 0 HB3 PHE A 42 -1.309 7.853 -7.612 1.00 0.78 H new ATOM 0 HD1 PHE A 42 -3.355 7.332 -6.293 1.00 1.48 H new ATOM 0 HD2 PHE A 42 -1.942 11.376 -6.736 1.00 2.49 H new ATOM 0 HE1 PHE A 42 -5.487 8.179 -5.343 1.00 1.57 H new ATOM 0 HE2 PHE A 42 -4.098 12.223 -5.839 1.00 2.92 H new ATOM 0 HZ PHE A 42 -5.866 10.628 -5.126 1.00 1.94 H new ATOM 684 N THR A 43 1.224 10.496 -6.122 1.00 0.80 N ATOM 685 CA THR A 43 2.076 11.579 -5.642 1.00 0.95 C ATOM 686 C THR A 43 2.238 12.682 -6.702 1.00 1.19 C ATOM 687 O THR A 43 3.313 13.279 -6.852 1.00 2.66 O ATOM 688 CB THR A 43 3.394 10.971 -5.144 1.00 1.23 C ATOM 689 OG1 THR A 43 4.317 11.963 -4.767 1.00 1.79 O ATOM 690 CG2 THR A 43 4.031 10.111 -6.225 1.00 2.57 C ATOM 0 H THR A 43 1.278 10.352 -7.130 1.00 0.80 H new ATOM 0 HA THR A 43 1.613 12.092 -4.799 1.00 0.95 H new ATOM 0 HB THR A 43 3.149 10.363 -4.274 1.00 1.23 H new ATOM 0 HG1 THR A 43 4.215 12.743 -5.351 1.00 1.79 H new ATOM 0 HG21 THR A 43 4.964 9.689 -5.852 1.00 2.57 H new ATOM 0 HG22 THR A 43 3.351 9.304 -6.496 1.00 2.57 H new ATOM 0 HG23 THR A 43 4.235 10.723 -7.104 1.00 2.57 H new ATOM 698 N ASN A 44 1.129 12.996 -7.375 1.00 1.20 N ATOM 699 CA ASN A 44 1.003 14.086 -8.328 1.00 1.34 C ATOM 700 C ASN A 44 -0.168 14.963 -7.892 1.00 1.71 C ATOM 701 O ASN A 44 -1.294 14.774 -8.346 1.00 2.45 O ATOM 702 CB ASN A 44 0.799 13.517 -9.737 1.00 1.85 C ATOM 703 CG ASN A 44 0.455 14.610 -10.745 1.00 2.59 C ATOM 704 OD1 ASN A 44 0.917 15.741 -10.627 1.00 3.06 O ATOM 705 ND2 ASN A 44 -0.359 14.289 -11.747 1.00 3.37 N ATOM 0 H ASN A 44 0.261 12.472 -7.262 1.00 1.20 H new ATOM 0 HA ASN A 44 1.907 14.694 -8.353 1.00 1.34 H new ATOM 0 HB2 ASN A 44 1.705 13.001 -10.055 1.00 1.85 H new ATOM 0 HB3 ASN A 44 0.000 12.776 -9.718 1.00 1.85 H new ATOM 0 HD21 ASN A 44 -0.614 14.991 -12.442 1.00 3.37 H new ATOM 0 HD22 ASN A 44 -0.728 13.341 -11.820 1.00 3.37 H new ATOM 712 N CYS A 45 0.093 15.906 -6.984 1.00 2.08 N ATOM 713 CA CYS A 45 -0.869 16.907 -6.546 1.00 2.81 C ATOM 714 C CYS A 45 -0.081 18.105 -6.026 1.00 3.31 C ATOM 715 O CYS A 45 0.903 17.912 -5.316 1.00 4.21 O ATOM 716 CB CYS A 45 -1.782 16.344 -5.453 1.00 3.11 C ATOM 717 SG CYS A 45 -2.832 17.691 -4.857 1.00 4.23 S ATOM 0 H CYS A 45 1.000 15.993 -6.526 1.00 2.08 H new ATOM 0 HA CYS A 45 -1.509 17.204 -7.376 1.00 2.81 H new ATOM 0 HB2 CYS A 45 -2.392 15.531 -5.847 1.00 3.11 H new ATOM 0 HB3 CYS A 45 -1.190 15.932 -4.636 1.00 3.11 H new ATOM 0 HG CYS A 45 -3.623 17.245 -3.927 1.00 4.23 H new ATOM 723 N GLU A 46 -0.475 19.320 -6.423 1.00 3.36 N ATOM 724 CA GLU A 46 0.173 20.554 -6.009 1.00 3.94 C ATOM 725 C GLU A 46 -0.405 20.973 -4.654 1.00 3.39 C ATOM 726 O GLU A 46 0.247 20.824 -3.621 1.00 4.03 O ATOM 727 CB GLU A 46 0.015 21.591 -7.131 1.00 5.04 C ATOM 728 CG GLU A 46 0.839 22.859 -6.883 1.00 6.19 C ATOM 729 CD GLU A 46 0.063 23.894 -6.082 1.00 7.12 C ATOM 730 OE1 GLU A 46 -0.820 24.529 -6.697 1.00 7.09 O ATOM 731 OE2 GLU A 46 0.347 24.010 -4.872 1.00 8.26 O ATOM 0 H GLU A 46 -1.266 19.468 -7.050 1.00 3.36 H new ATOM 0 HA GLU A 46 1.246 20.438 -5.858 1.00 3.94 H new ATOM 0 HB2 GLU A 46 0.318 21.145 -8.078 1.00 5.04 H new ATOM 0 HB3 GLU A 46 -1.037 21.859 -7.227 1.00 5.04 H new ATOM 0 HG2 GLU A 46 1.753 22.599 -6.350 1.00 6.19 H new ATOM 0 HG3 GLU A 46 1.138 23.290 -7.838 1.00 6.19 H new ATOM 738 N THR A 47 -1.663 21.418 -4.645 1.00 2.75 N ATOM 739 CA THR A 47 -2.399 21.788 -3.451 1.00 2.54 C ATOM 740 C THR A 47 -2.778 20.532 -2.658 1.00 2.26 C ATOM 741 O THR A 47 -3.941 20.132 -2.607 1.00 2.75 O ATOM 742 CB THR A 47 -3.618 22.617 -3.889 1.00 2.51 C ATOM 743 OG1 THR A 47 -4.064 22.169 -5.159 1.00 2.97 O ATOM 744 CG2 THR A 47 -3.240 24.097 -4.005 1.00 3.34 C ATOM 0 H THR A 47 -2.208 21.532 -5.500 1.00 2.75 H new ATOM 0 HA THR A 47 -1.794 22.397 -2.779 1.00 2.54 H new ATOM 0 HB THR A 47 -4.405 22.496 -3.144 1.00 2.51 H new ATOM 0 HG1 THR A 47 -4.842 22.696 -5.437 1.00 2.97 H new ATOM 0 HG21 THR A 47 -4.112 24.672 -4.316 1.00 3.34 H new ATOM 0 HG22 THR A 47 -2.891 24.460 -3.038 1.00 3.34 H new ATOM 0 HG23 THR A 47 -2.447 24.213 -4.744 1.00 3.34 H new ATOM 752 N ILE A 48 -1.781 19.911 -2.022 1.00 2.10 N ATOM 753 CA ILE A 48 -1.977 18.780 -1.128 1.00 1.91 C ATOM 754 C ILE A 48 -3.042 19.146 -0.087 1.00 1.63 C ATOM 755 O ILE A 48 -2.979 20.219 0.511 1.00 2.26 O ATOM 756 CB ILE A 48 -0.648 18.355 -0.505 1.00 2.24 C ATOM 757 CG1 ILE A 48 0.334 17.885 -1.595 1.00 2.57 C ATOM 758 CG2 ILE A 48 -0.836 17.231 0.518 1.00 2.74 C ATOM 759 CD1 ILE A 48 1.673 18.597 -1.427 1.00 4.07 C ATOM 0 H ILE A 48 -0.804 20.188 -2.119 1.00 2.10 H new ATOM 0 HA ILE A 48 -2.341 17.914 -1.682 1.00 1.91 H new ATOM 0 HB ILE A 48 -0.241 19.227 0.007 1.00 2.24 H new ATOM 0 HG12 ILE A 48 0.475 16.806 -1.530 1.00 2.57 H new ATOM 0 HG13 ILE A 48 -0.078 18.093 -2.583 1.00 2.57 H new ATOM 0 HG21 ILE A 48 0.131 16.956 0.939 1.00 2.74 H new ATOM 0 HG22 ILE A 48 -1.495 17.572 1.316 1.00 2.74 H new ATOM 0 HG23 ILE A 48 -1.278 16.363 0.028 1.00 2.74 H new ATOM 0 HD11 ILE A 48 2.363 18.261 -2.200 1.00 4.07 H new ATOM 0 HD12 ILE A 48 1.526 19.674 -1.515 1.00 4.07 H new ATOM 0 HD13 ILE A 48 2.087 18.366 -0.446 1.00 4.07 H new ATOM 771 N CYS A 49 -4.038 18.273 0.095 1.00 1.25 N ATOM 772 CA CYS A 49 -5.237 18.573 0.874 1.00 1.16 C ATOM 773 C CYS A 49 -5.758 17.348 1.635 1.00 1.07 C ATOM 774 O CYS A 49 -5.717 17.365 2.865 1.00 1.09 O ATOM 775 CB CYS A 49 -6.298 19.245 -0.006 1.00 1.36 C ATOM 776 SG CYS A 49 -7.849 19.328 0.922 1.00 1.84 S ATOM 0 H CYS A 49 -4.032 17.332 -0.298 1.00 1.25 H new ATOM 0 HA CYS A 49 -4.969 19.291 1.649 1.00 1.16 H new ATOM 0 HB2 CYS A 49 -5.974 20.246 -0.292 1.00 1.36 H new ATOM 0 HB3 CYS A 49 -6.438 18.680 -0.928 1.00 1.36 H new ATOM 0 HG CYS A 49 -8.762 19.897 0.192 1.00 1.84 H new ATOM 782 N PRO A 50 -6.243 16.276 0.979 1.00 1.13 N ATOM 783 CA PRO A 50 -6.751 15.124 1.708 1.00 1.20 C ATOM 784 C PRO A 50 -5.650 14.482 2.570 1.00 0.98 C ATOM 785 O PRO A 50 -4.480 14.476 2.181 1.00 0.91 O ATOM 786 CB PRO A 50 -7.309 14.160 0.654 1.00 1.45 C ATOM 787 CG PRO A 50 -6.612 14.584 -0.638 1.00 1.44 C ATOM 788 CD PRO A 50 -6.435 16.089 -0.451 1.00 1.26 C ATOM 0 HA PRO A 50 -7.535 15.408 2.410 1.00 1.20 H new ATOM 0 HB2 PRO A 50 -7.088 13.122 0.905 1.00 1.45 H new ATOM 0 HB3 PRO A 50 -8.392 14.244 0.570 1.00 1.45 H new ATOM 0 HG2 PRO A 50 -5.655 14.077 -0.766 1.00 1.44 H new ATOM 0 HG3 PRO A 50 -7.215 14.354 -1.517 1.00 1.44 H new ATOM 0 HD2 PRO A 50 -5.578 16.458 -1.015 1.00 1.26 H new ATOM 0 HD3 PRO A 50 -7.309 16.635 -0.806 1.00 1.26 H new ATOM 796 N PRO A 51 -5.995 13.935 3.746 1.00 0.97 N ATOM 797 CA PRO A 51 -5.040 13.344 4.675 1.00 0.86 C ATOM 798 C PRO A 51 -4.604 11.954 4.203 1.00 0.81 C ATOM 799 O PRO A 51 -4.913 10.940 4.830 1.00 1.00 O ATOM 800 CB PRO A 51 -5.775 13.321 6.014 1.00 1.01 C ATOM 801 CG PRO A 51 -7.230 13.119 5.596 1.00 1.13 C ATOM 802 CD PRO A 51 -7.329 13.956 4.325 1.00 1.15 C ATOM 0 HA PRO A 51 -4.111 13.908 4.750 1.00 0.86 H new ATOM 0 HB2 PRO A 51 -5.422 12.513 6.655 1.00 1.01 H new ATOM 0 HB3 PRO A 51 -5.638 14.250 6.567 1.00 1.01 H new ATOM 0 HG2 PRO A 51 -7.456 12.069 5.409 1.00 1.13 H new ATOM 0 HG3 PRO A 51 -7.924 13.463 6.363 1.00 1.13 H new ATOM 0 HD2 PRO A 51 -8.063 13.539 3.636 1.00 1.15 H new ATOM 0 HD3 PRO A 51 -7.645 14.975 4.549 1.00 1.15 H new ATOM 810 N MET A 52 -3.873 11.931 3.085 1.00 0.82 N ATOM 811 CA MET A 52 -3.366 10.727 2.445 1.00 0.79 C ATOM 812 C MET A 52 -2.329 10.053 3.346 1.00 0.67 C ATOM 813 O MET A 52 -2.672 9.190 4.155 1.00 0.87 O ATOM 814 CB MET A 52 -2.808 11.069 1.053 1.00 0.94 C ATOM 815 CG MET A 52 -3.930 11.478 0.088 1.00 1.57 C ATOM 816 SD MET A 52 -3.420 11.940 -1.591 1.00 1.89 S ATOM 817 CE MET A 52 -2.561 13.499 -1.283 1.00 3.12 C ATOM 0 H MET A 52 -3.612 12.783 2.588 1.00 0.82 H new ATOM 0 HA MET A 52 -4.177 10.013 2.300 1.00 0.79 H new ATOM 0 HB2 MET A 52 -2.085 11.880 1.138 1.00 0.94 H new ATOM 0 HB3 MET A 52 -2.275 10.207 0.651 1.00 0.94 H new ATOM 0 HG2 MET A 52 -4.637 10.651 0.015 1.00 1.57 H new ATOM 0 HG3 MET A 52 -4.468 12.319 0.526 1.00 1.57 H new ATOM 0 HE1 MET A 52 -2.253 13.938 -2.232 1.00 3.12 H new ATOM 0 HE2 MET A 52 -3.229 14.186 -0.765 1.00 3.12 H new ATOM 0 HE3 MET A 52 -1.681 13.314 -0.666 1.00 3.12 H new ATOM 827 N THR A 53 -1.057 10.450 3.257 1.00 0.69 N ATOM 828 CA THR A 53 0.001 9.809 4.018 1.00 0.61 C ATOM 829 C THR A 53 0.066 10.493 5.381 1.00 0.76 C ATOM 830 O THR A 53 1.078 11.079 5.750 1.00 1.58 O ATOM 831 CB THR A 53 1.293 9.828 3.188 1.00 0.79 C ATOM 832 OG1 THR A 53 0.991 9.310 1.908 1.00 1.20 O ATOM 833 CG2 THR A 53 2.382 8.939 3.786 1.00 0.93 C ATOM 0 H THR A 53 -0.741 11.216 2.661 1.00 0.69 H new ATOM 0 HA THR A 53 -0.181 8.753 4.219 1.00 0.61 H new ATOM 0 HB THR A 53 1.659 10.855 3.160 1.00 0.79 H new ATOM 0 HG1 THR A 53 1.817 9.014 1.472 1.00 1.20 H new ATOM 0 HG21 THR A 53 3.274 8.987 3.162 1.00 0.93 H new ATOM 0 HG22 THR A 53 2.623 9.285 4.791 1.00 0.93 H new ATOM 0 HG23 THR A 53 2.027 7.910 3.832 1.00 0.93 H new ATOM 841 N ALA A 54 -1.055 10.429 6.105 1.00 0.68 N ATOM 842 CA ALA A 54 -1.234 10.969 7.444 1.00 0.69 C ATOM 843 C ALA A 54 -1.476 9.795 8.384 1.00 0.63 C ATOM 844 O ALA A 54 -0.627 9.472 9.208 1.00 0.68 O ATOM 845 CB ALA A 54 -2.402 11.960 7.448 1.00 0.85 C ATOM 0 H ALA A 54 -1.898 9.977 5.752 1.00 0.68 H new ATOM 0 HA ALA A 54 -0.352 11.516 7.776 1.00 0.69 H new ATOM 0 HB1 ALA A 54 -2.534 12.363 8.452 1.00 0.85 H new ATOM 0 HB2 ALA A 54 -2.191 12.774 6.755 1.00 0.85 H new ATOM 0 HB3 ALA A 54 -3.314 11.449 7.140 1.00 0.85 H new ATOM 851 N HIS A 55 -2.590 9.089 8.198 1.00 0.64 N ATOM 852 CA HIS A 55 -2.921 7.910 8.987 1.00 0.63 C ATOM 853 C HIS A 55 -1.765 6.908 8.949 1.00 0.59 C ATOM 854 O HIS A 55 -1.273 6.474 9.986 1.00 0.56 O ATOM 855 CB HIS A 55 -4.228 7.317 8.456 1.00 0.72 C ATOM 856 CG HIS A 55 -5.319 8.354 8.389 1.00 0.80 C ATOM 857 ND1 HIS A 55 -5.768 8.996 7.254 1.00 0.94 N ATOM 858 CD2 HIS A 55 -5.884 8.978 9.469 1.00 0.90 C ATOM 859 CE1 HIS A 55 -6.622 9.953 7.653 1.00 1.04 C ATOM 860 NE2 HIS A 55 -6.714 9.994 8.990 1.00 0.98 N ATOM 0 H HIS A 55 -3.289 9.322 7.493 1.00 0.64 H new ATOM 0 HA HIS A 55 -3.068 8.177 10.034 1.00 0.63 H new ATOM 0 HB2 HIS A 55 -4.062 6.898 7.464 1.00 0.72 H new ATOM 0 HB3 HIS A 55 -4.544 6.496 9.100 1.00 0.72 H new ATOM 0 HD2 HIS A 55 -5.717 8.729 10.507 1.00 0.90 H new ATOM 0 HE1 HIS A 55 -7.164 10.605 6.984 1.00 1.04 H new ATOM 0 HE2 HIS A 55 -7.277 10.638 9.546 1.00 0.98 H new ATOM 868 N MET A 56 -1.281 6.582 7.747 1.00 0.65 N ATOM 869 CA MET A 56 -0.049 5.831 7.572 1.00 0.65 C ATOM 870 C MET A 56 1.103 6.336 8.470 1.00 0.62 C ATOM 871 O MET A 56 1.819 5.516 9.037 1.00 0.64 O ATOM 872 CB MET A 56 0.335 5.778 6.083 1.00 0.71 C ATOM 873 CG MET A 56 -0.606 4.912 5.225 1.00 0.78 C ATOM 874 SD MET A 56 -2.230 5.585 4.768 1.00 1.79 S ATOM 875 CE MET A 56 -1.852 6.282 3.145 1.00 2.13 C ATOM 0 H MET A 56 -1.738 6.835 6.871 1.00 0.65 H new ATOM 0 HA MET A 56 -0.235 4.811 7.908 1.00 0.65 H new ATOM 0 HB2 MET A 56 0.344 6.792 5.684 1.00 0.71 H new ATOM 0 HB3 MET A 56 1.350 5.392 5.993 1.00 0.71 H new ATOM 0 HG2 MET A 56 -0.079 4.664 4.304 1.00 0.78 H new ATOM 0 HG3 MET A 56 -0.773 3.976 5.759 1.00 0.78 H new ATOM 0 HE1 MET A 56 -2.635 6.984 2.859 1.00 2.13 H new ATOM 0 HE2 MET A 56 -0.895 6.803 3.187 1.00 2.13 H new ATOM 0 HE3 MET A 56 -1.797 5.480 2.409 1.00 2.13 H new ATOM 885 N THR A 57 1.296 7.651 8.646 1.00 0.61 N ATOM 886 CA THR A 57 2.352 8.165 9.524 1.00 0.62 C ATOM 887 C THR A 57 2.042 7.927 10.995 1.00 0.60 C ATOM 888 O THR A 57 2.907 7.483 11.751 1.00 0.64 O ATOM 889 CB THR A 57 2.736 9.625 9.264 1.00 0.64 C ATOM 890 OG1 THR A 57 1.792 10.584 9.684 1.00 1.81 O ATOM 891 CG2 THR A 57 3.055 9.823 7.789 1.00 1.94 C ATOM 0 H THR A 57 0.736 8.374 8.193 1.00 0.61 H new ATOM 0 HA THR A 57 3.234 7.580 9.264 1.00 0.62 H new ATOM 0 HB THR A 57 3.615 9.801 9.884 1.00 0.64 H new ATOM 0 HG1 THR A 57 0.892 10.198 9.640 1.00 1.81 H new ATOM 0 HG21 THR A 57 3.327 10.864 7.612 1.00 1.94 H new ATOM 0 HG22 THR A 57 3.887 9.177 7.507 1.00 1.94 H new ATOM 0 HG23 THR A 57 2.180 9.570 7.190 1.00 1.94 H new ATOM 899 N ASP A 58 0.798 8.188 11.401 1.00 0.58 N ATOM 900 CA ASP A 58 0.356 7.858 12.747 1.00 0.62 C ATOM 901 C ASP A 58 0.652 6.384 13.029 1.00 0.61 C ATOM 902 O ASP A 58 1.162 6.019 14.090 1.00 0.69 O ATOM 903 CB ASP A 58 -1.130 8.195 12.913 1.00 0.72 C ATOM 904 CG ASP A 58 -1.359 9.695 13.015 1.00 1.96 C ATOM 905 OD1 ASP A 58 -0.879 10.268 14.018 1.00 2.74 O ATOM 906 OD2 ASP A 58 -2.003 10.234 12.090 1.00 3.55 O ATOM 0 H ASP A 58 0.086 8.625 10.816 1.00 0.58 H new ATOM 0 HA ASP A 58 0.901 8.455 13.478 1.00 0.62 H new ATOM 0 HB2 ASP A 58 -1.690 7.798 12.066 1.00 0.72 H new ATOM 0 HB3 ASP A 58 -1.516 7.706 13.808 1.00 0.72 H new ATOM 911 N LEU A 59 0.395 5.534 12.034 1.00 0.56 N ATOM 912 CA LEU A 59 0.696 4.117 12.135 1.00 0.57 C ATOM 913 C LEU A 59 2.202 3.854 12.107 1.00 0.59 C ATOM 914 O LEU A 59 2.644 2.964 12.815 1.00 0.66 O ATOM 915 CB LEU A 59 -0.075 3.280 11.102 1.00 0.56 C ATOM 916 CG LEU A 59 -1.423 2.784 11.645 1.00 0.71 C ATOM 917 CD1 LEU A 59 -2.444 3.913 11.581 1.00 1.06 C ATOM 918 CD2 LEU A 59 -1.921 1.586 10.833 1.00 0.96 C ATOM 0 H LEU A 59 -0.024 5.811 11.146 1.00 0.56 H new ATOM 0 HA LEU A 59 0.342 3.784 13.111 1.00 0.57 H new ATOM 0 HB2 LEU A 59 -0.244 3.878 10.206 1.00 0.56 H new ATOM 0 HB3 LEU A 59 0.532 2.425 10.805 1.00 0.56 H new ATOM 0 HG LEU A 59 -1.291 2.470 12.680 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -3.401 3.561 11.966 1.00 1.06 H new ATOM 0 HD12 LEU A 59 -2.097 4.752 12.184 1.00 1.06 H new ATOM 0 HD13 LEU A 59 -2.566 4.235 10.547 1.00 1.06 H new ATOM 0 HD21 LEU A 59 -2.877 1.248 11.232 1.00 0.96 H new ATOM 0 HD22 LEU A 59 -2.046 1.880 9.791 1.00 0.96 H new ATOM 0 HD23 LEU A 59 -1.195 0.776 10.897 1.00 0.96 H new ATOM 930 N GLN A 60 3.004 4.611 11.353 1.00 0.58 N ATOM 931 CA GLN A 60 4.470 4.525 11.306 1.00 0.62 C ATOM 932 C GLN A 60 5.074 4.603 12.711 1.00 0.64 C ATOM 933 O GLN A 60 6.068 3.939 13.012 1.00 0.73 O ATOM 934 CB GLN A 60 4.988 5.664 10.412 1.00 0.73 C ATOM 935 CG GLN A 60 6.299 5.445 9.657 1.00 1.13 C ATOM 936 CD GLN A 60 7.571 5.450 10.482 1.00 1.33 C ATOM 937 OE1 GLN A 60 7.574 5.759 11.669 1.00 2.49 O ATOM 938 NE2 GLN A 60 8.683 5.130 9.841 1.00 1.69 N ATOM 0 H GLN A 60 2.636 5.331 10.732 1.00 0.58 H new ATOM 0 HA GLN A 60 4.771 3.564 10.890 1.00 0.62 H new ATOM 0 HB2 GLN A 60 4.214 5.891 9.678 1.00 0.73 H new ATOM 0 HB3 GLN A 60 5.106 6.550 11.035 1.00 0.73 H new ATOM 0 HG2 GLN A 60 6.236 4.490 9.136 1.00 1.13 H new ATOM 0 HG3 GLN A 60 6.385 6.219 8.894 1.00 1.13 H new ATOM 0 HE21 GLN A 60 8.648 4.877 8.853 1.00 1.69 H new ATOM 0 HE22 GLN A 60 9.576 5.136 10.334 1.00 1.69 H new ATOM 947 N LYS A 61 4.464 5.419 13.572 1.00 0.63 N ATOM 948 CA LYS A 61 4.841 5.550 14.962 1.00 0.68 C ATOM 949 C LYS A 61 4.523 4.247 15.690 1.00 0.66 C ATOM 950 O LYS A 61 5.430 3.595 16.204 1.00 0.73 O ATOM 951 CB LYS A 61 4.140 6.767 15.563 1.00 0.75 C ATOM 952 CG LYS A 61 4.567 7.040 17.011 1.00 0.79 C ATOM 953 CD LYS A 61 3.804 8.243 17.587 1.00 0.85 C ATOM 954 CE LYS A 61 4.181 9.581 16.926 1.00 2.31 C ATOM 955 NZ LYS A 61 3.337 10.697 17.405 1.00 2.59 N ATOM 0 H LYS A 61 3.680 6.015 13.308 1.00 0.63 H new ATOM 0 HA LYS A 61 5.912 5.721 15.067 1.00 0.68 H new ATOM 0 HB2 LYS A 61 4.356 7.644 14.953 1.00 0.75 H new ATOM 0 HB3 LYS A 61 3.061 6.614 15.529 1.00 0.75 H new ATOM 0 HG2 LYS A 61 4.379 6.158 17.623 1.00 0.79 H new ATOM 0 HG3 LYS A 61 5.639 7.232 17.049 1.00 0.79 H new ATOM 0 HD2 LYS A 61 2.734 8.076 17.467 1.00 0.85 H new ATOM 0 HD3 LYS A 61 3.998 8.308 18.658 1.00 0.85 H new ATOM 0 HE2 LYS A 61 5.228 9.804 17.133 1.00 2.31 H new ATOM 0 HE3 LYS A 61 4.082 9.491 15.844 1.00 2.31 H new ATOM 0 HZ1 LYS A 61 3.626 11.578 16.934 1.00 2.59 H new ATOM 0 HZ2 LYS A 61 2.340 10.498 17.185 1.00 2.59 H new ATOM 0 HZ3 LYS A 61 3.451 10.801 18.433 1.00 2.59 H new ATOM 969 N LYS A 62 3.243 3.854 15.708 1.00 0.64 N ATOM 970 CA LYS A 62 2.802 2.605 16.327 1.00 0.64 C ATOM 971 C LYS A 62 3.646 1.428 15.832 1.00 0.55 C ATOM 972 O LYS A 62 3.968 0.541 16.612 1.00 0.60 O ATOM 973 CB LYS A 62 1.307 2.379 16.048 1.00 0.72 C ATOM 974 CG LYS A 62 0.697 1.196 16.824 1.00 1.34 C ATOM 975 CD LYS A 62 0.600 1.482 18.333 1.00 2.34 C ATOM 976 CE LYS A 62 -0.231 0.430 19.083 1.00 3.26 C ATOM 977 NZ LYS A 62 0.445 -0.881 19.163 1.00 4.51 N ATOM 0 H LYS A 62 2.486 4.396 15.292 1.00 0.64 H new ATOM 0 HA LYS A 62 2.941 2.677 17.406 1.00 0.64 H new ATOM 0 HB2 LYS A 62 0.759 3.287 16.301 1.00 0.72 H new ATOM 0 HB3 LYS A 62 1.169 2.210 14.980 1.00 0.72 H new ATOM 0 HG2 LYS A 62 -0.297 0.980 16.432 1.00 1.34 H new ATOM 0 HG3 LYS A 62 1.304 0.305 16.663 1.00 1.34 H new ATOM 0 HD2 LYS A 62 1.603 1.517 18.757 1.00 2.34 H new ATOM 0 HD3 LYS A 62 0.156 2.466 18.484 1.00 2.34 H new ATOM 0 HE2 LYS A 62 -0.439 0.789 20.091 1.00 3.26 H new ATOM 0 HE3 LYS A 62 -1.192 0.309 18.583 1.00 3.26 H new ATOM 0 HZ1 LYS A 62 -0.242 -1.609 19.443 1.00 4.51 H new ATOM 0 HZ2 LYS A 62 0.846 -1.122 18.234 1.00 4.51 H new ATOM 0 HZ3 LYS A 62 1.208 -0.836 19.868 1.00 4.51 H new ATOM 991 N LEU A 63 4.036 1.456 14.558 1.00 0.48 N ATOM 992 CA LEU A 63 4.892 0.493 13.886 1.00 0.44 C ATOM 993 C LEU A 63 6.095 0.139 14.746 1.00 0.49 C ATOM 994 O LEU A 63 6.470 -1.024 14.798 1.00 0.51 O ATOM 995 CB LEU A 63 5.345 1.033 12.528 1.00 0.53 C ATOM 996 CG LEU A 63 5.262 0.015 11.388 1.00 0.75 C ATOM 997 CD1 LEU A 63 6.094 -1.238 11.652 1.00 0.97 C ATOM 998 CD2 LEU A 63 3.817 -0.337 11.010 1.00 0.96 C ATOM 0 H LEU A 63 3.740 2.204 13.931 1.00 0.48 H new ATOM 0 HA LEU A 63 4.313 -0.416 13.723 1.00 0.44 H new ATOM 0 HB2 LEU A 63 4.734 1.899 12.272 1.00 0.53 H new ATOM 0 HB3 LEU A 63 6.374 1.383 12.614 1.00 0.53 H new ATOM 0 HG LEU A 63 5.703 0.511 10.523 1.00 0.75 H new ATOM 0 HD11 LEU A 63 5.997 -1.924 10.810 1.00 0.97 H new ATOM 0 HD12 LEU A 63 7.141 -0.960 11.775 1.00 0.97 H new ATOM 0 HD13 LEU A 63 5.739 -1.726 12.560 1.00 0.97 H new ATOM 0 HD21 LEU A 63 3.820 -1.063 10.197 1.00 0.96 H new ATOM 0 HD22 LEU A 63 3.308 -0.763 11.875 1.00 0.96 H new ATOM 0 HD23 LEU A 63 3.295 0.565 10.690 1.00 0.96 H new ATOM 1010 N LYS A 64 6.690 1.108 15.452 1.00 0.61 N ATOM 1011 CA LYS A 64 7.821 0.777 16.329 1.00 0.76 C ATOM 1012 C LYS A 64 7.471 -0.363 17.305 1.00 0.82 C ATOM 1013 O LYS A 64 8.309 -1.215 17.592 1.00 0.95 O ATOM 1014 CB LYS A 64 8.380 2.006 17.079 1.00 0.91 C ATOM 1015 CG LYS A 64 9.770 2.448 16.579 1.00 1.22 C ATOM 1016 CD LYS A 64 9.766 3.514 15.470 1.00 1.31 C ATOM 1017 CE LYS A 64 8.741 3.224 14.371 1.00 2.49 C ATOM 1018 NZ LYS A 64 8.897 4.106 13.202 1.00 3.50 N ATOM 0 H LYS A 64 6.421 2.092 15.437 1.00 0.61 H new ATOM 0 HA LYS A 64 8.618 0.424 15.674 1.00 0.76 H new ATOM 0 HB2 LYS A 64 7.682 2.836 16.971 1.00 0.91 H new ATOM 0 HB3 LYS A 64 8.441 1.777 18.143 1.00 0.91 H new ATOM 0 HG2 LYS A 64 10.337 2.833 17.427 1.00 1.22 H new ATOM 0 HG3 LYS A 64 10.302 1.570 16.213 1.00 1.22 H new ATOM 0 HD2 LYS A 64 9.554 4.488 15.910 1.00 1.31 H new ATOM 0 HD3 LYS A 64 10.760 3.574 15.027 1.00 1.31 H new ATOM 0 HE2 LYS A 64 8.839 2.186 14.053 1.00 2.49 H new ATOM 0 HE3 LYS A 64 7.736 3.340 14.777 1.00 2.49 H new ATOM 0 HZ1 LYS A 64 7.960 4.414 12.872 1.00 3.50 H new ATOM 0 HZ2 LYS A 64 9.461 4.938 13.468 1.00 3.50 H new ATOM 0 HZ3 LYS A 64 9.380 3.589 12.439 1.00 3.50 H new ATOM 1032 N ALA A 65 6.235 -0.388 17.806 1.00 0.81 N ATOM 1033 CA ALA A 65 5.721 -1.448 18.669 1.00 0.92 C ATOM 1034 C ALA A 65 5.434 -2.751 17.915 1.00 0.90 C ATOM 1035 O ALA A 65 5.483 -3.825 18.510 1.00 1.14 O ATOM 1036 CB ALA A 65 4.462 -0.954 19.390 1.00 0.99 C ATOM 0 H ALA A 65 5.550 0.344 17.618 1.00 0.81 H new ATOM 0 HA ALA A 65 6.499 -1.683 19.395 1.00 0.92 H new ATOM 0 HB1 ALA A 65 4.078 -1.745 20.034 1.00 0.99 H new ATOM 0 HB2 ALA A 65 4.708 -0.081 19.994 1.00 0.99 H new ATOM 0 HB3 ALA A 65 3.704 -0.685 18.655 1.00 0.99 H new ATOM 1042 N GLU A 66 5.120 -2.658 16.622 1.00 0.68 N ATOM 1043 CA GLU A 66 4.749 -3.780 15.777 1.00 0.67 C ATOM 1044 C GLU A 66 5.993 -4.331 15.081 1.00 0.60 C ATOM 1045 O GLU A 66 5.927 -5.393 14.474 1.00 0.65 O ATOM 1046 CB GLU A 66 3.729 -3.339 14.715 1.00 0.66 C ATOM 1047 CG GLU A 66 2.605 -2.425 15.219 1.00 0.81 C ATOM 1048 CD GLU A 66 1.842 -2.999 16.400 1.00 0.88 C ATOM 1049 OE1 GLU A 66 1.457 -4.181 16.332 1.00 1.78 O ATOM 1050 OE2 GLU A 66 1.614 -2.214 17.347 1.00 1.78 O ATOM 0 H GLU A 66 5.119 -1.768 16.124 1.00 0.68 H new ATOM 0 HA GLU A 66 4.300 -4.553 16.401 1.00 0.67 H new ATOM 0 HB2 GLU A 66 4.262 -2.824 13.916 1.00 0.66 H new ATOM 0 HB3 GLU A 66 3.280 -4.230 14.276 1.00 0.66 H new ATOM 0 HG2 GLU A 66 3.030 -1.463 15.504 1.00 0.81 H new ATOM 0 HG3 GLU A 66 1.908 -2.236 14.403 1.00 0.81 H new ATOM 1057 N ASN A 67 7.100 -3.576 15.126 1.00 0.58 N ATOM 1058 CA ASN A 67 8.269 -3.670 14.296 1.00 0.56 C ATOM 1059 C ASN A 67 8.669 -5.095 14.005 1.00 0.90 C ATOM 1060 O ASN A 67 8.967 -5.376 12.855 1.00 1.66 O ATOM 1061 CB ASN A 67 9.410 -2.919 14.984 1.00 0.90 C ATOM 1062 CG ASN A 67 10.579 -2.737 14.037 1.00 1.30 C ATOM 1063 OD1 ASN A 67 10.824 -1.632 13.563 1.00 2.03 O ATOM 1064 ND2 ASN A 67 11.308 -3.801 13.730 1.00 2.01 N ATOM 0 H ASN A 67 7.189 -2.824 15.810 1.00 0.58 H new ATOM 0 HA ASN A 67 8.040 -3.220 13.330 1.00 0.56 H new ATOM 0 HB2 ASN A 67 9.058 -1.946 15.326 1.00 0.90 H new ATOM 0 HB3 ASN A 67 9.734 -3.469 15.868 1.00 0.90 H new ATOM 0 HD21 ASN A 67 12.094 -3.712 13.086 1.00 2.01 H new ATOM 0 HD22 ASN A 67 11.083 -4.708 14.138 1.00 2.01 H new ATOM 1071 N ILE A 68 8.723 -5.918 15.059 1.00 0.71 N ATOM 1072 CA ILE A 68 9.346 -7.252 15.105 1.00 0.86 C ATOM 1073 C ILE A 68 10.240 -7.462 13.864 1.00 0.81 C ATOM 1074 O ILE A 68 11.353 -6.931 13.875 1.00 0.88 O ATOM 1075 CB ILE A 68 8.325 -8.366 15.435 1.00 0.99 C ATOM 1076 CG1 ILE A 68 7.801 -8.295 16.889 1.00 1.13 C ATOM 1077 CG2 ILE A 68 8.956 -9.769 15.331 1.00 1.08 C ATOM 1078 CD1 ILE A 68 6.912 -7.104 17.258 1.00 1.15 C ATOM 0 H ILE A 68 8.310 -5.659 15.955 1.00 0.71 H new ATOM 0 HA ILE A 68 10.031 -7.319 15.950 1.00 0.86 H new ATOM 0 HB ILE A 68 7.524 -8.208 14.713 1.00 0.99 H new ATOM 0 HG12 ILE A 68 7.242 -9.209 17.091 1.00 1.13 H new ATOM 0 HG13 ILE A 68 8.662 -8.294 17.558 1.00 1.13 H new ATOM 0 HG21 ILE A 68 8.207 -10.524 15.570 1.00 1.08 H new ATOM 0 HG22 ILE A 68 9.321 -9.929 14.317 1.00 1.08 H new ATOM 0 HG23 ILE A 68 9.787 -9.847 16.033 1.00 1.08 H new ATOM 0 HD11 ILE A 68 6.617 -7.181 18.305 1.00 1.15 H new ATOM 0 HD12 ILE A 68 7.463 -6.177 17.103 1.00 1.15 H new ATOM 0 HD13 ILE A 68 6.022 -7.106 16.629 1.00 1.15 H new ATOM 1090 N ASP A 69 9.743 -8.082 12.780 1.00 0.82 N ATOM 1091 CA ASP A 69 10.267 -7.891 11.421 1.00 0.90 C ATOM 1092 C ASP A 69 9.113 -7.691 10.422 1.00 0.80 C ATOM 1093 O ASP A 69 9.143 -8.139 9.275 1.00 1.05 O ATOM 1094 CB ASP A 69 11.219 -9.019 11.039 1.00 1.24 C ATOM 1095 CG ASP A 69 11.967 -8.780 9.724 1.00 1.50 C ATOM 1096 OD1 ASP A 69 12.127 -7.600 9.336 1.00 1.61 O ATOM 1097 OD2 ASP A 69 12.415 -9.792 9.141 1.00 2.71 O ATOM 0 H ASP A 69 8.960 -8.734 12.825 1.00 0.82 H new ATOM 0 HA ASP A 69 10.862 -6.978 11.389 1.00 0.90 H new ATOM 0 HB2 ASP A 69 11.946 -9.155 11.840 1.00 1.24 H new ATOM 0 HB3 ASP A 69 10.654 -9.948 10.961 1.00 1.24 H new ATOM 1102 N VAL A 70 8.087 -6.967 10.865 1.00 0.62 N ATOM 1103 CA VAL A 70 7.061 -6.401 10.009 1.00 0.53 C ATOM 1104 C VAL A 70 7.627 -5.127 9.377 1.00 0.56 C ATOM 1105 O VAL A 70 8.542 -4.505 9.913 1.00 0.82 O ATOM 1106 CB VAL A 70 5.756 -6.100 10.783 1.00 0.47 C ATOM 1107 CG1 VAL A 70 5.390 -7.151 11.841 1.00 0.57 C ATOM 1108 CG2 VAL A 70 5.733 -4.715 11.439 1.00 0.50 C ATOM 0 H VAL A 70 7.948 -6.756 11.853 1.00 0.62 H new ATOM 0 HA VAL A 70 6.796 -7.125 9.239 1.00 0.53 H new ATOM 0 HB VAL A 70 5.003 -6.131 9.996 1.00 0.47 H new ATOM 0 HG11 VAL A 70 4.463 -6.862 12.335 1.00 0.57 H new ATOM 0 HG12 VAL A 70 5.258 -8.120 11.360 1.00 0.57 H new ATOM 0 HG13 VAL A 70 6.189 -7.218 12.579 1.00 0.57 H new ATOM 0 HG21 VAL A 70 4.787 -4.576 11.963 1.00 0.50 H new ATOM 0 HG22 VAL A 70 6.556 -4.635 12.149 1.00 0.50 H new ATOM 0 HG23 VAL A 70 5.839 -3.947 10.672 1.00 0.50 H new ATOM 1118 N ARG A 71 7.035 -4.687 8.269 1.00 0.49 N ATOM 1119 CA ARG A 71 7.294 -3.395 7.655 1.00 0.47 C ATOM 1120 C ARG A 71 5.953 -2.851 7.193 1.00 0.58 C ATOM 1121 O ARG A 71 4.986 -3.609 7.068 1.00 0.99 O ATOM 1122 CB ARG A 71 8.289 -3.554 6.498 1.00 0.69 C ATOM 1123 CG ARG A 71 9.732 -3.536 7.017 1.00 0.80 C ATOM 1124 CD ARG A 71 10.736 -3.843 5.906 1.00 0.99 C ATOM 1125 NE ARG A 71 10.846 -5.292 5.662 1.00 1.18 N ATOM 1126 CZ ARG A 71 11.309 -5.845 4.529 1.00 1.10 C ATOM 1127 NH1 ARG A 71 11.616 -5.090 3.469 1.00 0.99 N ATOM 1128 NH2 ARG A 71 11.468 -7.168 4.431 1.00 1.43 N ATOM 0 H ARG A 71 6.343 -5.238 7.762 1.00 0.49 H new ATOM 0 HA ARG A 71 7.749 -2.695 8.356 1.00 0.47 H new ATOM 0 HB2 ARG A 71 8.098 -4.490 5.973 1.00 0.69 H new ATOM 0 HB3 ARG A 71 8.147 -2.749 5.776 1.00 0.69 H new ATOM 0 HG2 ARG A 71 9.952 -2.559 7.447 1.00 0.80 H new ATOM 0 HG3 ARG A 71 9.840 -4.268 7.818 1.00 0.80 H new ATOM 0 HD2 ARG A 71 10.430 -3.341 4.988 1.00 0.99 H new ATOM 0 HD3 ARG A 71 11.713 -3.443 6.177 1.00 0.99 H new ATOM 0 HE ARG A 71 10.549 -5.921 6.408 1.00 1.18 H new ATOM 0 HH11 ARG A 71 11.500 -4.078 3.513 1.00 0.99 H new ATOM 0 HH12 ARG A 71 11.966 -5.526 2.616 1.00 0.99 H new ATOM 0 HH21 ARG A 71 11.237 -7.769 5.222 1.00 1.43 H new ATOM 0 HH22 ARG A 71 11.820 -7.577 3.565 1.00 1.43 H new ATOM 1142 N ILE A 72 5.899 -1.539 6.959 1.00 0.33 N ATOM 1143 CA ILE A 72 4.796 -0.928 6.245 1.00 0.31 C ATOM 1144 C ILE A 72 5.298 -0.760 4.799 1.00 0.30 C ATOM 1145 O ILE A 72 6.237 -0.003 4.550 1.00 0.37 O ATOM 1146 CB ILE A 72 4.317 0.351 6.992 1.00 0.30 C ATOM 1147 CG1 ILE A 72 3.022 1.024 6.488 1.00 0.53 C ATOM 1148 CG2 ILE A 72 5.386 1.437 7.122 1.00 0.39 C ATOM 1149 CD1 ILE A 72 2.856 1.003 4.981 1.00 1.97 C ATOM 0 H ILE A 72 6.617 -0.881 7.260 1.00 0.33 H new ATOM 0 HA ILE A 72 3.884 -1.524 6.206 1.00 0.31 H new ATOM 0 HB ILE A 72 4.091 -0.086 7.964 1.00 0.30 H new ATOM 0 HG12 ILE A 72 2.166 0.526 6.943 1.00 0.53 H new ATOM 0 HG13 ILE A 72 3.007 2.059 6.829 1.00 0.53 H new ATOM 0 HG21 ILE A 72 4.972 2.293 7.654 1.00 0.39 H new ATOM 0 HG22 ILE A 72 6.239 1.044 7.675 1.00 0.39 H new ATOM 0 HG23 ILE A 72 5.710 1.749 6.129 1.00 0.39 H new ATOM 0 HD11 ILE A 72 1.922 1.495 4.711 1.00 1.97 H new ATOM 0 HD12 ILE A 72 3.690 1.528 4.516 1.00 1.97 H new ATOM 0 HD13 ILE A 72 2.836 -0.029 4.631 1.00 1.97 H new ATOM 1161 N ILE A 73 4.753 -1.524 3.845 1.00 0.31 N ATOM 1162 CA ILE A 73 5.077 -1.390 2.434 1.00 0.32 C ATOM 1163 C ILE A 73 4.076 -0.430 1.803 1.00 0.35 C ATOM 1164 O ILE A 73 2.929 -0.315 2.234 1.00 0.46 O ATOM 1165 CB ILE A 73 5.069 -2.784 1.774 1.00 0.34 C ATOM 1166 CG1 ILE A 73 6.456 -3.442 1.792 1.00 0.35 C ATOM 1167 CG2 ILE A 73 4.546 -2.798 0.328 1.00 0.41 C ATOM 1168 CD1 ILE A 73 6.976 -3.692 3.209 1.00 0.36 C ATOM 0 H ILE A 73 4.070 -2.256 4.040 1.00 0.31 H new ATOM 0 HA ILE A 73 6.075 -0.977 2.289 1.00 0.32 H new ATOM 0 HB ILE A 73 4.372 -3.355 2.388 1.00 0.34 H new ATOM 0 HG12 ILE A 73 6.411 -4.389 1.254 1.00 0.35 H new ATOM 0 HG13 ILE A 73 7.162 -2.806 1.258 1.00 0.35 H new ATOM 0 HG21 ILE A 73 4.575 -3.816 -0.059 1.00 0.41 H new ATOM 0 HG22 ILE A 73 3.520 -2.431 0.309 1.00 0.41 H new ATOM 0 HG23 ILE A 73 5.172 -2.156 -0.292 1.00 0.41 H new ATOM 0 HD11 ILE A 73 7.960 -4.159 3.159 1.00 0.36 H new ATOM 0 HD12 ILE A 73 7.051 -2.744 3.742 1.00 0.36 H new ATOM 0 HD13 ILE A 73 6.288 -4.352 3.738 1.00 0.36 H new ATOM 1180 N SER A 74 4.500 0.284 0.764 1.00 0.42 N ATOM 1181 CA SER A 74 3.609 1.196 0.078 1.00 0.44 C ATOM 1182 C SER A 74 3.971 1.268 -1.398 1.00 0.46 C ATOM 1183 O SER A 74 4.969 1.898 -1.738 1.00 0.49 O ATOM 1184 CB SER A 74 3.717 2.559 0.750 1.00 0.50 C ATOM 1185 OG SER A 74 3.184 2.491 2.058 1.00 1.53 O ATOM 0 H SER A 74 5.447 0.245 0.386 1.00 0.42 H new ATOM 0 HA SER A 74 2.578 0.848 0.140 1.00 0.44 H new ATOM 0 HB2 SER A 74 4.760 2.874 0.788 1.00 0.50 H new ATOM 0 HB3 SER A 74 3.179 3.306 0.166 1.00 0.50 H new ATOM 0 HG SER A 74 2.676 3.307 2.247 1.00 1.53 H new ATOM 1191 N PHE A 75 3.208 0.614 -2.278 1.00 0.61 N ATOM 1192 CA PHE A 75 3.550 0.628 -3.693 1.00 0.70 C ATOM 1193 C PHE A 75 3.034 1.887 -4.387 1.00 0.60 C ATOM 1194 O PHE A 75 2.039 2.482 -3.976 1.00 0.57 O ATOM 1195 CB PHE A 75 3.145 -0.666 -4.406 1.00 0.97 C ATOM 1196 CG PHE A 75 1.680 -1.033 -4.349 1.00 0.68 C ATOM 1197 CD1 PHE A 75 0.788 -0.530 -5.317 1.00 2.09 C ATOM 1198 CD2 PHE A 75 1.258 -2.045 -3.467 1.00 1.88 C ATOM 1199 CE1 PHE A 75 -0.508 -1.066 -5.425 1.00 2.16 C ATOM 1200 CE2 PHE A 75 -0.019 -2.608 -3.605 1.00 1.97 C ATOM 1201 CZ PHE A 75 -0.902 -2.115 -4.578 1.00 1.07 C ATOM 0 H PHE A 75 2.371 0.082 -2.040 1.00 0.61 H new ATOM 0 HA PHE A 75 4.637 0.667 -3.761 1.00 0.70 H new ATOM 0 HB2 PHE A 75 3.437 -0.585 -5.453 1.00 0.97 H new ATOM 0 HB3 PHE A 75 3.720 -1.487 -3.977 1.00 0.97 H new ATOM 0 HD1 PHE A 75 1.099 0.267 -5.976 1.00 2.09 H new ATOM 0 HD2 PHE A 75 1.918 -2.388 -2.684 1.00 1.88 H new ATOM 0 HE1 PHE A 75 -1.198 -0.672 -6.157 1.00 2.16 H new ATOM 0 HE2 PHE A 75 -0.323 -3.421 -2.962 1.00 1.97 H new ATOM 0 HZ PHE A 75 -1.888 -2.544 -4.676 1.00 1.07 H new ATOM 1211 N SER A 76 3.727 2.282 -5.456 1.00 0.62 N ATOM 1212 CA SER A 76 3.454 3.511 -6.181 1.00 0.53 C ATOM 1213 C SER A 76 2.204 3.347 -7.043 1.00 0.59 C ATOM 1214 O SER A 76 2.163 2.483 -7.921 1.00 0.75 O ATOM 1215 CB SER A 76 4.668 3.820 -7.064 1.00 0.64 C ATOM 1216 OG SER A 76 4.484 5.032 -7.767 1.00 1.50 O ATOM 0 H SER A 76 4.503 1.746 -5.843 1.00 0.62 H new ATOM 0 HA SER A 76 3.278 4.329 -5.483 1.00 0.53 H new ATOM 0 HB2 SER A 76 5.564 3.885 -6.447 1.00 0.64 H new ATOM 0 HB3 SER A 76 4.826 3.005 -7.771 1.00 0.64 H new ATOM 0 HG SER A 76 5.271 5.211 -8.323 1.00 1.50 H new ATOM 1222 N VAL A 77 1.186 4.183 -6.826 1.00 0.75 N ATOM 1223 CA VAL A 77 0.026 4.212 -7.702 1.00 0.80 C ATOM 1224 C VAL A 77 0.387 5.016 -8.956 1.00 0.77 C ATOM 1225 O VAL A 77 0.076 6.198 -9.057 1.00 1.05 O ATOM 1226 CB VAL A 77 -1.195 4.753 -6.947 1.00 0.83 C ATOM 1227 CG1 VAL A 77 -2.462 4.830 -7.813 1.00 0.95 C ATOM 1228 CG2 VAL A 77 -1.526 3.826 -5.771 1.00 0.90 C ATOM 0 H VAL A 77 1.147 4.845 -6.051 1.00 0.75 H new ATOM 0 HA VAL A 77 -0.252 3.209 -8.026 1.00 0.80 H new ATOM 0 HB VAL A 77 -0.924 5.759 -6.627 1.00 0.83 H new ATOM 0 HG11 VAL A 77 -3.287 5.221 -7.217 1.00 0.95 H new ATOM 0 HG12 VAL A 77 -2.283 5.490 -8.662 1.00 0.95 H new ATOM 0 HG13 VAL A 77 -2.716 3.834 -8.175 1.00 0.95 H new ATOM 0 HG21 VAL A 77 -2.394 4.212 -5.236 1.00 0.90 H new ATOM 0 HG22 VAL A 77 -1.746 2.827 -6.146 1.00 0.90 H new ATOM 0 HG23 VAL A 77 -0.673 3.779 -5.093 1.00 0.90 H new ATOM 1238 N ASP A 78 1.011 4.316 -9.908 1.00 0.78 N ATOM 1239 CA ASP A 78 1.207 4.662 -11.318 1.00 0.86 C ATOM 1240 C ASP A 78 2.620 5.174 -11.624 1.00 0.82 C ATOM 1241 O ASP A 78 2.826 6.332 -11.999 1.00 0.98 O ATOM 1242 CB ASP A 78 0.081 5.530 -11.905 1.00 1.02 C ATOM 1243 CG ASP A 78 0.028 5.424 -13.427 1.00 1.46 C ATOM 1244 OD1 ASP A 78 0.600 4.446 -13.965 1.00 2.20 O ATOM 1245 OD2 ASP A 78 -0.621 6.302 -14.037 1.00 2.40 O ATOM 0 H ASP A 78 1.429 3.411 -9.691 1.00 0.78 H new ATOM 0 HA ASP A 78 1.128 3.720 -11.861 1.00 0.86 H new ATOM 0 HB2 ASP A 78 -0.876 5.220 -11.484 1.00 1.02 H new ATOM 0 HB3 ASP A 78 0.234 6.570 -11.617 1.00 1.02 H new ATOM 1250 N PRO A 79 3.630 4.294 -11.501 1.00 0.87 N ATOM 1251 CA PRO A 79 5.027 4.670 -11.600 1.00 0.95 C ATOM 1252 C PRO A 79 5.480 4.886 -13.045 1.00 1.07 C ATOM 1253 O PRO A 79 6.669 5.098 -13.261 1.00 1.42 O ATOM 1254 CB PRO A 79 5.803 3.523 -10.952 1.00 1.05 C ATOM 1255 CG PRO A 79 4.939 2.324 -11.327 1.00 1.10 C ATOM 1256 CD PRO A 79 3.522 2.875 -11.194 1.00 0.95 C ATOM 0 HA PRO A 79 5.202 5.624 -11.103 1.00 0.95 H new ATOM 0 HB2 PRO A 79 6.816 3.438 -11.346 1.00 1.05 H new ATOM 0 HB3 PRO A 79 5.890 3.645 -9.872 1.00 1.05 H new ATOM 0 HG2 PRO A 79 5.145 1.978 -12.340 1.00 1.10 H new ATOM 0 HG3 PRO A 79 5.109 1.479 -10.660 1.00 1.10 H new ATOM 0 HD2 PRO A 79 2.840 2.375 -11.881 1.00 0.95 H new ATOM 0 HD3 PRO A 79 3.132 2.719 -10.188 1.00 0.95 H new ATOM 1264 N GLU A 80 4.580 4.871 -14.039 1.00 0.96 N ATOM 1265 CA GLU A 80 4.865 5.518 -15.303 1.00 1.02 C ATOM 1266 C GLU A 80 5.266 6.970 -15.025 1.00 0.76 C ATOM 1267 O GLU A 80 6.363 7.416 -15.368 1.00 0.89 O ATOM 1268 CB GLU A 80 3.592 5.482 -16.163 1.00 1.43 C ATOM 1269 CG GLU A 80 3.818 6.208 -17.486 1.00 2.59 C ATOM 1270 CD GLU A 80 2.522 6.553 -18.190 1.00 3.53 C ATOM 1271 OE1 GLU A 80 1.625 7.134 -17.538 1.00 4.74 O ATOM 1272 OE2 GLU A 80 2.386 6.254 -19.395 1.00 3.57 O ATOM 0 H GLU A 80 3.666 4.422 -13.983 1.00 0.96 H new ATOM 0 HA GLU A 80 5.675 5.011 -15.828 1.00 1.02 H new ATOM 0 HB2 GLU A 80 3.304 4.448 -16.354 1.00 1.43 H new ATOM 0 HB3 GLU A 80 2.768 5.948 -15.622 1.00 1.43 H new ATOM 0 HG2 GLU A 80 4.382 7.122 -17.303 1.00 2.59 H new ATOM 0 HG3 GLU A 80 4.427 5.583 -18.140 1.00 2.59 H new ATOM 1279 N ASN A 81 4.316 7.709 -14.451 1.00 0.76 N ATOM 1280 CA ASN A 81 4.293 9.164 -14.465 1.00 0.95 C ATOM 1281 C ASN A 81 4.658 9.731 -13.097 1.00 1.06 C ATOM 1282 O ASN A 81 5.397 10.712 -13.045 1.00 1.47 O ATOM 1283 CB ASN A 81 2.953 9.684 -15.010 1.00 1.27 C ATOM 1284 CG ASN A 81 1.743 9.026 -14.354 1.00 1.93 C ATOM 1285 OD1 ASN A 81 1.394 9.359 -13.228 1.00 3.30 O ATOM 1286 ND2 ASN A 81 1.118 8.076 -15.045 1.00 2.31 N ATOM 0 H ASN A 81 3.525 7.299 -13.953 1.00 0.76 H new ATOM 0 HA ASN A 81 5.059 9.524 -15.151 1.00 0.95 H new ATOM 0 HB2 ASN A 81 2.900 10.762 -14.858 1.00 1.27 H new ATOM 0 HB3 ASN A 81 2.914 9.512 -16.086 1.00 1.27 H new ATOM 0 HD21 ASN A 81 0.315 7.595 -14.639 1.00 2.31 H new ATOM 0 HD22 ASN A 81 1.441 7.829 -15.980 1.00 2.31 H new ATOM 1293 N ASP A 82 4.208 9.109 -12.002 1.00 1.13 N ATOM 1294 CA ASP A 82 4.581 9.559 -10.663 1.00 1.18 C ATOM 1295 C ASP A 82 6.083 9.346 -10.448 1.00 1.23 C ATOM 1296 O ASP A 82 6.865 10.292 -10.425 1.00 2.44 O ATOM 1297 CB ASP A 82 3.745 8.811 -9.600 1.00 1.12 C ATOM 1298 CG ASP A 82 2.586 9.627 -9.029 1.00 1.80 C ATOM 1299 OD1 ASP A 82 2.579 10.863 -9.187 1.00 2.28 O ATOM 1300 OD2 ASP A 82 1.761 9.024 -8.313 1.00 2.97 O ATOM 0 H ASP A 82 3.589 8.298 -12.019 1.00 1.13 H new ATOM 0 HA ASP A 82 4.371 10.624 -10.562 1.00 1.18 H new ATOM 0 HB2 ASP A 82 3.348 7.897 -10.042 1.00 1.12 H new ATOM 0 HB3 ASP A 82 4.401 8.511 -8.783 1.00 1.12 H new ATOM 1305 N LYS A 83 6.473 8.076 -10.323 1.00 1.22 N ATOM 1306 CA LYS A 83 7.842 7.585 -10.166 1.00 1.14 C ATOM 1307 C LYS A 83 8.326 7.754 -8.713 1.00 1.03 C ATOM 1308 O LYS A 83 7.955 8.718 -8.047 1.00 1.04 O ATOM 1309 CB LYS A 83 8.797 8.182 -11.213 1.00 1.25 C ATOM 1310 CG LYS A 83 8.255 7.997 -12.640 1.00 1.81 C ATOM 1311 CD LYS A 83 9.179 8.529 -13.741 1.00 1.84 C ATOM 1312 CE LYS A 83 10.450 7.680 -13.888 1.00 2.66 C ATOM 1313 NZ LYS A 83 11.157 7.967 -15.154 1.00 3.18 N ATOM 0 H LYS A 83 5.796 7.313 -10.329 1.00 1.22 H new ATOM 0 HA LYS A 83 7.843 6.513 -10.365 1.00 1.14 H new ATOM 0 HB2 LYS A 83 8.941 9.244 -11.012 1.00 1.25 H new ATOM 0 HB3 LYS A 83 9.774 7.706 -11.129 1.00 1.25 H new ATOM 0 HG2 LYS A 83 8.077 6.936 -12.813 1.00 1.81 H new ATOM 0 HG3 LYS A 83 7.291 8.499 -12.717 1.00 1.81 H new ATOM 0 HD2 LYS A 83 8.642 8.544 -14.689 1.00 1.84 H new ATOM 0 HD3 LYS A 83 9.455 9.559 -13.515 1.00 1.84 H new ATOM 0 HE2 LYS A 83 11.116 7.874 -13.047 1.00 2.66 H new ATOM 0 HE3 LYS A 83 10.188 6.623 -13.849 1.00 2.66 H new ATOM 0 HZ1 LYS A 83 12.010 7.375 -15.217 1.00 3.18 H new ATOM 0 HZ2 LYS A 83 10.530 7.758 -15.957 1.00 3.18 H new ATOM 0 HZ3 LYS A 83 11.430 8.970 -15.180 1.00 3.18 H new ATOM 1327 N PRO A 84 9.148 6.827 -8.183 1.00 0.96 N ATOM 1328 CA PRO A 84 9.514 6.777 -6.767 1.00 0.84 C ATOM 1329 C PRO A 84 10.038 8.103 -6.214 1.00 0.79 C ATOM 1330 O PRO A 84 9.836 8.420 -5.043 1.00 0.72 O ATOM 1331 CB PRO A 84 10.571 5.672 -6.644 1.00 0.80 C ATOM 1332 CG PRO A 84 11.074 5.483 -8.074 1.00 0.86 C ATOM 1333 CD PRO A 84 9.811 5.743 -8.889 1.00 0.98 C ATOM 0 HA PRO A 84 8.626 6.571 -6.169 1.00 0.84 H new ATOM 0 HB2 PRO A 84 11.378 5.964 -5.972 1.00 0.80 H new ATOM 0 HB3 PRO A 84 10.143 4.752 -6.246 1.00 0.80 H new ATOM 0 HG2 PRO A 84 11.872 6.183 -8.322 1.00 0.86 H new ATOM 0 HG3 PRO A 84 11.467 4.480 -8.239 1.00 0.86 H new ATOM 0 HD2 PRO A 84 10.050 6.023 -9.915 1.00 0.98 H new ATOM 0 HD3 PRO A 84 9.180 4.856 -8.939 1.00 0.98 H new ATOM 1341 N LYS A 85 10.735 8.882 -7.040 1.00 0.85 N ATOM 1342 CA LYS A 85 11.260 10.161 -6.603 1.00 0.82 C ATOM 1343 C LYS A 85 10.142 11.141 -6.241 1.00 0.72 C ATOM 1344 O LYS A 85 10.307 11.925 -5.307 1.00 0.69 O ATOM 1345 CB LYS A 85 12.229 10.723 -7.640 1.00 0.90 C ATOM 1346 CG LYS A 85 13.683 10.744 -7.130 1.00 1.23 C ATOM 1347 CD LYS A 85 14.418 9.383 -7.092 1.00 2.44 C ATOM 1348 CE LYS A 85 14.001 8.414 -5.962 1.00 4.32 C ATOM 1349 NZ LYS A 85 14.923 7.259 -5.820 1.00 5.45 N ATOM 0 H LYS A 85 10.945 8.646 -8.010 1.00 0.85 H new ATOM 0 HA LYS A 85 11.825 10.005 -5.684 1.00 0.82 H new ATOM 0 HB2 LYS A 85 12.174 10.123 -8.549 1.00 0.90 H new ATOM 0 HB3 LYS A 85 11.925 11.735 -7.907 1.00 0.90 H new ATOM 0 HG2 LYS A 85 14.256 11.424 -7.760 1.00 1.23 H new ATOM 0 HG3 LYS A 85 13.686 11.162 -6.123 1.00 1.23 H new ATOM 0 HD2 LYS A 85 14.262 8.882 -8.048 1.00 2.44 H new ATOM 0 HD3 LYS A 85 15.488 9.573 -7.003 1.00 2.44 H new ATOM 0 HE2 LYS A 85 13.962 8.959 -5.019 1.00 4.32 H new ATOM 0 HE3 LYS A 85 12.994 8.046 -6.159 1.00 4.32 H new ATOM 0 HZ1 LYS A 85 14.441 6.491 -5.311 1.00 5.45 H new ATOM 0 HZ2 LYS A 85 15.208 6.924 -6.763 1.00 5.45 H new ATOM 0 HZ3 LYS A 85 15.767 7.552 -5.287 1.00 5.45 H new ATOM 1363 N GLN A 86 9.003 11.095 -6.942 1.00 0.71 N ATOM 1364 CA GLN A 86 7.863 11.901 -6.547 1.00 0.67 C ATOM 1365 C GLN A 86 7.394 11.450 -5.170 1.00 0.57 C ATOM 1366 O GLN A 86 7.166 12.291 -4.304 1.00 0.55 O ATOM 1367 CB GLN A 86 6.758 11.851 -7.600 1.00 0.77 C ATOM 1368 CG GLN A 86 7.034 12.788 -8.788 1.00 1.05 C ATOM 1369 CD GLN A 86 7.066 14.256 -8.369 1.00 1.33 C ATOM 1370 OE1 GLN A 86 8.055 14.966 -8.581 1.00 2.31 O ATOM 1371 NE2 GLN A 86 5.997 14.710 -7.722 1.00 1.79 N ATOM 0 H GLN A 86 8.856 10.517 -7.769 1.00 0.71 H new ATOM 0 HA GLN A 86 8.154 12.949 -6.479 1.00 0.67 H new ATOM 0 HB2 GLN A 86 6.654 10.829 -7.964 1.00 0.77 H new ATOM 0 HB3 GLN A 86 5.809 12.124 -7.139 1.00 0.77 H new ATOM 0 HG2 GLN A 86 7.987 12.521 -9.245 1.00 1.05 H new ATOM 0 HG3 GLN A 86 6.265 12.645 -9.547 1.00 1.05 H new ATOM 0 HE21 GLN A 86 5.198 14.096 -7.564 1.00 1.79 H new ATOM 0 HE22 GLN A 86 5.976 15.672 -7.383 1.00 1.79 H new ATOM 1380 N LEU A 87 7.333 10.134 -4.937 1.00 0.56 N ATOM 1381 CA LEU A 87 6.953 9.622 -3.629 1.00 0.53 C ATOM 1382 C LEU A 87 7.922 10.165 -2.573 1.00 0.48 C ATOM 1383 O LEU A 87 7.479 10.686 -1.552 1.00 0.50 O ATOM 1384 CB LEU A 87 6.812 8.085 -3.599 1.00 0.61 C ATOM 1385 CG LEU A 87 5.540 7.583 -4.317 1.00 0.71 C ATOM 1386 CD1 LEU A 87 5.769 7.224 -5.790 1.00 1.06 C ATOM 1387 CD2 LEU A 87 4.961 6.338 -3.642 1.00 1.13 C ATOM 0 H LEU A 87 7.540 9.417 -5.632 1.00 0.56 H new ATOM 0 HA LEU A 87 5.952 9.983 -3.391 1.00 0.53 H new ATOM 0 HB2 LEU A 87 7.688 7.636 -4.067 1.00 0.61 H new ATOM 0 HB3 LEU A 87 6.795 7.747 -2.563 1.00 0.61 H new ATOM 0 HG LEU A 87 4.849 8.423 -4.254 1.00 0.71 H new ATOM 0 HD11 LEU A 87 4.833 6.879 -6.230 1.00 1.06 H new ATOM 0 HD12 LEU A 87 6.121 8.104 -6.328 1.00 1.06 H new ATOM 0 HD13 LEU A 87 6.516 6.433 -5.860 1.00 1.06 H new ATOM 0 HD21 LEU A 87 4.067 6.016 -4.177 1.00 1.13 H new ATOM 0 HD22 LEU A 87 5.701 5.538 -3.658 1.00 1.13 H new ATOM 0 HD23 LEU A 87 4.701 6.571 -2.609 1.00 1.13 H new ATOM 1399 N LYS A 88 9.237 10.116 -2.818 1.00 0.47 N ATOM 1400 CA LYS A 88 10.190 10.648 -1.848 1.00 0.50 C ATOM 1401 C LYS A 88 10.037 12.163 -1.633 1.00 0.52 C ATOM 1402 O LYS A 88 10.126 12.623 -0.498 1.00 0.57 O ATOM 1403 CB LYS A 88 11.638 10.237 -2.160 1.00 0.59 C ATOM 1404 CG LYS A 88 12.310 9.781 -0.853 1.00 0.81 C ATOM 1405 CD LYS A 88 13.804 9.479 -1.026 1.00 0.95 C ATOM 1406 CE LYS A 88 14.376 8.627 0.126 1.00 1.23 C ATOM 1407 NZ LYS A 88 14.273 9.263 1.455 1.00 2.15 N ATOM 0 H LYS A 88 9.655 9.722 -3.661 1.00 0.47 H new ATOM 0 HA LYS A 88 9.941 10.184 -0.894 1.00 0.50 H new ATOM 0 HB2 LYS A 88 11.653 9.432 -2.894 1.00 0.59 H new ATOM 0 HB3 LYS A 88 12.184 11.075 -2.594 1.00 0.59 H new ATOM 0 HG2 LYS A 88 12.186 10.556 -0.097 1.00 0.81 H new ATOM 0 HG3 LYS A 88 11.804 8.889 -0.482 1.00 0.81 H new ATOM 0 HD2 LYS A 88 13.958 8.956 -1.970 1.00 0.95 H new ATOM 0 HD3 LYS A 88 14.356 10.417 -1.087 1.00 0.95 H new ATOM 0 HE2 LYS A 88 13.853 7.671 0.151 1.00 1.23 H new ATOM 0 HE3 LYS A 88 15.424 8.411 -0.082 1.00 1.23 H new ATOM 0 HZ1 LYS A 88 14.952 8.820 2.106 1.00 2.15 H new ATOM 0 HZ2 LYS A 88 14.485 10.278 1.372 1.00 2.15 H new ATOM 0 HZ3 LYS A 88 13.309 9.140 1.825 1.00 2.15 H new ATOM 1421 N LYS A 89 9.800 12.948 -2.690 1.00 0.56 N ATOM 1422 CA LYS A 89 9.490 14.370 -2.519 1.00 0.62 C ATOM 1423 C LYS A 89 8.257 14.545 -1.627 1.00 0.60 C ATOM 1424 O LYS A 89 8.287 15.251 -0.626 1.00 0.65 O ATOM 1425 CB LYS A 89 9.213 15.048 -3.863 1.00 0.74 C ATOM 1426 CG LYS A 89 10.460 15.297 -4.716 1.00 1.42 C ATOM 1427 CD LYS A 89 9.962 16.006 -5.979 1.00 1.68 C ATOM 1428 CE LYS A 89 11.065 16.298 -6.999 1.00 2.58 C ATOM 1429 NZ LYS A 89 10.481 16.858 -8.236 1.00 3.42 N ATOM 0 H LYS A 89 9.816 12.628 -3.658 1.00 0.56 H new ATOM 0 HA LYS A 89 10.360 14.834 -2.055 1.00 0.62 H new ATOM 0 HB2 LYS A 89 8.517 14.431 -4.431 1.00 0.74 H new ATOM 0 HB3 LYS A 89 8.717 16.001 -3.680 1.00 0.74 H new ATOM 0 HG2 LYS A 89 11.184 15.912 -4.181 1.00 1.42 H new ATOM 0 HG3 LYS A 89 10.959 14.360 -4.964 1.00 1.42 H new ATOM 0 HD2 LYS A 89 9.196 15.391 -6.452 1.00 1.68 H new ATOM 0 HD3 LYS A 89 9.486 16.944 -5.694 1.00 1.68 H new ATOM 0 HE2 LYS A 89 11.784 17.000 -6.577 1.00 2.58 H new ATOM 0 HE3 LYS A 89 11.611 15.382 -7.228 1.00 2.58 H new ATOM 0 HZ1 LYS A 89 11.178 16.800 -9.006 1.00 3.42 H new ATOM 0 HZ2 LYS A 89 9.632 16.316 -8.496 1.00 3.42 H new ATOM 0 HZ3 LYS A 89 10.221 17.853 -8.078 1.00 3.42 H new ATOM 1443 N PHE A 90 7.162 13.891 -1.992 1.00 0.57 N ATOM 1444 CA PHE A 90 5.890 13.948 -1.288 1.00 0.60 C ATOM 1445 C PHE A 90 6.069 13.519 0.170 1.00 0.61 C ATOM 1446 O PHE A 90 5.476 14.096 1.078 1.00 0.68 O ATOM 1447 CB PHE A 90 4.925 13.069 -2.080 1.00 0.61 C ATOM 1448 CG PHE A 90 3.541 12.829 -1.518 1.00 0.67 C ATOM 1449 CD1 PHE A 90 2.464 13.600 -1.994 1.00 1.87 C ATOM 1450 CD2 PHE A 90 3.287 11.612 -0.856 1.00 1.62 C ATOM 1451 CE1 PHE A 90 1.146 13.127 -1.869 1.00 2.01 C ATOM 1452 CE2 PHE A 90 1.970 11.144 -0.730 1.00 1.77 C ATOM 1453 CZ PHE A 90 0.899 11.902 -1.226 1.00 1.23 C ATOM 0 H PHE A 90 7.135 13.287 -2.813 1.00 0.57 H new ATOM 0 HA PHE A 90 5.485 14.958 -1.232 1.00 0.60 H new ATOM 0 HB2 PHE A 90 4.809 13.512 -3.069 1.00 0.61 H new ATOM 0 HB3 PHE A 90 5.399 12.098 -2.219 1.00 0.61 H new ATOM 0 HD1 PHE A 90 2.651 14.558 -2.457 1.00 1.87 H new ATOM 0 HD2 PHE A 90 4.105 11.039 -0.446 1.00 1.62 H new ATOM 0 HE1 PHE A 90 0.324 13.704 -2.267 1.00 2.01 H new ATOM 0 HE2 PHE A 90 1.780 10.196 -0.249 1.00 1.77 H new ATOM 0 HZ PHE A 90 -0.114 11.545 -1.114 1.00 1.23 H new ATOM 1463 N ALA A 91 6.957 12.556 0.405 1.00 0.61 N ATOM 1464 CA ALA A 91 7.312 12.073 1.726 1.00 0.70 C ATOM 1465 C ALA A 91 8.118 13.093 2.529 1.00 0.78 C ATOM 1466 O ALA A 91 8.230 12.972 3.744 1.00 1.00 O ATOM 1467 CB ALA A 91 8.140 10.810 1.565 1.00 0.69 C ATOM 0 H ALA A 91 7.461 12.080 -0.344 1.00 0.61 H new ATOM 0 HA ALA A 91 6.389 11.885 2.274 1.00 0.70 H new ATOM 0 HB1 ALA A 91 8.418 10.429 2.548 1.00 0.69 H new ATOM 0 HB2 ALA A 91 7.556 10.057 1.036 1.00 0.69 H new ATOM 0 HB3 ALA A 91 9.041 11.036 0.995 1.00 0.69 H new ATOM 1473 N ALA A 92 8.725 14.072 1.861 1.00 0.81 N ATOM 1474 CA ALA A 92 9.287 15.229 2.532 1.00 0.92 C ATOM 1475 C ALA A 92 8.166 16.142 3.044 1.00 0.86 C ATOM 1476 O ALA A 92 8.377 16.898 3.988 1.00 0.98 O ATOM 1477 CB ALA A 92 10.221 15.966 1.572 1.00 1.07 C ATOM 0 H ALA A 92 8.838 14.081 0.847 1.00 0.81 H new ATOM 0 HA ALA A 92 9.867 14.909 3.397 1.00 0.92 H new ATOM 0 HB1 ALA A 92 10.645 16.836 2.073 1.00 1.07 H new ATOM 0 HB2 ALA A 92 11.025 15.298 1.262 1.00 1.07 H new ATOM 0 HB3 ALA A 92 9.660 16.290 0.695 1.00 1.07 H new ATOM 1483 N ASN A 93 6.989 16.090 2.406 1.00 0.74 N ATOM 1484 CA ASN A 93 5.877 16.991 2.705 1.00 0.80 C ATOM 1485 C ASN A 93 4.989 16.363 3.776 1.00 0.82 C ATOM 1486 O ASN A 93 4.799 16.932 4.847 1.00 0.84 O ATOM 1487 CB ASN A 93 5.064 17.318 1.442 1.00 0.84 C ATOM 1488 CG ASN A 93 5.908 17.906 0.314 1.00 0.88 C ATOM 1489 OD1 ASN A 93 6.954 18.505 0.541 1.00 1.41 O ATOM 1490 ND2 ASN A 93 5.459 17.743 -0.926 1.00 1.98 N ATOM 0 H ASN A 93 6.785 15.418 1.666 1.00 0.74 H new ATOM 0 HA ASN A 93 6.281 17.932 3.079 1.00 0.80 H new ATOM 0 HB2 ASN A 93 4.578 16.410 1.086 1.00 0.84 H new ATOM 0 HB3 ASN A 93 4.274 18.023 1.700 1.00 0.84 H new ATOM 0 HD21 ASN A 93 5.987 18.120 -1.713 1.00 1.98 H new ATOM 0 HD22 ASN A 93 4.586 17.241 -1.091 1.00 1.98 H new ATOM 1497 N TYR A 94 4.448 15.174 3.495 1.00 0.88 N ATOM 1498 CA TYR A 94 3.791 14.372 4.517 1.00 0.91 C ATOM 1499 C TYR A 94 4.849 13.979 5.549 1.00 0.91 C ATOM 1500 O TYR A 94 5.872 13.431 5.149 1.00 0.95 O ATOM 1501 CB TYR A 94 3.151 13.138 3.884 1.00 0.96 C ATOM 1502 CG TYR A 94 1.802 13.452 3.277 1.00 1.02 C ATOM 1503 CD1 TYR A 94 0.677 13.578 4.112 1.00 1.54 C ATOM 1504 CD2 TYR A 94 1.692 13.737 1.908 1.00 2.53 C ATOM 1505 CE1 TYR A 94 -0.578 13.907 3.569 1.00 1.44 C ATOM 1506 CE2 TYR A 94 0.449 14.117 1.375 1.00 2.68 C ATOM 1507 CZ TYR A 94 -0.686 14.191 2.198 1.00 1.26 C ATOM 1508 OH TYR A 94 -1.879 14.528 1.635 1.00 1.46 O ATOM 0 H TYR A 94 4.455 14.750 2.567 1.00 0.88 H new ATOM 0 HA TYR A 94 2.995 14.937 5.002 1.00 0.91 H new ATOM 0 HB2 TYR A 94 3.812 12.741 3.114 1.00 0.96 H new ATOM 0 HB3 TYR A 94 3.037 12.360 4.639 1.00 0.96 H new ATOM 0 HD1 TYR A 94 0.778 13.421 5.176 1.00 1.54 H new ATOM 0 HD2 TYR A 94 2.558 13.665 1.267 1.00 2.53 H new ATOM 0 HE1 TYR A 94 -1.452 13.941 4.202 1.00 1.44 H new ATOM 0 HE2 TYR A 94 0.366 14.354 0.325 1.00 2.68 H new ATOM 0 HH TYR A 94 -2.595 14.417 2.295 1.00 1.46 H new ATOM 1518 N PRO A 95 4.655 14.256 6.848 1.00 0.94 N ATOM 1519 CA PRO A 95 5.692 14.083 7.856 1.00 0.98 C ATOM 1520 C PRO A 95 5.876 12.600 8.195 1.00 0.97 C ATOM 1521 O PRO A 95 5.545 12.161 9.295 1.00 1.06 O ATOM 1522 CB PRO A 95 5.211 14.915 9.052 1.00 1.07 C ATOM 1523 CG PRO A 95 3.689 14.818 8.944 1.00 1.08 C ATOM 1524 CD PRO A 95 3.464 14.850 7.432 1.00 1.00 C ATOM 0 HA PRO A 95 6.674 14.416 7.521 1.00 0.98 H new ATOM 0 HB2 PRO A 95 5.576 14.513 9.997 1.00 1.07 H new ATOM 0 HB3 PRO A 95 5.556 15.947 8.991 1.00 1.07 H new ATOM 0 HG2 PRO A 95 3.308 13.900 9.392 1.00 1.08 H new ATOM 0 HG3 PRO A 95 3.192 15.648 9.446 1.00 1.08 H new ATOM 0 HD2 PRO A 95 2.571 14.289 7.157 1.00 1.00 H new ATOM 0 HD3 PRO A 95 3.321 15.871 7.078 1.00 1.00 H new ATOM 1532 N LEU A 96 6.398 11.819 7.246 1.00 0.99 N ATOM 1533 CA LEU A 96 6.645 10.403 7.426 1.00 0.97 C ATOM 1534 C LEU A 96 8.101 10.151 7.795 1.00 0.89 C ATOM 1535 O LEU A 96 8.897 11.079 7.919 1.00 0.91 O ATOM 1536 CB LEU A 96 6.144 9.633 6.199 1.00 0.93 C ATOM 1537 CG LEU A 96 6.931 9.699 4.888 1.00 0.81 C ATOM 1538 CD1 LEU A 96 8.129 8.742 4.875 1.00 0.70 C ATOM 1539 CD2 LEU A 96 5.956 9.286 3.781 1.00 0.92 C ATOM 0 H LEU A 96 6.661 12.165 6.323 1.00 0.99 H new ATOM 0 HA LEU A 96 6.076 10.019 8.273 1.00 0.97 H new ATOM 0 HB2 LEU A 96 6.070 8.583 6.482 1.00 0.93 H new ATOM 0 HB3 LEU A 96 5.132 9.979 5.989 1.00 0.93 H new ATOM 0 HG LEU A 96 7.328 10.705 4.753 1.00 0.81 H new ATOM 0 HD11 LEU A 96 8.653 8.828 3.923 1.00 0.70 H new ATOM 0 HD12 LEU A 96 8.808 8.999 5.688 1.00 0.70 H new ATOM 0 HD13 LEU A 96 7.778 7.718 5.005 1.00 0.70 H new ATOM 0 HD21 LEU A 96 6.466 9.315 2.818 1.00 0.92 H new ATOM 0 HD22 LEU A 96 5.597 8.275 3.971 1.00 0.92 H new ATOM 0 HD23 LEU A 96 5.111 9.974 3.765 1.00 0.92 H new ATOM 1551 N SER A 97 8.445 8.877 7.975 1.00 0.94 N ATOM 1552 CA SER A 97 9.817 8.456 8.221 1.00 0.89 C ATOM 1553 C SER A 97 10.067 7.110 7.547 1.00 0.68 C ATOM 1554 O SER A 97 9.157 6.292 7.413 1.00 0.81 O ATOM 1555 CB SER A 97 10.113 8.434 9.724 1.00 1.17 C ATOM 1556 OG SER A 97 11.458 8.059 9.944 1.00 1.70 O ATOM 0 H SER A 97 7.776 8.108 7.954 1.00 0.94 H new ATOM 0 HA SER A 97 10.509 9.175 7.783 1.00 0.89 H new ATOM 0 HB2 SER A 97 9.925 9.418 10.155 1.00 1.17 H new ATOM 0 HB3 SER A 97 9.445 7.734 10.225 1.00 1.17 H new ATOM 0 HG SER A 97 11.490 7.312 10.577 1.00 1.70 H new ATOM 1562 N PHE A 98 11.299 6.913 7.081 1.00 0.63 N ATOM 1563 CA PHE A 98 11.683 5.798 6.226 1.00 0.53 C ATOM 1564 C PHE A 98 12.096 4.564 7.028 1.00 0.43 C ATOM 1565 O PHE A 98 12.053 3.459 6.489 1.00 0.40 O ATOM 1566 CB PHE A 98 12.820 6.240 5.296 1.00 0.63 C ATOM 1567 CG PHE A 98 12.371 7.192 4.201 1.00 0.67 C ATOM 1568 CD1 PHE A 98 11.847 6.670 3.003 1.00 1.94 C ATOM 1569 CD2 PHE A 98 12.299 8.577 4.447 1.00 1.78 C ATOM 1570 CE1 PHE A 98 11.227 7.521 2.073 1.00 2.13 C ATOM 1571 CE2 PHE A 98 11.660 9.426 3.527 1.00 1.66 C ATOM 1572 CZ PHE A 98 11.119 8.895 2.344 1.00 0.90 C ATOM 0 H PHE A 98 12.074 7.541 7.294 1.00 0.63 H new ATOM 0 HA PHE A 98 10.812 5.511 5.637 1.00 0.53 H new ATOM 0 HB2 PHE A 98 13.597 6.722 5.889 1.00 0.63 H new ATOM 0 HB3 PHE A 98 13.268 5.358 4.839 1.00 0.63 H new ATOM 0 HD1 PHE A 98 11.922 5.612 2.798 1.00 1.94 H new ATOM 0 HD2 PHE A 98 12.736 8.988 5.345 1.00 1.78 H new ATOM 0 HE1 PHE A 98 10.834 7.119 1.151 1.00 2.13 H new ATOM 0 HE2 PHE A 98 11.585 10.484 3.729 1.00 1.66 H new ATOM 0 HZ PHE A 98 10.619 9.545 1.641 1.00 0.90 H new ATOM 1582 N ASP A 99 12.519 4.763 8.284 1.00 0.52 N ATOM 1583 CA ASP A 99 13.154 3.790 9.164 1.00 0.64 C ATOM 1584 C ASP A 99 12.659 2.356 8.976 1.00 0.54 C ATOM 1585 O ASP A 99 13.478 1.445 8.863 1.00 0.67 O ATOM 1586 CB ASP A 99 13.048 4.257 10.622 1.00 1.19 C ATOM 1587 CG ASP A 99 11.623 4.494 11.089 1.00 1.20 C ATOM 1588 OD1 ASP A 99 11.119 5.607 10.830 1.00 2.59 O ATOM 1589 OD2 ASP A 99 11.001 3.585 11.677 1.00 2.26 O ATOM 0 H ASP A 99 12.417 5.671 8.736 1.00 0.52 H new ATOM 0 HA ASP A 99 14.206 3.747 8.881 1.00 0.64 H new ATOM 0 HB2 ASP A 99 13.512 3.511 11.267 1.00 1.19 H new ATOM 0 HB3 ASP A 99 13.617 5.179 10.740 1.00 1.19 H new ATOM 1594 N ASN A 100 11.342 2.145 8.918 1.00 0.44 N ATOM 1595 CA ASN A 100 10.789 0.827 8.634 1.00 0.42 C ATOM 1596 C ASN A 100 9.595 0.948 7.692 1.00 0.38 C ATOM 1597 O ASN A 100 8.541 0.363 7.941 1.00 0.55 O ATOM 1598 CB ASN A 100 10.426 0.214 9.987 1.00 0.56 C ATOM 1599 CG ASN A 100 10.268 -1.298 9.921 1.00 0.82 C ATOM 1600 OD1 ASN A 100 11.182 -2.006 9.513 1.00 1.69 O ATOM 1601 ND2 ASN A 100 9.116 -1.805 10.333 1.00 0.70 N ATOM 0 H ASN A 100 10.642 2.872 9.064 1.00 0.44 H new ATOM 0 HA ASN A 100 11.500 0.180 8.121 1.00 0.42 H new ATOM 0 HB2 ASN A 100 11.199 0.463 10.714 1.00 0.56 H new ATOM 0 HB3 ASN A 100 9.497 0.657 10.345 1.00 0.56 H new ATOM 0 HD21 ASN A 100 8.968 -2.814 10.317 1.00 0.70 H new ATOM 0 HD22 ASN A 100 8.377 -1.186 10.666 1.00 0.70 H new ATOM 1608 N TRP A 101 9.801 1.654 6.572 1.00 0.31 N ATOM 1609 CA TRP A 101 8.803 1.904 5.530 1.00 0.32 C ATOM 1610 C TRP A 101 9.407 1.628 4.151 1.00 0.36 C ATOM 1611 O TRP A 101 10.330 2.328 3.736 1.00 0.45 O ATOM 1612 CB TRP A 101 8.295 3.353 5.615 1.00 0.41 C ATOM 1613 CG TRP A 101 6.997 3.692 4.927 1.00 0.42 C ATOM 1614 CD1 TRP A 101 6.449 3.088 3.845 1.00 0.46 C ATOM 1615 CD2 TRP A 101 6.014 4.687 5.344 1.00 0.48 C ATOM 1616 NE1 TRP A 101 5.195 3.611 3.608 1.00 0.56 N ATOM 1617 CE2 TRP A 101 4.872 4.605 4.499 1.00 0.57 C ATOM 1618 CE3 TRP A 101 5.974 5.649 6.366 1.00 0.54 C ATOM 1619 CZ2 TRP A 101 3.748 5.432 4.664 1.00 0.69 C ATOM 1620 CZ3 TRP A 101 4.826 6.423 6.596 1.00 0.62 C ATOM 1621 CH2 TRP A 101 3.733 6.351 5.724 1.00 0.70 C ATOM 0 H TRP A 101 10.703 2.082 6.361 1.00 0.31 H new ATOM 0 HA TRP A 101 7.957 1.234 5.682 1.00 0.32 H new ATOM 0 HB2 TRP A 101 8.190 3.608 6.669 1.00 0.41 H new ATOM 0 HB3 TRP A 101 9.069 4.002 5.205 1.00 0.41 H new ATOM 0 HD1 TRP A 101 6.922 2.315 3.258 1.00 0.46 H new ATOM 0 HE1 TRP A 101 4.579 3.296 2.858 1.00 0.56 H new ATOM 0 HE3 TRP A 101 6.845 5.796 6.988 1.00 0.54 H new ATOM 0 HZ2 TRP A 101 2.910 5.361 3.986 1.00 0.69 H new ATOM 0 HZ3 TRP A 101 4.785 7.079 7.453 1.00 0.62 H new ATOM 0 HH2 TRP A 101 2.882 7.000 5.867 1.00 0.70 H new ATOM 1632 N ASP A 102 8.869 0.641 3.425 1.00 0.35 N ATOM 1633 CA ASP A 102 9.328 0.297 2.082 1.00 0.42 C ATOM 1634 C ASP A 102 8.370 0.872 1.033 1.00 0.41 C ATOM 1635 O ASP A 102 7.345 0.273 0.703 1.00 0.47 O ATOM 1636 CB ASP A 102 9.496 -1.227 1.941 1.00 0.48 C ATOM 1637 CG ASP A 102 10.949 -1.675 2.010 1.00 0.66 C ATOM 1638 OD1 ASP A 102 11.756 -1.135 1.223 1.00 1.83 O ATOM 1639 OD2 ASP A 102 11.229 -2.587 2.822 1.00 1.28 O ATOM 0 H ASP A 102 8.100 0.059 3.757 1.00 0.35 H new ATOM 0 HA ASP A 102 10.308 0.744 1.913 1.00 0.42 H new ATOM 0 HB2 ASP A 102 8.931 -1.724 2.730 1.00 0.48 H new ATOM 0 HB3 ASP A 102 9.068 -1.548 0.991 1.00 0.48 H new ATOM 1644 N PHE A 103 8.710 2.035 0.476 1.00 0.40 N ATOM 1645 CA PHE A 103 7.974 2.592 -0.651 1.00 0.42 C ATOM 1646 C PHE A 103 8.402 1.865 -1.924 1.00 0.46 C ATOM 1647 O PHE A 103 9.541 2.038 -2.359 1.00 0.55 O ATOM 1648 CB PHE A 103 8.215 4.099 -0.769 1.00 0.47 C ATOM 1649 CG PHE A 103 7.302 4.922 0.112 1.00 0.53 C ATOM 1650 CD1 PHE A 103 5.977 5.149 -0.301 1.00 2.04 C ATOM 1651 CD2 PHE A 103 7.739 5.396 1.362 1.00 1.52 C ATOM 1652 CE1 PHE A 103 5.100 5.883 0.513 1.00 2.18 C ATOM 1653 CE2 PHE A 103 6.864 6.140 2.172 1.00 1.50 C ATOM 1654 CZ PHE A 103 5.547 6.386 1.745 1.00 0.92 C ATOM 0 H PHE A 103 9.493 2.608 0.791 1.00 0.40 H new ATOM 0 HA PHE A 103 6.905 2.449 -0.496 1.00 0.42 H new ATOM 0 HB2 PHE A 103 9.251 4.316 -0.509 1.00 0.47 H new ATOM 0 HB3 PHE A 103 8.077 4.402 -1.807 1.00 0.47 H new ATOM 0 HD1 PHE A 103 5.633 4.758 -1.247 1.00 2.04 H new ATOM 0 HD2 PHE A 103 8.744 5.189 1.698 1.00 1.52 H new ATOM 0 HE1 PHE A 103 4.084 6.060 0.192 1.00 2.18 H new ATOM 0 HE2 PHE A 103 7.203 6.523 3.123 1.00 1.50 H new ATOM 0 HZ PHE A 103 4.878 6.963 2.366 1.00 0.92 H new ATOM 1664 N LEU A 104 7.512 1.052 -2.502 1.00 0.46 N ATOM 1665 CA LEU A 104 7.816 0.169 -3.622 1.00 0.51 C ATOM 1666 C LEU A 104 7.478 0.796 -4.971 1.00 0.54 C ATOM 1667 O LEU A 104 6.447 1.449 -5.135 1.00 0.67 O ATOM 1668 CB LEU A 104 7.167 -1.208 -3.454 1.00 0.52 C ATOM 1669 CG LEU A 104 7.548 -1.906 -2.138 1.00 0.46 C ATOM 1670 CD1 LEU A 104 7.052 -3.351 -2.188 1.00 0.46 C ATOM 1671 CD2 LEU A 104 9.056 -1.948 -1.878 1.00 0.49 C ATOM 0 H LEU A 104 6.541 0.992 -2.195 1.00 0.46 H new ATOM 0 HA LEU A 104 8.896 0.020 -3.614 1.00 0.51 H new ATOM 0 HB2 LEU A 104 6.083 -1.099 -3.498 1.00 0.52 H new ATOM 0 HB3 LEU A 104 7.458 -1.843 -4.291 1.00 0.52 H new ATOM 0 HG LEU A 104 7.088 -1.328 -1.337 1.00 0.46 H new ATOM 0 HD11 LEU A 104 7.316 -3.858 -1.260 1.00 0.46 H new ATOM 0 HD12 LEU A 104 5.969 -3.360 -2.311 1.00 0.46 H new ATOM 0 HD13 LEU A 104 7.517 -3.866 -3.028 1.00 0.46 H new ATOM 0 HD21 LEU A 104 9.248 -2.455 -0.932 1.00 0.49 H new ATOM 0 HD22 LEU A 104 9.550 -2.488 -2.686 1.00 0.49 H new ATOM 0 HD23 LEU A 104 9.445 -0.931 -1.830 1.00 0.49 H new ATOM 1683 N THR A 105 8.350 0.575 -5.957 1.00 0.48 N ATOM 1684 CA THR A 105 8.086 1.013 -7.315 1.00 0.52 C ATOM 1685 C THR A 105 6.917 0.213 -7.887 1.00 0.60 C ATOM 1686 O THR A 105 5.887 0.774 -8.249 1.00 0.80 O ATOM 1687 CB THR A 105 9.345 0.846 -8.173 1.00 0.56 C ATOM 1688 OG1 THR A 105 9.805 -0.493 -8.132 1.00 0.62 O ATOM 1689 CG2 THR A 105 10.465 1.773 -7.700 1.00 0.64 C ATOM 0 H THR A 105 9.242 0.095 -5.833 1.00 0.48 H new ATOM 0 HA THR A 105 7.817 2.069 -7.317 1.00 0.52 H new ATOM 0 HB THR A 105 9.076 1.108 -9.196 1.00 0.56 H new ATOM 0 HG1 THR A 105 10.298 -0.644 -7.299 1.00 0.62 H new ATOM 0 HG21 THR A 105 11.344 1.631 -8.328 1.00 0.64 H new ATOM 0 HG22 THR A 105 10.133 2.809 -7.769 1.00 0.64 H new ATOM 0 HG23 THR A 105 10.717 1.541 -6.665 1.00 0.64 H new ATOM 1697 N GLY A 106 7.117 -1.097 -8.032 1.00 0.73 N ATOM 1698 CA GLY A 106 6.199 -1.995 -8.723 1.00 0.94 C ATOM 1699 C GLY A 106 6.559 -2.041 -10.206 1.00 0.94 C ATOM 1700 O GLY A 106 6.580 -3.109 -10.812 1.00 1.37 O ATOM 0 H GLY A 106 7.941 -1.571 -7.663 1.00 0.73 H new ATOM 0 HA2 GLY A 106 6.256 -2.994 -8.292 1.00 0.94 H new ATOM 0 HA3 GLY A 106 5.172 -1.652 -8.597 1.00 0.94 H new ATOM 1704 N TYR A 107 6.896 -0.871 -10.753 1.00 1.06 N ATOM 1705 CA TYR A 107 7.340 -0.654 -12.115 1.00 1.04 C ATOM 1706 C TYR A 107 6.146 -0.644 -13.055 1.00 1.19 C ATOM 1707 O TYR A 107 5.029 -0.396 -12.605 1.00 1.62 O ATOM 1708 CB TYR A 107 8.506 -1.588 -12.491 1.00 1.05 C ATOM 1709 CG TYR A 107 9.488 -1.024 -13.504 1.00 1.23 C ATOM 1710 CD1 TYR A 107 10.138 0.200 -13.255 1.00 2.07 C ATOM 1711 CD2 TYR A 107 9.822 -1.763 -14.654 1.00 2.21 C ATOM 1712 CE1 TYR A 107 11.037 0.726 -14.197 1.00 2.34 C ATOM 1713 CE2 TYR A 107 10.710 -1.229 -15.604 1.00 2.47 C ATOM 1714 CZ TYR A 107 11.300 0.025 -15.386 1.00 1.98 C ATOM 1715 OH TYR A 107 12.169 0.546 -16.297 1.00 2.41 O ATOM 0 H TYR A 107 6.861 -0.003 -10.218 1.00 1.06 H new ATOM 0 HA TYR A 107 7.783 0.337 -12.217 1.00 1.04 H new ATOM 0 HB2 TYR A 107 9.052 -1.844 -11.583 1.00 1.05 H new ATOM 0 HB3 TYR A 107 8.094 -2.516 -12.887 1.00 1.05 H new ATOM 0 HD1 TYR A 107 9.945 0.736 -12.337 1.00 2.07 H new ATOM 0 HD2 TYR A 107 9.395 -2.743 -14.807 1.00 2.21 H new ATOM 0 HE1 TYR A 107 11.526 1.670 -14.007 1.00 2.34 H new ATOM 0 HE2 TYR A 107 10.938 -1.784 -16.502 1.00 2.47 H new ATOM 0 HH TYR A 107 12.242 -0.061 -17.063 1.00 2.41 H new ATOM 1725 N SER A 108 6.387 -0.763 -14.357 1.00 1.06 N ATOM 1726 CA SER A 108 5.414 -0.337 -15.342 1.00 1.09 C ATOM 1727 C SER A 108 4.100 -1.116 -15.239 1.00 1.05 C ATOM 1728 O SER A 108 3.963 -2.096 -14.513 1.00 1.06 O ATOM 1729 CB SER A 108 6.033 -0.325 -16.750 1.00 1.24 C ATOM 1730 OG SER A 108 7.447 -0.376 -16.674 1.00 1.86 O ATOM 0 H SER A 108 7.246 -1.150 -14.748 1.00 1.06 H new ATOM 0 HA SER A 108 5.134 0.694 -15.124 1.00 1.09 H new ATOM 0 HB2 SER A 108 5.663 -1.176 -17.323 1.00 1.24 H new ATOM 0 HB3 SER A 108 5.724 0.575 -17.281 1.00 1.24 H new ATOM 0 HG SER A 108 7.749 -1.299 -16.807 1.00 1.86 H new ATOM 1736 N GLN A 109 3.098 -0.605 -15.939 1.00 1.15 N ATOM 1737 CA GLN A 109 1.694 -0.896 -15.788 1.00 1.09 C ATOM 1738 C GLN A 109 1.510 -2.399 -15.889 1.00 1.13 C ATOM 1739 O GLN A 109 0.852 -2.963 -15.033 1.00 1.20 O ATOM 1740 CB GLN A 109 0.868 -0.089 -16.807 1.00 1.27 C ATOM 1741 CG GLN A 109 0.749 1.411 -16.447 1.00 1.49 C ATOM 1742 CD GLN A 109 2.093 2.044 -16.121 1.00 2.26 C ATOM 1743 OE1 GLN A 109 3.039 1.923 -16.897 1.00 4.01 O ATOM 1744 NE2 GLN A 109 2.252 2.606 -14.932 1.00 2.11 N ATOM 0 H GLN A 109 3.266 0.074 -16.681 1.00 1.15 H new ATOM 0 HA GLN A 109 1.323 -0.586 -14.811 1.00 1.09 H new ATOM 0 HB2 GLN A 109 1.325 -0.184 -17.792 1.00 1.27 H new ATOM 0 HB3 GLN A 109 -0.131 -0.519 -16.877 1.00 1.27 H new ATOM 0 HG2 GLN A 109 0.293 1.945 -17.280 1.00 1.49 H new ATOM 0 HG3 GLN A 109 0.082 1.524 -15.592 1.00 1.49 H new ATOM 0 HE21 GLN A 109 1.456 2.698 -14.301 1.00 2.11 H new ATOM 0 HE22 GLN A 109 3.170 2.947 -14.648 1.00 2.11 H new ATOM 1753 N SER A 110 2.145 -3.045 -16.868 1.00 1.30 N ATOM 1754 CA SER A 110 2.062 -4.486 -17.065 1.00 1.57 C ATOM 1755 C SER A 110 2.571 -5.238 -15.830 1.00 1.41 C ATOM 1756 O SER A 110 1.925 -6.156 -15.327 1.00 1.59 O ATOM 1757 CB SER A 110 2.851 -4.866 -18.321 1.00 2.00 C ATOM 1758 OG SER A 110 2.526 -3.979 -19.380 1.00 2.26 O ATOM 0 H SER A 110 2.737 -2.574 -17.552 1.00 1.30 H new ATOM 0 HA SER A 110 1.020 -4.775 -17.204 1.00 1.57 H new ATOM 0 HB2 SER A 110 3.921 -4.825 -18.116 1.00 2.00 H new ATOM 0 HB3 SER A 110 2.621 -5.892 -18.610 1.00 2.00 H new ATOM 0 HG SER A 110 3.035 -4.225 -20.181 1.00 2.26 H new ATOM 1764 N GLU A 111 3.745 -4.837 -15.353 1.00 1.22 N ATOM 1765 CA GLU A 111 4.430 -5.404 -14.214 1.00 1.04 C ATOM 1766 C GLU A 111 3.563 -5.270 -12.959 1.00 0.88 C ATOM 1767 O GLU A 111 3.233 -6.257 -12.301 1.00 1.02 O ATOM 1768 CB GLU A 111 5.780 -4.678 -14.062 1.00 1.06 C ATOM 1769 CG GLU A 111 6.689 -4.841 -15.293 1.00 2.25 C ATOM 1770 CD GLU A 111 6.578 -3.678 -16.275 1.00 4.11 C ATOM 1771 OE1 GLU A 111 5.471 -3.481 -16.822 1.00 5.45 O ATOM 1772 OE2 GLU A 111 7.597 -2.980 -16.456 1.00 4.79 O ATOM 0 H GLU A 111 4.264 -4.068 -15.777 1.00 1.22 H new ATOM 0 HA GLU A 111 4.613 -6.469 -14.360 1.00 1.04 H new ATOM 0 HB2 GLU A 111 5.599 -3.617 -13.888 1.00 1.06 H new ATOM 0 HB3 GLU A 111 6.296 -5.062 -13.182 1.00 1.06 H new ATOM 0 HG2 GLU A 111 7.724 -4.934 -14.964 1.00 2.25 H new ATOM 0 HG3 GLU A 111 6.434 -5.768 -15.806 1.00 2.25 H new ATOM 1779 N ILE A 112 3.205 -4.034 -12.617 1.00 0.78 N ATOM 1780 CA ILE A 112 2.493 -3.740 -11.387 1.00 0.79 C ATOM 1781 C ILE A 112 1.052 -4.257 -11.456 1.00 0.86 C ATOM 1782 O ILE A 112 0.537 -4.724 -10.444 1.00 0.93 O ATOM 1783 CB ILE A 112 2.650 -2.246 -11.030 1.00 0.85 C ATOM 1784 CG1 ILE A 112 2.465 -1.911 -9.539 1.00 1.14 C ATOM 1785 CG2 ILE A 112 1.814 -1.330 -11.924 1.00 0.97 C ATOM 1786 CD1 ILE A 112 1.019 -1.724 -9.076 1.00 1.96 C ATOM 0 H ILE A 112 3.403 -3.212 -13.188 1.00 0.78 H new ATOM 0 HA ILE A 112 2.934 -4.281 -10.550 1.00 0.79 H new ATOM 0 HB ILE A 112 3.700 -2.040 -11.238 1.00 0.85 H new ATOM 0 HG12 ILE A 112 2.916 -2.708 -8.948 1.00 1.14 H new ATOM 0 HG13 ILE A 112 3.019 -0.998 -9.319 1.00 1.14 H new ATOM 0 HG21 ILE A 112 1.966 -0.293 -11.625 1.00 0.97 H new ATOM 0 HG22 ILE A 112 2.120 -1.457 -12.962 1.00 0.97 H new ATOM 0 HG23 ILE A 112 0.759 -1.586 -11.823 1.00 0.97 H new ATOM 0 HD11 ILE A 112 1.005 -1.492 -8.011 1.00 1.96 H new ATOM 0 HD12 ILE A 112 0.562 -0.905 -9.632 1.00 1.96 H new ATOM 0 HD13 ILE A 112 0.458 -2.641 -9.255 1.00 1.96 H new ATOM 1798 N GLU A 113 0.378 -4.199 -12.613 1.00 0.95 N ATOM 1799 CA GLU A 113 -1.031 -4.513 -12.677 1.00 1.13 C ATOM 1800 C GLU A 113 -1.325 -5.961 -12.306 1.00 0.95 C ATOM 1801 O GLU A 113 -2.171 -6.168 -11.443 1.00 0.93 O ATOM 1802 CB GLU A 113 -1.674 -4.071 -13.996 1.00 1.68 C ATOM 1803 CG GLU A 113 -1.359 -4.902 -15.241 1.00 1.64 C ATOM 1804 CD GLU A 113 -1.933 -4.240 -16.482 1.00 1.93 C ATOM 1805 OE1 GLU A 113 -2.939 -3.505 -16.384 1.00 2.90 O ATOM 1806 OE2 GLU A 113 -1.352 -4.346 -17.579 1.00 2.57 O ATOM 0 H GLU A 113 0.795 -3.937 -13.506 1.00 0.95 H new ATOM 0 HA GLU A 113 -1.518 -3.915 -11.907 1.00 1.13 H new ATOM 0 HB2 GLU A 113 -2.755 -4.065 -13.859 1.00 1.68 H new ATOM 0 HB3 GLU A 113 -1.371 -3.042 -14.191 1.00 1.68 H new ATOM 0 HG2 GLU A 113 -0.280 -5.014 -15.347 1.00 1.64 H new ATOM 0 HG3 GLU A 113 -1.774 -5.904 -15.131 1.00 1.64 H new ATOM 1813 N GLU A 114 -0.655 -6.963 -12.896 1.00 0.93 N ATOM 1814 CA GLU A 114 -0.968 -8.346 -12.542 1.00 0.91 C ATOM 1815 C GLU A 114 -0.839 -8.515 -11.027 1.00 0.79 C ATOM 1816 O GLU A 114 -1.790 -8.929 -10.359 1.00 0.80 O ATOM 1817 CB GLU A 114 -0.147 -9.372 -13.327 1.00 1.03 C ATOM 1818 CG GLU A 114 -0.674 -10.779 -12.989 1.00 1.25 C ATOM 1819 CD GLU A 114 0.099 -11.933 -13.611 1.00 1.28 C ATOM 1820 OE1 GLU A 114 0.836 -11.687 -14.586 1.00 1.73 O ATOM 1821 OE2 GLU A 114 -0.086 -13.057 -13.088 1.00 2.10 O ATOM 0 H GLU A 114 0.079 -6.845 -13.594 1.00 0.93 H new ATOM 0 HA GLU A 114 -1.999 -8.550 -12.832 1.00 0.91 H new ATOM 0 HB2 GLU A 114 -0.229 -9.184 -14.398 1.00 1.03 H new ATOM 0 HB3 GLU A 114 0.909 -9.290 -13.069 1.00 1.03 H new ATOM 0 HG2 GLU A 114 -0.666 -10.901 -11.906 1.00 1.25 H new ATOM 0 HG3 GLU A 114 -1.714 -10.846 -13.310 1.00 1.25 H new ATOM 1828 N PHE A 115 0.324 -8.118 -10.499 1.00 0.73 N ATOM 1829 CA PHE A 115 0.595 -8.059 -9.073 1.00 0.63 C ATOM 1830 C PHE A 115 -0.597 -7.461 -8.316 1.00 0.62 C ATOM 1831 O PHE A 115 -1.213 -8.139 -7.499 1.00 0.66 O ATOM 1832 CB PHE A 115 1.894 -7.271 -8.825 1.00 0.61 C ATOM 1833 CG PHE A 115 2.020 -6.689 -7.429 1.00 0.61 C ATOM 1834 CD1 PHE A 115 2.027 -7.544 -6.312 1.00 1.73 C ATOM 1835 CD2 PHE A 115 1.924 -5.296 -7.240 1.00 2.11 C ATOM 1836 CE1 PHE A 115 1.933 -7.008 -5.016 1.00 1.66 C ATOM 1837 CE2 PHE A 115 1.851 -4.761 -5.944 1.00 2.26 C ATOM 1838 CZ PHE A 115 1.856 -5.618 -4.830 1.00 0.90 C ATOM 0 H PHE A 115 1.116 -7.824 -11.071 1.00 0.73 H new ATOM 0 HA PHE A 115 0.736 -9.070 -8.689 1.00 0.63 H new ATOM 0 HB2 PHE A 115 2.744 -7.929 -9.009 1.00 0.61 H new ATOM 0 HB3 PHE A 115 1.956 -6.460 -9.550 1.00 0.61 H new ATOM 0 HD1 PHE A 115 2.105 -8.612 -6.450 1.00 1.73 H new ATOM 0 HD2 PHE A 115 1.907 -4.637 -8.096 1.00 2.11 H new ATOM 0 HE1 PHE A 115 1.920 -7.667 -4.161 1.00 1.66 H new ATOM 0 HE2 PHE A 115 1.791 -3.692 -5.803 1.00 2.26 H new ATOM 0 HZ PHE A 115 1.801 -5.208 -3.832 1.00 0.90 H new ATOM 1848 N ALA A 116 -0.928 -6.194 -8.563 1.00 0.67 N ATOM 1849 CA ALA A 116 -1.906 -5.472 -7.766 1.00 0.82 C ATOM 1850 C ALA A 116 -3.339 -5.967 -7.986 1.00 0.87 C ATOM 1851 O ALA A 116 -4.179 -5.810 -7.097 1.00 0.92 O ATOM 1852 CB ALA A 116 -1.774 -3.974 -8.020 1.00 1.09 C ATOM 0 H ALA A 116 -0.524 -5.644 -9.321 1.00 0.67 H new ATOM 0 HA ALA A 116 -1.691 -5.671 -6.716 1.00 0.82 H new ATOM 0 HB1 ALA A 116 -2.509 -3.437 -7.420 1.00 1.09 H new ATOM 0 HB2 ALA A 116 -0.772 -3.645 -7.745 1.00 1.09 H new ATOM 0 HB3 ALA A 116 -1.947 -3.767 -9.076 1.00 1.09 H new ATOM 1858 N LEU A 117 -3.636 -6.558 -9.148 1.00 0.92 N ATOM 1859 CA LEU A 117 -4.902 -7.226 -9.407 1.00 1.06 C ATOM 1860 C LEU A 117 -5.000 -8.413 -8.465 1.00 1.03 C ATOM 1861 O LEU A 117 -5.853 -8.455 -7.584 1.00 1.19 O ATOM 1862 CB LEU A 117 -4.987 -7.687 -10.869 1.00 1.16 C ATOM 1863 CG LEU A 117 -6.401 -7.848 -11.449 1.00 1.50 C ATOM 1864 CD1 LEU A 117 -7.264 -8.780 -10.594 1.00 1.83 C ATOM 1865 CD2 LEU A 117 -7.113 -6.507 -11.663 1.00 1.84 C ATOM 0 H LEU A 117 -2.993 -6.583 -9.939 1.00 0.92 H new ATOM 0 HA LEU A 117 -5.731 -6.538 -9.237 1.00 1.06 H new ATOM 0 HB2 LEU A 117 -4.443 -6.972 -11.486 1.00 1.16 H new ATOM 0 HB3 LEU A 117 -4.470 -8.642 -10.958 1.00 1.16 H new ATOM 0 HG LEU A 117 -6.268 -8.305 -12.430 1.00 1.50 H new ATOM 0 HD11 LEU A 117 -8.256 -8.867 -11.038 1.00 1.83 H new ATOM 0 HD12 LEU A 117 -6.800 -9.765 -10.547 1.00 1.83 H new ATOM 0 HD13 LEU A 117 -7.352 -8.372 -9.587 1.00 1.83 H new ATOM 0 HD21 LEU A 117 -8.107 -6.684 -12.074 1.00 1.84 H new ATOM 0 HD22 LEU A 117 -7.202 -5.986 -10.710 1.00 1.84 H new ATOM 0 HD23 LEU A 117 -6.537 -5.896 -12.358 1.00 1.84 H new ATOM 1877 N LYS A 118 -4.097 -9.370 -8.673 1.00 0.91 N ATOM 1878 CA LYS A 118 -4.098 -10.627 -7.956 1.00 0.94 C ATOM 1879 C LYS A 118 -3.977 -10.396 -6.448 1.00 0.99 C ATOM 1880 O LYS A 118 -4.618 -11.094 -5.669 1.00 1.27 O ATOM 1881 CB LYS A 118 -2.999 -11.528 -8.513 1.00 1.07 C ATOM 1882 CG LYS A 118 -3.277 -11.886 -9.983 1.00 1.58 C ATOM 1883 CD LYS A 118 -2.628 -13.212 -10.388 1.00 1.95 C ATOM 1884 CE LYS A 118 -1.149 -13.223 -9.989 1.00 2.67 C ATOM 1885 NZ LYS A 118 -0.341 -14.210 -10.728 1.00 3.20 N ATOM 0 H LYS A 118 -3.341 -9.286 -9.352 1.00 0.91 H new ATOM 0 HA LYS A 118 -5.049 -11.138 -8.105 1.00 0.94 H new ATOM 0 HB2 LYS A 118 -2.035 -11.025 -8.433 1.00 1.07 H new ATOM 0 HB3 LYS A 118 -2.934 -12.439 -7.918 1.00 1.07 H new ATOM 0 HG2 LYS A 118 -4.353 -11.947 -10.143 1.00 1.58 H new ATOM 0 HG3 LYS A 118 -2.903 -11.089 -10.626 1.00 1.58 H new ATOM 0 HD2 LYS A 118 -3.148 -14.041 -9.907 1.00 1.95 H new ATOM 0 HD3 LYS A 118 -2.723 -13.357 -11.464 1.00 1.95 H new ATOM 0 HE2 LYS A 118 -0.731 -12.230 -10.152 1.00 2.67 H new ATOM 0 HE3 LYS A 118 -1.072 -13.430 -8.922 1.00 2.67 H new ATOM 0 HZ1 LYS A 118 0.414 -14.572 -10.111 1.00 3.20 H new ATOM 0 HZ2 LYS A 118 -0.948 -14.998 -11.031 1.00 3.20 H new ATOM 0 HZ3 LYS A 118 0.082 -13.757 -11.563 1.00 3.20 H new ATOM 1899 N SER A 119 -3.186 -9.400 -6.039 1.00 0.84 N ATOM 1900 CA SER A 119 -3.079 -9.024 -4.644 1.00 0.92 C ATOM 1901 C SER A 119 -4.386 -8.420 -4.135 1.00 1.06 C ATOM 1902 O SER A 119 -4.937 -8.942 -3.172 1.00 1.25 O ATOM 1903 CB SER A 119 -1.888 -8.092 -4.408 1.00 0.89 C ATOM 1904 OG SER A 119 -0.703 -8.686 -4.896 1.00 1.59 O ATOM 0 H SER A 119 -2.609 -8.841 -6.668 1.00 0.84 H new ATOM 0 HA SER A 119 -2.895 -9.930 -4.066 1.00 0.92 H new ATOM 0 HB2 SER A 119 -2.058 -7.138 -4.907 1.00 0.89 H new ATOM 0 HB3 SER A 119 -1.787 -7.881 -3.343 1.00 0.89 H new ATOM 0 HG SER A 119 -0.673 -8.603 -5.872 1.00 1.59 H new ATOM 1910 N PHE A 120 -4.855 -7.309 -4.725 1.00 1.07 N ATOM 1911 CA PHE A 120 -5.936 -6.510 -4.145 1.00 1.32 C ATOM 1912 C PHE A 120 -7.114 -6.293 -5.092 1.00 1.40 C ATOM 1913 O PHE A 120 -8.236 -6.589 -4.708 1.00 1.69 O ATOM 1914 CB PHE A 120 -5.404 -5.166 -3.621 1.00 1.44 C ATOM 1915 CG PHE A 120 -4.300 -5.218 -2.575 1.00 1.42 C ATOM 1916 CD1 PHE A 120 -4.202 -6.288 -1.662 1.00 2.39 C ATOM 1917 CD2 PHE A 120 -3.439 -4.115 -2.426 1.00 1.64 C ATOM 1918 CE1 PHE A 120 -3.146 -6.336 -0.737 1.00 2.35 C ATOM 1919 CE2 PHE A 120 -2.445 -4.121 -1.432 1.00 1.69 C ATOM 1920 CZ PHE A 120 -2.262 -5.254 -0.625 1.00 1.41 C ATOM 0 H PHE A 120 -4.497 -6.946 -5.608 1.00 1.07 H new ATOM 0 HA PHE A 120 -6.323 -7.092 -3.309 1.00 1.32 H new ATOM 0 HB2 PHE A 120 -5.037 -4.592 -4.472 1.00 1.44 H new ATOM 0 HB3 PHE A 120 -6.243 -4.611 -3.201 1.00 1.44 H new ATOM 0 HD1 PHE A 120 -4.942 -7.074 -1.674 1.00 2.39 H new ATOM 0 HD2 PHE A 120 -3.542 -3.260 -3.078 1.00 1.64 H new ATOM 0 HE1 PHE A 120 -3.015 -7.207 -0.112 1.00 2.35 H new ATOM 0 HE2 PHE A 120 -1.821 -3.251 -1.289 1.00 1.69 H new ATOM 0 HZ PHE A 120 -1.444 -5.292 0.079 1.00 1.41 H new ATOM 1930 N LYS A 121 -6.896 -5.810 -6.316 1.00 1.34 N ATOM 1931 CA LYS A 121 -7.683 -4.789 -7.023 1.00 1.70 C ATOM 1932 C LYS A 121 -7.097 -3.380 -6.859 1.00 1.91 C ATOM 1933 O LYS A 121 -7.766 -2.445 -6.429 1.00 2.56 O ATOM 1934 CB LYS A 121 -9.217 -4.866 -6.782 1.00 2.09 C ATOM 1935 CG LYS A 121 -9.916 -3.947 -5.747 1.00 2.37 C ATOM 1936 CD LYS A 121 -9.280 -3.832 -4.351 1.00 2.63 C ATOM 1937 CE LYS A 121 -10.040 -2.872 -3.416 1.00 2.93 C ATOM 1938 NZ LYS A 121 -9.436 -1.522 -3.285 1.00 3.39 N ATOM 0 H LYS A 121 -6.114 -6.141 -6.880 1.00 1.34 H new ATOM 0 HA LYS A 121 -7.584 -5.037 -8.080 1.00 1.70 H new ATOM 0 HB2 LYS A 121 -9.699 -4.687 -7.743 1.00 2.09 H new ATOM 0 HB3 LYS A 121 -9.443 -5.894 -6.498 1.00 2.09 H new ATOM 0 HG2 LYS A 121 -9.974 -2.945 -6.173 1.00 2.37 H new ATOM 0 HG3 LYS A 121 -10.940 -4.300 -5.622 1.00 2.37 H new ATOM 0 HD2 LYS A 121 -9.242 -4.821 -3.893 1.00 2.63 H new ATOM 0 HD3 LYS A 121 -8.251 -3.489 -4.455 1.00 2.63 H new ATOM 0 HE2 LYS A 121 -11.061 -2.764 -3.782 1.00 2.93 H new ATOM 0 HE3 LYS A 121 -10.102 -3.324 -2.426 1.00 2.93 H new ATOM 0 HZ1 LYS A 121 -10.120 -0.877 -2.841 1.00 3.39 H new ATOM 0 HZ2 LYS A 121 -8.581 -1.580 -2.695 1.00 3.39 H new ATOM 0 HZ3 LYS A 121 -9.183 -1.162 -4.227 1.00 3.39 H new ATOM 1952 N ALA A 122 -5.835 -3.193 -7.262 1.00 1.50 N ATOM 1953 CA ALA A 122 -5.230 -1.866 -7.172 1.00 1.76 C ATOM 1954 C ALA A 122 -4.253 -1.548 -8.305 1.00 1.72 C ATOM 1955 O ALA A 122 -3.223 -0.918 -8.067 1.00 2.67 O ATOM 1956 CB ALA A 122 -4.598 -1.711 -5.784 1.00 1.95 C ATOM 0 H ALA A 122 -5.231 -3.921 -7.642 1.00 1.50 H new ATOM 0 HA ALA A 122 -6.019 -1.124 -7.300 1.00 1.76 H new ATOM 0 HB1 ALA A 122 -4.141 -0.725 -5.700 1.00 1.95 H new ATOM 0 HB2 ALA A 122 -5.367 -1.821 -5.020 1.00 1.95 H new ATOM 0 HB3 ALA A 122 -3.835 -2.477 -5.644 1.00 1.95 H new ATOM 1962 N ILE A 123 -4.588 -1.929 -9.540 1.00 1.70 N ATOM 1963 CA ILE A 123 -3.744 -1.645 -10.700 1.00 1.65 C ATOM 1964 C ILE A 123 -3.711 -0.158 -11.049 1.00 1.29 C ATOM 1965 O ILE A 123 -4.444 0.648 -10.476 1.00 2.13 O ATOM 1966 CB ILE A 123 -4.151 -2.476 -11.920 1.00 2.62 C ATOM 1967 CG1 ILE A 123 -5.423 -1.927 -12.584 1.00 3.92 C ATOM 1968 CG2 ILE A 123 -4.354 -3.936 -11.483 1.00 3.99 C ATOM 1969 CD1 ILE A 123 -5.737 -2.742 -13.831 1.00 5.11 C ATOM 0 H ILE A 123 -5.444 -2.438 -9.762 1.00 1.70 H new ATOM 0 HA ILE A 123 -2.733 -1.936 -10.414 1.00 1.65 H new ATOM 0 HB ILE A 123 -3.356 -2.419 -12.663 1.00 2.62 H new ATOM 0 HG12 ILE A 123 -6.259 -1.973 -11.886 1.00 3.92 H new ATOM 0 HG13 ILE A 123 -5.285 -0.878 -12.847 1.00 3.92 H new ATOM 0 HG21 ILE A 123 -4.644 -4.537 -12.345 1.00 3.99 H new ATOM 0 HG22 ILE A 123 -3.424 -4.324 -11.067 1.00 3.99 H new ATOM 0 HG23 ILE A 123 -5.138 -3.984 -10.727 1.00 3.99 H new ATOM 0 HD11 ILE A 123 -6.639 -2.353 -14.302 1.00 5.11 H new ATOM 0 HD12 ILE A 123 -4.904 -2.673 -14.530 1.00 5.11 H new ATOM 0 HD13 ILE A 123 -5.893 -3.785 -13.554 1.00 5.11 H new ATOM 1981 N VAL A 124 -2.891 0.179 -12.047 1.00 1.28 N ATOM 1982 CA VAL A 124 -2.750 1.502 -12.603 1.00 2.00 C ATOM 1983 C VAL A 124 -2.517 1.353 -14.106 1.00 1.84 C ATOM 1984 O VAL A 124 -2.076 0.298 -14.566 1.00 2.91 O ATOM 1985 CB VAL A 124 -1.596 2.217 -11.891 1.00 3.74 C ATOM 1986 CG1 VAL A 124 -2.058 2.636 -10.493 1.00 5.02 C ATOM 1987 CG2 VAL A 124 -0.342 1.333 -11.775 1.00 4.42 C ATOM 0 H VAL A 124 -2.285 -0.504 -12.502 1.00 1.28 H new ATOM 0 HA VAL A 124 -3.643 2.109 -12.455 1.00 2.00 H new ATOM 0 HB VAL A 124 -1.324 3.089 -12.486 1.00 3.74 H new ATOM 0 HG11 VAL A 124 -1.244 3.146 -9.978 1.00 5.02 H new ATOM 0 HG12 VAL A 124 -2.911 3.309 -10.578 1.00 5.02 H new ATOM 0 HG13 VAL A 124 -2.349 1.752 -9.926 1.00 5.02 H new ATOM 0 HG21 VAL A 124 0.446 1.885 -11.263 1.00 4.42 H new ATOM 0 HG22 VAL A 124 -0.582 0.434 -11.208 1.00 4.42 H new ATOM 0 HG23 VAL A 124 -0.001 1.053 -12.772 1.00 4.42 H new ATOM 1997 N LYS A 125 -2.865 2.392 -14.868 1.00 1.70 N ATOM 1998 CA LYS A 125 -2.805 2.421 -16.324 1.00 2.32 C ATOM 1999 C LYS A 125 -2.744 3.888 -16.750 1.00 3.00 C ATOM 2000 O LYS A 125 -1.851 4.299 -17.491 1.00 4.18 O ATOM 2001 CB LYS A 125 -4.024 1.689 -16.914 1.00 2.94 C ATOM 2002 CG LYS A 125 -3.884 1.386 -18.416 1.00 3.96 C ATOM 2003 CD LYS A 125 -2.802 0.350 -18.770 1.00 4.67 C ATOM 2004 CE LYS A 125 -3.013 -0.975 -18.018 1.00 6.17 C ATOM 2005 NZ LYS A 125 -2.191 -2.078 -18.549 1.00 6.97 N ATOM 0 H LYS A 125 -3.208 3.266 -14.470 1.00 1.70 H new ATOM 0 HA LYS A 125 -1.922 1.904 -16.699 1.00 2.32 H new ATOM 0 HB2 LYS A 125 -4.174 0.754 -16.374 1.00 2.94 H new ATOM 0 HB3 LYS A 125 -4.916 2.295 -16.754 1.00 2.94 H new ATOM 0 HG2 LYS A 125 -4.844 1.030 -18.791 1.00 3.96 H new ATOM 0 HG3 LYS A 125 -3.662 2.316 -18.940 1.00 3.96 H new ATOM 0 HD2 LYS A 125 -2.814 0.164 -19.844 1.00 4.67 H new ATOM 0 HD3 LYS A 125 -1.819 0.753 -18.527 1.00 4.67 H new ATOM 0 HE2 LYS A 125 -2.778 -0.829 -16.964 1.00 6.17 H new ATOM 0 HE3 LYS A 125 -4.065 -1.254 -18.074 1.00 6.17 H new ATOM 0 HZ1 LYS A 125 -2.550 -2.984 -18.186 1.00 6.97 H new ATOM 0 HZ2 LYS A 125 -2.239 -2.077 -19.588 1.00 6.97 H new ATOM 0 HZ3 LYS A 125 -1.204 -1.951 -18.248 1.00 6.97 H new ATOM 2019 N LYS A 126 -3.715 4.649 -16.235 1.00 3.11 N ATOM 2020 CA LYS A 126 -3.749 6.093 -16.068 1.00 4.45 C ATOM 2021 C LYS A 126 -4.964 6.355 -15.177 1.00 4.09 C ATOM 2022 O LYS A 126 -5.958 5.638 -15.321 1.00 3.61 O ATOM 2023 CB LYS A 126 -3.889 6.815 -17.418 1.00 5.79 C ATOM 2024 CG LYS A 126 -2.531 7.365 -17.866 1.00 7.34 C ATOM 2025 CD LYS A 126 -2.469 7.491 -19.396 1.00 8.26 C ATOM 2026 CE LYS A 126 -1.036 7.722 -19.889 1.00 9.72 C ATOM 2027 NZ LYS A 126 -0.122 6.681 -19.381 1.00 10.48 N ATOM 0 H LYS A 126 -4.576 4.222 -15.894 1.00 3.11 H new ATOM 0 HA LYS A 126 -2.826 6.470 -15.628 1.00 4.45 H new ATOM 0 HB2 LYS A 126 -4.276 6.126 -18.169 1.00 5.79 H new ATOM 0 HB3 LYS A 126 -4.609 7.629 -17.331 1.00 5.79 H new ATOM 0 HG2 LYS A 126 -2.360 8.340 -17.409 1.00 7.34 H new ATOM 0 HG3 LYS A 126 -1.735 6.707 -17.519 1.00 7.34 H new ATOM 0 HD2 LYS A 126 -2.869 6.585 -19.852 1.00 8.26 H new ATOM 0 HD3 LYS A 126 -3.102 8.317 -19.719 1.00 8.26 H new ATOM 0 HE2 LYS A 126 -1.020 7.724 -20.979 1.00 9.72 H new ATOM 0 HE3 LYS A 126 -0.690 8.703 -19.564 1.00 9.72 H new ATOM 0 HZ1 LYS A 126 0.747 6.673 -19.952 1.00 10.48 H new ATOM 0 HZ2 LYS A 126 0.118 6.883 -18.389 1.00 10.48 H new ATOM 0 HZ3 LYS A 126 -0.585 5.752 -19.443 1.00 10.48 H new ATOM 2041 N PRO A 127 -4.896 7.299 -14.232 1.00 4.90 N ATOM 2042 CA PRO A 127 -6.036 7.655 -13.407 1.00 4.90 C ATOM 2043 C PRO A 127 -6.972 8.575 -14.202 1.00 5.21 C ATOM 2044 O PRO A 127 -6.559 9.170 -15.199 1.00 6.07 O ATOM 2045 CB PRO A 127 -5.417 8.355 -12.198 1.00 6.26 C ATOM 2046 CG PRO A 127 -4.220 9.081 -12.814 1.00 7.25 C ATOM 2047 CD PRO A 127 -3.731 8.094 -13.875 1.00 6.34 C ATOM 0 HA PRO A 127 -6.644 6.805 -13.098 1.00 4.90 H new ATOM 0 HB2 PRO A 127 -6.115 9.049 -11.729 1.00 6.26 H new ATOM 0 HB3 PRO A 127 -5.110 7.644 -11.431 1.00 6.26 H new ATOM 0 HG2 PRO A 127 -4.509 10.036 -13.253 1.00 7.25 H new ATOM 0 HG3 PRO A 127 -3.450 9.291 -12.072 1.00 7.25 H new ATOM 0 HD2 PRO A 127 -3.332 8.617 -14.744 1.00 6.34 H new ATOM 0 HD3 PRO A 127 -2.930 7.465 -13.486 1.00 6.34 H new ATOM 2055 N GLU A 128 -8.234 8.667 -13.770 1.00 5.18 N ATOM 2056 CA GLU A 128 -9.215 9.609 -14.297 1.00 6.08 C ATOM 2057 C GLU A 128 -10.302 9.793 -13.228 1.00 6.06 C ATOM 2058 O GLU A 128 -11.454 9.401 -13.404 1.00 6.18 O ATOM 2059 CB GLU A 128 -9.755 9.126 -15.657 1.00 6.68 C ATOM 2060 CG GLU A 128 -10.488 10.240 -16.420 1.00 8.08 C ATOM 2061 CD GLU A 128 -10.941 9.772 -17.799 1.00 8.92 C ATOM 2062 OE1 GLU A 128 -10.045 9.520 -18.634 1.00 9.32 O ATOM 2063 OE2 GLU A 128 -12.171 9.674 -17.995 1.00 9.57 O ATOM 0 H GLU A 128 -8.606 8.074 -13.028 1.00 5.18 H new ATOM 0 HA GLU A 128 -8.768 10.582 -14.500 1.00 6.08 H new ATOM 0 HB2 GLU A 128 -8.928 8.756 -16.263 1.00 6.68 H new ATOM 0 HB3 GLU A 128 -10.434 8.288 -15.499 1.00 6.68 H new ATOM 0 HG2 GLU A 128 -11.353 10.568 -15.844 1.00 8.08 H new ATOM 0 HG3 GLU A 128 -9.830 11.103 -16.526 1.00 8.08 H new ATOM 2070 N GLY A 129 -9.909 10.344 -12.081 1.00 6.34 N ATOM 2071 CA GLY A 129 -10.768 10.559 -10.929 1.00 6.72 C ATOM 2072 C GLY A 129 -9.901 10.911 -9.726 1.00 6.88 C ATOM 2073 O GLY A 129 -9.878 10.168 -8.739 1.00 6.50 O ATOM 0 H GLY A 129 -8.952 10.662 -11.928 1.00 6.34 H new ATOM 0 HA2 GLY A 129 -11.476 11.363 -11.131 1.00 6.72 H new ATOM 0 HA3 GLY A 129 -11.353 9.663 -10.723 1.00 6.72 H new ATOM 2077 N GLU A 130 -9.167 12.026 -9.845 1.00 7.89 N ATOM 2078 CA GLU A 130 -8.047 12.419 -8.996 1.00 8.64 C ATOM 2079 C GLU A 130 -8.493 12.814 -7.585 1.00 8.76 C ATOM 2080 O GLU A 130 -8.420 13.974 -7.183 1.00 10.15 O ATOM 2081 CB GLU A 130 -7.248 13.546 -9.670 1.00 10.51 C ATOM 2082 CG GLU A 130 -6.974 13.328 -11.167 1.00 10.85 C ATOM 2083 CD GLU A 130 -6.503 11.916 -11.475 1.00 10.94 C ATOM 2084 OE1 GLU A 130 -5.332 11.619 -11.160 1.00 11.87 O ATOM 2085 OE2 GLU A 130 -7.347 11.150 -11.990 1.00 10.48 O ATOM 0 H GLU A 130 -9.353 12.711 -10.577 1.00 7.89 H new ATOM 0 HA GLU A 130 -7.399 11.551 -8.877 1.00 8.64 H new ATOM 0 HB2 GLU A 130 -7.791 14.483 -9.546 1.00 10.51 H new ATOM 0 HB3 GLU A 130 -6.296 13.658 -9.152 1.00 10.51 H new ATOM 0 HG2 GLU A 130 -7.882 13.536 -11.733 1.00 10.85 H new ATOM 0 HG3 GLU A 130 -6.220 14.040 -11.502 1.00 10.85 H new ATOM 2092 N ASP A 131 -8.949 11.810 -6.848 1.00 7.53 N ATOM 2093 CA ASP A 131 -9.507 11.878 -5.511 1.00 7.66 C ATOM 2094 C ASP A 131 -9.424 10.467 -4.935 1.00 5.85 C ATOM 2095 O ASP A 131 -8.677 10.212 -3.992 1.00 5.73 O ATOM 2096 CB ASP A 131 -10.960 12.372 -5.589 1.00 8.79 C ATOM 2097 CG ASP A 131 -11.700 12.113 -4.284 1.00 9.33 C ATOM 2098 OD1 ASP A 131 -11.355 12.786 -3.292 1.00 10.33 O ATOM 2099 OD2 ASP A 131 -12.583 11.230 -4.308 1.00 9.08 O ATOM 0 H ASP A 131 -8.936 10.853 -7.201 1.00 7.53 H new ATOM 0 HA ASP A 131 -8.964 12.575 -4.873 1.00 7.66 H new ATOM 0 HB2 ASP A 131 -10.973 13.439 -5.812 1.00 8.79 H new ATOM 0 HB3 ASP A 131 -11.474 11.869 -6.408 1.00 8.79 H new ATOM 2104 N GLN A 132 -10.155 9.543 -5.565 1.00 4.87 N ATOM 2105 CA GLN A 132 -10.297 8.162 -5.118 1.00 3.57 C ATOM 2106 C GLN A 132 -10.081 7.154 -6.258 1.00 2.66 C ATOM 2107 O GLN A 132 -9.849 5.973 -5.989 1.00 3.21 O ATOM 2108 CB GLN A 132 -11.672 8.019 -4.446 1.00 5.21 C ATOM 2109 CG GLN A 132 -11.886 6.698 -3.698 1.00 4.92 C ATOM 2110 CD GLN A 132 -10.855 6.502 -2.586 1.00 5.03 C ATOM 2111 OE1 GLN A 132 -9.838 5.839 -2.773 1.00 4.98 O ATOM 2112 NE2 GLN A 132 -11.106 7.076 -1.414 1.00 5.96 N ATOM 0 H GLN A 132 -10.675 9.743 -6.419 1.00 4.87 H new ATOM 0 HA GLN A 132 -9.518 7.927 -4.393 1.00 3.57 H new ATOM 0 HB2 GLN A 132 -11.806 8.843 -3.745 1.00 5.21 H new ATOM 0 HB3 GLN A 132 -12.445 8.119 -5.208 1.00 5.21 H new ATOM 0 HG2 GLN A 132 -12.889 6.680 -3.271 1.00 4.92 H new ATOM 0 HG3 GLN A 132 -11.824 5.868 -4.402 1.00 4.92 H new ATOM 0 HE21 GLN A 132 -11.958 7.621 -1.285 1.00 5.96 H new ATOM 0 HE22 GLN A 132 -10.446 6.971 -0.643 1.00 5.96 H new ATOM 2121 N VAL A 133 -10.146 7.606 -7.519 1.00 2.59 N ATOM 2122 CA VAL A 133 -10.001 6.799 -8.725 1.00 3.38 C ATOM 2123 C VAL A 133 -10.894 5.547 -8.677 1.00 4.36 C ATOM 2124 O VAL A 133 -12.068 5.626 -9.032 1.00 5.64 O ATOM 2125 CB VAL A 133 -8.510 6.530 -9.029 1.00 4.24 C ATOM 2126 CG1 VAL A 133 -8.332 5.808 -10.374 1.00 5.49 C ATOM 2127 CG2 VAL A 133 -7.717 7.843 -9.105 1.00 4.96 C ATOM 0 H VAL A 133 -10.309 8.591 -7.728 1.00 2.59 H new ATOM 0 HA VAL A 133 -10.370 7.362 -9.582 1.00 3.38 H new ATOM 0 HB VAL A 133 -8.139 5.906 -8.216 1.00 4.24 H new ATOM 0 HG11 VAL A 133 -7.271 5.635 -10.556 1.00 5.49 H new ATOM 0 HG12 VAL A 133 -8.856 4.853 -10.346 1.00 5.49 H new ATOM 0 HG13 VAL A 133 -8.742 6.424 -11.175 1.00 5.49 H new ATOM 0 HG21 VAL A 133 -6.671 7.624 -9.320 1.00 4.96 H new ATOM 0 HG22 VAL A 133 -8.127 8.470 -9.897 1.00 4.96 H new ATOM 0 HG23 VAL A 133 -7.790 8.368 -8.152 1.00 4.96 H new ATOM 2137 N ILE A 134 -10.351 4.400 -8.256 1.00 4.91 N ATOM 2138 CA ILE A 134 -11.040 3.112 -8.187 1.00 6.73 C ATOM 2139 C ILE A 134 -10.840 2.561 -6.766 1.00 7.07 C ATOM 2140 O ILE A 134 -10.478 1.406 -6.564 1.00 8.37 O ATOM 2141 CB ILE A 134 -10.538 2.199 -9.339 1.00 7.99 C ATOM 2142 CG1 ILE A 134 -10.996 2.762 -10.702 1.00 8.63 C ATOM 2143 CG2 ILE A 134 -11.040 0.746 -9.232 1.00 9.11 C ATOM 2144 CD1 ILE A 134 -10.151 2.254 -11.876 1.00 10.34 C ATOM 0 H ILE A 134 -9.382 4.344 -7.942 1.00 4.91 H new ATOM 0 HA ILE A 134 -12.116 3.188 -8.345 1.00 6.73 H new ATOM 0 HB ILE A 134 -9.451 2.188 -9.257 1.00 7.99 H new ATOM 0 HG12 ILE A 134 -12.039 2.491 -10.868 1.00 8.63 H new ATOM 0 HG13 ILE A 134 -10.950 3.851 -10.673 1.00 8.63 H new ATOM 0 HG21 ILE A 134 -10.652 0.164 -10.068 1.00 9.11 H new ATOM 0 HG22 ILE A 134 -10.694 0.310 -8.295 1.00 9.11 H new ATOM 0 HG23 ILE A 134 -12.130 0.735 -9.257 1.00 9.11 H new ATOM 0 HD11 ILE A 134 -10.523 2.685 -12.805 1.00 10.34 H new ATOM 0 HD12 ILE A 134 -9.111 2.548 -11.730 1.00 10.34 H new ATOM 0 HD13 ILE A 134 -10.217 1.167 -11.929 1.00 10.34 H new ATOM 2156 N HIS A 135 -11.051 3.416 -5.761 1.00 6.19 N ATOM 2157 CA HIS A 135 -10.848 3.076 -4.357 1.00 6.58 C ATOM 2158 C HIS A 135 -9.397 2.668 -4.132 1.00 5.76 C ATOM 2159 O HIS A 135 -9.088 1.522 -3.800 1.00 6.69 O ATOM 2160 CB HIS A 135 -11.909 2.099 -3.842 1.00 8.38 C ATOM 2161 CG HIS A 135 -13.252 2.775 -3.736 1.00 8.73 C ATOM 2162 ND1 HIS A 135 -14.183 2.890 -4.770 1.00 9.40 N ATOM 2163 CD2 HIS A 135 -13.703 3.459 -2.643 1.00 8.86 C ATOM 2164 CE1 HIS A 135 -15.186 3.623 -4.265 1.00 9.89 C ATOM 2165 NE2 HIS A 135 -14.930 3.973 -2.992 1.00 9.57 N ATOM 0 H HIS A 135 -11.371 4.374 -5.905 1.00 6.19 H new ATOM 0 HA HIS A 135 -11.005 3.955 -3.732 1.00 6.58 H new ATOM 0 HB2 HIS A 135 -11.979 1.244 -4.514 1.00 8.38 H new ATOM 0 HB3 HIS A 135 -11.612 1.714 -2.866 1.00 8.38 H new ATOM 0 HD2 HIS A 135 -13.198 3.573 -1.695 1.00 8.86 H new ATOM 0 HE1 HIS A 135 -16.079 3.896 -4.808 1.00 9.89 H new ATOM 0 HE2 HIS A 135 -15.541 4.525 -2.389 1.00 9.57 H new ATOM 2173 N GLN A 136 -8.522 3.658 -4.345 1.00 4.41 N ATOM 2174 CA GLN A 136 -7.077 3.547 -4.246 1.00 4.14 C ATOM 2175 C GLN A 136 -6.556 4.406 -3.090 1.00 2.96 C ATOM 2176 O GLN A 136 -5.602 5.163 -3.260 1.00 2.76 O ATOM 2177 CB GLN A 136 -6.438 3.958 -5.582 1.00 4.44 C ATOM 2178 CG GLN A 136 -6.819 3.043 -6.755 1.00 6.08 C ATOM 2179 CD GLN A 136 -6.035 1.738 -6.703 1.00 7.63 C ATOM 2180 OE1 GLN A 136 -6.343 0.863 -5.903 1.00 7.94 O ATOM 2181 NE2 GLN A 136 -5.009 1.597 -7.539 1.00 9.12 N ATOM 0 H GLN A 136 -8.824 4.598 -4.602 1.00 4.41 H new ATOM 0 HA GLN A 136 -6.804 2.513 -4.037 1.00 4.14 H new ATOM 0 HB2 GLN A 136 -6.736 4.980 -5.818 1.00 4.44 H new ATOM 0 HB3 GLN A 136 -5.354 3.959 -5.471 1.00 4.44 H new ATOM 0 HG2 GLN A 136 -7.888 2.831 -6.724 1.00 6.08 H new ATOM 0 HG3 GLN A 136 -6.622 3.553 -7.698 1.00 6.08 H new ATOM 0 HE21 GLN A 136 -4.778 2.344 -8.194 1.00 9.12 H new ATOM 0 HE22 GLN A 136 -4.454 0.742 -7.525 1.00 9.12 H new ATOM 2190 N SER A 137 -7.196 4.317 -1.922 1.00 2.97 N ATOM 2191 CA SER A 137 -6.722 4.953 -0.702 1.00 2.37 C ATOM 2192 C SER A 137 -7.342 4.244 0.507 1.00 2.24 C ATOM 2193 O SER A 137 -8.202 4.809 1.179 1.00 3.02 O ATOM 2194 CB SER A 137 -7.028 6.460 -0.740 1.00 3.16 C ATOM 2195 OG SER A 137 -6.289 7.148 0.254 1.00 2.80 O ATOM 0 H SER A 137 -8.064 3.796 -1.801 1.00 2.97 H new ATOM 0 HA SER A 137 -5.639 4.860 -0.616 1.00 2.37 H new ATOM 0 HB2 SER A 137 -6.784 6.861 -1.724 1.00 3.16 H new ATOM 0 HB3 SER A 137 -8.095 6.623 -0.585 1.00 3.16 H new ATOM 0 HG SER A 137 -6.497 8.105 0.212 1.00 2.80 H new ATOM 2201 N SER A 138 -6.912 3.005 0.769 1.00 1.54 N ATOM 2202 CA SER A 138 -7.323 2.228 1.932 1.00 1.28 C ATOM 2203 C SER A 138 -6.123 1.434 2.448 1.00 1.13 C ATOM 2204 O SER A 138 -5.203 1.143 1.685 1.00 1.34 O ATOM 2205 CB SER A 138 -8.493 1.294 1.583 1.00 1.41 C ATOM 2206 OG SER A 138 -9.644 2.038 1.222 1.00 1.83 O ATOM 0 H SER A 138 -6.257 2.510 0.164 1.00 1.54 H new ATOM 0 HA SER A 138 -7.671 2.904 2.714 1.00 1.28 H new ATOM 0 HB2 SER A 138 -8.207 0.638 0.761 1.00 1.41 H new ATOM 0 HB3 SER A 138 -8.721 0.655 2.436 1.00 1.41 H new ATOM 0 HG SER A 138 -10.439 1.625 1.620 1.00 1.83 H new ATOM 2212 N PHE A 139 -6.164 1.076 3.733 1.00 0.88 N ATOM 2213 CA PHE A 139 -5.175 0.234 4.386 1.00 0.77 C ATOM 2214 C PHE A 139 -5.440 -1.217 3.986 1.00 0.71 C ATOM 2215 O PHE A 139 -6.602 -1.615 3.915 1.00 0.76 O ATOM 2216 CB PHE A 139 -5.359 0.300 5.908 1.00 0.91 C ATOM 2217 CG PHE A 139 -4.625 1.434 6.581 1.00 0.96 C ATOM 2218 CD1 PHE A 139 -3.221 1.401 6.607 1.00 1.50 C ATOM 2219 CD2 PHE A 139 -5.317 2.479 7.219 1.00 2.36 C ATOM 2220 CE1 PHE A 139 -2.504 2.440 7.211 1.00 1.55 C ATOM 2221 CE2 PHE A 139 -4.596 3.525 7.822 1.00 2.67 C ATOM 2222 CZ PHE A 139 -3.190 3.521 7.783 1.00 1.63 C ATOM 0 H PHE A 139 -6.910 1.376 4.361 1.00 0.88 H new ATOM 0 HA PHE A 139 -4.178 0.569 4.098 1.00 0.77 H new ATOM 0 HB2 PHE A 139 -6.423 0.391 6.129 1.00 0.91 H new ATOM 0 HB3 PHE A 139 -5.023 -0.641 6.343 1.00 0.91 H new ATOM 0 HD1 PHE A 139 -2.693 0.572 6.160 1.00 1.50 H new ATOM 0 HD2 PHE A 139 -6.397 2.478 7.246 1.00 2.36 H new ATOM 0 HE1 PHE A 139 -1.425 2.409 7.237 1.00 1.55 H new ATOM 0 HE2 PHE A 139 -5.121 4.330 8.314 1.00 2.67 H new ATOM 0 HZ PHE A 139 -2.637 4.353 8.195 1.00 1.63 H new ATOM 2232 N TYR A 140 -4.380 -2.012 3.824 1.00 0.70 N ATOM 2233 CA TYR A 140 -4.440 -3.460 3.640 1.00 0.72 C ATOM 2234 C TYR A 140 -3.428 -4.109 4.605 1.00 0.74 C ATOM 2235 O TYR A 140 -2.225 -3.975 4.397 1.00 1.08 O ATOM 2236 CB TYR A 140 -4.134 -3.785 2.160 1.00 0.79 C ATOM 2237 CG TYR A 140 -5.305 -4.303 1.335 1.00 1.30 C ATOM 2238 CD1 TYR A 140 -5.622 -5.666 1.403 1.00 3.01 C ATOM 2239 CD2 TYR A 140 -6.010 -3.484 0.433 1.00 1.61 C ATOM 2240 CE1 TYR A 140 -6.696 -6.201 0.671 1.00 3.74 C ATOM 2241 CE2 TYR A 140 -7.003 -4.048 -0.391 1.00 1.93 C ATOM 2242 CZ TYR A 140 -7.438 -5.366 -0.174 1.00 2.77 C ATOM 2243 OH TYR A 140 -8.539 -5.837 -0.830 1.00 3.51 O ATOM 0 H TYR A 140 -3.426 -1.652 3.817 1.00 0.70 H new ATOM 0 HA TYR A 140 -5.429 -3.858 3.867 1.00 0.72 H new ATOM 0 HB2 TYR A 140 -3.749 -2.884 1.683 1.00 0.79 H new ATOM 0 HB3 TYR A 140 -3.337 -4.527 2.129 1.00 0.79 H new ATOM 0 HD1 TYR A 140 -5.030 -6.317 2.029 1.00 3.01 H new ATOM 0 HD2 TYR A 140 -5.790 -2.428 0.373 1.00 1.61 H new ATOM 0 HE1 TYR A 140 -6.947 -7.248 0.759 1.00 3.74 H new ATOM 0 HE2 TYR A 140 -7.432 -3.465 -1.193 1.00 1.93 H new ATOM 0 HH TYR A 140 -9.107 -6.331 -0.203 1.00 3.51 H new ATOM 2253 N LEU A 141 -3.863 -4.790 5.676 1.00 0.49 N ATOM 2254 CA LEU A 141 -2.948 -5.490 6.587 1.00 0.42 C ATOM 2255 C LEU A 141 -2.700 -6.892 6.054 1.00 0.37 C ATOM 2256 O LEU A 141 -3.596 -7.737 6.092 1.00 0.39 O ATOM 2257 CB LEU A 141 -3.494 -5.500 8.026 1.00 0.40 C ATOM 2258 CG LEU A 141 -2.682 -6.349 9.035 1.00 0.38 C ATOM 2259 CD1 LEU A 141 -2.781 -5.682 10.414 1.00 0.72 C ATOM 2260 CD2 LEU A 141 -3.237 -7.779 9.167 1.00 0.61 C ATOM 0 H LEU A 141 -4.847 -4.870 5.932 1.00 0.49 H new ATOM 0 HA LEU A 141 -1.996 -4.961 6.629 1.00 0.42 H new ATOM 0 HB2 LEU A 141 -3.534 -4.473 8.389 1.00 0.40 H new ATOM 0 HB3 LEU A 141 -4.519 -5.871 8.006 1.00 0.40 H new ATOM 0 HG LEU A 141 -1.655 -6.407 8.675 1.00 0.38 H new ATOM 0 HD11 LEU A 141 -2.215 -6.264 11.141 1.00 0.72 H new ATOM 0 HD12 LEU A 141 -2.372 -4.673 10.360 1.00 0.72 H new ATOM 0 HD13 LEU A 141 -3.826 -5.634 10.721 1.00 0.72 H new ATOM 0 HD21 LEU A 141 -2.636 -8.338 9.885 1.00 0.61 H new ATOM 0 HD22 LEU A 141 -4.270 -7.738 9.512 1.00 0.61 H new ATOM 0 HD23 LEU A 141 -3.198 -8.275 8.197 1.00 0.61 H new ATOM 2272 N VAL A 142 -1.481 -7.136 5.569 1.00 0.36 N ATOM 2273 CA VAL A 142 -1.082 -8.403 4.996 1.00 0.37 C ATOM 2274 C VAL A 142 -0.509 -9.280 6.111 1.00 0.41 C ATOM 2275 O VAL A 142 0.538 -8.977 6.683 1.00 0.45 O ATOM 2276 CB VAL A 142 -0.085 -8.193 3.853 1.00 0.44 C ATOM 2277 CG1 VAL A 142 0.121 -9.545 3.155 1.00 0.59 C ATOM 2278 CG2 VAL A 142 -0.557 -7.168 2.812 1.00 0.66 C ATOM 0 H VAL A 142 -0.736 -6.439 5.568 1.00 0.36 H new ATOM 0 HA VAL A 142 -1.944 -8.909 4.561 1.00 0.37 H new ATOM 0 HB VAL A 142 0.836 -7.802 4.285 1.00 0.44 H new ATOM 0 HG11 VAL A 142 0.828 -9.427 2.334 1.00 0.59 H new ATOM 0 HG12 VAL A 142 0.513 -10.268 3.870 1.00 0.59 H new ATOM 0 HG13 VAL A 142 -0.832 -9.902 2.764 1.00 0.59 H new ATOM 0 HG21 VAL A 142 0.197 -7.069 2.031 1.00 0.66 H new ATOM 0 HG22 VAL A 142 -1.495 -7.504 2.370 1.00 0.66 H new ATOM 0 HG23 VAL A 142 -0.709 -6.203 3.295 1.00 0.66 H new ATOM 2288 N GLY A 143 -1.214 -10.363 6.433 1.00 0.66 N ATOM 2289 CA GLY A 143 -0.799 -11.335 7.428 1.00 0.80 C ATOM 2290 C GLY A 143 0.368 -12.206 6.948 1.00 0.66 C ATOM 2291 O GLY A 143 1.040 -11.879 5.969 1.00 0.72 O ATOM 0 H GLY A 143 -2.108 -10.589 5.997 1.00 0.66 H new ATOM 0 HA2 GLY A 143 -0.508 -10.814 8.340 1.00 0.80 H new ATOM 0 HA3 GLY A 143 -1.645 -11.974 7.682 1.00 0.80 H new ATOM 2295 N PRO A 144 0.606 -13.335 7.635 1.00 0.65 N ATOM 2296 CA PRO A 144 1.855 -14.053 7.590 1.00 0.74 C ATOM 2297 C PRO A 144 2.054 -14.648 6.213 1.00 0.65 C ATOM 2298 O PRO A 144 3.009 -14.258 5.561 1.00 1.02 O ATOM 2299 CB PRO A 144 1.795 -15.080 8.720 1.00 0.89 C ATOM 2300 CG PRO A 144 0.303 -15.364 8.878 1.00 0.86 C ATOM 2301 CD PRO A 144 -0.355 -14.048 8.451 1.00 0.73 C ATOM 0 HA PRO A 144 2.725 -13.416 7.747 1.00 0.74 H new ATOM 0 HB2 PRO A 144 2.349 -15.984 8.468 1.00 0.89 H new ATOM 0 HB3 PRO A 144 2.227 -14.687 9.641 1.00 0.89 H new ATOM 0 HG2 PRO A 144 -0.017 -16.196 8.250 1.00 0.86 H new ATOM 0 HG3 PRO A 144 0.050 -15.625 9.906 1.00 0.86 H new ATOM 0 HD2 PRO A 144 -1.270 -14.239 7.890 1.00 0.73 H new ATOM 0 HD3 PRO A 144 -0.634 -13.456 9.323 1.00 0.73 H new ATOM 2309 N ASP A 145 1.175 -15.523 5.718 1.00 0.77 N ATOM 2310 CA ASP A 145 1.399 -16.233 4.458 1.00 0.75 C ATOM 2311 C ASP A 145 1.180 -15.336 3.225 1.00 0.72 C ATOM 2312 O ASP A 145 0.771 -15.820 2.176 1.00 1.21 O ATOM 2313 CB ASP A 145 0.482 -17.460 4.387 1.00 1.24 C ATOM 2314 CG ASP A 145 0.568 -18.341 5.620 1.00 2.12 C ATOM 2315 OD1 ASP A 145 1.603 -19.014 5.783 1.00 3.27 O ATOM 2316 OD2 ASP A 145 -0.424 -18.312 6.384 1.00 2.78 O ATOM 0 H ASP A 145 0.294 -15.758 6.176 1.00 0.77 H new ATOM 0 HA ASP A 145 2.443 -16.545 4.441 1.00 0.75 H new ATOM 0 HB2 ASP A 145 -0.548 -17.129 4.256 1.00 1.24 H new ATOM 0 HB3 ASP A 145 0.742 -18.050 3.508 1.00 1.24 H new ATOM 2321 N GLY A 146 1.417 -14.025 3.335 1.00 0.78 N ATOM 2322 CA GLY A 146 1.048 -13.063 2.309 1.00 0.82 C ATOM 2323 C GLY A 146 -0.468 -12.844 2.230 1.00 0.82 C ATOM 2324 O GLY A 146 -0.930 -12.165 1.317 1.00 0.88 O ATOM 0 H GLY A 146 1.873 -13.606 4.145 1.00 0.78 H new ATOM 0 HA2 GLY A 146 1.539 -12.112 2.513 1.00 0.82 H new ATOM 0 HA3 GLY A 146 1.413 -13.409 1.342 1.00 0.82 H new ATOM 2328 N LYS A 147 -1.245 -13.392 3.174 1.00 0.96 N ATOM 2329 CA LYS A 147 -2.695 -13.296 3.171 1.00 1.01 C ATOM 2330 C LYS A 147 -3.197 -12.183 4.069 1.00 0.99 C ATOM 2331 O LYS A 147 -2.875 -12.137 5.253 1.00 0.99 O ATOM 2332 CB LYS A 147 -3.357 -14.644 3.414 1.00 1.13 C ATOM 2333 CG LYS A 147 -3.148 -15.170 4.825 1.00 1.21 C ATOM 2334 CD LYS A 147 -3.476 -16.665 4.863 1.00 1.35 C ATOM 2335 CE LYS A 147 -3.378 -17.202 6.295 1.00 1.75 C ATOM 2336 NZ LYS A 147 -2.993 -18.624 6.312 1.00 2.30 N ATOM 0 H LYS A 147 -0.873 -13.918 3.965 1.00 0.96 H new ATOM 0 HA LYS A 147 -3.003 -13.006 2.167 1.00 1.01 H new ATOM 0 HB2 LYS A 147 -4.426 -14.556 3.221 1.00 1.13 H new ATOM 0 HB3 LYS A 147 -2.963 -15.368 2.701 1.00 1.13 H new ATOM 0 HG2 LYS A 147 -2.117 -15.004 5.138 1.00 1.21 H new ATOM 0 HG3 LYS A 147 -3.784 -14.629 5.525 1.00 1.21 H new ATOM 0 HD2 LYS A 147 -4.480 -16.833 4.474 1.00 1.35 H new ATOM 0 HD3 LYS A 147 -2.789 -17.210 4.216 1.00 1.35 H new ATOM 0 HE2 LYS A 147 -2.646 -16.619 6.854 1.00 1.75 H new ATOM 0 HE3 LYS A 147 -4.337 -17.077 6.798 1.00 1.75 H new ATOM 0 HZ1 LYS A 147 -3.303 -19.057 7.206 1.00 2.30 H new ATOM 0 HZ2 LYS A 147 -3.445 -19.116 5.515 1.00 2.30 H new ATOM 0 HZ3 LYS A 147 -1.960 -18.705 6.228 1.00 2.30 H new ATOM 2350 N VAL A 148 -3.997 -11.287 3.502 1.00 0.99 N ATOM 2351 CA VAL A 148 -4.563 -10.168 4.227 1.00 0.96 C ATOM 2352 C VAL A 148 -5.712 -10.666 5.079 1.00 1.01 C ATOM 2353 O VAL A 148 -6.573 -11.382 4.571 1.00 1.06 O ATOM 2354 CB VAL A 148 -5.083 -9.144 3.226 1.00 1.02 C ATOM 2355 CG1 VAL A 148 -5.909 -8.017 3.859 1.00 1.56 C ATOM 2356 CG2 VAL A 148 -3.967 -8.587 2.342 1.00 1.29 C ATOM 0 H VAL A 148 -4.270 -11.322 2.520 1.00 0.99 H new ATOM 0 HA VAL A 148 -3.805 -9.710 4.863 1.00 0.96 H new ATOM 0 HB VAL A 148 -5.773 -9.697 2.589 1.00 1.02 H new ATOM 0 HG11 VAL A 148 -6.243 -7.330 3.082 1.00 1.56 H new ATOM 0 HG12 VAL A 148 -6.776 -8.441 4.365 1.00 1.56 H new ATOM 0 HG13 VAL A 148 -5.296 -7.478 4.581 1.00 1.56 H new ATOM 0 HG21 VAL A 148 -4.384 -7.861 1.644 1.00 1.29 H new ATOM 0 HG22 VAL A 148 -3.217 -8.101 2.966 1.00 1.29 H new ATOM 0 HG23 VAL A 148 -3.503 -9.401 1.785 1.00 1.29 H new ATOM 2366 N LEU A 149 -5.724 -10.248 6.347 1.00 0.95 N ATOM 2367 CA LEU A 149 -6.777 -10.574 7.295 1.00 0.86 C ATOM 2368 C LEU A 149 -7.718 -9.396 7.545 1.00 0.70 C ATOM 2369 O LEU A 149 -8.854 -9.633 7.948 1.00 0.72 O ATOM 2370 CB LEU A 149 -6.177 -11.058 8.621 1.00 0.97 C ATOM 2371 CG LEU A 149 -5.806 -12.548 8.619 1.00 1.30 C ATOM 2372 CD1 LEU A 149 -4.696 -12.886 7.626 1.00 1.29 C ATOM 2373 CD2 LEU A 149 -5.359 -12.941 10.030 1.00 2.15 C ATOM 0 H LEU A 149 -4.988 -9.664 6.744 1.00 0.95 H new ATOM 0 HA LEU A 149 -7.367 -11.376 6.851 1.00 0.86 H new ATOM 0 HB2 LEU A 149 -5.286 -10.470 8.843 1.00 0.97 H new ATOM 0 HB3 LEU A 149 -6.891 -10.871 9.423 1.00 0.97 H new ATOM 0 HG LEU A 149 -6.689 -13.107 8.309 1.00 1.30 H new ATOM 0 HD11 LEU A 149 -4.479 -13.953 7.672 1.00 1.29 H new ATOM 0 HD12 LEU A 149 -5.017 -12.624 6.618 1.00 1.29 H new ATOM 0 HD13 LEU A 149 -3.798 -12.322 7.878 1.00 1.29 H new ATOM 0 HD21 LEU A 149 -5.092 -13.998 10.046 1.00 2.15 H new ATOM 0 HD22 LEU A 149 -4.494 -12.343 10.317 1.00 2.15 H new ATOM 0 HD23 LEU A 149 -6.173 -12.762 10.733 1.00 2.15 H new ATOM 2385 N LYS A 150 -7.252 -8.152 7.365 1.00 0.63 N ATOM 2386 CA LYS A 150 -8.016 -6.952 7.690 1.00 0.62 C ATOM 2387 C LYS A 150 -7.640 -5.773 6.786 1.00 0.63 C ATOM 2388 O LYS A 150 -6.455 -5.521 6.575 1.00 0.68 O ATOM 2389 CB LYS A 150 -7.803 -6.577 9.160 1.00 0.72 C ATOM 2390 CG LYS A 150 -8.903 -7.035 10.134 1.00 0.90 C ATOM 2391 CD LYS A 150 -10.317 -6.510 9.819 1.00 2.27 C ATOM 2392 CE LYS A 150 -10.412 -4.980 9.647 1.00 3.22 C ATOM 2393 NZ LYS A 150 -11.642 -4.578 8.931 1.00 4.69 N ATOM 0 H LYS A 150 -6.326 -7.955 6.986 1.00 0.63 H new ATOM 0 HA LYS A 150 -9.069 -7.174 7.520 1.00 0.62 H new ATOM 0 HB2 LYS A 150 -6.854 -6.999 9.489 1.00 0.72 H new ATOM 0 HB3 LYS A 150 -7.711 -5.493 9.229 1.00 0.72 H new ATOM 0 HG2 LYS A 150 -8.930 -8.125 10.140 1.00 0.90 H new ATOM 0 HG3 LYS A 150 -8.630 -6.717 11.140 1.00 0.90 H new ATOM 0 HD2 LYS A 150 -10.672 -6.988 8.906 1.00 2.27 H new ATOM 0 HD3 LYS A 150 -10.990 -6.815 10.621 1.00 2.27 H new ATOM 0 HE2 LYS A 150 -10.391 -4.503 10.627 1.00 3.22 H new ATOM 0 HE3 LYS A 150 -9.540 -4.622 9.099 1.00 3.22 H new ATOM 0 HZ1 LYS A 150 -11.634 -3.549 8.777 1.00 4.69 H new ATOM 0 HZ2 LYS A 150 -11.684 -5.065 8.013 1.00 4.69 H new ATOM 0 HZ3 LYS A 150 -12.474 -4.836 9.499 1.00 4.69 H new ATOM 2407 N ASP A 151 -8.660 -5.021 6.354 1.00 0.73 N ATOM 2408 CA ASP A 151 -8.547 -3.754 5.637 1.00 0.76 C ATOM 2409 C ASP A 151 -9.361 -2.697 6.394 1.00 1.06 C ATOM 2410 O ASP A 151 -10.154 -3.028 7.280 1.00 1.54 O ATOM 2411 CB ASP A 151 -9.058 -3.892 4.197 1.00 0.83 C ATOM 2412 CG ASP A 151 -8.468 -5.059 3.422 1.00 1.36 C ATOM 2413 OD1 ASP A 151 -7.314 -5.413 3.732 1.00 2.70 O ATOM 2414 OD2 ASP A 151 -9.186 -5.598 2.548 1.00 2.12 O ATOM 0 H ASP A 151 -9.631 -5.296 6.504 1.00 0.73 H new ATOM 0 HA ASP A 151 -7.500 -3.455 5.586 1.00 0.76 H new ATOM 0 HB2 ASP A 151 -10.142 -4.000 4.220 1.00 0.83 H new ATOM 0 HB3 ASP A 151 -8.841 -2.969 3.659 1.00 0.83 H new ATOM 2419 N TYR A 152 -9.122 -1.420 6.097 1.00 0.95 N ATOM 2420 CA TYR A 152 -9.827 -0.266 6.636 1.00 1.07 C ATOM 2421 C TYR A 152 -9.489 0.919 5.725 1.00 0.98 C ATOM 2422 O TYR A 152 -8.648 0.760 4.846 1.00 1.06 O ATOM 2423 CB TYR A 152 -9.454 -0.012 8.106 1.00 1.35 C ATOM 2424 CG TYR A 152 -10.414 0.922 8.822 1.00 2.42 C ATOM 2425 CD1 TYR A 152 -11.758 0.540 8.994 1.00 4.04 C ATOM 2426 CD2 TYR A 152 -9.997 2.203 9.230 1.00 3.26 C ATOM 2427 CE1 TYR A 152 -12.697 1.460 9.493 1.00 5.43 C ATOM 2428 CE2 TYR A 152 -10.933 3.112 9.752 1.00 4.91 C ATOM 2429 CZ TYR A 152 -12.285 2.752 9.858 1.00 5.70 C ATOM 2430 OH TYR A 152 -13.192 3.661 10.313 1.00 7.41 O ATOM 0 H TYR A 152 -8.391 -1.152 5.438 1.00 0.95 H new ATOM 0 HA TYR A 152 -10.904 -0.432 6.646 1.00 1.07 H new ATOM 0 HB2 TYR A 152 -9.424 -0.965 8.635 1.00 1.35 H new ATOM 0 HB3 TYR A 152 -8.449 0.409 8.150 1.00 1.35 H new ATOM 0 HD1 TYR A 152 -12.069 -0.463 8.742 1.00 4.04 H new ATOM 0 HD2 TYR A 152 -8.959 2.487 9.142 1.00 3.26 H new ATOM 0 HE1 TYR A 152 -13.733 1.174 9.595 1.00 5.43 H new ATOM 0 HE2 TYR A 152 -10.610 4.091 10.073 1.00 4.91 H new ATOM 0 HH TYR A 152 -12.735 4.503 10.521 1.00 7.41 H new ATOM 2440 N ASN A 153 -10.055 2.110 5.934 1.00 0.91 N ATOM 2441 CA ASN A 153 -9.604 3.332 5.282 1.00 0.87 C ATOM 2442 C ASN A 153 -9.145 4.294 6.361 1.00 1.15 C ATOM 2443 O ASN A 153 -9.920 4.625 7.257 1.00 2.52 O ATOM 2444 CB ASN A 153 -10.763 3.943 4.511 1.00 1.01 C ATOM 2445 CG ASN A 153 -10.505 5.333 3.961 1.00 1.34 C ATOM 2446 OD1 ASN A 153 -9.391 5.846 3.972 1.00 2.19 O ATOM 2447 ND2 ASN A 153 -11.575 5.963 3.506 1.00 1.53 N ATOM 0 H ASN A 153 -10.844 2.250 6.565 1.00 0.91 H new ATOM 0 HA ASN A 153 -8.788 3.123 4.591 1.00 0.87 H new ATOM 0 HB2 ASN A 153 -11.017 3.282 3.682 1.00 1.01 H new ATOM 0 HB3 ASN A 153 -11.634 3.983 5.165 1.00 1.01 H new ATOM 0 HD21 ASN A 153 -11.492 6.914 3.146 1.00 1.53 H new ATOM 0 HD22 ASN A 153 -12.483 5.498 3.515 1.00 1.53 H new ATOM 2454 N GLY A 154 -7.903 4.764 6.269 1.00 1.42 N ATOM 2455 CA GLY A 154 -7.393 5.758 7.190 1.00 1.55 C ATOM 2456 C GLY A 154 -8.318 6.968 7.284 1.00 1.48 C ATOM 2457 O GLY A 154 -8.601 7.450 8.376 1.00 2.12 O ATOM 0 H GLY A 154 -7.234 4.466 5.559 1.00 1.42 H new ATOM 0 HA2 GLY A 154 -7.275 5.312 8.178 1.00 1.55 H new ATOM 0 HA3 GLY A 154 -6.404 6.081 6.866 1.00 1.55 H new ATOM 2461 N VAL A 155 -8.838 7.423 6.142 1.00 1.08 N ATOM 2462 CA VAL A 155 -9.767 8.542 6.062 1.00 1.39 C ATOM 2463 C VAL A 155 -11.201 8.104 6.410 1.00 1.71 C ATOM 2464 O VAL A 155 -12.157 8.741 5.968 1.00 2.08 O ATOM 2465 CB VAL A 155 -9.673 9.215 4.672 1.00 1.47 C ATOM 2466 CG1 VAL A 155 -10.170 10.669 4.733 1.00 2.14 C ATOM 2467 CG2 VAL A 155 -8.241 9.230 4.113 1.00 1.61 C ATOM 0 H VAL A 155 -8.619 7.014 5.234 1.00 1.08 H new ATOM 0 HA VAL A 155 -9.486 9.287 6.806 1.00 1.39 H new ATOM 0 HB VAL A 155 -10.302 8.617 4.012 1.00 1.47 H new ATOM 0 HG11 VAL A 155 -10.094 11.121 3.744 1.00 2.14 H new ATOM 0 HG12 VAL A 155 -11.209 10.685 5.061 1.00 2.14 H new ATOM 0 HG13 VAL A 155 -9.559 11.233 5.438 1.00 2.14 H new ATOM 0 HG21 VAL A 155 -8.237 9.714 3.136 1.00 1.61 H new ATOM 0 HG22 VAL A 155 -7.591 9.780 4.793 1.00 1.61 H new ATOM 0 HG23 VAL A 155 -7.879 8.207 4.012 1.00 1.61 H new ATOM 2477 N GLU A 156 -11.380 7.050 7.218 1.00 2.37 N ATOM 2478 CA GLU A 156 -12.669 6.717 7.801 1.00 2.78 C ATOM 2479 C GLU A 156 -13.711 6.502 6.701 1.00 1.59 C ATOM 2480 O GLU A 156 -13.512 5.658 5.832 1.00 1.41 O ATOM 2481 CB GLU A 156 -12.992 7.751 8.887 1.00 4.16 C ATOM 2482 CG GLU A 156 -14.163 7.334 9.790 1.00 5.18 C ATOM 2483 CD GLU A 156 -15.220 8.423 9.878 1.00 5.66 C ATOM 2484 OE1 GLU A 156 -15.650 8.834 8.779 1.00 5.56 O ATOM 2485 OE2 GLU A 156 -15.566 8.814 11.011 1.00 6.86 O ATOM 0 H GLU A 156 -10.630 6.410 7.480 1.00 2.37 H new ATOM 0 HA GLU A 156 -12.663 5.758 8.319 1.00 2.78 H new ATOM 0 HB2 GLU A 156 -12.106 7.911 9.502 1.00 4.16 H new ATOM 0 HB3 GLU A 156 -13.228 8.704 8.414 1.00 4.16 H new ATOM 0 HG2 GLU A 156 -14.613 6.420 9.403 1.00 5.18 H new ATOM 0 HG3 GLU A 156 -13.790 7.107 10.789 1.00 5.18 H new ATOM 2492 N ASN A 157 -14.764 7.314 6.727 1.00 1.94 N ATOM 2493 CA ASN A 157 -15.976 7.347 5.910 1.00 2.89 C ATOM 2494 C ASN A 157 -16.399 5.995 5.330 1.00 2.91 C ATOM 2495 O ASN A 157 -17.407 5.440 5.762 1.00 3.86 O ATOM 2496 CB ASN A 157 -15.803 8.376 4.784 1.00 3.70 C ATOM 2497 CG ASN A 157 -15.714 9.812 5.295 1.00 4.19 C ATOM 2498 OD1 ASN A 157 -16.688 10.556 5.233 1.00 5.34 O ATOM 2499 ND2 ASN A 157 -14.542 10.235 5.760 1.00 4.00 N ATOM 0 H ASN A 157 -14.791 8.066 7.415 1.00 1.94 H new ATOM 0 HA ASN A 157 -16.785 7.633 6.583 1.00 2.89 H new ATOM 0 HB2 ASN A 157 -14.900 8.141 4.220 1.00 3.70 H new ATOM 0 HB3 ASN A 157 -16.642 8.294 4.092 1.00 3.70 H new ATOM 0 HD21 ASN A 157 -14.437 11.199 6.076 1.00 4.00 H new ATOM 0 HD22 ASN A 157 -13.749 9.595 5.801 1.00 4.00 H new ATOM 2506 N THR A 158 -15.666 5.471 4.348 1.00 2.26 N ATOM 2507 CA THR A 158 -15.850 4.138 3.811 1.00 2.12 C ATOM 2508 C THR A 158 -14.486 3.428 3.805 1.00 2.08 C ATOM 2509 O THR A 158 -13.546 3.960 3.214 1.00 2.37 O ATOM 2510 CB THR A 158 -16.514 4.254 2.432 1.00 2.31 C ATOM 2511 OG1 THR A 158 -17.030 3.007 2.020 1.00 2.98 O ATOM 2512 CG2 THR A 158 -15.638 4.845 1.322 1.00 3.12 C ATOM 0 H THR A 158 -14.908 5.983 3.896 1.00 2.26 H new ATOM 0 HA THR A 158 -16.516 3.527 4.420 1.00 2.12 H new ATOM 0 HB THR A 158 -17.317 4.976 2.580 1.00 2.31 H new ATOM 0 HG1 THR A 158 -16.599 2.735 1.183 1.00 2.98 H new ATOM 0 HG21 THR A 158 -16.205 4.881 0.392 1.00 3.12 H new ATOM 0 HG22 THR A 158 -15.331 5.853 1.599 1.00 3.12 H new ATOM 0 HG23 THR A 158 -14.755 4.221 1.185 1.00 3.12 H new ATOM 2520 N PRO A 159 -14.350 2.259 4.458 1.00 1.89 N ATOM 2521 CA PRO A 159 -13.165 1.422 4.390 1.00 2.09 C ATOM 2522 C PRO A 159 -13.034 0.774 3.009 1.00 2.37 C ATOM 2523 O PRO A 159 -12.051 0.982 2.296 1.00 2.88 O ATOM 2524 CB PRO A 159 -13.266 0.461 5.566 1.00 2.05 C ATOM 2525 CG PRO A 159 -14.758 0.357 5.866 1.00 1.73 C ATOM 2526 CD PRO A 159 -15.339 1.669 5.339 1.00 1.73 C ATOM 0 HA PRO A 159 -12.234 1.981 4.486 1.00 2.09 H new ATOM 0 HB2 PRO A 159 -12.845 -0.513 5.317 1.00 2.05 H new ATOM 0 HB3 PRO A 159 -12.715 0.835 6.429 1.00 2.05 H new ATOM 0 HG2 PRO A 159 -15.205 -0.504 5.369 1.00 1.73 H new ATOM 0 HG3 PRO A 159 -14.942 0.240 6.934 1.00 1.73 H new ATOM 0 HD2 PRO A 159 -16.271 1.488 4.803 1.00 1.73 H new ATOM 0 HD3 PRO A 159 -15.571 2.344 6.163 1.00 1.73 H new ATOM 2534 N TYR A 160 -14.071 0.029 2.627 1.00 2.15 N ATOM 2535 CA TYR A 160 -14.477 -0.393 1.302 1.00 2.90 C ATOM 2536 C TYR A 160 -13.624 -1.511 0.724 1.00 3.63 C ATOM 2537 O TYR A 160 -14.161 -2.434 0.112 1.00 3.57 O ATOM 2538 CB TYR A 160 -14.395 0.826 0.379 1.00 4.10 C ATOM 2539 CG TYR A 160 -15.312 0.715 -0.802 1.00 4.41 C ATOM 2540 CD1 TYR A 160 -16.696 0.776 -0.587 1.00 5.39 C ATOM 2541 CD2 TYR A 160 -14.806 0.475 -2.088 1.00 4.59 C ATOM 2542 CE1 TYR A 160 -17.575 0.636 -1.665 1.00 6.28 C ATOM 2543 CE2 TYR A 160 -15.684 0.432 -3.182 1.00 5.31 C ATOM 2544 CZ TYR A 160 -17.073 0.513 -2.972 1.00 6.07 C ATOM 2545 OH TYR A 160 -17.928 0.483 -4.032 1.00 7.14 O ATOM 0 H TYR A 160 -14.718 -0.331 3.329 1.00 2.15 H new ATOM 0 HA TYR A 160 -15.489 -0.791 1.379 1.00 2.90 H new ATOM 0 HB2 TYR A 160 -14.644 1.724 0.945 1.00 4.10 H new ATOM 0 HB3 TYR A 160 -13.370 0.944 0.029 1.00 4.10 H new ATOM 0 HD1 TYR A 160 -17.082 0.931 0.410 1.00 5.39 H new ATOM 0 HD2 TYR A 160 -13.747 0.324 -2.235 1.00 4.59 H new ATOM 0 HE1 TYR A 160 -18.641 0.622 -1.493 1.00 6.28 H new ATOM 0 HE2 TYR A 160 -15.294 0.337 -4.185 1.00 5.31 H new ATOM 0 HH TYR A 160 -17.416 0.395 -4.863 1.00 7.14 H new ATOM 2555 N ASP A 161 -12.348 -1.549 1.078 1.00 4.43 N ATOM 2556 CA ASP A 161 -11.494 -2.646 0.682 1.00 5.47 C ATOM 2557 C ASP A 161 -11.839 -3.854 1.528 1.00 4.58 C ATOM 2558 O ASP A 161 -11.889 -4.957 1.000 1.00 4.54 O ATOM 2559 CB ASP A 161 -10.024 -2.248 0.734 1.00 7.23 C ATOM 2560 CG ASP A 161 -9.663 -1.324 -0.434 1.00 8.74 C ATOM 2561 OD1 ASP A 161 -10.575 -0.754 -1.077 1.00 9.72 O ATOM 2562 OD2 ASP A 161 -8.487 -1.309 -0.860 1.00 9.45 O ATOM 0 H ASP A 161 -11.887 -0.832 1.638 1.00 4.43 H new ATOM 0 HA ASP A 161 -11.670 -2.914 -0.360 1.00 5.47 H new ATOM 0 HB2 ASP A 161 -9.813 -1.746 1.678 1.00 7.23 H new ATOM 0 HB3 ASP A 161 -9.400 -3.141 0.702 1.00 7.23 H new ATOM 2567 N ASP A 162 -12.158 -3.639 2.809 1.00 4.14 N ATOM 2568 CA ASP A 162 -12.569 -4.724 3.680 1.00 4.20 C ATOM 2569 C ASP A 162 -13.862 -5.318 3.143 1.00 2.94 C ATOM 2570 O ASP A 162 -13.897 -6.504 2.856 1.00 3.08 O ATOM 2571 CB ASP A 162 -12.686 -4.352 5.170 1.00 4.66 C ATOM 2572 CG ASP A 162 -13.428 -3.071 5.478 1.00 4.58 C ATOM 2573 OD1 ASP A 162 -13.959 -2.484 4.510 1.00 4.62 O ATOM 2574 OD2 ASP A 162 -13.424 -2.683 6.667 1.00 5.22 O ATOM 0 H ASP A 162 -12.137 -2.723 3.256 1.00 4.14 H new ATOM 0 HA ASP A 162 -11.772 -5.467 3.663 1.00 4.20 H new ATOM 0 HB2 ASP A 162 -13.183 -5.171 5.690 1.00 4.66 H new ATOM 0 HB3 ASP A 162 -11.681 -4.275 5.585 1.00 4.66 H new ATOM 2579 N ILE A 163 -14.905 -4.504 2.961 1.00 1.85 N ATOM 2580 CA ILE A 163 -16.133 -4.908 2.266 1.00 1.35 C ATOM 2581 C ILE A 163 -15.834 -5.735 1.007 1.00 1.00 C ATOM 2582 O ILE A 163 -16.307 -6.865 0.901 1.00 1.28 O ATOM 2583 CB ILE A 163 -17.049 -3.707 1.950 1.00 1.52 C ATOM 2584 CG1 ILE A 163 -17.559 -3.064 3.252 1.00 2.01 C ATOM 2585 CG2 ILE A 163 -18.267 -4.140 1.116 1.00 2.57 C ATOM 2586 CD1 ILE A 163 -16.896 -1.713 3.508 1.00 1.53 C ATOM 0 H ILE A 163 -14.923 -3.540 3.293 1.00 1.85 H new ATOM 0 HA ILE A 163 -16.680 -5.552 2.955 1.00 1.35 H new ATOM 0 HB ILE A 163 -16.457 -2.990 1.382 1.00 1.52 H new ATOM 0 HG12 ILE A 163 -18.640 -2.935 3.196 1.00 2.01 H new ATOM 0 HG13 ILE A 163 -17.361 -3.732 4.090 1.00 2.01 H new ATOM 0 HG21 ILE A 163 -18.893 -3.272 0.909 1.00 2.57 H new ATOM 0 HG22 ILE A 163 -17.928 -4.575 0.176 1.00 2.57 H new ATOM 0 HG23 ILE A 163 -18.844 -4.880 1.671 1.00 2.57 H new ATOM 0 HD11 ILE A 163 -17.281 -1.289 4.436 1.00 1.53 H new ATOM 0 HD12 ILE A 163 -15.817 -1.847 3.590 1.00 1.53 H new ATOM 0 HD13 ILE A 163 -17.116 -1.037 2.682 1.00 1.53 H new ATOM 2598 N ILE A 164 -15.087 -5.208 0.029 1.00 1.51 N ATOM 2599 CA ILE A 164 -14.761 -5.985 -1.155 1.00 2.15 C ATOM 2600 C ILE A 164 -14.093 -7.316 -0.781 1.00 2.04 C ATOM 2601 O ILE A 164 -14.536 -8.373 -1.234 1.00 1.72 O ATOM 2602 CB ILE A 164 -13.971 -5.115 -2.156 1.00 3.47 C ATOM 2603 CG1 ILE A 164 -14.960 -4.311 -3.022 1.00 4.17 C ATOM 2604 CG2 ILE A 164 -13.091 -5.955 -3.096 1.00 4.21 C ATOM 2605 CD1 ILE A 164 -15.568 -3.065 -2.384 1.00 3.42 C ATOM 0 H ILE A 164 -14.706 -4.262 0.040 1.00 1.51 H new ATOM 0 HA ILE A 164 -15.674 -6.278 -1.673 1.00 2.15 H new ATOM 0 HB ILE A 164 -13.324 -4.460 -1.572 1.00 3.47 H new ATOM 0 HG12 ILE A 164 -14.447 -4.011 -3.936 1.00 4.17 H new ATOM 0 HG13 ILE A 164 -15.773 -4.975 -3.316 1.00 4.17 H new ATOM 0 HG21 ILE A 164 -12.557 -5.296 -3.780 1.00 4.21 H new ATOM 0 HG22 ILE A 164 -12.373 -6.527 -2.508 1.00 4.21 H new ATOM 0 HG23 ILE A 164 -13.719 -6.639 -3.667 1.00 4.21 H new ATOM 0 HD11 ILE A 164 -16.246 -2.588 -3.092 1.00 3.42 H new ATOM 0 HD12 ILE A 164 -16.120 -3.348 -1.488 1.00 3.42 H new ATOM 0 HD13 ILE A 164 -14.773 -2.369 -2.116 1.00 3.42 H new ATOM 2617 N SER A 165 -13.055 -7.287 0.052 1.00 2.78 N ATOM 2618 CA SER A 165 -12.413 -8.479 0.582 1.00 3.34 C ATOM 2619 C SER A 165 -13.433 -9.457 1.190 1.00 2.80 C ATOM 2620 O SER A 165 -13.344 -10.658 0.935 1.00 2.87 O ATOM 2621 CB SER A 165 -11.276 -8.077 1.518 1.00 4.71 C ATOM 2622 OG SER A 165 -10.300 -7.296 0.841 1.00 6.94 O ATOM 0 H SER A 165 -12.633 -6.419 0.381 1.00 2.78 H new ATOM 0 HA SER A 165 -11.958 -9.044 -0.232 1.00 3.34 H new ATOM 0 HB2 SER A 165 -11.677 -7.512 2.359 1.00 4.71 H new ATOM 0 HB3 SER A 165 -10.808 -8.971 1.929 1.00 4.71 H new ATOM 0 HG SER A 165 -9.791 -6.771 1.494 1.00 6.94 H new ATOM 2628 N ASP A 166 -14.430 -8.969 1.936 1.00 2.64 N ATOM 2629 CA ASP A 166 -15.462 -9.808 2.538 1.00 3.12 C ATOM 2630 C ASP A 166 -16.333 -10.446 1.456 1.00 2.55 C ATOM 2631 O ASP A 166 -16.447 -11.669 1.378 1.00 2.91 O ATOM 2632 CB ASP A 166 -16.317 -9.004 3.520 1.00 3.64 C ATOM 2633 CG ASP A 166 -17.510 -9.833 3.975 1.00 4.56 C ATOM 2634 OD1 ASP A 166 -17.298 -10.705 4.843 1.00 6.14 O ATOM 2635 OD2 ASP A 166 -18.602 -9.604 3.411 1.00 3.99 O ATOM 0 H ASP A 166 -14.541 -7.975 2.138 1.00 2.64 H new ATOM 0 HA ASP A 166 -14.970 -10.604 3.096 1.00 3.12 H new ATOM 0 HB2 ASP A 166 -15.717 -8.712 4.382 1.00 3.64 H new ATOM 0 HB3 ASP A 166 -16.662 -8.085 3.046 1.00 3.64 H new ATOM 2640 N VAL A 167 -16.918 -9.626 0.582 1.00 1.96 N ATOM 2641 CA VAL A 167 -17.783 -10.096 -0.490 1.00 2.32 C ATOM 2642 C VAL A 167 -17.056 -11.159 -1.322 1.00 1.87 C ATOM 2643 O VAL A 167 -17.618 -12.199 -1.658 1.00 2.44 O ATOM 2644 CB VAL A 167 -18.254 -8.895 -1.330 1.00 2.68 C ATOM 2645 CG1 VAL A 167 -19.016 -9.344 -2.581 1.00 3.66 C ATOM 2646 CG2 VAL A 167 -19.185 -7.998 -0.500 1.00 3.26 C ATOM 0 H VAL A 167 -16.802 -8.613 0.602 1.00 1.96 H new ATOM 0 HA VAL A 167 -18.673 -10.574 -0.080 1.00 2.32 H new ATOM 0 HB VAL A 167 -17.361 -8.347 -1.632 1.00 2.68 H new ATOM 0 HG11 VAL A 167 -19.332 -8.469 -3.148 1.00 3.66 H new ATOM 0 HG12 VAL A 167 -18.366 -9.962 -3.200 1.00 3.66 H new ATOM 0 HG13 VAL A 167 -19.892 -9.921 -2.286 1.00 3.66 H new ATOM 0 HG21 VAL A 167 -19.511 -7.152 -1.106 1.00 3.26 H new ATOM 0 HG22 VAL A 167 -20.055 -8.573 -0.181 1.00 3.26 H new ATOM 0 HG23 VAL A 167 -18.651 -7.632 0.377 1.00 3.26 H new ATOM 2656 N LYS A 168 -15.787 -10.918 -1.653 1.00 1.19 N ATOM 2657 CA LYS A 168 -14.980 -11.909 -2.348 1.00 1.31 C ATOM 2658 C LYS A 168 -14.758 -13.146 -1.462 1.00 1.16 C ATOM 2659 O LYS A 168 -14.932 -14.271 -1.929 1.00 1.15 O ATOM 2660 CB LYS A 168 -13.683 -11.259 -2.839 1.00 2.26 C ATOM 2661 CG LYS A 168 -13.837 -10.613 -4.233 1.00 3.53 C ATOM 2662 CD LYS A 168 -14.943 -9.551 -4.300 1.00 4.10 C ATOM 2663 CE LYS A 168 -14.959 -8.835 -5.655 1.00 4.59 C ATOM 2664 NZ LYS A 168 -15.974 -7.760 -5.687 1.00 5.64 N ATOM 0 H LYS A 168 -15.301 -10.045 -1.449 1.00 1.19 H new ATOM 0 HA LYS A 168 -15.506 -12.272 -3.231 1.00 1.31 H new ATOM 0 HB2 LYS A 168 -13.367 -10.500 -2.123 1.00 2.26 H new ATOM 0 HB3 LYS A 168 -12.895 -12.011 -2.875 1.00 2.26 H new ATOM 0 HG2 LYS A 168 -12.889 -10.157 -4.519 1.00 3.53 H new ATOM 0 HG3 LYS A 168 -14.049 -11.393 -4.964 1.00 3.53 H new ATOM 0 HD2 LYS A 168 -15.911 -10.022 -4.125 1.00 4.10 H new ATOM 0 HD3 LYS A 168 -14.795 -8.821 -3.504 1.00 4.10 H new ATOM 0 HE2 LYS A 168 -13.974 -8.413 -5.857 1.00 4.59 H new ATOM 0 HE3 LYS A 168 -15.165 -9.556 -6.446 1.00 4.59 H new ATOM 0 HZ1 LYS A 168 -15.959 -7.296 -6.617 1.00 5.64 H new ATOM 0 HZ2 LYS A 168 -16.916 -8.167 -5.519 1.00 5.64 H new ATOM 0 HZ3 LYS A 168 -15.762 -7.060 -4.947 1.00 5.64 H new ATOM 2678 N SER A 169 -14.438 -12.968 -0.179 1.00 1.94 N ATOM 2679 CA SER A 169 -14.332 -14.073 0.771 1.00 2.91 C ATOM 2680 C SER A 169 -15.597 -14.920 0.831 1.00 3.25 C ATOM 2681 O SER A 169 -15.513 -16.135 1.033 1.00 3.77 O ATOM 2682 CB SER A 169 -13.905 -13.567 2.162 1.00 4.05 C ATOM 2683 OG SER A 169 -13.734 -14.622 3.102 1.00 4.98 O ATOM 0 H SER A 169 -14.245 -12.053 0.229 1.00 1.94 H new ATOM 0 HA SER A 169 -13.548 -14.736 0.405 1.00 2.91 H new ATOM 0 HB2 SER A 169 -12.971 -13.012 2.071 1.00 4.05 H new ATOM 0 HB3 SER A 169 -14.655 -12.870 2.537 1.00 4.05 H new ATOM 0 HG SER A 169 -13.462 -14.249 3.966 1.00 4.98 H new ATOM 2689 N ALA A 170 -16.759 -14.305 0.630 1.00 3.31 N ATOM 2690 CA ALA A 170 -18.017 -15.032 0.589 1.00 4.22 C ATOM 2691 C ALA A 170 -18.067 -15.951 -0.635 1.00 4.18 C ATOM 2692 O ALA A 170 -18.700 -17.001 -0.586 1.00 4.88 O ATOM 2693 CB ALA A 170 -19.200 -14.060 0.619 1.00 4.53 C ATOM 0 H ALA A 170 -16.852 -13.299 0.493 1.00 3.31 H new ATOM 0 HA ALA A 170 -18.088 -15.663 1.475 1.00 4.22 H new ATOM 0 HB1 ALA A 170 -20.133 -14.622 0.588 1.00 4.53 H new ATOM 0 HB2 ALA A 170 -19.163 -13.469 1.534 1.00 4.53 H new ATOM 0 HB3 ALA A 170 -19.147 -13.396 -0.244 1.00 4.53 H new ATOM 2699 N SER A 171 -17.407 -15.556 -1.730 1.00 3.55 N ATOM 2700 CA SER A 171 -17.383 -16.321 -2.966 1.00 3.72 C ATOM 2701 C SER A 171 -16.530 -17.588 -2.829 1.00 3.53 C ATOM 2702 O SER A 171 -17.075 -18.689 -2.796 1.00 4.47 O ATOM 2703 CB SER A 171 -16.975 -15.420 -4.140 1.00 3.49 C ATOM 2704 OG SER A 171 -17.090 -16.116 -5.365 1.00 4.72 O ATOM 0 H SER A 171 -16.873 -14.688 -1.776 1.00 3.55 H new ATOM 0 HA SER A 171 -18.389 -16.679 -3.184 1.00 3.72 H new ATOM 0 HB2 SER A 171 -17.606 -14.531 -4.160 1.00 3.49 H new ATOM 0 HB3 SER A 171 -15.949 -15.079 -4.004 1.00 3.49 H new ATOM 0 HG SER A 171 -16.828 -15.526 -6.102 1.00 4.72 H new ATOM 2710 N THR A 172 -15.199 -17.454 -2.777 1.00 2.61 N ATOM 2711 CA THR A 172 -14.294 -18.609 -2.793 1.00 2.55 C ATOM 2712 C THR A 172 -12.843 -18.186 -2.549 1.00 2.30 C ATOM 2713 O THR A 172 -12.194 -18.706 -1.645 1.00 2.44 O ATOM 2714 CB THR A 172 -14.460 -19.445 -4.087 1.00 2.75 C ATOM 2715 OG1 THR A 172 -13.531 -20.509 -4.097 1.00 3.36 O ATOM 2716 CG2 THR A 172 -14.298 -18.654 -5.391 1.00 3.31 C ATOM 0 H THR A 172 -14.724 -16.553 -2.723 1.00 2.61 H new ATOM 0 HA THR A 172 -14.573 -19.261 -1.965 1.00 2.55 H new ATOM 0 HB THR A 172 -15.489 -19.802 -4.061 1.00 2.75 H new ATOM 0 HG1 THR A 172 -13.643 -21.034 -4.917 1.00 3.36 H new ATOM 0 HG21 THR A 172 -14.431 -19.323 -6.241 1.00 3.31 H new ATOM 0 HG22 THR A 172 -15.046 -17.862 -5.432 1.00 3.31 H new ATOM 0 HG23 THR A 172 -13.301 -18.214 -5.428 1.00 3.31 H new ATOM 2724 N LEU A 173 -12.346 -17.235 -3.345 1.00 3.02 N ATOM 2725 CA LEU A 173 -10.963 -16.775 -3.344 1.00 4.04 C ATOM 2726 C LEU A 173 -10.434 -16.452 -1.944 1.00 2.96 C ATOM 2727 O LEU A 173 -9.356 -16.925 -1.590 1.00 3.47 O ATOM 2728 CB LEU A 173 -10.759 -15.611 -4.334 1.00 5.60 C ATOM 2729 CG LEU A 173 -11.611 -14.343 -4.117 1.00 6.22 C ATOM 2730 CD1 LEU A 173 -11.032 -13.201 -4.957 1.00 7.99 C ATOM 2731 CD2 LEU A 173 -13.079 -14.533 -4.524 1.00 6.64 C ATOM 0 H LEU A 173 -12.922 -16.749 -4.032 1.00 3.02 H new ATOM 0 HA LEU A 173 -10.357 -17.611 -3.693 1.00 4.04 H new ATOM 0 HB2 LEU A 173 -9.709 -15.322 -4.303 1.00 5.60 H new ATOM 0 HB3 LEU A 173 -10.958 -15.984 -5.339 1.00 5.60 H new ATOM 0 HG LEU A 173 -11.582 -14.120 -3.051 1.00 6.22 H new ATOM 0 HD11 LEU A 173 -11.629 -12.301 -4.809 1.00 7.99 H new ATOM 0 HD12 LEU A 173 -10.004 -13.009 -4.650 1.00 7.99 H new ATOM 0 HD13 LEU A 173 -11.050 -13.479 -6.011 1.00 7.99 H new ATOM 0 HD21 LEU A 173 -13.628 -13.608 -4.349 1.00 6.64 H new ATOM 0 HD22 LEU A 173 -13.133 -14.792 -5.581 1.00 6.64 H new ATOM 0 HD23 LEU A 173 -13.520 -15.334 -3.931 1.00 6.64 H new ATOM 2743 N LYS A 174 -11.213 -15.695 -1.163 1.00 1.83 N ATOM 2744 CA LYS A 174 -10.828 -15.235 0.168 1.00 1.85 C ATOM 2745 C LYS A 174 -9.649 -14.273 0.178 1.00 3.06 C ATOM 2746 O LYS A 174 -9.105 -13.980 -0.910 1.00 3.78 O ATOM 2747 CB LYS A 174 -10.690 -16.408 1.150 1.00 2.94 C ATOM 2748 CG LYS A 174 -12.065 -17.051 1.330 1.00 4.02 C ATOM 2749 CD LYS A 174 -12.052 -18.204 2.335 1.00 5.74 C ATOM 2750 CE LYS A 174 -13.472 -18.753 2.538 1.00 6.80 C ATOM 2751 NZ LYS A 174 -14.441 -17.697 2.916 1.00 7.61 N ATOM 2752 OXT LYS A 174 -9.402 -13.758 1.290 1.00 4.17 O ATOM 0 H LYS A 174 -12.142 -15.382 -1.446 1.00 1.83 H new ATOM 0 HA LYS A 174 -11.652 -14.622 0.533 1.00 1.85 H new ATOM 0 HB2 LYS A 174 -9.976 -17.139 0.770 1.00 2.94 H new ATOM 0 HB3 LYS A 174 -10.307 -16.057 2.108 1.00 2.94 H new ATOM 0 HG2 LYS A 174 -12.775 -16.293 1.662 1.00 4.02 H new ATOM 0 HG3 LYS A 174 -12.418 -17.419 0.367 1.00 4.02 H new ATOM 0 HD2 LYS A 174 -11.396 -18.998 1.979 1.00 5.74 H new ATOM 0 HD3 LYS A 174 -11.648 -17.860 3.287 1.00 5.74 H new ATOM 0 HE2 LYS A 174 -13.806 -19.236 1.620 1.00 6.80 H new ATOM 0 HE3 LYS A 174 -13.454 -19.519 3.313 1.00 6.80 H new ATOM 0 HZ1 LYS A 174 -15.046 -18.041 3.689 1.00 7.61 H new ATOM 0 HZ2 LYS A 174 -13.926 -16.850 3.230 1.00 7.61 H new ATOM 0 HZ3 LYS A 174 -15.032 -17.458 2.094 1.00 7.61 H new TER 2766 LYS A 174