USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1112 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 132 THR OG1 : rot 140:sc= 0.51 USER MOD Set 1.2: A 133 LYS NZ :NH3+ -164:sc= 0.801 (180deg=0) USER MOD Set 2.1: A 16 TYR OH : rot 58:sc= 0.161 USER MOD Set 2.2: A 20 GLN : amide:sc= -0.287 K(o=-0.32,f=-11!) USER MOD Set 2.3: A 52 GLN : amide:sc= -0.291 K(o=-0.32,f=-7.1!) USER MOD Set 2.4: A 107 LYS NZ :NH3+ 171:sc= 0.0916 (180deg=-0.313) USER MOD Set 3.1: A 8 GLN :FLIP amide:sc= -0.156 F(o=-0.75,f=0.41) USER MOD Set 3.2: A 37 SER OG : rot -17:sc= 0.567 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -84:sc= 0.86 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.251 USER MOD Single : A 36 THR OG1 : rot -120:sc= 0.681 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 70:sc= 0.574 USER MOD Single : A 54 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.31) USER MOD Single : A 55 HIS : no HD1:sc= -0.333 X(o=-0.33,f=-0.22) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.541 X(o=-0.54,f=-0.82) USER MOD Single : A 62 MET CE :methyl 179:sc= -0.56 (180deg=-0.582) USER MOD Single : A 65 LYS NZ :NH3+ -163:sc= -0.0416 (180deg=-0.294) USER MOD Single : A 69 LYS NZ :NH3+ 171:sc= -0.0119 (180deg=-0.111) USER MOD Single : A 70 ASN :FLIP amide:sc= -0.218 F(o=-1.8!,f=-0.22) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 74:sc= 0.69 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 156:sc= -0.0826 (180deg=-2.2) USER MOD Single : A 83 HIS :FLIP no HD1:sc= -0.163 F(o=-0.87,f=-0.16) USER MOD Single : A 97 THR OG1 : rot 70:sc= 0.522 USER MOD Single : A 100 SER OG : rot 82:sc= 0.894 USER MOD Single : A 108 HIS : no HD1:sc= 0.539 K(o=0.54,f=-3.2!) USER MOD Single : A 110 LYS NZ :NH3+ -164:sc= -0.0479 (180deg=-0.331) USER MOD Single : A 111 THR OG1 : rot 75:sc= 0.952 USER MOD Single : A 113 ASN : amide:sc= -0.133 X(o=-0.13,f=0) USER MOD Single : A 114 GLN : amide:sc= -0.0108 X(o=-0.011,f=-0.011) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 69:sc= 0.725 USER MOD Single : A 126 THR OG1 : rot 73:sc= -1.13 USER MOD Single : A 139 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0151) USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.277 X(o=-0.28,f=0.032) USER MOD ----------------------------------------------------------------- ATOM 35 N ASP A 3 3.605 -3.013 -6.335 1.00 64.10 N ATOM 36 CA ASP A 3 4.068 -3.607 -7.597 1.00 41.52 C ATOM 37 C ASP A 3 2.957 -4.340 -8.370 1.00 73.44 C ATOM 38 O ASP A 3 1.976 -4.819 -7.792 1.00 31.30 O ATOM 39 CB ASP A 3 5.215 -4.587 -7.321 1.00 3.41 C ATOM 40 CG ASP A 3 6.486 -3.894 -6.866 1.00 62.23 C ATOM 41 OD1 ASP A 3 6.616 -3.614 -5.656 1.00 71.34 O ATOM 42 OD2 ASP A 3 7.368 -3.646 -7.713 1.00 71.33 O ATOM 0 HA ASP A 3 4.404 -2.779 -8.221 1.00 41.52 H new ATOM 0 HB2 ASP A 3 4.902 -5.299 -6.558 1.00 3.41 H new ATOM 0 HB3 ASP A 3 5.423 -5.159 -8.225 1.00 3.41 H new ATOM 47 N GLU A 4 3.148 -4.440 -9.686 1.00 50.21 N ATOM 48 CA GLU A 4 2.264 -5.225 -10.555 1.00 1.31 C ATOM 49 C GLU A 4 2.184 -6.680 -10.075 1.00 50.21 C ATOM 50 O GLU A 4 1.103 -7.264 -9.998 1.00 51.43 O ATOM 51 CB GLU A 4 2.782 -5.182 -12.003 1.00 73.43 C ATOM 52 CG GLU A 4 2.068 -6.142 -12.956 1.00 43.12 C ATOM 53 CD GLU A 4 2.617 -6.082 -14.377 1.00 62.33 C ATOM 54 OE1 GLU A 4 3.855 -6.106 -14.546 1.00 60.13 O ATOM 55 OE2 GLU A 4 1.816 -6.015 -15.331 1.00 61.51 O ATOM 0 H GLU A 4 3.915 -3.983 -10.179 1.00 50.21 H new ATOM 0 HA GLU A 4 1.265 -4.791 -10.514 1.00 1.31 H new ATOM 0 HB2 GLU A 4 2.677 -4.166 -12.384 1.00 73.43 H new ATOM 0 HB3 GLU A 4 3.847 -5.414 -12.003 1.00 73.43 H new ATOM 0 HG2 GLU A 4 2.163 -7.160 -12.578 1.00 43.12 H new ATOM 0 HG3 GLU A 4 1.004 -5.906 -12.972 1.00 43.12 H new ATOM 62 N LEU A 5 3.343 -7.245 -9.738 1.00 65.34 N ATOM 63 CA LEU A 5 3.433 -8.623 -9.243 1.00 14.50 C ATOM 64 C LEU A 5 2.518 -8.854 -8.027 1.00 3.34 C ATOM 65 O LEU A 5 1.824 -9.871 -7.942 1.00 5.22 O ATOM 66 CB LEU A 5 4.890 -8.945 -8.875 1.00 25.22 C ATOM 67 CG LEU A 5 5.142 -10.359 -8.320 1.00 23.03 C ATOM 68 CD1 LEU A 5 4.733 -11.425 -9.337 1.00 33.22 C ATOM 69 CD2 LEU A 5 6.607 -10.521 -7.916 1.00 25.10 C ATOM 0 H LEU A 5 4.242 -6.766 -9.799 1.00 65.34 H new ATOM 0 HA LEU A 5 3.097 -9.289 -10.038 1.00 14.50 H new ATOM 0 HB2 LEU A 5 5.508 -8.807 -9.762 1.00 25.22 H new ATOM 0 HB3 LEU A 5 5.228 -8.219 -8.135 1.00 25.22 H new ATOM 0 HG LEU A 5 4.526 -10.493 -7.431 1.00 23.03 H new ATOM 0 HD11 LEU A 5 4.921 -12.415 -8.922 1.00 33.22 H new ATOM 0 HD12 LEU A 5 3.672 -11.322 -9.565 1.00 33.22 H new ATOM 0 HD13 LEU A 5 5.314 -11.299 -10.250 1.00 33.22 H new ATOM 0 HD21 LEU A 5 6.768 -11.526 -7.526 1.00 25.10 H new ATOM 0 HD22 LEU A 5 7.244 -10.363 -8.786 1.00 25.10 H new ATOM 0 HD23 LEU A 5 6.855 -9.789 -7.147 1.00 25.10 H new ATOM 81 N TYR A 6 2.516 -7.902 -7.094 1.00 22.23 N ATOM 82 CA TYR A 6 1.675 -7.996 -5.894 1.00 72.04 C ATOM 83 C TYR A 6 0.185 -7.872 -6.244 1.00 53.13 C ATOM 84 O TYR A 6 -0.627 -8.696 -5.836 1.00 32.42 O ATOM 85 CB TYR A 6 2.068 -6.909 -4.877 1.00 33.24 C ATOM 86 CG TYR A 6 1.180 -6.865 -3.640 1.00 2.33 C ATOM 87 CD1 TYR A 6 1.431 -7.684 -2.543 1.00 44.12 C ATOM 88 CD2 TYR A 6 0.087 -6.004 -3.573 1.00 22.54 C ATOM 89 CE1 TYR A 6 0.620 -7.646 -1.421 1.00 44.45 C ATOM 90 CE2 TYR A 6 -0.724 -5.961 -2.456 1.00 71.51 C ATOM 91 CZ TYR A 6 -0.455 -6.783 -1.383 1.00 22.14 C ATOM 92 OH TYR A 6 -1.265 -6.743 -0.269 1.00 1.32 O ATOM 0 H TYR A 6 3.085 -7.057 -7.143 1.00 22.23 H new ATOM 0 HA TYR A 6 1.839 -8.978 -5.450 1.00 72.04 H new ATOM 0 HB2 TYR A 6 3.099 -7.074 -4.565 1.00 33.24 H new ATOM 0 HB3 TYR A 6 2.036 -5.937 -5.369 1.00 33.24 H new ATOM 0 HD1 TYR A 6 2.272 -8.361 -2.567 1.00 44.12 H new ATOM 0 HD2 TYR A 6 -0.130 -5.358 -4.411 1.00 22.54 H new ATOM 0 HE1 TYR A 6 0.829 -8.290 -0.579 1.00 44.45 H new ATOM 0 HE2 TYR A 6 -1.566 -5.286 -2.423 1.00 71.51 H new ATOM 0 HH TYR A 6 -1.975 -6.081 -0.404 1.00 1.32 H new ATOM 102 N ARG A 7 -0.166 -6.838 -7.007 1.00 42.11 N ATOM 103 CA ARG A 7 -1.569 -6.580 -7.362 1.00 71.34 C ATOM 104 C ARG A 7 -2.168 -7.712 -8.210 1.00 22.51 C ATOM 105 O ARG A 7 -3.337 -8.072 -8.051 1.00 4.54 O ATOM 106 CB ARG A 7 -1.690 -5.241 -8.102 1.00 10.44 C ATOM 107 CG ARG A 7 -1.251 -4.048 -7.259 1.00 60.04 C ATOM 108 CD ARG A 7 -1.584 -2.711 -7.912 1.00 25.11 C ATOM 109 NE ARG A 7 -0.768 -2.425 -9.092 1.00 22.51 N ATOM 110 CZ ARG A 7 -0.682 -1.239 -9.634 1.00 60.54 C ATOM 111 NH1 ARG A 7 -1.337 -0.247 -9.126 1.00 14.23 N ATOM 112 NH2 ARG A 7 0.053 -1.040 -10.676 1.00 23.05 N ATOM 0 H ARG A 7 0.496 -6.165 -7.392 1.00 42.11 H new ATOM 0 HA ARG A 7 -2.138 -6.533 -6.433 1.00 71.34 H new ATOM 0 HB2 ARG A 7 -1.087 -5.279 -9.009 1.00 10.44 H new ATOM 0 HB3 ARG A 7 -2.725 -5.097 -8.413 1.00 10.44 H new ATOM 0 HG2 ARG A 7 -1.733 -4.101 -6.283 1.00 60.04 H new ATOM 0 HG3 ARG A 7 -0.176 -4.106 -7.087 1.00 60.04 H new ATOM 0 HD2 ARG A 7 -2.636 -2.705 -8.196 1.00 25.11 H new ATOM 0 HD3 ARG A 7 -1.447 -1.914 -7.182 1.00 25.11 H new ATOM 0 HE ARG A 7 -0.240 -3.189 -9.513 1.00 22.51 H new ATOM 0 HH11 ARG A 7 -1.921 -0.390 -8.302 1.00 14.23 H new ATOM 0 HH12 ARG A 7 -1.270 0.679 -9.549 1.00 14.23 H new ATOM 0 HH21 ARG A 7 0.576 -1.814 -11.087 1.00 23.05 H new ATOM 0 HH22 ARG A 7 0.111 -0.109 -11.089 1.00 23.05 H new ATOM 126 N GLN A 8 -1.363 -8.266 -9.110 1.00 21.53 N ATOM 127 CA GLN A 8 -1.800 -9.377 -9.957 1.00 64.25 C ATOM 128 C GLN A 8 -1.987 -10.662 -9.135 1.00 74.33 C ATOM 129 O GLN A 8 -3.044 -11.290 -9.179 1.00 74.23 O ATOM 130 CB GLN A 8 -0.780 -9.610 -11.079 1.00 1.42 C ATOM 131 CG GLN A 8 -1.206 -10.662 -12.099 1.00 44.53 C ATOM 132 CD GLN A 8 -0.194 -10.839 -13.219 1.00 64.52 C ATOM 133 OE1 GLN A 8 -0.151 -12.020 -13.800 1.00 61.41 O flip ATOM 134 NE2 GLN A 8 0.525 -9.915 -13.577 1.00 43.23 N flip ATOM 0 H GLN A 8 -0.402 -7.965 -9.274 1.00 21.53 H new ATOM 0 HA GLN A 8 -2.763 -9.115 -10.394 1.00 64.25 H new ATOM 0 HB2 GLN A 8 -0.604 -8.667 -11.597 1.00 1.42 H new ATOM 0 HB3 GLN A 8 0.169 -9.912 -10.636 1.00 1.42 H new ATOM 0 HG2 GLN A 8 -1.351 -11.616 -11.592 1.00 44.53 H new ATOM 0 HG3 GLN A 8 -2.168 -10.379 -12.526 1.00 44.53 H new ATOM 0 HE21 GLN A 8 0.467 -9.012 -13.106 1.00 43.23 H new ATOM 0 HE22 GLN A 8 1.182 -10.048 -14.346 1.00 43.23 H new ATOM 143 N SER A 9 -0.959 -11.037 -8.369 1.00 74.04 N ATOM 144 CA SER A 9 -1.018 -12.242 -7.523 1.00 12.53 C ATOM 145 C SER A 9 -2.162 -12.153 -6.507 1.00 20.22 C ATOM 146 O SER A 9 -2.984 -13.064 -6.404 1.00 74.53 O ATOM 147 CB SER A 9 0.310 -12.453 -6.781 1.00 65.51 C ATOM 148 OG SER A 9 0.617 -11.350 -5.946 1.00 42.00 O ATOM 0 H SER A 9 -0.077 -10.528 -8.314 1.00 74.04 H new ATOM 0 HA SER A 9 -1.200 -13.092 -8.181 1.00 12.53 H new ATOM 0 HB2 SER A 9 0.253 -13.361 -6.181 1.00 65.51 H new ATOM 0 HB3 SER A 9 1.113 -12.599 -7.504 1.00 65.51 H new ATOM 0 HG SER A 9 1.063 -10.655 -6.473 1.00 42.00 H new ATOM 154 N LEU A 10 -2.205 -11.049 -5.762 1.00 74.31 N ATOM 155 CA LEU A 10 -3.271 -10.801 -4.783 1.00 25.10 C ATOM 156 C LEU A 10 -4.664 -10.954 -5.410 1.00 24.33 C ATOM 157 O LEU A 10 -5.550 -11.580 -4.829 1.00 20.43 O ATOM 158 CB LEU A 10 -3.126 -9.395 -4.181 1.00 31.42 C ATOM 159 CG LEU A 10 -4.188 -9.010 -3.135 1.00 62.53 C ATOM 160 CD1 LEU A 10 -4.121 -9.944 -1.928 1.00 63.24 C ATOM 161 CD2 LEU A 10 -4.022 -7.554 -2.707 1.00 40.10 C ATOM 0 H LEU A 10 -1.510 -10.305 -5.816 1.00 74.31 H new ATOM 0 HA LEU A 10 -3.171 -11.547 -3.995 1.00 25.10 H new ATOM 0 HB2 LEU A 10 -2.141 -9.316 -3.720 1.00 31.42 H new ATOM 0 HB3 LEU A 10 -3.158 -8.667 -4.991 1.00 31.42 H new ATOM 0 HG LEU A 10 -5.172 -9.118 -3.592 1.00 62.53 H new ATOM 0 HD11 LEU A 10 -4.880 -9.654 -1.201 1.00 63.24 H new ATOM 0 HD12 LEU A 10 -4.301 -10.969 -2.251 1.00 63.24 H new ATOM 0 HD13 LEU A 10 -3.135 -9.876 -1.469 1.00 63.24 H new ATOM 0 HD21 LEU A 10 -4.783 -7.303 -1.968 1.00 40.10 H new ATOM 0 HD22 LEU A 10 -3.033 -7.413 -2.272 1.00 40.10 H new ATOM 0 HD23 LEU A 10 -4.132 -6.905 -3.575 1.00 40.10 H new ATOM 173 N GLU A 11 -4.852 -10.383 -6.601 1.00 64.45 N ATOM 174 CA GLU A 11 -6.140 -10.470 -7.295 1.00 41.43 C ATOM 175 C GLU A 11 -6.491 -11.928 -7.637 1.00 5.41 C ATOM 176 O GLU A 11 -7.578 -12.407 -7.310 1.00 45.20 O ATOM 177 CB GLU A 11 -6.123 -9.631 -8.579 1.00 2.12 C ATOM 178 CG GLU A 11 -7.494 -9.512 -9.238 1.00 4.04 C ATOM 179 CD GLU A 11 -7.440 -8.910 -10.631 1.00 62.04 C ATOM 180 OE1 GLU A 11 -7.196 -7.690 -10.749 1.00 45.13 O ATOM 181 OE2 GLU A 11 -7.651 -9.657 -11.611 1.00 25.52 O ATOM 0 H GLU A 11 -4.135 -9.859 -7.103 1.00 64.45 H new ATOM 0 HA GLU A 11 -6.901 -10.077 -6.621 1.00 41.43 H new ATOM 0 HB2 GLU A 11 -5.750 -8.633 -8.348 1.00 2.12 H new ATOM 0 HB3 GLU A 11 -5.424 -10.076 -9.287 1.00 2.12 H new ATOM 0 HG2 GLU A 11 -7.950 -10.501 -9.294 1.00 4.04 H new ATOM 0 HG3 GLU A 11 -8.140 -8.899 -8.609 1.00 4.04 H new ATOM 188 N ILE A 12 -5.554 -12.630 -8.279 1.00 21.14 N ATOM 189 CA ILE A 12 -5.756 -14.033 -8.669 1.00 63.33 C ATOM 190 C ILE A 12 -6.137 -14.904 -7.459 1.00 45.14 C ATOM 191 O ILE A 12 -7.102 -15.670 -7.505 1.00 24.25 O ATOM 192 CB ILE A 12 -4.482 -14.618 -9.338 1.00 41.22 C ATOM 193 CG1 ILE A 12 -4.115 -13.816 -10.599 1.00 12.43 C ATOM 194 CG2 ILE A 12 -4.677 -16.097 -9.680 1.00 31.23 C ATOM 195 CD1 ILE A 12 -2.843 -14.285 -11.276 1.00 51.41 C ATOM 0 H ILE A 12 -4.644 -12.251 -8.542 1.00 21.14 H new ATOM 0 HA ILE A 12 -6.576 -14.047 -9.387 1.00 63.33 H new ATOM 0 HB ILE A 12 -3.659 -14.538 -8.628 1.00 41.22 H new ATOM 0 HG12 ILE A 12 -4.938 -13.879 -11.310 1.00 12.43 H new ATOM 0 HG13 ILE A 12 -4.006 -12.765 -10.331 1.00 12.43 H new ATOM 0 HG21 ILE A 12 -3.772 -16.485 -10.147 1.00 31.23 H new ATOM 0 HG22 ILE A 12 -4.883 -16.657 -8.768 1.00 31.23 H new ATOM 0 HG23 ILE A 12 -5.515 -16.204 -10.369 1.00 31.23 H new ATOM 0 HD11 ILE A 12 -2.652 -13.671 -12.156 1.00 51.41 H new ATOM 0 HD12 ILE A 12 -2.007 -14.195 -10.582 1.00 51.41 H new ATOM 0 HD13 ILE A 12 -2.954 -15.327 -11.577 1.00 51.41 H new ATOM 207 N ILE A 13 -5.374 -14.771 -6.379 1.00 54.51 N ATOM 208 CA ILE A 13 -5.623 -15.527 -5.148 1.00 62.34 C ATOM 209 C ILE A 13 -6.978 -15.153 -4.518 1.00 3.42 C ATOM 210 O ILE A 13 -7.787 -16.028 -4.205 1.00 44.12 O ATOM 211 CB ILE A 13 -4.484 -15.293 -4.123 1.00 1.33 C ATOM 212 CG1 ILE A 13 -3.133 -15.711 -4.735 1.00 12.51 C ATOM 213 CG2 ILE A 13 -4.752 -16.056 -2.824 1.00 73.31 C ATOM 214 CD1 ILE A 13 -1.931 -15.400 -3.866 1.00 30.01 C ATOM 0 H ILE A 13 -4.572 -14.143 -6.328 1.00 54.51 H new ATOM 0 HA ILE A 13 -5.652 -16.583 -5.416 1.00 62.34 H new ATOM 0 HB ILE A 13 -4.446 -14.231 -3.881 1.00 1.33 H new ATOM 0 HG12 ILE A 13 -3.154 -16.782 -4.935 1.00 12.51 H new ATOM 0 HG13 ILE A 13 -3.012 -15.210 -5.695 1.00 12.51 H new ATOM 0 HG21 ILE A 13 -3.938 -15.875 -2.121 1.00 73.31 H new ATOM 0 HG22 ILE A 13 -5.691 -15.714 -2.388 1.00 73.31 H new ATOM 0 HG23 ILE A 13 -4.818 -17.123 -3.036 1.00 73.31 H new ATOM 0 HD11 ILE A 13 -1.022 -15.727 -4.372 1.00 30.01 H new ATOM 0 HD12 ILE A 13 -1.880 -14.326 -3.686 1.00 30.01 H new ATOM 0 HD13 ILE A 13 -2.025 -15.923 -2.914 1.00 30.01 H new ATOM 226 N SER A 14 -7.224 -13.852 -4.349 1.00 64.40 N ATOM 227 CA SER A 14 -8.487 -13.361 -3.768 1.00 41.33 C ATOM 228 C SER A 14 -9.709 -13.919 -4.509 1.00 15.31 C ATOM 229 O SER A 14 -10.597 -14.519 -3.900 1.00 1.33 O ATOM 230 CB SER A 14 -8.537 -11.827 -3.800 1.00 1.34 C ATOM 231 OG SER A 14 -9.799 -11.340 -3.360 1.00 64.43 O ATOM 0 H SER A 14 -6.568 -13.114 -4.605 1.00 64.40 H new ATOM 0 HA SER A 14 -8.519 -13.709 -2.735 1.00 41.33 H new ATOM 0 HB2 SER A 14 -7.748 -11.422 -3.166 1.00 1.34 H new ATOM 0 HB3 SER A 14 -8.343 -11.476 -4.814 1.00 1.34 H new ATOM 0 HG SER A 14 -9.800 -10.360 -3.390 1.00 64.43 H new ATOM 237 N ARG A 15 -9.739 -13.726 -5.828 1.00 40.32 N ATOM 238 CA ARG A 15 -10.861 -14.178 -6.661 1.00 72.53 C ATOM 239 C ARG A 15 -11.079 -15.695 -6.533 1.00 15.32 C ATOM 240 O ARG A 15 -12.194 -16.146 -6.266 1.00 51.32 O ATOM 241 CB ARG A 15 -10.619 -13.781 -8.126 1.00 54.11 C ATOM 242 CG ARG A 15 -10.445 -12.275 -8.313 1.00 75.34 C ATOM 243 CD ARG A 15 -9.983 -11.910 -9.719 1.00 24.14 C ATOM 244 NE ARG A 15 -11.031 -12.079 -10.720 1.00 63.14 N ATOM 245 CZ ARG A 15 -10.973 -11.590 -11.927 1.00 32.13 C ATOM 246 NH1 ARG A 15 -9.961 -10.877 -12.313 1.00 34.20 N ATOM 247 NH2 ARG A 15 -11.947 -11.801 -12.743 1.00 61.10 N ATOM 0 H ARG A 15 -8.997 -13.258 -6.347 1.00 40.32 H new ATOM 0 HA ARG A 15 -11.769 -13.689 -6.308 1.00 72.53 H new ATOM 0 HB2 ARG A 15 -9.730 -14.293 -8.494 1.00 54.11 H new ATOM 0 HB3 ARG A 15 -11.457 -14.123 -8.733 1.00 54.11 H new ATOM 0 HG2 ARG A 15 -11.390 -11.775 -8.104 1.00 75.34 H new ATOM 0 HG3 ARG A 15 -9.720 -11.904 -7.588 1.00 75.34 H new ATOM 0 HD2 ARG A 15 -9.642 -10.875 -9.727 1.00 24.14 H new ATOM 0 HD3 ARG A 15 -9.127 -12.529 -9.988 1.00 24.14 H new ATOM 0 HE ARG A 15 -11.860 -12.613 -10.459 1.00 63.14 H new ATOM 0 HH11 ARG A 15 -9.193 -10.691 -11.668 1.00 34.20 H new ATOM 0 HH12 ARG A 15 -9.933 -10.503 -13.261 1.00 34.20 H new ATOM 0 HH21 ARG A 15 -12.755 -12.347 -12.443 1.00 61.10 H new ATOM 0 HH22 ARG A 15 -11.911 -11.422 -13.689 1.00 61.10 H new ATOM 261 N TYR A 16 -10.003 -16.471 -6.694 1.00 70.34 N ATOM 262 CA TYR A 16 -10.065 -17.934 -6.546 1.00 25.42 C ATOM 263 C TYR A 16 -10.654 -18.338 -5.179 1.00 5.24 C ATOM 264 O TYR A 16 -11.529 -19.198 -5.100 1.00 40.13 O ATOM 265 CB TYR A 16 -8.665 -18.547 -6.701 1.00 53.15 C ATOM 266 CG TYR A 16 -8.639 -20.049 -6.484 1.00 60.15 C ATOM 267 CD1 TYR A 16 -9.244 -20.912 -7.390 1.00 12.52 C ATOM 268 CD2 TYR A 16 -8.023 -20.603 -5.366 1.00 51.00 C ATOM 269 CE1 TYR A 16 -9.232 -22.278 -7.191 1.00 14.32 C ATOM 270 CE2 TYR A 16 -8.007 -21.969 -5.162 1.00 23.54 C ATOM 271 CZ TYR A 16 -8.614 -22.801 -6.078 1.00 23.51 C ATOM 272 OH TYR A 16 -8.600 -24.162 -5.884 1.00 23.25 O ATOM 0 H TYR A 16 -9.077 -16.113 -6.927 1.00 70.34 H new ATOM 0 HA TYR A 16 -10.719 -18.315 -7.330 1.00 25.42 H new ATOM 0 HB2 TYR A 16 -8.287 -18.325 -7.699 1.00 53.15 H new ATOM 0 HB3 TYR A 16 -7.988 -18.073 -5.991 1.00 53.15 H new ATOM 0 HD1 TYR A 16 -9.732 -20.507 -8.264 1.00 12.52 H new ATOM 0 HD2 TYR A 16 -7.549 -19.953 -4.645 1.00 51.00 H new ATOM 0 HE1 TYR A 16 -9.706 -22.934 -7.906 1.00 14.32 H new ATOM 0 HE2 TYR A 16 -7.522 -22.383 -4.290 1.00 23.54 H new ATOM 0 HH TYR A 16 -8.168 -24.597 -6.649 1.00 23.25 H new ATOM 282 N LEU A 17 -10.162 -17.717 -4.106 1.00 63.42 N ATOM 283 CA LEU A 17 -10.658 -17.994 -2.750 1.00 13.24 C ATOM 284 C LEU A 17 -12.166 -17.706 -2.623 1.00 21.12 C ATOM 285 O LEU A 17 -12.917 -18.515 -2.069 1.00 31.45 O ATOM 286 CB LEU A 17 -9.865 -17.177 -1.709 1.00 24.13 C ATOM 287 CG LEU A 17 -8.620 -17.874 -1.122 1.00 33.13 C ATOM 288 CD1 LEU A 17 -7.685 -18.369 -2.223 1.00 62.12 C ATOM 289 CD2 LEU A 17 -7.882 -16.936 -0.168 1.00 71.03 C ATOM 0 H LEU A 17 -9.420 -17.018 -4.146 1.00 63.42 H new ATOM 0 HA LEU A 17 -10.508 -19.056 -2.556 1.00 13.24 H new ATOM 0 HB2 LEU A 17 -9.551 -16.241 -2.171 1.00 24.13 H new ATOM 0 HB3 LEU A 17 -10.535 -16.919 -0.889 1.00 24.13 H new ATOM 0 HG LEU A 17 -8.959 -18.745 -0.561 1.00 33.13 H new ATOM 0 HD11 LEU A 17 -6.819 -18.855 -1.774 1.00 62.12 H new ATOM 0 HD12 LEU A 17 -8.213 -19.082 -2.856 1.00 62.12 H new ATOM 0 HD13 LEU A 17 -7.354 -17.524 -2.827 1.00 62.12 H new ATOM 0 HD21 LEU A 17 -7.007 -17.444 0.237 1.00 71.03 H new ATOM 0 HD22 LEU A 17 -7.566 -16.043 -0.707 1.00 71.03 H new ATOM 0 HD23 LEU A 17 -8.546 -16.651 0.648 1.00 71.03 H new ATOM 301 N ARG A 18 -12.609 -16.562 -3.149 1.00 43.04 N ATOM 302 CA ARG A 18 -14.030 -16.192 -3.092 1.00 23.25 C ATOM 303 C ARG A 18 -14.900 -17.202 -3.862 1.00 62.10 C ATOM 304 O ARG A 18 -15.856 -17.754 -3.314 1.00 31.31 O ATOM 305 CB ARG A 18 -14.255 -14.776 -3.653 1.00 51.10 C ATOM 306 CG ARG A 18 -13.432 -13.690 -2.961 1.00 3.42 C ATOM 307 CD ARG A 18 -13.764 -13.555 -1.475 1.00 72.53 C ATOM 308 NE ARG A 18 -15.127 -13.074 -1.243 1.00 62.43 N ATOM 309 CZ ARG A 18 -15.419 -11.978 -0.589 1.00 45.43 C ATOM 310 NH1 ARG A 18 -14.478 -11.210 -0.145 1.00 2.54 N ATOM 311 NH2 ARG A 18 -16.652 -11.649 -0.382 1.00 44.41 N ATOM 0 H ARG A 18 -12.012 -15.879 -3.616 1.00 43.04 H new ATOM 0 HA ARG A 18 -14.327 -16.206 -2.043 1.00 23.25 H new ATOM 0 HB2 ARG A 18 -14.015 -14.776 -4.716 1.00 51.10 H new ATOM 0 HB3 ARG A 18 -15.312 -14.526 -3.565 1.00 51.10 H new ATOM 0 HG2 ARG A 18 -12.372 -13.917 -3.073 1.00 3.42 H new ATOM 0 HG3 ARG A 18 -13.608 -12.735 -3.457 1.00 3.42 H new ATOM 0 HD2 ARG A 18 -13.637 -14.522 -0.989 1.00 72.53 H new ATOM 0 HD3 ARG A 18 -13.057 -12.869 -1.010 1.00 72.53 H new ATOM 0 HE ARG A 18 -15.899 -13.628 -1.615 1.00 62.43 H new ATOM 0 HH11 ARG A 18 -13.501 -11.457 -0.304 1.00 2.54 H new ATOM 0 HH12 ARG A 18 -14.713 -10.358 0.364 1.00 2.54 H new ATOM 0 HH21 ARG A 18 -17.404 -12.245 -0.729 1.00 44.41 H new ATOM 0 HH22 ARG A 18 -16.873 -10.794 0.128 1.00 44.41 H new ATOM 325 N GLU A 19 -14.553 -17.456 -5.123 1.00 43.14 N ATOM 326 CA GLU A 19 -15.324 -18.383 -5.964 1.00 42.44 C ATOM 327 C GLU A 19 -15.266 -19.826 -5.430 1.00 34.42 C ATOM 328 O GLU A 19 -16.242 -20.571 -5.518 1.00 40.35 O ATOM 329 CB GLU A 19 -14.830 -18.336 -7.418 1.00 13.13 C ATOM 330 CG GLU A 19 -13.369 -18.719 -7.603 1.00 62.14 C ATOM 331 CD GLU A 19 -12.982 -18.875 -9.066 1.00 3.32 C ATOM 332 OE1 GLU A 19 -12.991 -17.869 -9.807 1.00 73.34 O ATOM 333 OE2 GLU A 19 -12.668 -20.009 -9.479 1.00 21.53 O ATOM 0 H GLU A 19 -13.747 -17.037 -5.587 1.00 43.14 H new ATOM 0 HA GLU A 19 -16.364 -18.058 -5.932 1.00 42.44 H new ATOM 0 HB2 GLU A 19 -15.446 -19.005 -8.019 1.00 13.13 H new ATOM 0 HB3 GLU A 19 -14.980 -17.329 -7.807 1.00 13.13 H new ATOM 0 HG2 GLU A 19 -12.738 -17.958 -7.144 1.00 62.14 H new ATOM 0 HG3 GLU A 19 -13.174 -19.654 -7.078 1.00 62.14 H new ATOM 340 N GLN A 20 -14.123 -20.210 -4.865 1.00 73.13 N ATOM 341 CA GLN A 20 -13.955 -21.545 -4.275 1.00 11.42 C ATOM 342 C GLN A 20 -14.793 -21.694 -2.992 1.00 73.20 C ATOM 343 O GLN A 20 -15.163 -22.804 -2.601 1.00 23.35 O ATOM 344 CB GLN A 20 -12.467 -21.800 -3.976 1.00 43.42 C ATOM 345 CG GLN A 20 -12.151 -23.190 -3.420 1.00 22.11 C ATOM 346 CD GLN A 20 -12.499 -24.328 -4.371 1.00 33.55 C ATOM 347 OE1 GLN A 20 -12.817 -25.432 -3.940 1.00 42.24 O ATOM 348 NE2 GLN A 20 -12.429 -24.080 -5.664 1.00 72.22 N ATOM 0 H GLN A 20 -13.295 -19.617 -4.801 1.00 73.13 H new ATOM 0 HA GLN A 20 -14.308 -22.286 -4.992 1.00 11.42 H new ATOM 0 HB2 GLN A 20 -11.897 -21.653 -4.893 1.00 43.42 H new ATOM 0 HB3 GLN A 20 -12.121 -21.052 -3.263 1.00 43.42 H new ATOM 0 HG2 GLN A 20 -11.089 -23.242 -3.180 1.00 22.11 H new ATOM 0 HG3 GLN A 20 -12.696 -23.330 -2.486 1.00 22.11 H new ATOM 0 HE21 GLN A 20 -12.162 -23.152 -5.992 1.00 72.22 H new ATOM 0 HE22 GLN A 20 -12.642 -24.816 -6.337 1.00 72.22 H new ATOM 357 N ALA A 21 -15.074 -20.570 -2.334 1.00 71.33 N ATOM 358 CA ALA A 21 -15.916 -20.560 -1.130 1.00 2.13 C ATOM 359 C ALA A 21 -17.415 -20.452 -1.471 1.00 70.12 C ATOM 360 O ALA A 21 -18.267 -20.969 -0.742 1.00 53.42 O ATOM 361 CB ALA A 21 -15.500 -19.413 -0.214 1.00 41.51 C ATOM 0 H ALA A 21 -14.732 -19.650 -2.612 1.00 71.33 H new ATOM 0 HA ALA A 21 -15.768 -21.510 -0.617 1.00 2.13 H new ATOM 0 HB1 ALA A 21 -16.129 -19.412 0.676 1.00 41.51 H new ATOM 0 HB2 ALA A 21 -14.458 -19.540 0.078 1.00 41.51 H new ATOM 0 HB3 ALA A 21 -15.616 -18.466 -0.741 1.00 41.51 H new ATOM 367 N THR A 22 -17.735 -19.772 -2.573 1.00 50.01 N ATOM 368 CA THR A 22 -19.136 -19.564 -2.986 1.00 14.33 C ATOM 369 C THR A 22 -19.660 -20.713 -3.857 1.00 1.21 C ATOM 370 O THR A 22 -20.821 -21.115 -3.743 1.00 14.32 O ATOM 371 CB THR A 22 -19.306 -18.255 -3.796 1.00 11.04 C ATOM 372 OG1 THR A 22 -18.578 -18.351 -5.030 1.00 0.21 O ATOM 373 CG2 THR A 22 -18.820 -17.042 -3.007 1.00 32.43 C ATOM 0 H THR A 22 -17.048 -19.353 -3.200 1.00 50.01 H new ATOM 0 HA THR A 22 -19.706 -19.513 -2.058 1.00 14.33 H new ATOM 0 HB THR A 22 -20.368 -18.122 -4.001 1.00 11.04 H new ATOM 0 HG1 THR A 22 -18.689 -17.522 -5.541 1.00 0.21 H new ATOM 0 HG21 THR A 22 -18.954 -16.141 -3.606 1.00 32.43 H new ATOM 0 HG22 THR A 22 -19.394 -16.954 -2.085 1.00 32.43 H new ATOM 0 HG23 THR A 22 -17.764 -17.164 -2.766 1.00 32.43 H new ATOM 381 N GLY A 23 -18.796 -21.235 -4.723 1.00 43.53 N ATOM 382 CA GLY A 23 -19.205 -22.241 -5.699 1.00 34.32 C ATOM 383 C GLY A 23 -19.421 -21.647 -7.092 1.00 13.31 C ATOM 384 O GLY A 23 -19.636 -22.374 -8.064 1.00 65.25 O ATOM 0 H GLY A 23 -17.810 -20.979 -4.769 1.00 43.53 H new ATOM 0 HA2 GLY A 23 -18.445 -23.021 -5.753 1.00 34.32 H new ATOM 0 HA3 GLY A 23 -20.126 -22.716 -5.363 1.00 34.32 H new ATOM 541 N GLY A 34 -3.126 -10.165 -18.996 1.00 1.30 N ATOM 542 CA GLY A 34 -4.383 -10.823 -19.347 1.00 23.02 C ATOM 543 C GLY A 34 -4.297 -12.347 -19.353 1.00 52.03 C ATOM 544 O GLY A 34 -4.669 -13.005 -18.375 1.00 53.32 O ATOM 0 HA2 GLY A 34 -5.154 -10.514 -18.641 1.00 23.02 H new ATOM 0 HA3 GLY A 34 -4.699 -10.482 -20.333 1.00 23.02 H new ATOM 548 N ALA A 35 -3.794 -12.907 -20.454 1.00 32.31 N ATOM 549 CA ALA A 35 -3.737 -14.363 -20.644 1.00 55.11 C ATOM 550 C ALA A 35 -3.077 -15.087 -19.460 1.00 3.42 C ATOM 551 O ALA A 35 -3.640 -16.036 -18.916 1.00 41.42 O ATOM 552 CB ALA A 35 -2.992 -14.691 -21.935 1.00 51.42 C ATOM 0 H ALA A 35 -3.416 -12.372 -21.236 1.00 32.31 H new ATOM 0 HA ALA A 35 -4.765 -14.720 -20.707 1.00 55.11 H new ATOM 0 HB1 ALA A 35 -2.954 -15.772 -22.069 1.00 51.42 H new ATOM 0 HB2 ALA A 35 -3.512 -14.239 -22.780 1.00 51.42 H new ATOM 0 HB3 ALA A 35 -1.977 -14.296 -21.880 1.00 51.42 H new ATOM 558 N THR A 36 -1.897 -14.619 -19.052 1.00 14.02 N ATOM 559 CA THR A 36 -1.144 -15.248 -17.955 1.00 71.45 C ATOM 560 C THR A 36 -1.977 -15.356 -16.669 1.00 24.14 C ATOM 561 O THR A 36 -2.088 -16.433 -16.080 1.00 21.03 O ATOM 562 CB THR A 36 0.169 -14.482 -17.653 1.00 3.22 C ATOM 563 OG1 THR A 36 1.045 -14.548 -18.788 1.00 11.01 O ATOM 564 CG2 THR A 36 0.883 -15.055 -16.432 1.00 11.21 C ATOM 0 H THR A 36 -1.438 -13.806 -19.462 1.00 14.02 H new ATOM 0 HA THR A 36 -0.900 -16.255 -18.294 1.00 71.45 H new ATOM 0 HB THR A 36 -0.093 -13.445 -17.443 1.00 3.22 H new ATOM 0 HG1 THR A 36 1.882 -14.989 -18.530 1.00 11.01 H new ATOM 0 HG21 THR A 36 1.799 -14.494 -16.250 1.00 11.21 H new ATOM 0 HG22 THR A 36 0.232 -14.980 -15.561 1.00 11.21 H new ATOM 0 HG23 THR A 36 1.128 -16.102 -16.612 1.00 11.21 H new ATOM 572 N SER A 37 -2.567 -14.243 -16.237 1.00 40.31 N ATOM 573 CA SER A 37 -3.426 -14.243 -15.042 1.00 21.23 C ATOM 574 C SER A 37 -4.636 -15.177 -15.205 1.00 3.34 C ATOM 575 O SER A 37 -4.996 -15.907 -14.278 1.00 74.00 O ATOM 576 CB SER A 37 -3.914 -12.828 -14.723 1.00 22.11 C ATOM 577 OG SER A 37 -2.828 -11.959 -14.462 1.00 74.22 O ATOM 0 H SER A 37 -2.471 -13.334 -16.689 1.00 40.31 H new ATOM 0 HA SER A 37 -2.818 -14.612 -14.216 1.00 21.23 H new ATOM 0 HB2 SER A 37 -4.497 -12.444 -15.560 1.00 22.11 H new ATOM 0 HB3 SER A 37 -4.577 -12.855 -13.858 1.00 22.11 H new ATOM 0 HG SER A 37 -2.024 -12.487 -14.274 1.00 74.22 H new ATOM 583 N ARG A 38 -5.263 -15.151 -16.382 1.00 32.22 N ATOM 584 CA ARG A 38 -6.407 -16.030 -16.668 1.00 53.41 C ATOM 585 C ARG A 38 -6.000 -17.510 -16.568 1.00 41.03 C ATOM 586 O ARG A 38 -6.729 -18.334 -16.010 1.00 50.41 O ATOM 587 CB ARG A 38 -6.973 -15.731 -18.067 1.00 3.13 C ATOM 588 CG ARG A 38 -7.493 -14.302 -18.237 1.00 64.15 C ATOM 589 CD ARG A 38 -8.758 -14.037 -17.419 1.00 50.24 C ATOM 590 NE ARG A 38 -9.913 -14.784 -17.923 1.00 31.51 N ATOM 591 CZ ARG A 38 -11.157 -14.395 -17.796 1.00 73.43 C ATOM 592 NH1 ARG A 38 -11.443 -13.285 -17.195 1.00 43.53 N ATOM 593 NH2 ARG A 38 -12.118 -15.115 -18.273 1.00 62.22 N ATOM 0 H ARG A 38 -5.002 -14.535 -17.152 1.00 32.22 H new ATOM 0 HA ARG A 38 -7.179 -15.835 -15.924 1.00 53.41 H new ATOM 0 HB2 ARG A 38 -6.196 -15.914 -18.809 1.00 3.13 H new ATOM 0 HB3 ARG A 38 -7.784 -16.429 -18.276 1.00 3.13 H new ATOM 0 HG2 ARG A 38 -6.716 -13.598 -17.937 1.00 64.15 H new ATOM 0 HG3 ARG A 38 -7.701 -14.117 -19.291 1.00 64.15 H new ATOM 0 HD2 ARG A 38 -8.579 -14.308 -16.379 1.00 50.24 H new ATOM 0 HD3 ARG A 38 -8.982 -12.970 -17.436 1.00 50.24 H new ATOM 0 HE ARG A 38 -9.737 -15.666 -18.405 1.00 31.51 H new ATOM 0 HH11 ARG A 38 -10.696 -12.704 -16.815 1.00 43.53 H new ATOM 0 HH12 ARG A 38 -12.415 -12.991 -17.102 1.00 43.53 H new ATOM 0 HH21 ARG A 38 -11.910 -15.991 -18.751 1.00 62.22 H new ATOM 0 HH22 ARG A 38 -13.085 -14.807 -18.171 1.00 62.22 H new ATOM 607 N LYS A 39 -4.820 -17.827 -17.103 1.00 14.30 N ATOM 608 CA LYS A 39 -4.265 -19.186 -17.054 1.00 31.43 C ATOM 609 C LYS A 39 -3.973 -19.621 -15.609 1.00 32.34 C ATOM 610 O LYS A 39 -4.267 -20.752 -15.221 1.00 70.20 O ATOM 611 CB LYS A 39 -2.976 -19.251 -17.892 1.00 32.22 C ATOM 612 CG LYS A 39 -3.192 -18.987 -19.381 1.00 22.20 C ATOM 613 CD LYS A 39 -1.884 -18.678 -20.114 1.00 13.44 C ATOM 614 CE LYS A 39 -0.883 -19.826 -20.038 1.00 0.03 C ATOM 615 NZ LYS A 39 0.348 -19.540 -20.823 1.00 52.02 N ATOM 0 H LYS A 39 -4.222 -17.154 -17.582 1.00 14.30 H new ATOM 0 HA LYS A 39 -5.006 -19.870 -17.467 1.00 31.43 H new ATOM 0 HB2 LYS A 39 -2.264 -18.522 -17.503 1.00 32.22 H new ATOM 0 HB3 LYS A 39 -2.524 -20.235 -17.769 1.00 32.22 H new ATOM 0 HG2 LYS A 39 -3.664 -19.857 -19.837 1.00 22.20 H new ATOM 0 HG3 LYS A 39 -3.880 -18.151 -19.503 1.00 22.20 H new ATOM 0 HD2 LYS A 39 -2.101 -18.459 -21.159 1.00 13.44 H new ATOM 0 HD3 LYS A 39 -1.436 -17.781 -19.687 1.00 13.44 H new ATOM 0 HE2 LYS A 39 -0.616 -20.007 -18.997 1.00 0.03 H new ATOM 0 HE3 LYS A 39 -1.348 -20.739 -20.411 1.00 0.03 H new ATOM 0 HZ1 LYS A 39 1.003 -20.344 -20.746 1.00 52.02 H new ATOM 0 HZ2 LYS A 39 0.097 -19.392 -21.821 1.00 52.02 H new ATOM 0 HZ3 LYS A 39 0.806 -18.683 -20.451 1.00 52.02 H new ATOM 629 N ALA A 40 -3.385 -18.719 -14.822 1.00 24.33 N ATOM 630 CA ALA A 40 -3.075 -18.993 -13.413 1.00 24.13 C ATOM 631 C ALA A 40 -4.347 -19.305 -12.605 1.00 71.01 C ATOM 632 O ALA A 40 -4.447 -20.355 -11.967 1.00 43.12 O ATOM 633 CB ALA A 40 -2.333 -17.810 -12.800 1.00 3.31 C ATOM 0 H ALA A 40 -3.112 -17.788 -15.136 1.00 24.33 H new ATOM 0 HA ALA A 40 -2.435 -19.875 -13.375 1.00 24.13 H new ATOM 0 HB1 ALA A 40 -2.108 -18.024 -11.755 1.00 3.31 H new ATOM 0 HB2 ALA A 40 -1.404 -17.642 -13.344 1.00 3.31 H new ATOM 0 HB3 ALA A 40 -2.956 -16.918 -12.862 1.00 3.31 H new ATOM 639 N LEU A 41 -5.317 -18.389 -12.650 1.00 32.12 N ATOM 640 CA LEU A 41 -6.610 -18.580 -11.973 1.00 34.11 C ATOM 641 C LEU A 41 -7.272 -19.897 -12.412 1.00 34.33 C ATOM 642 O LEU A 41 -7.819 -20.640 -11.595 1.00 44.13 O ATOM 643 CB LEU A 41 -7.542 -17.394 -12.276 1.00 55.52 C ATOM 644 CG LEU A 41 -8.927 -17.449 -11.608 1.00 72.40 C ATOM 645 CD1 LEU A 41 -8.796 -17.431 -10.087 1.00 75.14 C ATOM 646 CD2 LEU A 41 -9.802 -16.294 -12.092 1.00 11.23 C ATOM 0 H LEU A 41 -5.235 -17.503 -13.149 1.00 32.12 H new ATOM 0 HA LEU A 41 -6.430 -18.631 -10.899 1.00 34.11 H new ATOM 0 HB2 LEU A 41 -7.045 -16.475 -11.965 1.00 55.52 H new ATOM 0 HB3 LEU A 41 -7.681 -17.331 -13.355 1.00 55.52 H new ATOM 0 HG LEU A 41 -9.408 -18.385 -11.894 1.00 72.40 H new ATOM 0 HD11 LEU A 41 -9.787 -17.471 -9.636 1.00 75.14 H new ATOM 0 HD12 LEU A 41 -8.215 -18.294 -9.762 1.00 75.14 H new ATOM 0 HD13 LEU A 41 -8.292 -16.516 -9.776 1.00 75.14 H new ATOM 0 HD21 LEU A 41 -10.778 -16.349 -11.609 1.00 11.23 H new ATOM 0 HD22 LEU A 41 -9.326 -15.346 -11.840 1.00 11.23 H new ATOM 0 HD23 LEU A 41 -9.928 -16.361 -13.173 1.00 11.23 H new ATOM 658 N GLU A 42 -7.195 -20.180 -13.711 1.00 72.51 N ATOM 659 CA GLU A 42 -7.738 -21.418 -14.276 1.00 15.32 C ATOM 660 C GLU A 42 -7.032 -22.657 -13.700 1.00 60.43 C ATOM 661 O GLU A 42 -7.679 -23.622 -13.281 1.00 44.45 O ATOM 662 CB GLU A 42 -7.597 -21.386 -15.807 1.00 70.25 C ATOM 663 CG GLU A 42 -8.187 -22.600 -16.521 1.00 5.12 C ATOM 664 CD GLU A 42 -9.659 -22.812 -16.202 1.00 24.12 C ATOM 665 OE1 GLU A 42 -10.436 -21.834 -16.269 1.00 53.13 O ATOM 666 OE2 GLU A 42 -10.047 -23.954 -15.887 1.00 2.12 O ATOM 0 H GLU A 42 -6.759 -19.565 -14.398 1.00 72.51 H new ATOM 0 HA GLU A 42 -8.792 -21.487 -14.007 1.00 15.32 H new ATOM 0 HB2 GLU A 42 -8.082 -20.486 -16.185 1.00 70.25 H new ATOM 0 HB3 GLU A 42 -6.540 -21.309 -16.061 1.00 70.25 H new ATOM 0 HG2 GLU A 42 -8.067 -22.477 -17.597 1.00 5.12 H new ATOM 0 HG3 GLU A 42 -7.626 -23.491 -16.238 1.00 5.12 H new ATOM 673 N THR A 43 -5.703 -22.613 -13.670 1.00 3.31 N ATOM 674 CA THR A 43 -4.896 -23.729 -13.161 1.00 74.41 C ATOM 675 C THR A 43 -5.191 -24.008 -11.681 1.00 44.11 C ATOM 676 O THR A 43 -5.312 -25.164 -11.273 1.00 70.44 O ATOM 677 CB THR A 43 -3.378 -23.466 -13.338 1.00 30.23 C ATOM 678 OG1 THR A 43 -3.076 -23.242 -14.723 1.00 51.42 O ATOM 679 CG2 THR A 43 -2.544 -24.640 -12.829 1.00 30.34 C ATOM 0 H THR A 43 -5.156 -21.815 -13.993 1.00 3.31 H new ATOM 0 HA THR A 43 -5.173 -24.603 -13.750 1.00 74.41 H new ATOM 0 HB THR A 43 -3.126 -22.582 -12.753 1.00 30.23 H new ATOM 0 HG1 THR A 43 -3.455 -22.384 -15.006 1.00 51.42 H new ATOM 0 HG21 THR A 43 -1.485 -24.422 -12.969 1.00 30.34 H new ATOM 0 HG22 THR A 43 -2.746 -24.797 -11.769 1.00 30.34 H new ATOM 0 HG23 THR A 43 -2.805 -25.540 -13.385 1.00 30.34 H new ATOM 687 N LEU A 44 -5.335 -22.945 -10.887 1.00 24.01 N ATOM 688 CA LEU A 44 -5.605 -23.075 -9.446 1.00 71.01 C ATOM 689 C LEU A 44 -6.829 -23.964 -9.162 1.00 23.04 C ATOM 690 O LEU A 44 -6.870 -24.671 -8.156 1.00 22.41 O ATOM 691 CB LEU A 44 -5.817 -21.692 -8.813 1.00 3.24 C ATOM 692 CG LEU A 44 -4.575 -20.786 -8.764 1.00 11.22 C ATOM 693 CD1 LEU A 44 -4.919 -19.426 -8.159 1.00 31.35 C ATOM 694 CD2 LEU A 44 -3.450 -21.458 -7.978 1.00 61.22 C ATOM 0 H LEU A 44 -5.270 -21.981 -11.214 1.00 24.01 H new ATOM 0 HA LEU A 44 -4.733 -23.554 -9.001 1.00 71.01 H new ATOM 0 HB2 LEU A 44 -6.600 -21.175 -9.367 1.00 3.24 H new ATOM 0 HB3 LEU A 44 -6.184 -21.830 -7.796 1.00 3.24 H new ATOM 0 HG LEU A 44 -4.230 -20.625 -9.785 1.00 11.22 H new ATOM 0 HD11 LEU A 44 -4.025 -18.802 -8.134 1.00 31.35 H new ATOM 0 HD12 LEU A 44 -5.684 -18.941 -8.766 1.00 31.35 H new ATOM 0 HD13 LEU A 44 -5.294 -19.563 -7.145 1.00 31.35 H new ATOM 0 HD21 LEU A 44 -2.580 -20.802 -7.955 1.00 61.22 H new ATOM 0 HD22 LEU A 44 -3.784 -21.654 -6.959 1.00 61.22 H new ATOM 0 HD23 LEU A 44 -3.182 -22.399 -8.459 1.00 61.22 H new ATOM 706 N ARG A 45 -7.824 -23.924 -10.043 1.00 21.32 N ATOM 707 CA ARG A 45 -9.028 -24.742 -9.873 1.00 54.20 C ATOM 708 C ARG A 45 -8.754 -26.231 -10.155 1.00 51.41 C ATOM 709 O ARG A 45 -8.983 -27.088 -9.295 1.00 12.03 O ATOM 710 CB ARG A 45 -10.152 -24.218 -10.782 1.00 51.04 C ATOM 711 CG ARG A 45 -10.726 -22.878 -10.323 1.00 41.34 C ATOM 712 CD ARG A 45 -11.775 -22.327 -11.286 1.00 70.34 C ATOM 713 NE ARG A 45 -11.181 -21.780 -12.503 1.00 4.12 N ATOM 714 CZ ARG A 45 -11.187 -20.512 -12.817 1.00 70.35 C ATOM 715 NH1 ARG A 45 -11.668 -19.631 -12.000 1.00 3.43 N ATOM 716 NH2 ARG A 45 -10.701 -20.128 -13.953 1.00 10.25 N ATOM 0 H ARG A 45 -7.824 -23.339 -10.878 1.00 21.32 H new ATOM 0 HA ARG A 45 -9.342 -24.663 -8.832 1.00 54.20 H new ATOM 0 HB2 ARG A 45 -9.769 -24.113 -11.797 1.00 51.04 H new ATOM 0 HB3 ARG A 45 -10.954 -24.955 -10.818 1.00 51.04 H new ATOM 0 HG2 ARG A 45 -11.172 -22.997 -9.336 1.00 41.34 H new ATOM 0 HG3 ARG A 45 -9.916 -22.156 -10.222 1.00 41.34 H new ATOM 0 HD2 ARG A 45 -12.474 -23.121 -11.551 1.00 70.34 H new ATOM 0 HD3 ARG A 45 -12.351 -21.549 -10.785 1.00 70.34 H new ATOM 0 HE ARG A 45 -10.733 -22.430 -13.149 1.00 4.12 H new ATOM 0 HH11 ARG A 45 -12.048 -19.924 -11.100 1.00 3.43 H new ATOM 0 HH12 ARG A 45 -11.667 -18.644 -12.256 1.00 3.43 H new ATOM 0 HH21 ARG A 45 -10.315 -20.815 -14.601 1.00 10.25 H new ATOM 0 HH22 ARG A 45 -10.704 -19.139 -14.201 1.00 10.25 H new ATOM 730 N ARG A 46 -8.225 -26.526 -11.342 1.00 63.10 N ATOM 731 CA ARG A 46 -7.981 -27.916 -11.764 1.00 42.42 C ATOM 732 C ARG A 46 -6.955 -28.641 -10.870 1.00 61.40 C ATOM 733 O ARG A 46 -7.098 -29.837 -10.599 1.00 33.35 O ATOM 734 CB ARG A 46 -7.537 -27.959 -13.236 1.00 45.31 C ATOM 735 CG ARG A 46 -6.407 -26.992 -13.573 1.00 5.51 C ATOM 736 CD ARG A 46 -6.008 -27.068 -15.043 1.00 51.11 C ATOM 737 NE ARG A 46 -5.231 -28.272 -15.351 1.00 1.22 N ATOM 738 CZ ARG A 46 -5.215 -28.857 -16.519 1.00 3.33 C ATOM 739 NH1 ARG A 46 -5.985 -28.447 -17.474 1.00 54.44 N ATOM 740 NH2 ARG A 46 -4.434 -29.864 -16.719 1.00 14.41 N ATOM 0 H ARG A 46 -7.955 -25.825 -12.032 1.00 63.10 H new ATOM 0 HA ARG A 46 -8.925 -28.450 -11.655 1.00 42.42 H new ATOM 0 HB2 ARG A 46 -7.218 -28.973 -13.479 1.00 45.31 H new ATOM 0 HB3 ARG A 46 -8.395 -27.734 -13.870 1.00 45.31 H new ATOM 0 HG2 ARG A 46 -6.717 -25.975 -13.334 1.00 5.51 H new ATOM 0 HG3 ARG A 46 -5.541 -27.216 -12.950 1.00 5.51 H new ATOM 0 HD2 ARG A 46 -6.905 -27.050 -15.661 1.00 51.11 H new ATOM 0 HD3 ARG A 46 -5.424 -26.186 -15.304 1.00 51.11 H new ATOM 0 HE ARG A 46 -4.666 -28.679 -14.605 1.00 1.22 H new ATOM 0 HH11 ARG A 46 -6.614 -27.659 -17.319 1.00 54.44 H new ATOM 0 HH12 ARG A 46 -5.963 -28.912 -18.382 1.00 54.44 H new ATOM 0 HH21 ARG A 46 -3.833 -30.200 -15.967 1.00 14.41 H new ATOM 0 HH22 ARG A 46 -4.418 -30.324 -17.629 1.00 14.41 H new ATOM 754 N VAL A 47 -5.921 -27.931 -10.416 1.00 21.12 N ATOM 755 CA VAL A 47 -4.895 -28.542 -9.552 1.00 1.55 C ATOM 756 C VAL A 47 -5.227 -28.375 -8.058 1.00 31.12 C ATOM 757 O VAL A 47 -4.888 -29.230 -7.236 1.00 43.53 O ATOM 758 CB VAL A 47 -3.481 -27.960 -9.828 1.00 21.11 C ATOM 759 CG1 VAL A 47 -3.127 -28.078 -11.309 1.00 51.33 C ATOM 760 CG2 VAL A 47 -3.366 -26.510 -9.352 1.00 70.21 C ATOM 0 H VAL A 47 -5.767 -26.945 -10.625 1.00 21.12 H new ATOM 0 HA VAL A 47 -4.893 -29.604 -9.797 1.00 1.55 H new ATOM 0 HB VAL A 47 -2.764 -28.549 -9.256 1.00 21.11 H new ATOM 0 HG11 VAL A 47 -2.133 -27.664 -11.480 1.00 51.33 H new ATOM 0 HG12 VAL A 47 -3.139 -29.127 -11.603 1.00 51.33 H new ATOM 0 HG13 VAL A 47 -3.856 -27.526 -11.902 1.00 51.33 H new ATOM 0 HG21 VAL A 47 -2.364 -26.137 -9.562 1.00 70.21 H new ATOM 0 HG22 VAL A 47 -4.099 -25.896 -9.876 1.00 70.21 H new ATOM 0 HG23 VAL A 47 -3.554 -26.463 -8.279 1.00 70.21 H new ATOM 770 N GLY A 48 -5.899 -27.277 -7.718 1.00 13.21 N ATOM 771 CA GLY A 48 -6.188 -26.967 -6.321 1.00 23.12 C ATOM 772 C GLY A 48 -7.167 -27.931 -5.660 1.00 42.23 C ATOM 773 O GLY A 48 -6.949 -28.356 -4.524 1.00 22.14 O ATOM 0 H GLY A 48 -6.251 -26.592 -8.386 1.00 13.21 H new ATOM 0 HA2 GLY A 48 -5.254 -26.971 -5.758 1.00 23.12 H new ATOM 0 HA3 GLY A 48 -6.592 -25.957 -6.260 1.00 23.12 H new ATOM 777 N ASP A 49 -8.245 -28.280 -6.367 1.00 52.24 N ATOM 778 CA ASP A 49 -9.286 -29.156 -5.808 1.00 63.13 C ATOM 779 C ASP A 49 -8.694 -30.453 -5.219 1.00 4.42 C ATOM 780 O ASP A 49 -8.940 -30.787 -4.057 1.00 61.52 O ATOM 781 CB ASP A 49 -10.325 -29.493 -6.881 1.00 63.42 C ATOM 782 CG ASP A 49 -11.466 -30.330 -6.328 1.00 64.02 C ATOM 783 OD1 ASP A 49 -12.331 -29.767 -5.621 1.00 30.54 O ATOM 784 OD2 ASP A 49 -11.495 -31.554 -6.584 1.00 21.40 O ATOM 0 H ASP A 49 -8.422 -27.973 -7.323 1.00 52.24 H new ATOM 0 HA ASP A 49 -9.767 -28.614 -4.994 1.00 63.13 H new ATOM 0 HB2 ASP A 49 -10.724 -28.570 -7.302 1.00 63.42 H new ATOM 0 HB3 ASP A 49 -9.842 -30.032 -7.696 1.00 63.42 H new ATOM 789 N GLY A 50 -7.909 -31.168 -6.027 1.00 12.21 N ATOM 790 CA GLY A 50 -7.282 -32.406 -5.569 1.00 25.12 C ATOM 791 C GLY A 50 -6.460 -32.219 -4.296 1.00 70.43 C ATOM 792 O GLY A 50 -6.577 -32.998 -3.346 1.00 64.50 O ATOM 0 H GLY A 50 -7.695 -30.914 -6.991 1.00 12.21 H new ATOM 0 HA2 GLY A 50 -8.054 -33.154 -5.390 1.00 25.12 H new ATOM 0 HA3 GLY A 50 -6.638 -32.795 -6.358 1.00 25.12 H new ATOM 796 N VAL A 51 -5.635 -31.174 -4.275 1.00 44.11 N ATOM 797 CA VAL A 51 -4.823 -30.849 -3.098 1.00 15.13 C ATOM 798 C VAL A 51 -5.709 -30.612 -1.861 1.00 32.33 C ATOM 799 O VAL A 51 -5.476 -31.189 -0.798 1.00 41.41 O ATOM 800 CB VAL A 51 -3.946 -29.596 -3.360 1.00 31.13 C ATOM 801 CG1 VAL A 51 -3.108 -29.240 -2.134 1.00 43.44 C ATOM 802 CG2 VAL A 51 -3.051 -29.812 -4.581 1.00 53.24 C ATOM 0 H VAL A 51 -5.509 -30.535 -5.060 1.00 44.11 H new ATOM 0 HA VAL A 51 -4.173 -31.702 -2.904 1.00 15.13 H new ATOM 0 HB VAL A 51 -4.612 -28.758 -3.563 1.00 31.13 H new ATOM 0 HG11 VAL A 51 -2.505 -28.358 -2.349 1.00 43.44 H new ATOM 0 HG12 VAL A 51 -3.767 -29.032 -1.291 1.00 43.44 H new ATOM 0 HG13 VAL A 51 -2.454 -30.075 -1.886 1.00 43.44 H new ATOM 0 HG21 VAL A 51 -2.444 -28.923 -4.749 1.00 53.24 H new ATOM 0 HG22 VAL A 51 -2.400 -30.669 -4.408 1.00 53.24 H new ATOM 0 HG23 VAL A 51 -3.671 -29.999 -5.458 1.00 53.24 H new ATOM 812 N GLN A 52 -6.738 -29.783 -2.021 1.00 24.20 N ATOM 813 CA GLN A 52 -7.673 -29.464 -0.931 1.00 72.30 C ATOM 814 C GLN A 52 -8.335 -30.728 -0.353 1.00 64.00 C ATOM 815 O GLN A 52 -8.437 -30.887 0.864 1.00 21.12 O ATOM 816 CB GLN A 52 -8.750 -28.492 -1.442 1.00 61.01 C ATOM 817 CG GLN A 52 -8.189 -27.157 -1.925 1.00 61.33 C ATOM 818 CD GLN A 52 -9.202 -26.307 -2.674 1.00 41.21 C ATOM 819 OE1 GLN A 52 -10.401 -26.358 -2.414 1.00 32.30 O ATOM 820 NE2 GLN A 52 -8.724 -25.525 -3.620 1.00 22.45 N ATOM 0 H GLN A 52 -6.951 -29.314 -2.901 1.00 24.20 H new ATOM 0 HA GLN A 52 -7.104 -28.997 -0.128 1.00 72.30 H new ATOM 0 HB2 GLN A 52 -9.295 -28.964 -2.259 1.00 61.01 H new ATOM 0 HB3 GLN A 52 -9.469 -28.307 -0.644 1.00 61.01 H new ATOM 0 HG2 GLN A 52 -7.820 -26.596 -1.067 1.00 61.33 H new ATOM 0 HG3 GLN A 52 -7.334 -27.345 -2.574 1.00 61.33 H new ATOM 0 HE21 GLN A 52 -7.722 -25.508 -3.809 1.00 22.45 H new ATOM 0 HE22 GLN A 52 -9.356 -24.937 -4.163 1.00 22.45 H new ATOM 829 N ARG A 53 -8.772 -31.627 -1.234 1.00 31.20 N ATOM 830 CA ARG A 53 -9.454 -32.858 -0.815 1.00 10.33 C ATOM 831 C ARG A 53 -8.507 -33.835 -0.093 1.00 52.32 C ATOM 832 O ARG A 53 -8.809 -34.309 1.004 1.00 41.31 O ATOM 833 CB ARG A 53 -10.103 -33.544 -2.025 1.00 3.41 C ATOM 834 CG ARG A 53 -11.220 -32.726 -2.676 1.00 31.24 C ATOM 835 CD ARG A 53 -12.313 -32.358 -1.674 1.00 11.23 C ATOM 836 NE ARG A 53 -12.756 -33.521 -0.904 1.00 24.23 N ATOM 837 CZ ARG A 53 -13.126 -33.481 0.348 1.00 3.12 C ATOM 838 NH1 ARG A 53 -13.222 -32.354 0.974 1.00 61.32 N ATOM 839 NH2 ARG A 53 -13.410 -34.578 0.970 1.00 22.44 N ATOM 0 H ARG A 53 -8.667 -31.529 -2.244 1.00 31.20 H new ATOM 0 HA ARG A 53 -10.227 -32.572 -0.102 1.00 10.33 H new ATOM 0 HB2 ARG A 53 -9.334 -33.748 -2.770 1.00 3.41 H new ATOM 0 HB3 ARG A 53 -10.507 -34.507 -1.711 1.00 3.41 H new ATOM 0 HG2 ARG A 53 -10.801 -31.817 -3.106 1.00 31.24 H new ATOM 0 HG3 ARG A 53 -11.656 -33.295 -3.497 1.00 31.24 H new ATOM 0 HD2 ARG A 53 -11.940 -31.592 -0.994 1.00 11.23 H new ATOM 0 HD3 ARG A 53 -13.163 -31.928 -2.204 1.00 11.23 H new ATOM 0 HE ARG A 53 -12.777 -34.424 -1.377 1.00 24.23 H new ATOM 0 HH11 ARG A 53 -13.008 -31.482 0.490 1.00 61.32 H new ATOM 0 HH12 ARG A 53 -13.512 -32.337 1.952 1.00 61.32 H new ATOM 0 HH21 ARG A 53 -13.345 -35.472 0.483 1.00 22.44 H new ATOM 0 HH22 ARG A 53 -13.699 -34.550 1.948 1.00 22.44 H new ATOM 853 N ASN A 54 -7.360 -34.129 -0.706 1.00 12.13 N ATOM 854 CA ASN A 54 -6.369 -35.044 -0.108 1.00 23.01 C ATOM 855 C ASN A 54 -5.837 -34.499 1.227 1.00 1.12 C ATOM 856 O ASN A 54 -5.578 -35.249 2.169 1.00 43.44 O ATOM 857 CB ASN A 54 -5.205 -35.257 -1.080 1.00 73.20 C ATOM 858 CG ASN A 54 -5.665 -35.797 -2.419 1.00 43.02 C ATOM 859 OD1 ASN A 54 -6.605 -36.582 -2.507 1.00 13.14 O ATOM 860 ND2 ASN A 54 -5.019 -35.364 -3.479 1.00 12.42 N ATOM 0 H ASN A 54 -7.088 -33.752 -1.614 1.00 12.13 H new ATOM 0 HA ASN A 54 -6.864 -35.995 0.087 1.00 23.01 H new ATOM 0 HB2 ASN A 54 -4.684 -34.312 -1.232 1.00 73.20 H new ATOM 0 HB3 ASN A 54 -4.488 -35.949 -0.639 1.00 73.20 H new ATOM 0 HD21 ASN A 54 -5.295 -35.680 -4.409 1.00 12.42 H new ATOM 0 HD22 ASN A 54 -4.242 -34.712 -3.372 1.00 12.42 H new ATOM 867 N HIS A 55 -5.675 -33.183 1.283 1.00 54.42 N ATOM 868 CA HIS A 55 -5.191 -32.489 2.484 1.00 41.01 C ATOM 869 C HIS A 55 -6.282 -32.314 3.559 1.00 12.34 C ATOM 870 O HIS A 55 -5.963 -32.029 4.714 1.00 20.35 O ATOM 871 CB HIS A 55 -4.594 -31.128 2.110 1.00 12.24 C ATOM 872 CG HIS A 55 -3.243 -31.212 1.462 1.00 40.35 C ATOM 873 ND1 HIS A 55 -2.120 -30.615 1.991 1.00 33.14 N ATOM 874 CD2 HIS A 55 -2.837 -31.809 0.317 1.00 74.33 C ATOM 875 CE1 HIS A 55 -1.089 -30.839 1.204 1.00 61.13 C ATOM 876 NE2 HIS A 55 -1.494 -31.561 0.182 1.00 14.24 N ATOM 0 H HIS A 55 -5.874 -32.561 0.500 1.00 54.42 H new ATOM 0 HA HIS A 55 -4.417 -33.121 2.919 1.00 41.01 H new ATOM 0 HB2 HIS A 55 -5.279 -30.616 1.434 1.00 12.24 H new ATOM 0 HB3 HIS A 55 -4.517 -30.517 3.009 1.00 12.24 H new ATOM 0 HD2 HIS A 55 -3.455 -32.375 -0.364 1.00 74.33 H new ATOM 0 HE1 HIS A 55 -0.081 -30.489 1.370 1.00 61.13 H new ATOM 0 HE2 HIS A 55 -0.906 -31.884 -0.586 1.00 14.24 H new ATOM 885 N GLU A 56 -7.557 -32.473 3.182 1.00 2.22 N ATOM 886 CA GLU A 56 -8.688 -32.150 4.074 1.00 52.10 C ATOM 887 C GLU A 56 -8.517 -32.726 5.491 1.00 20.43 C ATOM 888 O GLU A 56 -8.671 -32.001 6.474 1.00 44.11 O ATOM 889 CB GLU A 56 -10.006 -32.676 3.481 1.00 71.04 C ATOM 890 CG GLU A 56 -11.193 -32.583 4.442 1.00 4.51 C ATOM 891 CD GLU A 56 -12.471 -33.185 3.879 1.00 63.05 C ATOM 892 OE1 GLU A 56 -12.504 -34.409 3.631 1.00 0.30 O ATOM 893 OE2 GLU A 56 -13.451 -32.440 3.682 1.00 72.12 O ATOM 0 H GLU A 56 -7.836 -32.823 2.266 1.00 2.22 H new ATOM 0 HA GLU A 56 -8.712 -31.063 4.154 1.00 52.10 H new ATOM 0 HB2 GLU A 56 -10.237 -32.113 2.576 1.00 71.04 H new ATOM 0 HB3 GLU A 56 -9.871 -33.716 3.184 1.00 71.04 H new ATOM 0 HG2 GLU A 56 -10.939 -33.091 5.372 1.00 4.51 H new ATOM 0 HG3 GLU A 56 -11.371 -31.536 4.689 1.00 4.51 H new ATOM 900 N THR A 57 -8.201 -34.017 5.603 1.00 23.02 N ATOM 901 CA THR A 57 -7.994 -34.640 6.923 1.00 51.24 C ATOM 902 C THR A 57 -6.956 -33.873 7.760 1.00 23.14 C ATOM 903 O THR A 57 -7.134 -33.678 8.964 1.00 14.33 O ATOM 904 CB THR A 57 -7.553 -36.123 6.816 1.00 10.42 C ATOM 905 OG1 THR A 57 -7.265 -36.653 8.124 1.00 61.13 O ATOM 906 CG2 THR A 57 -6.323 -36.276 5.925 1.00 12.54 C ATOM 0 H THR A 57 -8.083 -34.649 4.811 1.00 23.02 H new ATOM 0 HA THR A 57 -8.963 -34.599 7.420 1.00 51.24 H new ATOM 0 HB THR A 57 -8.376 -36.680 6.367 1.00 10.42 H new ATOM 0 HG1 THR A 57 -6.989 -37.590 8.044 1.00 61.13 H new ATOM 0 HG21 THR A 57 -6.041 -37.327 5.872 1.00 12.54 H new ATOM 0 HG22 THR A 57 -6.551 -35.910 4.924 1.00 12.54 H new ATOM 0 HG23 THR A 57 -5.497 -35.699 6.342 1.00 12.54 H new ATOM 914 N ALA A 58 -5.882 -33.421 7.110 1.00 73.21 N ATOM 915 CA ALA A 58 -4.816 -32.675 7.789 1.00 41.51 C ATOM 916 C ALA A 58 -5.252 -31.237 8.114 1.00 44.42 C ATOM 917 O ALA A 58 -4.962 -30.719 9.198 1.00 60.24 O ATOM 918 CB ALA A 58 -3.554 -32.665 6.933 1.00 1.22 C ATOM 0 H ALA A 58 -5.725 -33.558 6.111 1.00 73.21 H new ATOM 0 HA ALA A 58 -4.604 -33.178 8.732 1.00 41.51 H new ATOM 0 HB1 ALA A 58 -2.770 -32.109 7.447 1.00 1.22 H new ATOM 0 HB2 ALA A 58 -3.221 -33.689 6.764 1.00 1.22 H new ATOM 0 HB3 ALA A 58 -3.768 -32.190 5.975 1.00 1.22 H new ATOM 924 N PHE A 59 -5.945 -30.600 7.170 1.00 61.42 N ATOM 925 CA PHE A 59 -6.458 -29.238 7.364 1.00 44.33 C ATOM 926 C PHE A 59 -7.476 -29.177 8.514 1.00 40.54 C ATOM 927 O PHE A 59 -7.384 -28.311 9.381 1.00 65.12 O ATOM 928 CB PHE A 59 -7.091 -28.706 6.067 1.00 42.12 C ATOM 929 CG PHE A 59 -6.099 -28.393 4.964 1.00 63.21 C ATOM 930 CD1 PHE A 59 -4.740 -28.258 5.234 1.00 44.00 C ATOM 931 CD2 PHE A 59 -6.534 -28.211 3.658 1.00 14.30 C ATOM 932 CE1 PHE A 59 -3.844 -27.952 4.226 1.00 45.02 C ATOM 933 CE2 PHE A 59 -5.640 -27.906 2.647 1.00 1.12 C ATOM 934 CZ PHE A 59 -4.294 -27.776 2.932 1.00 35.35 C ATOM 0 H PHE A 59 -6.166 -31.004 6.260 1.00 61.42 H new ATOM 0 HA PHE A 59 -5.612 -28.605 7.629 1.00 44.33 H new ATOM 0 HB2 PHE A 59 -7.805 -29.442 5.698 1.00 42.12 H new ATOM 0 HB3 PHE A 59 -7.655 -27.802 6.297 1.00 42.12 H new ATOM 0 HD1 PHE A 59 -4.381 -28.394 6.243 1.00 44.00 H new ATOM 0 HD2 PHE A 59 -7.585 -28.309 3.428 1.00 14.30 H new ATOM 0 HE1 PHE A 59 -2.792 -27.851 4.451 1.00 45.02 H new ATOM 0 HE2 PHE A 59 -5.994 -27.770 1.636 1.00 1.12 H new ATOM 0 HZ PHE A 59 -3.595 -27.537 2.144 1.00 35.35 H new ATOM 944 N GLN A 60 -8.435 -30.106 8.521 1.00 51.30 N ATOM 945 CA GLN A 60 -9.424 -30.203 9.609 1.00 54.51 C ATOM 946 C GLN A 60 -8.730 -30.281 10.979 1.00 2.52 C ATOM 947 O GLN A 60 -9.182 -29.680 11.959 1.00 12.53 O ATOM 948 CB GLN A 60 -10.320 -31.439 9.409 1.00 41.24 C ATOM 949 CG GLN A 60 -11.248 -31.358 8.195 1.00 14.52 C ATOM 950 CD GLN A 60 -12.353 -30.324 8.356 1.00 1.31 C ATOM 951 OE1 GLN A 60 -12.796 -30.035 9.462 1.00 35.44 O ATOM 952 NE2 GLN A 60 -12.832 -29.782 7.255 1.00 72.03 N ATOM 0 H GLN A 60 -8.552 -30.805 7.787 1.00 51.30 H new ATOM 0 HA GLN A 60 -10.041 -29.305 9.583 1.00 54.51 H new ATOM 0 HB2 GLN A 60 -9.686 -32.320 9.308 1.00 41.24 H new ATOM 0 HB3 GLN A 60 -10.925 -31.583 10.304 1.00 41.24 H new ATOM 0 HG2 GLN A 60 -10.659 -31.117 7.310 1.00 14.52 H new ATOM 0 HG3 GLN A 60 -11.696 -32.336 8.022 1.00 14.52 H new ATOM 0 HE21 GLN A 60 -12.444 -30.041 6.348 1.00 72.03 H new ATOM 0 HE22 GLN A 60 -13.591 -29.103 7.309 1.00 72.03 H new ATOM 961 N GLY A 61 -7.617 -31.017 11.029 1.00 63.43 N ATOM 962 CA GLY A 61 -6.836 -31.128 12.256 1.00 10.00 C ATOM 963 C GLY A 61 -6.305 -29.784 12.751 1.00 40.10 C ATOM 964 O GLY A 61 -6.117 -29.584 13.951 1.00 50.02 O ATOM 0 H GLY A 61 -7.241 -31.540 10.238 1.00 63.43 H new ATOM 0 HA2 GLY A 61 -7.454 -31.577 13.034 1.00 10.00 H new ATOM 0 HA3 GLY A 61 -5.997 -31.803 12.086 1.00 10.00 H new ATOM 968 N MET A 62 -6.057 -28.858 11.826 1.00 25.21 N ATOM 969 CA MET A 62 -5.597 -27.512 12.186 1.00 3.25 C ATOM 970 C MET A 62 -6.779 -26.551 12.414 1.00 64.52 C ATOM 971 O MET A 62 -6.778 -25.770 13.363 1.00 32.31 O ATOM 972 CB MET A 62 -4.657 -26.955 11.109 1.00 73.44 C ATOM 973 CG MET A 62 -3.395 -27.788 10.916 1.00 31.32 C ATOM 974 SD MET A 62 -2.163 -26.975 9.877 1.00 12.20 S ATOM 975 CE MET A 62 -3.081 -26.726 8.361 1.00 60.54 C ATOM 0 H MET A 62 -6.166 -29.012 10.824 1.00 25.21 H new ATOM 0 HA MET A 62 -5.048 -27.594 13.124 1.00 3.25 H new ATOM 0 HB2 MET A 62 -5.194 -26.899 10.162 1.00 73.44 H new ATOM 0 HB3 MET A 62 -4.374 -25.937 11.376 1.00 73.44 H new ATOM 0 HG2 MET A 62 -2.956 -28.002 11.890 1.00 31.32 H new ATOM 0 HG3 MET A 62 -3.663 -28.746 10.470 1.00 31.32 H new ATOM 0 HE1 MET A 62 -2.450 -26.216 7.633 1.00 60.54 H new ATOM 0 HE2 MET A 62 -3.390 -27.691 7.960 1.00 60.54 H new ATOM 0 HE3 MET A 62 -3.963 -26.118 8.565 1.00 60.54 H new ATOM 985 N LEU A 63 -7.792 -26.627 11.550 1.00 63.15 N ATOM 986 CA LEU A 63 -8.977 -25.760 11.654 1.00 43.30 C ATOM 987 C LEU A 63 -9.647 -25.854 13.034 1.00 30.15 C ATOM 988 O LEU A 63 -10.148 -24.855 13.550 1.00 12.44 O ATOM 989 CB LEU A 63 -9.994 -26.090 10.542 1.00 62.03 C ATOM 990 CG LEU A 63 -9.866 -25.247 9.257 1.00 22.21 C ATOM 991 CD1 LEU A 63 -8.490 -25.407 8.620 1.00 33.13 C ATOM 992 CD2 LEU A 63 -10.969 -25.609 8.265 1.00 70.21 C ATOM 0 H LEU A 63 -7.820 -27.280 10.767 1.00 63.15 H new ATOM 0 HA LEU A 63 -8.632 -24.734 11.528 1.00 43.30 H new ATOM 0 HB2 LEU A 63 -9.889 -27.142 10.278 1.00 62.03 H new ATOM 0 HB3 LEU A 63 -10.999 -25.961 10.943 1.00 62.03 H new ATOM 0 HG LEU A 63 -9.981 -24.199 9.533 1.00 22.21 H new ATOM 0 HD11 LEU A 63 -8.434 -24.799 7.717 1.00 33.13 H new ATOM 0 HD12 LEU A 63 -7.723 -25.082 9.324 1.00 33.13 H new ATOM 0 HD13 LEU A 63 -8.327 -26.454 8.364 1.00 33.13 H new ATOM 0 HD21 LEU A 63 -10.862 -25.004 7.365 1.00 70.21 H new ATOM 0 HD22 LEU A 63 -10.892 -26.664 8.004 1.00 70.21 H new ATOM 0 HD23 LEU A 63 -11.942 -25.418 8.717 1.00 70.21 H new ATOM 1004 N ARG A 64 -9.640 -27.046 13.631 1.00 13.34 N ATOM 1005 CA ARG A 64 -10.239 -27.247 14.961 1.00 71.54 C ATOM 1006 C ARG A 64 -9.523 -26.434 16.060 1.00 32.50 C ATOM 1007 O ARG A 64 -10.103 -26.169 17.113 1.00 31.30 O ATOM 1008 CB ARG A 64 -10.262 -28.738 15.330 1.00 30.43 C ATOM 1009 CG ARG A 64 -8.898 -29.414 15.289 1.00 14.13 C ATOM 1010 CD ARG A 64 -8.979 -30.870 15.736 1.00 52.43 C ATOM 1011 NE ARG A 64 -9.967 -31.635 14.972 1.00 74.04 N ATOM 1012 CZ ARG A 64 -10.310 -32.869 15.245 1.00 40.11 C ATOM 1013 NH1 ARG A 64 -9.805 -33.485 16.267 1.00 20.00 N ATOM 1014 NH2 ARG A 64 -11.181 -33.477 14.508 1.00 55.52 N ATOM 0 H ARG A 64 -9.230 -27.886 13.222 1.00 13.34 H new ATOM 0 HA ARG A 64 -11.263 -26.879 14.902 1.00 71.54 H new ATOM 0 HB2 ARG A 64 -10.678 -28.846 16.332 1.00 30.43 H new ATOM 0 HB3 ARG A 64 -10.934 -29.259 14.648 1.00 30.43 H new ATOM 0 HG2 ARG A 64 -8.498 -29.365 14.276 1.00 14.13 H new ATOM 0 HG3 ARG A 64 -8.204 -28.873 15.932 1.00 14.13 H new ATOM 0 HD2 ARG A 64 -8.000 -31.336 15.627 1.00 52.43 H new ATOM 0 HD3 ARG A 64 -9.234 -30.908 16.795 1.00 52.43 H new ATOM 0 HE ARG A 64 -10.416 -31.178 14.178 1.00 74.04 H new ATOM 0 HH11 ARG A 64 -9.133 -33.009 16.869 1.00 20.00 H new ATOM 0 HH12 ARG A 64 -10.080 -34.446 16.470 1.00 20.00 H new ATOM 0 HH21 ARG A 64 -11.602 -32.996 13.713 1.00 55.52 H new ATOM 0 HH22 ARG A 64 -11.448 -34.438 14.721 1.00 55.52 H new ATOM 1028 N LYS A 65 -8.265 -26.046 15.826 1.00 54.32 N ATOM 1029 CA LYS A 65 -7.549 -25.165 16.766 1.00 31.14 C ATOM 1030 C LYS A 65 -7.379 -23.748 16.183 1.00 5.10 C ATOM 1031 O LYS A 65 -6.662 -22.910 16.731 1.00 35.12 O ATOM 1032 CB LYS A 65 -6.198 -25.786 17.195 1.00 72.52 C ATOM 1033 CG LYS A 65 -5.230 -26.162 16.065 1.00 42.11 C ATOM 1034 CD LYS A 65 -4.499 -24.950 15.486 1.00 22.52 C ATOM 1035 CE LYS A 65 -3.348 -25.357 14.567 1.00 50.40 C ATOM 1036 NZ LYS A 65 -2.260 -26.062 15.301 1.00 52.24 N ATOM 0 H LYS A 65 -7.724 -26.321 15.006 1.00 54.32 H new ATOM 0 HA LYS A 65 -8.155 -25.068 17.666 1.00 31.14 H new ATOM 0 HB2 LYS A 65 -5.693 -25.082 17.857 1.00 72.52 H new ATOM 0 HB3 LYS A 65 -6.404 -26.682 17.780 1.00 72.52 H new ATOM 0 HG2 LYS A 65 -4.498 -26.877 16.442 1.00 42.11 H new ATOM 0 HG3 LYS A 65 -5.783 -26.662 15.270 1.00 42.11 H new ATOM 0 HD2 LYS A 65 -5.205 -24.333 14.930 1.00 22.52 H new ATOM 0 HD3 LYS A 65 -4.113 -24.337 16.300 1.00 22.52 H new ATOM 0 HE2 LYS A 65 -3.729 -26.004 13.777 1.00 50.40 H new ATOM 0 HE3 LYS A 65 -2.941 -24.469 14.083 1.00 50.40 H new ATOM 0 HZ1 LYS A 65 -1.395 -26.063 14.723 1.00 52.24 H new ATOM 0 HZ2 LYS A 65 -2.075 -25.574 16.200 1.00 52.24 H new ATOM 0 HZ3 LYS A 65 -2.549 -27.042 15.493 1.00 52.24 H new ATOM 1050 N LEU A 66 -8.071 -23.491 15.074 1.00 52.33 N ATOM 1051 CA LEU A 66 -8.094 -22.166 14.438 1.00 11.11 C ATOM 1052 C LEU A 66 -9.525 -21.593 14.449 1.00 14.45 C ATOM 1053 O LEU A 66 -9.846 -20.706 15.245 1.00 1.21 O ATOM 1054 CB LEU A 66 -7.582 -22.258 12.988 1.00 51.31 C ATOM 1055 CG LEU A 66 -6.123 -22.706 12.814 1.00 5.54 C ATOM 1056 CD1 LEU A 66 -5.807 -22.945 11.339 1.00 62.04 C ATOM 1057 CD2 LEU A 66 -5.166 -21.676 13.411 1.00 53.03 C ATOM 0 H LEU A 66 -8.632 -24.191 14.589 1.00 52.33 H new ATOM 0 HA LEU A 66 -7.440 -21.502 15.003 1.00 11.11 H new ATOM 0 HB2 LEU A 66 -8.221 -22.951 12.442 1.00 51.31 H new ATOM 0 HB3 LEU A 66 -7.699 -21.281 12.520 1.00 51.31 H new ATOM 0 HG LEU A 66 -5.988 -23.646 13.350 1.00 5.54 H new ATOM 0 HD11 LEU A 66 -4.769 -23.262 11.236 1.00 62.04 H new ATOM 0 HD12 LEU A 66 -6.464 -23.722 10.947 1.00 62.04 H new ATOM 0 HD13 LEU A 66 -5.962 -22.022 10.780 1.00 62.04 H new ATOM 0 HD21 LEU A 66 -4.138 -22.013 13.277 1.00 53.03 H new ATOM 0 HD22 LEU A 66 -5.302 -20.719 12.908 1.00 53.03 H new ATOM 0 HD23 LEU A 66 -5.374 -21.560 14.475 1.00 53.03 H new ATOM 1069 N ASP A 67 -10.365 -22.119 13.547 1.00 12.12 N ATOM 1070 CA ASP A 67 -11.792 -21.755 13.427 1.00 41.21 C ATOM 1071 C ASP A 67 -12.018 -20.338 12.860 1.00 35.11 C ATOM 1072 O ASP A 67 -12.898 -20.131 12.024 1.00 21.44 O ATOM 1073 CB ASP A 67 -12.509 -21.933 14.773 1.00 3.34 C ATOM 1074 CG ASP A 67 -14.020 -21.842 14.650 1.00 34.41 C ATOM 1075 OD1 ASP A 67 -14.581 -22.451 13.713 1.00 43.21 O ATOM 1076 OD2 ASP A 67 -14.653 -21.189 15.504 1.00 65.01 O ATOM 0 H ASP A 67 -10.072 -22.821 12.867 1.00 12.12 H new ATOM 0 HA ASP A 67 -12.226 -22.441 12.699 1.00 41.21 H new ATOM 0 HB2 ASP A 67 -12.241 -22.901 15.197 1.00 3.34 H new ATOM 0 HB3 ASP A 67 -12.159 -21.171 15.470 1.00 3.34 H new ATOM 1081 N ILE A 68 -11.197 -19.397 13.303 1.00 1.54 N ATOM 1082 CA ILE A 68 -11.266 -17.987 12.893 1.00 51.40 C ATOM 1083 C ILE A 68 -12.616 -17.333 13.250 1.00 22.44 C ATOM 1084 O ILE A 68 -13.587 -17.415 12.499 1.00 63.34 O ATOM 1085 CB ILE A 68 -10.971 -17.788 11.376 1.00 32.44 C ATOM 1086 CG1 ILE A 68 -9.531 -18.215 11.013 1.00 42.14 C ATOM 1087 CG2 ILE A 68 -11.201 -16.328 10.966 1.00 35.22 C ATOM 1088 CD1 ILE A 68 -9.289 -19.710 11.029 1.00 4.42 C ATOM 0 H ILE A 68 -10.448 -19.587 13.969 1.00 1.54 H new ATOM 0 HA ILE A 68 -10.482 -17.487 13.461 1.00 51.40 H new ATOM 0 HB ILE A 68 -11.662 -18.427 10.826 1.00 32.44 H new ATOM 0 HG12 ILE A 68 -9.293 -17.833 10.020 1.00 42.14 H new ATOM 0 HG13 ILE A 68 -8.840 -17.742 11.710 1.00 42.14 H new ATOM 0 HG21 ILE A 68 -10.989 -16.211 9.903 1.00 35.22 H new ATOM 0 HG22 ILE A 68 -12.238 -16.054 11.162 1.00 35.22 H new ATOM 0 HG23 ILE A 68 -10.540 -15.680 11.541 1.00 35.22 H new ATOM 0 HD11 ILE A 68 -8.252 -19.914 10.762 1.00 4.42 H new ATOM 0 HD12 ILE A 68 -9.490 -20.100 12.027 1.00 4.42 H new ATOM 0 HD13 ILE A 68 -9.950 -20.193 10.310 1.00 4.42 H new ATOM 1100 N LYS A 69 -12.664 -16.678 14.409 1.00 32.02 N ATOM 1101 CA LYS A 69 -13.862 -15.947 14.841 1.00 64.45 C ATOM 1102 C LYS A 69 -13.672 -14.426 14.685 1.00 51.11 C ATOM 1103 O LYS A 69 -14.622 -13.651 14.822 1.00 74.34 O ATOM 1104 CB LYS A 69 -14.220 -16.324 16.293 1.00 1.32 C ATOM 1105 CG LYS A 69 -13.130 -16.026 17.333 1.00 51.25 C ATOM 1106 CD LYS A 69 -13.211 -14.599 17.880 1.00 10.12 C ATOM 1107 CE LYS A 69 -14.542 -14.332 18.581 1.00 60.31 C ATOM 1108 NZ LYS A 69 -14.744 -15.219 19.759 1.00 3.14 N ATOM 0 H LYS A 69 -11.888 -16.637 15.069 1.00 32.02 H new ATOM 0 HA LYS A 69 -14.694 -16.235 14.198 1.00 64.45 H new ATOM 0 HB2 LYS A 69 -15.127 -15.790 16.577 1.00 1.32 H new ATOM 0 HB3 LYS A 69 -14.452 -17.388 16.328 1.00 1.32 H new ATOM 0 HG2 LYS A 69 -13.218 -16.733 18.158 1.00 51.25 H new ATOM 0 HG3 LYS A 69 -12.150 -16.183 16.882 1.00 51.25 H new ATOM 0 HD2 LYS A 69 -12.392 -14.431 18.580 1.00 10.12 H new ATOM 0 HD3 LYS A 69 -13.082 -13.889 17.063 1.00 10.12 H new ATOM 0 HE2 LYS A 69 -14.580 -13.291 18.901 1.00 60.31 H new ATOM 0 HE3 LYS A 69 -15.359 -14.478 17.874 1.00 60.31 H new ATOM 0 HZ1 LYS A 69 -15.580 -14.904 20.291 1.00 3.14 H new ATOM 0 HZ2 LYS A 69 -14.887 -16.197 19.436 1.00 3.14 H new ATOM 0 HZ3 LYS A 69 -13.906 -15.176 20.374 1.00 3.14 H new ATOM 1122 N ASN A 70 -12.435 -14.008 14.402 1.00 2.05 N ATOM 1123 CA ASN A 70 -12.127 -12.594 14.138 1.00 35.03 C ATOM 1124 C ASN A 70 -10.814 -12.447 13.347 1.00 2.00 C ATOM 1125 O ASN A 70 -10.062 -13.412 13.187 1.00 4.35 O ATOM 1126 CB ASN A 70 -12.074 -11.777 15.444 1.00 21.04 C ATOM 1127 CG ASN A 70 -10.893 -12.104 16.352 1.00 54.01 C ATOM 1128 OD1 ASN A 70 -10.437 -13.336 16.351 1.00 44.42 O flip ATOM 1129 ND2 ASN A 70 -10.402 -11.243 17.069 1.00 72.15 N flip ATOM 0 H ASN A 70 -11.627 -14.628 14.349 1.00 2.05 H new ATOM 0 HA ASN A 70 -12.935 -12.194 13.526 1.00 35.03 H new ATOM 0 HB2 ASN A 70 -12.039 -10.717 15.192 1.00 21.04 H new ATOM 0 HB3 ASN A 70 -12.998 -11.943 15.998 1.00 21.04 H new ATOM 0 HD21 ASN A 70 -10.773 -10.293 17.053 1.00 72.15 H new ATOM 0 HD22 ASN A 70 -9.621 -11.475 17.683 1.00 72.15 H new ATOM 1136 N GLU A 71 -10.541 -11.235 12.864 1.00 54.33 N ATOM 1137 CA GLU A 71 -9.396 -10.982 11.975 1.00 2.34 C ATOM 1138 C GLU A 71 -8.045 -11.390 12.595 1.00 72.20 C ATOM 1139 O GLU A 71 -7.132 -11.811 11.881 1.00 63.25 O ATOM 1140 CB GLU A 71 -9.365 -9.507 11.559 1.00 10.02 C ATOM 1141 CG GLU A 71 -8.304 -9.186 10.508 1.00 11.14 C ATOM 1142 CD GLU A 71 -8.388 -7.756 10.003 1.00 64.21 C ATOM 1143 OE1 GLU A 71 -7.744 -6.866 10.601 1.00 3.21 O ATOM 1144 OE2 GLU A 71 -9.093 -7.511 9.006 1.00 73.14 O ATOM 0 H GLU A 71 -11.098 -10.406 13.072 1.00 54.33 H new ATOM 0 HA GLU A 71 -9.538 -11.611 11.096 1.00 2.34 H new ATOM 0 HB2 GLU A 71 -10.344 -9.228 11.170 1.00 10.02 H new ATOM 0 HB3 GLU A 71 -9.186 -8.894 12.442 1.00 10.02 H new ATOM 0 HG2 GLU A 71 -7.315 -9.359 10.932 1.00 11.14 H new ATOM 0 HG3 GLU A 71 -8.414 -9.870 9.667 1.00 11.14 H new ATOM 1151 N ASP A 72 -7.916 -11.276 13.915 1.00 61.41 N ATOM 1152 CA ASP A 72 -6.689 -11.693 14.610 1.00 74.51 C ATOM 1153 C ASP A 72 -6.316 -13.153 14.283 1.00 33.24 C ATOM 1154 O ASP A 72 -5.135 -13.505 14.208 1.00 53.54 O ATOM 1155 CB ASP A 72 -6.858 -11.513 16.120 1.00 74.21 C ATOM 1156 CG ASP A 72 -7.036 -10.055 16.506 1.00 52.30 C ATOM 1157 OD1 ASP A 72 -8.037 -9.442 16.082 1.00 24.22 O ATOM 1158 OD2 ASP A 72 -6.165 -9.502 17.212 1.00 43.22 O ATOM 0 H ASP A 72 -8.640 -10.900 14.527 1.00 61.41 H new ATOM 0 HA ASP A 72 -5.874 -11.060 14.259 1.00 74.51 H new ATOM 0 HB2 ASP A 72 -7.722 -12.085 16.458 1.00 74.21 H new ATOM 0 HB3 ASP A 72 -5.986 -11.919 16.633 1.00 74.21 H new ATOM 1163 N ASP A 73 -7.326 -13.997 14.075 1.00 60.02 N ATOM 1164 CA ASP A 73 -7.094 -15.389 13.681 1.00 70.30 C ATOM 1165 C ASP A 73 -6.593 -15.460 12.232 1.00 32.04 C ATOM 1166 O ASP A 73 -5.705 -16.247 11.906 1.00 41.32 O ATOM 1167 CB ASP A 73 -8.376 -16.209 13.828 1.00 51.13 C ATOM 1168 CG ASP A 73 -8.969 -16.118 15.219 1.00 62.30 C ATOM 1169 OD1 ASP A 73 -8.239 -16.383 16.198 1.00 35.41 O ATOM 1170 OD2 ASP A 73 -10.169 -15.795 15.339 1.00 43.52 O ATOM 0 H ASP A 73 -8.309 -13.744 14.172 1.00 60.02 H new ATOM 0 HA ASP A 73 -6.332 -15.807 14.339 1.00 70.30 H new ATOM 0 HB2 ASP A 73 -9.110 -15.862 13.101 1.00 51.13 H new ATOM 0 HB3 ASP A 73 -8.164 -17.252 13.595 1.00 51.13 H new ATOM 1175 N VAL A 74 -7.166 -14.617 11.374 1.00 74.15 N ATOM 1176 CA VAL A 74 -6.747 -14.523 9.973 1.00 62.22 C ATOM 1177 C VAL A 74 -5.259 -14.153 9.872 1.00 72.45 C ATOM 1178 O VAL A 74 -4.501 -14.755 9.110 1.00 24.22 O ATOM 1179 CB VAL A 74 -7.595 -13.477 9.206 1.00 32.42 C ATOM 1180 CG1 VAL A 74 -7.161 -13.385 7.747 1.00 53.30 C ATOM 1181 CG2 VAL A 74 -9.082 -13.808 9.311 1.00 3.01 C ATOM 0 H VAL A 74 -7.926 -13.985 11.625 1.00 74.15 H new ATOM 0 HA VAL A 74 -6.902 -15.502 9.519 1.00 62.22 H new ATOM 0 HB VAL A 74 -7.429 -12.503 9.666 1.00 32.42 H new ATOM 0 HG11 VAL A 74 -7.772 -12.644 7.232 1.00 53.30 H new ATOM 0 HG12 VAL A 74 -6.113 -13.089 7.697 1.00 53.30 H new ATOM 0 HG13 VAL A 74 -7.287 -14.356 7.268 1.00 53.30 H new ATOM 0 HG21 VAL A 74 -9.660 -13.062 8.766 1.00 3.01 H new ATOM 0 HG22 VAL A 74 -9.266 -14.793 8.883 1.00 3.01 H new ATOM 0 HG23 VAL A 74 -9.382 -13.805 10.359 1.00 3.01 H new ATOM 1191 N LYS A 75 -4.844 -13.168 10.662 1.00 60.13 N ATOM 1192 CA LYS A 75 -3.433 -12.777 10.736 1.00 42.45 C ATOM 1193 C LYS A 75 -2.563 -13.939 11.244 1.00 13.21 C ATOM 1194 O LYS A 75 -1.409 -14.096 10.841 1.00 25.42 O ATOM 1195 CB LYS A 75 -3.280 -11.558 11.651 1.00 34.14 C ATOM 1196 CG LYS A 75 -4.055 -10.336 11.168 1.00 45.03 C ATOM 1197 CD LYS A 75 -3.943 -9.167 12.142 1.00 43.02 C ATOM 1198 CE LYS A 75 -4.701 -7.945 11.640 1.00 61.11 C ATOM 1199 NZ LYS A 75 -4.636 -6.817 12.603 1.00 61.23 N ATOM 0 H LYS A 75 -5.463 -12.623 11.262 1.00 60.13 H new ATOM 0 HA LYS A 75 -3.094 -12.518 9.733 1.00 42.45 H new ATOM 0 HB2 LYS A 75 -3.618 -11.821 12.653 1.00 34.14 H new ATOM 0 HB3 LYS A 75 -2.223 -11.302 11.728 1.00 34.14 H new ATOM 0 HG2 LYS A 75 -3.680 -10.031 10.191 1.00 45.03 H new ATOM 0 HG3 LYS A 75 -5.104 -10.600 11.038 1.00 45.03 H new ATOM 0 HD2 LYS A 75 -4.334 -9.464 13.115 1.00 43.02 H new ATOM 0 HD3 LYS A 75 -2.893 -8.911 12.285 1.00 43.02 H new ATOM 0 HE2 LYS A 75 -4.286 -7.629 10.683 1.00 61.11 H new ATOM 0 HE3 LYS A 75 -5.743 -8.212 11.464 1.00 61.11 H new ATOM 0 HZ1 LYS A 75 -5.164 -6.006 12.223 1.00 61.23 H new ATOM 0 HZ2 LYS A 75 -5.055 -7.109 13.509 1.00 61.23 H new ATOM 0 HZ3 LYS A 75 -3.643 -6.545 12.752 1.00 61.23 H new ATOM 1213 N SER A 76 -3.133 -14.757 12.127 1.00 23.33 N ATOM 1214 CA SER A 76 -2.448 -15.953 12.636 1.00 61.33 C ATOM 1215 C SER A 76 -2.299 -17.020 11.541 1.00 44.34 C ATOM 1216 O SER A 76 -1.352 -17.810 11.552 1.00 3.43 O ATOM 1217 CB SER A 76 -3.205 -16.532 13.841 1.00 41.12 C ATOM 1218 OG SER A 76 -3.235 -15.606 14.922 1.00 5.31 O ATOM 0 H SER A 76 -4.069 -14.617 12.508 1.00 23.33 H new ATOM 0 HA SER A 76 -1.449 -15.655 12.955 1.00 61.33 H new ATOM 0 HB2 SER A 76 -4.224 -16.785 13.547 1.00 41.12 H new ATOM 0 HB3 SER A 76 -2.727 -17.457 14.164 1.00 41.12 H new ATOM 0 HG SER A 76 -3.864 -14.883 14.716 1.00 5.31 H new ATOM 1224 N LEU A 77 -3.234 -17.037 10.591 1.00 23.52 N ATOM 1225 CA LEU A 77 -3.139 -17.934 9.434 1.00 64.14 C ATOM 1226 C LEU A 77 -1.885 -17.623 8.604 1.00 14.04 C ATOM 1227 O LEU A 77 -1.252 -18.525 8.058 1.00 22.54 O ATOM 1228 CB LEU A 77 -4.392 -17.820 8.555 1.00 53.00 C ATOM 1229 CG LEU A 77 -5.711 -18.231 9.231 1.00 63.04 C ATOM 1230 CD1 LEU A 77 -6.887 -18.056 8.273 1.00 20.12 C ATOM 1231 CD2 LEU A 77 -5.631 -19.669 9.740 1.00 4.20 C ATOM 0 H LEU A 77 -4.063 -16.443 10.597 1.00 23.52 H new ATOM 0 HA LEU A 77 -3.065 -18.955 9.807 1.00 64.14 H new ATOM 0 HB2 LEU A 77 -4.484 -16.789 8.215 1.00 53.00 H new ATOM 0 HB3 LEU A 77 -4.250 -18.437 7.668 1.00 53.00 H new ATOM 0 HG LEU A 77 -5.874 -17.577 10.088 1.00 63.04 H new ATOM 0 HD11 LEU A 77 -7.810 -18.352 8.772 1.00 20.12 H new ATOM 0 HD12 LEU A 77 -6.958 -17.011 7.971 1.00 20.12 H new ATOM 0 HD13 LEU A 77 -6.734 -18.679 7.392 1.00 20.12 H new ATOM 0 HD21 LEU A 77 -6.574 -19.940 10.215 1.00 4.20 H new ATOM 0 HD22 LEU A 77 -5.440 -20.341 8.903 1.00 4.20 H new ATOM 0 HD23 LEU A 77 -4.822 -19.754 10.466 1.00 4.20 H new ATOM 1243 N SER A 78 -1.527 -16.338 8.525 1.00 72.10 N ATOM 1244 CA SER A 78 -0.294 -15.914 7.839 1.00 22.33 C ATOM 1245 C SER A 78 0.931 -16.634 8.415 1.00 74.01 C ATOM 1246 O SER A 78 1.833 -17.040 7.681 1.00 34.12 O ATOM 1247 CB SER A 78 -0.100 -14.395 7.956 1.00 51.21 C ATOM 1248 OG SER A 78 1.079 -13.968 7.285 1.00 73.44 O ATOM 0 H SER A 78 -2.069 -15.572 8.925 1.00 72.10 H new ATOM 0 HA SER A 78 -0.395 -16.180 6.787 1.00 22.33 H new ATOM 0 HB2 SER A 78 -0.965 -13.883 7.535 1.00 51.21 H new ATOM 0 HB3 SER A 78 -0.044 -14.114 9.008 1.00 51.21 H new ATOM 0 HG SER A 78 1.174 -12.997 7.376 1.00 73.44 H new ATOM 1254 N ARG A 79 0.945 -16.808 9.737 1.00 42.12 N ATOM 1255 CA ARG A 79 2.028 -17.531 10.414 1.00 34.25 C ATOM 1256 C ARG A 79 2.086 -18.993 9.939 1.00 63.11 C ATOM 1257 O ARG A 79 3.165 -19.540 9.702 1.00 32.21 O ATOM 1258 CB ARG A 79 1.831 -17.471 11.936 1.00 73.43 C ATOM 1259 CG ARG A 79 1.615 -16.056 12.465 1.00 45.23 C ATOM 1260 CD ARG A 79 2.824 -15.157 12.219 1.00 44.12 C ATOM 1261 NE ARG A 79 2.528 -13.757 12.514 1.00 72.14 N ATOM 1262 CZ ARG A 79 2.516 -13.242 13.716 1.00 45.22 C ATOM 1263 NH1 ARG A 79 2.800 -13.967 14.751 1.00 72.11 N ATOM 1264 NH2 ARG A 79 2.223 -11.995 13.879 1.00 22.24 N ATOM 0 H ARG A 79 0.219 -16.459 10.363 1.00 42.12 H new ATOM 0 HA ARG A 79 2.974 -17.053 10.162 1.00 34.25 H new ATOM 0 HB2 ARG A 79 0.974 -18.087 12.208 1.00 73.43 H new ATOM 0 HB3 ARG A 79 2.704 -17.904 12.425 1.00 73.43 H new ATOM 0 HG2 ARG A 79 0.738 -15.621 11.986 1.00 45.23 H new ATOM 0 HG3 ARG A 79 1.407 -16.098 13.534 1.00 45.23 H new ATOM 0 HD2 ARG A 79 3.657 -15.491 12.838 1.00 44.12 H new ATOM 0 HD3 ARG A 79 3.141 -15.250 11.180 1.00 44.12 H new ATOM 0 HE ARG A 79 2.317 -13.140 11.730 1.00 72.14 H new ATOM 0 HH11 ARG A 79 3.037 -14.952 14.634 1.00 72.11 H new ATOM 0 HH12 ARG A 79 2.787 -13.553 15.683 1.00 72.11 H new ATOM 0 HH21 ARG A 79 2.001 -11.413 13.071 1.00 22.24 H new ATOM 0 HH22 ARG A 79 2.213 -11.592 14.816 1.00 22.24 H new ATOM 1278 N VAL A 80 0.913 -19.615 9.789 1.00 24.14 N ATOM 1279 CA VAL A 80 0.822 -20.973 9.237 1.00 62.24 C ATOM 1280 C VAL A 80 1.415 -21.018 7.820 1.00 20.22 C ATOM 1281 O VAL A 80 2.171 -21.928 7.479 1.00 51.24 O ATOM 1282 CB VAL A 80 -0.645 -21.482 9.196 1.00 43.32 C ATOM 1283 CG1 VAL A 80 -0.725 -22.888 8.596 1.00 25.42 C ATOM 1284 CG2 VAL A 80 -1.268 -21.453 10.591 1.00 44.04 C ATOM 0 H VAL A 80 0.015 -19.203 10.041 1.00 24.14 H new ATOM 0 HA VAL A 80 1.394 -21.626 9.896 1.00 62.24 H new ATOM 0 HB VAL A 80 -1.214 -20.810 8.553 1.00 43.32 H new ATOM 0 HG11 VAL A 80 -1.764 -23.218 8.580 1.00 25.42 H new ATOM 0 HG12 VAL A 80 -0.334 -22.872 7.579 1.00 25.42 H new ATOM 0 HG13 VAL A 80 -0.135 -23.576 9.201 1.00 25.42 H new ATOM 0 HG21 VAL A 80 -2.295 -21.814 10.538 1.00 44.04 H new ATOM 0 HG22 VAL A 80 -0.693 -22.093 11.260 1.00 44.04 H new ATOM 0 HG23 VAL A 80 -1.261 -20.432 10.971 1.00 44.04 H new ATOM 1294 N MET A 81 1.082 -20.009 7.015 1.00 75.10 N ATOM 1295 CA MET A 81 1.607 -19.891 5.647 1.00 1.23 C ATOM 1296 C MET A 81 3.145 -19.875 5.642 1.00 71.21 C ATOM 1297 O MET A 81 3.785 -20.539 4.822 1.00 65.32 O ATOM 1298 CB MET A 81 1.061 -18.624 4.977 1.00 73.45 C ATOM 1299 CG MET A 81 -0.454 -18.557 4.995 1.00 34.10 C ATOM 1300 SD MET A 81 -1.204 -20.058 4.341 1.00 50.05 S ATOM 1301 CE MET A 81 -2.895 -19.844 4.872 1.00 40.33 C ATOM 0 H MET A 81 0.448 -19.256 7.285 1.00 75.10 H new ATOM 0 HA MET A 81 1.277 -20.762 5.082 1.00 1.23 H new ATOM 0 HB2 MET A 81 1.465 -17.748 5.484 1.00 73.45 H new ATOM 0 HB3 MET A 81 1.410 -18.585 3.945 1.00 73.45 H new ATOM 0 HG2 MET A 81 -0.798 -18.396 6.017 1.00 34.10 H new ATOM 0 HG3 MET A 81 -0.786 -17.701 4.408 1.00 34.10 H new ATOM 0 HE1 MET A 81 -3.556 -20.419 4.223 1.00 40.33 H new ATOM 0 HE2 MET A 81 -3.001 -20.193 5.899 1.00 40.33 H new ATOM 0 HE3 MET A 81 -3.162 -18.789 4.818 1.00 40.33 H new ATOM 1311 N ILE A 82 3.728 -19.116 6.573 1.00 43.51 N ATOM 1312 CA ILE A 82 5.187 -19.080 6.754 1.00 4.51 C ATOM 1313 C ILE A 82 5.737 -20.482 7.077 1.00 70.20 C ATOM 1314 O ILE A 82 6.839 -20.847 6.661 1.00 70.51 O ATOM 1315 CB ILE A 82 5.588 -18.094 7.887 1.00 1.43 C ATOM 1316 CG1 ILE A 82 5.057 -16.681 7.581 1.00 54.23 C ATOM 1317 CG2 ILE A 82 7.107 -18.068 8.077 1.00 50.33 C ATOM 1318 CD1 ILE A 82 5.318 -15.672 8.681 1.00 42.32 C ATOM 0 H ILE A 82 3.213 -18.515 7.217 1.00 43.51 H new ATOM 0 HA ILE A 82 5.621 -18.734 5.816 1.00 4.51 H new ATOM 0 HB ILE A 82 5.137 -18.441 8.817 1.00 1.43 H new ATOM 0 HG12 ILE A 82 5.515 -16.324 6.659 1.00 54.23 H new ATOM 0 HG13 ILE A 82 3.983 -16.738 7.402 1.00 54.23 H new ATOM 0 HG21 ILE A 82 7.362 -17.371 8.875 1.00 50.33 H new ATOM 0 HG22 ILE A 82 7.458 -19.066 8.341 1.00 50.33 H new ATOM 0 HG23 ILE A 82 7.584 -17.749 7.150 1.00 50.33 H new ATOM 0 HD11 ILE A 82 4.914 -14.703 8.389 1.00 42.32 H new ATOM 0 HD12 ILE A 82 4.836 -16.004 9.601 1.00 42.32 H new ATOM 0 HD13 ILE A 82 6.392 -15.583 8.846 1.00 42.32 H new ATOM 1330 N HIS A 83 4.950 -21.268 7.811 1.00 14.33 N ATOM 1331 CA HIS A 83 5.333 -22.639 8.167 1.00 41.45 C ATOM 1332 C HIS A 83 5.237 -23.583 6.951 1.00 32.13 C ATOM 1333 O HIS A 83 6.006 -24.539 6.834 1.00 3.33 O ATOM 1334 CB HIS A 83 4.444 -23.168 9.303 1.00 42.24 C ATOM 1335 CG HIS A 83 4.433 -22.302 10.531 1.00 3.31 C ATOM 1336 ND1 HIS A 83 3.444 -22.036 11.419 1.00 33.11 N flip ATOM 1337 CD2 HIS A 83 5.526 -21.583 10.962 1.00 43.10 C flip ATOM 1338 CE1 HIS A 83 3.958 -21.175 12.357 1.00 41.40 C flip ATOM 1339 NE2 HIS A 83 5.215 -20.921 12.057 1.00 34.50 N flip ATOM 0 H HIS A 83 4.041 -20.980 8.173 1.00 14.33 H new ATOM 0 HA HIS A 83 6.370 -22.614 8.502 1.00 41.45 H new ATOM 0 HB2 HIS A 83 3.423 -23.268 8.934 1.00 42.24 H new ATOM 0 HB3 HIS A 83 4.783 -24.167 9.579 1.00 42.24 H new ATOM 0 HD2 HIS A 83 6.490 -21.565 10.476 1.00 43.10 H new ATOM 0 HE1 HIS A 83 3.420 -20.772 13.202 1.00 41.40 H new ATOM 0 HE2 HIS A 83 5.842 -20.314 12.584 1.00 34.50 H new ATOM 1348 N VAL A 84 4.287 -23.309 6.053 1.00 4.42 N ATOM 1349 CA VAL A 84 4.086 -24.127 4.845 1.00 1.53 C ATOM 1350 C VAL A 84 5.345 -24.162 3.958 1.00 0.31 C ATOM 1351 O VAL A 84 5.687 -25.199 3.384 1.00 73.11 O ATOM 1352 CB VAL A 84 2.883 -23.610 4.008 1.00 4.13 C ATOM 1353 CG1 VAL A 84 2.718 -24.419 2.719 1.00 52.51 C ATOM 1354 CG2 VAL A 84 1.595 -23.643 4.831 1.00 25.42 C ATOM 0 H VAL A 84 3.640 -22.525 6.137 1.00 4.42 H new ATOM 0 HA VAL A 84 3.876 -25.140 5.189 1.00 1.53 H new ATOM 0 HB VAL A 84 3.089 -22.576 3.733 1.00 4.13 H new ATOM 0 HG11 VAL A 84 1.869 -24.034 2.154 1.00 52.51 H new ATOM 0 HG12 VAL A 84 3.623 -24.333 2.117 1.00 52.51 H new ATOM 0 HG13 VAL A 84 2.545 -25.466 2.966 1.00 52.51 H new ATOM 0 HG21 VAL A 84 0.766 -23.277 4.225 1.00 25.42 H new ATOM 0 HG22 VAL A 84 1.390 -24.666 5.145 1.00 25.42 H new ATOM 0 HG23 VAL A 84 1.709 -23.009 5.711 1.00 25.42 H new ATOM 1364 N PHE A 85 6.038 -23.030 3.858 1.00 54.40 N ATOM 1365 CA PHE A 85 7.261 -22.934 3.048 1.00 53.42 C ATOM 1366 C PHE A 85 8.520 -23.307 3.850 1.00 54.21 C ATOM 1367 O PHE A 85 9.604 -22.776 3.605 1.00 65.43 O ATOM 1368 CB PHE A 85 7.403 -21.519 2.476 1.00 45.43 C ATOM 1369 CG PHE A 85 6.359 -21.179 1.448 1.00 24.33 C ATOM 1370 CD1 PHE A 85 6.388 -21.771 0.193 1.00 15.03 C ATOM 1371 CD2 PHE A 85 5.347 -20.273 1.732 1.00 4.54 C ATOM 1372 CE1 PHE A 85 5.433 -21.466 -0.755 1.00 45.31 C ATOM 1373 CE2 PHE A 85 4.391 -19.966 0.787 1.00 42.11 C ATOM 1374 CZ PHE A 85 4.433 -20.563 -0.458 1.00 62.35 C ATOM 0 H PHE A 85 5.777 -22.162 4.327 1.00 54.40 H new ATOM 0 HA PHE A 85 7.169 -23.652 2.233 1.00 53.42 H new ATOM 0 HB2 PHE A 85 7.346 -20.799 3.292 1.00 45.43 H new ATOM 0 HB3 PHE A 85 8.391 -21.415 2.027 1.00 45.43 H new ATOM 0 HD1 PHE A 85 7.168 -22.479 -0.045 1.00 15.03 H new ATOM 0 HD2 PHE A 85 5.308 -19.803 2.704 1.00 4.54 H new ATOM 0 HE1 PHE A 85 5.468 -21.933 -1.728 1.00 45.31 H new ATOM 0 HE2 PHE A 85 3.609 -19.259 1.020 1.00 42.11 H new ATOM 0 HZ PHE A 85 3.684 -20.323 -1.198 1.00 62.35 H new ATOM 1458 N TRP A 92 6.584 -25.359 -7.403 1.00 0.30 N ATOM 1459 CA TRP A 92 5.258 -24.736 -7.529 1.00 61.05 C ATOM 1460 C TRP A 92 4.173 -25.529 -6.776 1.00 71.13 C ATOM 1461 O TRP A 92 3.094 -25.005 -6.493 1.00 2.41 O ATOM 1462 CB TRP A 92 4.888 -24.585 -9.014 1.00 34.32 C ATOM 1463 CG TRP A 92 5.912 -23.809 -9.799 1.00 3.44 C ATOM 1464 CD1 TRP A 92 6.707 -24.280 -10.806 1.00 44.25 C ATOM 1465 CD2 TRP A 92 6.266 -22.430 -9.623 1.00 43.03 C ATOM 1466 NE1 TRP A 92 7.528 -23.279 -11.268 1.00 21.25 N ATOM 1467 CE2 TRP A 92 7.275 -22.135 -10.560 1.00 63.34 C ATOM 1468 CE3 TRP A 92 5.826 -21.415 -8.770 1.00 63.02 C ATOM 1469 CZ2 TRP A 92 7.851 -20.872 -10.664 1.00 70.54 C ATOM 1470 CZ3 TRP A 92 6.399 -20.162 -8.873 1.00 53.22 C ATOM 1471 CH2 TRP A 92 7.402 -19.900 -9.815 1.00 53.32 C ATOM 0 HA TRP A 92 5.309 -23.749 -7.069 1.00 61.05 H new ATOM 0 HB2 TRP A 92 4.772 -25.574 -9.456 1.00 34.32 H new ATOM 0 HB3 TRP A 92 3.922 -24.086 -9.093 1.00 34.32 H new ATOM 0 HD1 TRP A 92 6.692 -25.292 -11.184 1.00 44.25 H new ATOM 0 HE1 TRP A 92 8.214 -23.373 -12.017 1.00 21.25 H new ATOM 0 HE3 TRP A 92 5.051 -21.606 -8.042 1.00 63.02 H new ATOM 0 HZ2 TRP A 92 8.625 -20.668 -11.389 1.00 70.54 H new ATOM 0 HZ3 TRP A 92 6.068 -19.371 -8.216 1.00 53.22 H new ATOM 0 HH2 TRP A 92 7.829 -18.910 -9.871 1.00 53.32 H new ATOM 1482 N GLY A 93 4.468 -26.786 -6.445 1.00 12.53 N ATOM 1483 CA GLY A 93 3.542 -27.601 -5.660 1.00 30.44 C ATOM 1484 C GLY A 93 3.204 -26.979 -4.304 1.00 31.13 C ATOM 1485 O GLY A 93 2.071 -27.076 -3.825 1.00 12.12 O ATOM 0 H GLY A 93 5.333 -27.259 -6.706 1.00 12.53 H new ATOM 0 HA2 GLY A 93 2.622 -27.745 -6.227 1.00 30.44 H new ATOM 0 HA3 GLY A 93 3.978 -28.588 -5.503 1.00 30.44 H new ATOM 1489 N ARG A 94 4.190 -26.330 -3.684 1.00 23.12 N ATOM 1490 CA ARG A 94 3.975 -25.640 -2.408 1.00 74.22 C ATOM 1491 C ARG A 94 3.119 -24.380 -2.598 1.00 45.40 C ATOM 1492 O ARG A 94 2.337 -24.012 -1.721 1.00 15.51 O ATOM 1493 CB ARG A 94 5.320 -25.295 -1.749 1.00 34.02 C ATOM 1494 CG ARG A 94 6.093 -26.523 -1.273 1.00 2.32 C ATOM 1495 CD ARG A 94 5.321 -27.292 -0.203 1.00 30.22 C ATOM 1496 NE ARG A 94 5.953 -28.567 0.123 1.00 32.00 N ATOM 1497 CZ ARG A 94 5.695 -29.261 1.199 1.00 50.30 C ATOM 1498 NH1 ARG A 94 4.871 -28.820 2.096 1.00 52.22 N ATOM 1499 NH2 ARG A 94 6.265 -30.402 1.380 1.00 13.33 N ATOM 0 H ARG A 94 5.143 -26.267 -4.042 1.00 23.12 H new ATOM 0 HA ARG A 94 3.431 -26.314 -1.746 1.00 74.22 H new ATOM 0 HB2 ARG A 94 5.933 -24.741 -2.460 1.00 34.02 H new ATOM 0 HB3 ARG A 94 5.142 -24.635 -0.900 1.00 34.02 H new ATOM 0 HG2 ARG A 94 6.293 -27.179 -2.120 1.00 2.32 H new ATOM 0 HG3 ARG A 94 7.059 -26.214 -0.874 1.00 2.32 H new ATOM 0 HD2 ARG A 94 5.248 -26.683 0.698 1.00 30.22 H new ATOM 0 HD3 ARG A 94 4.303 -27.471 -0.550 1.00 30.22 H new ATOM 0 HE ARG A 94 6.640 -28.940 -0.532 1.00 32.00 H new ATOM 0 HH11 ARG A 94 4.412 -27.918 1.968 1.00 52.22 H new ATOM 0 HH12 ARG A 94 4.681 -29.375 2.931 1.00 52.22 H new ATOM 0 HH21 ARG A 94 6.917 -30.763 0.683 1.00 13.33 H new ATOM 0 HH22 ARG A 94 6.064 -30.945 2.220 1.00 13.33 H new ATOM 1513 N ILE A 95 3.260 -23.736 -3.755 1.00 72.24 N ATOM 1514 CA ILE A 95 2.422 -22.583 -4.108 1.00 70.10 C ATOM 1515 C ILE A 95 0.942 -22.996 -4.190 1.00 22.22 C ATOM 1516 O ILE A 95 0.062 -22.320 -3.650 1.00 61.31 O ATOM 1517 CB ILE A 95 2.857 -21.961 -5.461 1.00 11.12 C ATOM 1518 CG1 ILE A 95 4.352 -21.597 -5.435 1.00 3.22 C ATOM 1519 CG2 ILE A 95 2.008 -20.731 -5.794 1.00 23.42 C ATOM 1520 CD1 ILE A 95 4.730 -20.603 -4.355 1.00 42.35 C ATOM 0 H ILE A 95 3.945 -23.990 -4.466 1.00 72.24 H new ATOM 0 HA ILE A 95 2.549 -21.836 -3.324 1.00 70.10 H new ATOM 0 HB ILE A 95 2.698 -22.704 -6.242 1.00 11.12 H new ATOM 0 HG12 ILE A 95 4.934 -22.508 -5.295 1.00 3.22 H new ATOM 0 HG13 ILE A 95 4.632 -21.186 -6.405 1.00 3.22 H new ATOM 0 HG21 ILE A 95 2.332 -20.313 -6.747 1.00 23.42 H new ATOM 0 HG22 ILE A 95 0.959 -21.020 -5.862 1.00 23.42 H new ATOM 0 HG23 ILE A 95 2.128 -19.983 -5.010 1.00 23.42 H new ATOM 0 HD11 ILE A 95 5.800 -20.400 -4.405 1.00 42.35 H new ATOM 0 HD12 ILE A 95 4.178 -19.675 -4.505 1.00 42.35 H new ATOM 0 HD13 ILE A 95 4.485 -21.017 -3.377 1.00 42.35 H new ATOM 1532 N VAL A 96 0.681 -24.118 -4.866 1.00 3.23 N ATOM 1533 CA VAL A 96 -0.667 -24.695 -4.923 1.00 71.03 C ATOM 1534 C VAL A 96 -1.197 -24.986 -3.513 1.00 25.24 C ATOM 1535 O VAL A 96 -2.320 -24.625 -3.175 1.00 32.14 O ATOM 1536 CB VAL A 96 -0.697 -26.011 -5.743 1.00 51.21 C ATOM 1537 CG1 VAL A 96 -2.123 -26.549 -5.858 1.00 60.12 C ATOM 1538 CG2 VAL A 96 -0.087 -25.805 -7.124 1.00 64.25 C ATOM 0 H VAL A 96 1.385 -24.646 -5.382 1.00 3.23 H new ATOM 0 HA VAL A 96 -1.301 -23.957 -5.414 1.00 71.03 H new ATOM 0 HB VAL A 96 -0.096 -26.750 -5.213 1.00 51.21 H new ATOM 0 HG11 VAL A 96 -2.118 -27.472 -6.437 1.00 60.12 H new ATOM 0 HG12 VAL A 96 -2.518 -26.748 -4.862 1.00 60.12 H new ATOM 0 HG13 VAL A 96 -2.751 -25.811 -6.357 1.00 60.12 H new ATOM 0 HG21 VAL A 96 -0.120 -26.742 -7.680 1.00 64.25 H new ATOM 0 HG22 VAL A 96 -0.653 -25.044 -7.662 1.00 64.25 H new ATOM 0 HG23 VAL A 96 0.948 -25.481 -7.020 1.00 64.25 H new ATOM 1548 N THR A 97 -0.371 -25.639 -2.696 1.00 45.20 N ATOM 1549 CA THR A 97 -0.738 -25.969 -1.308 1.00 30.50 C ATOM 1550 C THR A 97 -1.123 -24.713 -0.509 1.00 51.10 C ATOM 1551 O THR A 97 -2.109 -24.712 0.231 1.00 73.43 O ATOM 1552 CB THR A 97 0.418 -26.699 -0.576 1.00 23.14 C ATOM 1553 OG1 THR A 97 0.767 -27.905 -1.275 1.00 1.21 O ATOM 1554 CG2 THR A 97 0.038 -27.041 0.863 1.00 35.33 C ATOM 0 H THR A 97 0.561 -25.953 -2.967 1.00 45.20 H new ATOM 0 HA THR A 97 -1.602 -26.631 -1.365 1.00 30.50 H new ATOM 0 HB THR A 97 1.274 -26.024 -0.558 1.00 23.14 H new ATOM 0 HG1 THR A 97 1.199 -27.677 -2.125 1.00 1.21 H new ATOM 0 HG21 THR A 97 0.870 -27.552 1.347 1.00 35.33 H new ATOM 0 HG22 THR A 97 -0.191 -26.124 1.406 1.00 35.33 H new ATOM 0 HG23 THR A 97 -0.837 -27.691 0.864 1.00 35.33 H new ATOM 1562 N LEU A 98 -0.343 -23.647 -0.677 1.00 41.35 N ATOM 1563 CA LEU A 98 -0.592 -22.372 0.010 1.00 44.54 C ATOM 1564 C LEU A 98 -1.980 -21.801 -0.337 1.00 72.24 C ATOM 1565 O LEU A 98 -2.802 -21.538 0.545 1.00 52.54 O ATOM 1566 CB LEU A 98 0.488 -21.358 -0.392 1.00 71.14 C ATOM 1567 CG LEU A 98 0.387 -19.983 0.289 1.00 70.22 C ATOM 1568 CD1 LEU A 98 0.769 -20.084 1.761 1.00 13.01 C ATOM 1569 CD2 LEU A 98 1.253 -18.953 -0.435 1.00 63.43 C ATOM 0 H LEU A 98 0.474 -23.637 -1.287 1.00 41.35 H new ATOM 0 HA LEU A 98 -0.560 -22.556 1.084 1.00 44.54 H new ATOM 0 HB2 LEU A 98 1.465 -21.785 -0.167 1.00 71.14 H new ATOM 0 HB3 LEU A 98 0.444 -21.214 -1.472 1.00 71.14 H new ATOM 0 HG LEU A 98 -0.648 -19.647 0.231 1.00 70.22 H new ATOM 0 HD11 LEU A 98 0.691 -19.101 2.225 1.00 13.01 H new ATOM 0 HD12 LEU A 98 0.096 -20.778 2.265 1.00 13.01 H new ATOM 0 HD13 LEU A 98 1.794 -20.446 1.847 1.00 13.01 H new ATOM 0 HD21 LEU A 98 1.165 -17.988 0.065 1.00 63.43 H new ATOM 0 HD22 LEU A 98 2.294 -19.277 -0.419 1.00 63.43 H new ATOM 0 HD23 LEU A 98 0.919 -18.858 -1.468 1.00 63.43 H new ATOM 1581 N ILE A 99 -2.237 -21.635 -1.632 1.00 64.32 N ATOM 1582 CA ILE A 99 -3.500 -21.057 -2.108 1.00 31.20 C ATOM 1583 C ILE A 99 -4.685 -22.005 -1.851 1.00 75.33 C ATOM 1584 O ILE A 99 -5.800 -21.563 -1.561 1.00 22.21 O ATOM 1585 CB ILE A 99 -3.412 -20.713 -3.620 1.00 62.45 C ATOM 1586 CG1 ILE A 99 -2.215 -19.777 -3.879 1.00 12.41 C ATOM 1587 CG2 ILE A 99 -4.714 -20.076 -4.114 1.00 33.14 C ATOM 1588 CD1 ILE A 99 -2.011 -19.417 -5.337 1.00 14.42 C ATOM 0 H ILE A 99 -1.588 -21.892 -2.376 1.00 64.32 H new ATOM 0 HA ILE A 99 -3.671 -20.139 -1.546 1.00 31.20 H new ATOM 0 HB ILE A 99 -3.262 -21.638 -4.177 1.00 62.45 H new ATOM 0 HG12 ILE A 99 -2.355 -18.860 -3.306 1.00 12.41 H new ATOM 0 HG13 ILE A 99 -1.309 -20.252 -3.504 1.00 12.41 H new ATOM 0 HG21 ILE A 99 -4.626 -19.845 -5.176 1.00 33.14 H new ATOM 0 HG22 ILE A 99 -5.540 -20.771 -3.961 1.00 33.14 H new ATOM 0 HG23 ILE A 99 -4.904 -19.158 -3.557 1.00 33.14 H new ATOM 0 HD11 ILE A 99 -1.149 -18.756 -5.431 1.00 14.42 H new ATOM 0 HD12 ILE A 99 -1.837 -20.325 -5.915 1.00 14.42 H new ATOM 0 HD13 ILE A 99 -2.899 -18.911 -5.715 1.00 14.42 H new ATOM 1600 N SER A 100 -4.432 -23.309 -1.941 1.00 10.13 N ATOM 1601 CA SER A 100 -5.464 -24.323 -1.674 1.00 72.52 C ATOM 1602 C SER A 100 -5.915 -24.290 -0.210 1.00 70.12 C ATOM 1603 O SER A 100 -7.111 -24.338 0.077 1.00 22.02 O ATOM 1604 CB SER A 100 -4.957 -25.728 -2.029 1.00 63.52 C ATOM 1605 OG SER A 100 -4.774 -25.871 -3.428 1.00 1.11 O ATOM 0 H SER A 100 -3.523 -23.694 -2.196 1.00 10.13 H new ATOM 0 HA SER A 100 -6.321 -24.086 -2.305 1.00 72.52 H new ATOM 0 HB2 SER A 100 -4.014 -25.917 -1.515 1.00 63.52 H new ATOM 0 HB3 SER A 100 -5.668 -26.474 -1.675 1.00 63.52 H new ATOM 0 HG SER A 100 -3.910 -25.488 -3.686 1.00 1.11 H new ATOM 1611 N PHE A 101 -4.958 -24.208 0.717 1.00 75.25 N ATOM 1612 CA PHE A 101 -5.283 -24.110 2.146 1.00 61.22 C ATOM 1613 C PHE A 101 -6.077 -22.828 2.434 1.00 34.11 C ATOM 1614 O PHE A 101 -7.061 -22.849 3.176 1.00 60.13 O ATOM 1615 CB PHE A 101 -4.010 -24.158 3.006 1.00 33.11 C ATOM 1616 CG PHE A 101 -4.276 -24.044 4.493 1.00 14.13 C ATOM 1617 CD1 PHE A 101 -5.222 -24.853 5.109 1.00 22.01 C ATOM 1618 CD2 PHE A 101 -3.580 -23.132 5.272 1.00 4.12 C ATOM 1619 CE1 PHE A 101 -5.467 -24.751 6.466 1.00 44.03 C ATOM 1620 CE2 PHE A 101 -3.822 -23.026 6.629 1.00 43.24 C ATOM 1621 CZ PHE A 101 -4.766 -23.836 7.226 1.00 11.22 C ATOM 0 H PHE A 101 -3.959 -24.207 0.509 1.00 75.25 H new ATOM 0 HA PHE A 101 -5.902 -24.968 2.409 1.00 61.22 H new ATOM 0 HB2 PHE A 101 -3.485 -25.093 2.810 1.00 33.11 H new ATOM 0 HB3 PHE A 101 -3.346 -23.349 2.702 1.00 33.11 H new ATOM 0 HD1 PHE A 101 -5.774 -25.571 4.520 1.00 22.01 H new ATOM 0 HD2 PHE A 101 -2.838 -22.496 4.812 1.00 4.12 H new ATOM 0 HE1 PHE A 101 -6.206 -25.387 6.931 1.00 44.03 H new ATOM 0 HE2 PHE A 101 -3.272 -22.310 7.221 1.00 43.24 H new ATOM 0 HZ PHE A 101 -4.956 -23.754 8.286 1.00 11.22 H new ATOM 1631 N GLY A 102 -5.651 -21.718 1.831 1.00 10.20 N ATOM 1632 CA GLY A 102 -6.393 -20.468 1.953 1.00 0.50 C ATOM 1633 C GLY A 102 -7.836 -20.598 1.471 1.00 14.22 C ATOM 1634 O GLY A 102 -8.770 -20.162 2.145 1.00 10.00 O ATOM 0 H GLY A 102 -4.807 -21.660 1.261 1.00 10.20 H new ATOM 0 HA2 GLY A 102 -6.388 -20.146 2.994 1.00 0.50 H new ATOM 0 HA3 GLY A 102 -5.889 -19.692 1.377 1.00 0.50 H new ATOM 1638 N ALA A 103 -8.013 -21.216 0.304 1.00 34.10 N ATOM 1639 CA ALA A 103 -9.345 -21.455 -0.262 1.00 65.35 C ATOM 1640 C ALA A 103 -10.159 -22.452 0.583 1.00 32.52 C ATOM 1641 O ALA A 103 -11.390 -22.371 0.655 1.00 23.15 O ATOM 1642 CB ALA A 103 -9.215 -21.955 -1.694 1.00 12.21 C ATOM 0 H ALA A 103 -7.247 -21.563 -0.273 1.00 34.10 H new ATOM 0 HA ALA A 103 -9.886 -20.509 -0.255 1.00 65.35 H new ATOM 0 HB1 ALA A 103 -10.207 -22.131 -2.109 1.00 12.21 H new ATOM 0 HB2 ALA A 103 -8.697 -21.207 -2.295 1.00 12.21 H new ATOM 0 HB3 ALA A 103 -8.647 -22.885 -1.704 1.00 12.21 H new ATOM 1648 N PHE A 104 -9.468 -23.399 1.211 1.00 24.45 N ATOM 1649 CA PHE A 104 -10.114 -24.377 2.093 1.00 13.14 C ATOM 1650 C PHE A 104 -10.692 -23.683 3.338 1.00 53.54 C ATOM 1651 O PHE A 104 -11.850 -23.901 3.703 1.00 22.12 O ATOM 1652 CB PHE A 104 -9.109 -25.462 2.507 1.00 63.23 C ATOM 1653 CG PHE A 104 -9.730 -26.622 3.254 1.00 32.32 C ATOM 1654 CD1 PHE A 104 -10.203 -27.732 2.566 1.00 51.21 C ATOM 1655 CD2 PHE A 104 -9.834 -26.606 4.640 1.00 32.12 C ATOM 1656 CE1 PHE A 104 -10.764 -28.798 3.242 1.00 62.15 C ATOM 1657 CE2 PHE A 104 -10.398 -27.672 5.319 1.00 21.33 C ATOM 1658 CZ PHE A 104 -10.862 -28.768 4.619 1.00 12.43 C ATOM 0 H PHE A 104 -8.458 -23.513 1.128 1.00 24.45 H new ATOM 0 HA PHE A 104 -10.934 -24.846 1.548 1.00 13.14 H new ATOM 0 HB2 PHE A 104 -8.612 -25.842 1.615 1.00 63.23 H new ATOM 0 HB3 PHE A 104 -8.339 -25.010 3.133 1.00 63.23 H new ATOM 0 HD1 PHE A 104 -10.131 -27.762 1.489 1.00 51.21 H new ATOM 0 HD2 PHE A 104 -9.471 -25.752 5.193 1.00 32.12 H new ATOM 0 HE1 PHE A 104 -11.126 -29.655 2.693 1.00 62.15 H new ATOM 0 HE2 PHE A 104 -10.475 -27.647 6.396 1.00 21.33 H new ATOM 0 HZ PHE A 104 -11.301 -29.601 5.148 1.00 12.43 H new ATOM 1668 N VAL A 105 -9.878 -22.839 3.981 1.00 72.43 N ATOM 1669 CA VAL A 105 -10.333 -22.060 5.138 1.00 12.22 C ATOM 1670 C VAL A 105 -11.416 -21.053 4.719 1.00 74.43 C ATOM 1671 O VAL A 105 -12.376 -20.813 5.455 1.00 54.32 O ATOM 1672 CB VAL A 105 -9.158 -21.310 5.823 1.00 25.02 C ATOM 1673 CG1 VAL A 105 -9.628 -20.577 7.080 1.00 71.12 C ATOM 1674 CG2 VAL A 105 -8.026 -22.277 6.162 1.00 43.11 C ATOM 0 H VAL A 105 -8.905 -22.678 3.721 1.00 72.43 H new ATOM 0 HA VAL A 105 -10.753 -22.764 5.857 1.00 12.22 H new ATOM 0 HB VAL A 105 -8.782 -20.567 5.120 1.00 25.02 H new ATOM 0 HG11 VAL A 105 -8.784 -20.061 7.538 1.00 71.12 H new ATOM 0 HG12 VAL A 105 -10.395 -19.850 6.812 1.00 71.12 H new ATOM 0 HG13 VAL A 105 -10.041 -21.296 7.788 1.00 71.12 H new ATOM 0 HG21 VAL A 105 -7.213 -21.732 6.641 1.00 43.11 H new ATOM 0 HG22 VAL A 105 -8.396 -23.047 6.840 1.00 43.11 H new ATOM 0 HG23 VAL A 105 -7.660 -22.744 5.248 1.00 43.11 H new ATOM 1684 N ALA A 106 -11.261 -20.490 3.516 1.00 44.31 N ATOM 1685 CA ALA A 106 -12.247 -19.562 2.945 1.00 10.53 C ATOM 1686 C ALA A 106 -13.662 -20.167 2.939 1.00 34.41 C ATOM 1687 O ALA A 106 -14.635 -19.493 3.289 1.00 74.22 O ATOM 1688 CB ALA A 106 -11.834 -19.160 1.533 1.00 72.51 C ATOM 0 H ALA A 106 -10.456 -20.662 2.914 1.00 44.31 H new ATOM 0 HA ALA A 106 -12.273 -18.674 3.576 1.00 10.53 H new ATOM 0 HB1 ALA A 106 -12.572 -18.472 1.120 1.00 72.51 H new ATOM 0 HB2 ALA A 106 -10.860 -18.671 1.564 1.00 72.51 H new ATOM 0 HB3 ALA A 106 -11.774 -20.049 0.904 1.00 72.51 H new ATOM 1694 N LYS A 107 -13.771 -21.442 2.545 1.00 1.13 N ATOM 1695 CA LYS A 107 -15.062 -22.154 2.590 1.00 30.34 C ATOM 1696 C LYS A 107 -15.671 -22.090 4.000 1.00 71.10 C ATOM 1697 O LYS A 107 -16.839 -21.734 4.175 1.00 13.35 O ATOM 1698 CB LYS A 107 -14.899 -23.629 2.187 1.00 35.41 C ATOM 1699 CG LYS A 107 -14.383 -23.856 0.768 1.00 60.24 C ATOM 1700 CD LYS A 107 -14.462 -25.336 0.389 1.00 11.51 C ATOM 1701 CE LYS A 107 -13.955 -25.603 -1.025 1.00 21.41 C ATOM 1702 NZ LYS A 107 -12.476 -25.473 -1.124 1.00 65.01 N ATOM 0 H LYS A 107 -12.992 -22.000 2.195 1.00 1.13 H new ATOM 0 HA LYS A 107 -15.726 -21.660 1.881 1.00 30.34 H new ATOM 0 HB2 LYS A 107 -14.215 -24.108 2.887 1.00 35.41 H new ATOM 0 HB3 LYS A 107 -15.863 -24.127 2.291 1.00 35.41 H new ATOM 0 HG2 LYS A 107 -14.969 -23.265 0.065 1.00 60.24 H new ATOM 0 HG3 LYS A 107 -13.352 -23.512 0.692 1.00 60.24 H new ATOM 0 HD2 LYS A 107 -13.877 -25.921 1.098 1.00 11.51 H new ATOM 0 HD3 LYS A 107 -15.495 -25.675 0.472 1.00 11.51 H new ATOM 0 HE2 LYS A 107 -14.252 -26.606 -1.332 1.00 21.41 H new ATOM 0 HE3 LYS A 107 -14.427 -24.905 -1.717 1.00 21.41 H new ATOM 0 HZ1 LYS A 107 -12.160 -25.809 -2.056 1.00 65.01 H new ATOM 0 HZ2 LYS A 107 -12.206 -24.476 -1.006 1.00 65.01 H new ATOM 0 HZ3 LYS A 107 -12.027 -26.044 -0.380 1.00 65.01 H new ATOM 1716 N HIS A 108 -14.859 -22.423 5.004 1.00 50.51 N ATOM 1717 CA HIS A 108 -15.292 -22.389 6.405 1.00 64.15 C ATOM 1718 C HIS A 108 -15.710 -20.973 6.827 1.00 63.12 C ATOM 1719 O HIS A 108 -16.699 -20.797 7.541 1.00 15.31 O ATOM 1720 CB HIS A 108 -14.170 -22.909 7.318 1.00 42.14 C ATOM 1721 CG HIS A 108 -14.486 -22.828 8.783 1.00 74.33 C ATOM 1722 ND1 HIS A 108 -15.508 -23.538 9.377 1.00 74.41 N ATOM 1723 CD2 HIS A 108 -13.916 -22.101 9.774 1.00 22.52 C ATOM 1724 CE1 HIS A 108 -15.552 -23.253 10.663 1.00 70.01 C ATOM 1725 NE2 HIS A 108 -14.600 -22.386 10.927 1.00 51.44 N ATOM 0 H HIS A 108 -13.892 -22.721 4.874 1.00 50.51 H new ATOM 0 HA HIS A 108 -16.163 -23.037 6.505 1.00 64.15 H new ATOM 0 HB2 HIS A 108 -13.957 -23.946 7.060 1.00 42.14 H new ATOM 0 HB3 HIS A 108 -13.262 -22.339 7.121 1.00 42.14 H new ATOM 0 HD2 HIS A 108 -13.080 -21.424 9.674 1.00 22.52 H new ATOM 0 HE1 HIS A 108 -16.251 -23.662 11.378 1.00 70.01 H new ATOM 0 HE2 HIS A 108 -14.402 -21.988 11.845 1.00 51.44 H new ATOM 1734 N LEU A 109 -14.959 -19.970 6.375 1.00 63.32 N ATOM 1735 CA LEU A 109 -15.239 -18.573 6.723 1.00 1.24 C ATOM 1736 C LEU A 109 -16.613 -18.127 6.211 1.00 70.30 C ATOM 1737 O LEU A 109 -17.421 -17.588 6.967 1.00 74.45 O ATOM 1738 CB LEU A 109 -14.156 -17.656 6.143 1.00 42.22 C ATOM 1739 CG LEU A 109 -12.732 -17.922 6.647 1.00 52.50 C ATOM 1740 CD1 LEU A 109 -11.744 -16.956 6.003 1.00 51.12 C ATOM 1741 CD2 LEU A 109 -12.671 -17.829 8.168 1.00 60.14 C ATOM 0 H LEU A 109 -14.150 -20.096 5.766 1.00 63.32 H new ATOM 0 HA LEU A 109 -15.240 -18.500 7.811 1.00 1.24 H new ATOM 0 HB2 LEU A 109 -14.164 -17.754 5.057 1.00 42.22 H new ATOM 0 HB3 LEU A 109 -14.417 -16.623 6.372 1.00 42.22 H new ATOM 0 HG LEU A 109 -12.451 -18.935 6.359 1.00 52.50 H new ATOM 0 HD11 LEU A 109 -10.740 -17.162 6.374 1.00 51.12 H new ATOM 0 HD12 LEU A 109 -11.764 -17.083 4.921 1.00 51.12 H new ATOM 0 HD13 LEU A 109 -12.021 -15.932 6.253 1.00 51.12 H new ATOM 0 HD21 LEU A 109 -11.652 -18.021 8.504 1.00 60.14 H new ATOM 0 HD22 LEU A 109 -12.975 -16.831 8.484 1.00 60.14 H new ATOM 0 HD23 LEU A 109 -13.342 -18.568 8.605 1.00 60.14 H new ATOM 1753 N LYS A 110 -16.884 -18.367 4.931 1.00 25.55 N ATOM 1754 CA LYS A 110 -18.167 -17.985 4.337 1.00 12.35 C ATOM 1755 C LYS A 110 -19.335 -18.736 5.003 1.00 4.20 C ATOM 1756 O LYS A 110 -20.441 -18.204 5.143 1.00 13.30 O ATOM 1757 CB LYS A 110 -18.158 -18.248 2.825 1.00 52.42 C ATOM 1758 CG LYS A 110 -19.458 -17.850 2.137 1.00 33.41 C ATOM 1759 CD LYS A 110 -19.411 -18.076 0.632 1.00 75.34 C ATOM 1760 CE LYS A 110 -20.740 -17.716 -0.027 1.00 53.21 C ATOM 1761 NZ LYS A 110 -21.866 -18.519 0.518 1.00 40.32 N ATOM 0 H LYS A 110 -16.238 -18.822 4.286 1.00 25.55 H new ATOM 0 HA LYS A 110 -18.310 -16.918 4.508 1.00 12.35 H new ATOM 0 HB2 LYS A 110 -17.332 -17.699 2.372 1.00 52.42 H new ATOM 0 HB3 LYS A 110 -17.971 -19.307 2.648 1.00 52.42 H new ATOM 0 HG2 LYS A 110 -20.281 -18.424 2.562 1.00 33.41 H new ATOM 0 HG3 LYS A 110 -19.665 -16.799 2.338 1.00 33.41 H new ATOM 0 HD2 LYS A 110 -18.613 -17.475 0.197 1.00 75.34 H new ATOM 0 HD3 LYS A 110 -19.172 -19.119 0.427 1.00 75.34 H new ATOM 0 HE2 LYS A 110 -20.944 -16.656 0.124 1.00 53.21 H new ATOM 0 HE3 LYS A 110 -20.667 -17.877 -1.103 1.00 53.21 H new ATOM 0 HZ1 LYS A 110 -22.683 -18.450 -0.122 1.00 40.32 H new ATOM 0 HZ2 LYS A 110 -21.574 -19.514 0.601 1.00 40.32 H new ATOM 0 HZ3 LYS A 110 -22.129 -18.156 1.456 1.00 40.32 H new ATOM 1775 N THR A 111 -19.078 -19.975 5.415 1.00 13.24 N ATOM 1776 CA THR A 111 -20.081 -20.786 6.117 1.00 43.11 C ATOM 1777 C THR A 111 -20.462 -20.171 7.473 1.00 51.32 C ATOM 1778 O THR A 111 -21.642 -20.068 7.810 1.00 54.32 O ATOM 1779 CB THR A 111 -19.578 -22.237 6.336 1.00 2.25 C ATOM 1780 OG1 THR A 111 -19.292 -22.850 5.068 1.00 72.33 O ATOM 1781 CG2 THR A 111 -20.609 -23.079 7.083 1.00 24.11 C ATOM 0 H THR A 111 -18.183 -20.444 5.276 1.00 13.24 H new ATOM 0 HA THR A 111 -20.966 -20.806 5.481 1.00 43.11 H new ATOM 0 HB THR A 111 -18.672 -22.189 6.940 1.00 2.25 H new ATOM 0 HG1 THR A 111 -18.450 -22.494 4.715 1.00 72.33 H new ATOM 0 HG21 THR A 111 -20.224 -24.090 7.219 1.00 24.11 H new ATOM 0 HG22 THR A 111 -20.807 -22.632 8.057 1.00 24.11 H new ATOM 0 HG23 THR A 111 -21.533 -23.118 6.507 1.00 24.11 H new ATOM 1789 N ILE A 112 -19.458 -19.742 8.240 1.00 74.41 N ATOM 1790 CA ILE A 112 -19.691 -19.168 9.577 1.00 23.50 C ATOM 1791 C ILE A 112 -19.891 -17.635 9.541 1.00 13.43 C ATOM 1792 O ILE A 112 -19.670 -16.951 10.540 1.00 63.55 O ATOM 1793 CB ILE A 112 -18.530 -19.515 10.547 1.00 32.14 C ATOM 1794 CG1 ILE A 112 -17.198 -18.942 10.036 1.00 33.11 C ATOM 1795 CG2 ILE A 112 -18.431 -21.028 10.739 1.00 32.30 C ATOM 1796 CD1 ILE A 112 -16.042 -19.102 11.004 1.00 53.02 C ATOM 0 H ILE A 112 -18.477 -19.779 7.964 1.00 74.41 H new ATOM 0 HA ILE A 112 -20.615 -19.618 9.941 1.00 23.50 H new ATOM 0 HB ILE A 112 -18.743 -19.058 11.513 1.00 32.14 H new ATOM 0 HG12 ILE A 112 -16.941 -19.431 9.096 1.00 33.11 H new ATOM 0 HG13 ILE A 112 -17.331 -17.882 9.818 1.00 33.11 H new ATOM 0 HG21 ILE A 112 -17.612 -21.255 11.422 1.00 32.30 H new ATOM 0 HG22 ILE A 112 -19.366 -21.404 11.155 1.00 32.30 H new ATOM 0 HG23 ILE A 112 -18.244 -21.505 9.777 1.00 32.30 H new ATOM 0 HD11 ILE A 112 -15.140 -18.672 10.568 1.00 53.02 H new ATOM 0 HD12 ILE A 112 -16.275 -18.588 11.937 1.00 53.02 H new ATOM 0 HD13 ILE A 112 -15.879 -20.161 11.204 1.00 53.02 H new ATOM 1808 N ASN A 113 -20.332 -17.112 8.391 1.00 34.15 N ATOM 1809 CA ASN A 113 -20.658 -15.677 8.227 1.00 1.11 C ATOM 1810 C ASN A 113 -19.411 -14.771 8.270 1.00 53.21 C ATOM 1811 O ASN A 113 -19.523 -13.547 8.358 1.00 61.22 O ATOM 1812 CB ASN A 113 -21.669 -15.216 9.291 1.00 72.05 C ATOM 1813 CG ASN A 113 -22.932 -16.058 9.296 1.00 61.10 C ATOM 1814 OD1 ASN A 113 -23.877 -15.788 8.561 1.00 41.12 O ATOM 1815 ND2 ASN A 113 -22.971 -17.071 10.137 1.00 12.14 N ATOM 0 H ASN A 113 -20.475 -17.664 7.545 1.00 34.15 H new ATOM 0 HA ASN A 113 -21.102 -15.579 7.236 1.00 1.11 H new ATOM 0 HB2 ASN A 113 -21.202 -15.261 10.275 1.00 72.05 H new ATOM 0 HB3 ASN A 113 -21.932 -14.174 9.110 1.00 72.05 H new ATOM 0 HD21 ASN A 113 -23.804 -17.658 10.191 1.00 12.14 H new ATOM 0 HD22 ASN A 113 -22.168 -17.269 10.735 1.00 12.14 H new ATOM 1822 N GLN A 114 -18.228 -15.366 8.186 1.00 3.21 N ATOM 1823 CA GLN A 114 -16.971 -14.607 8.202 1.00 44.02 C ATOM 1824 C GLN A 114 -16.408 -14.411 6.782 1.00 20.42 C ATOM 1825 O GLN A 114 -15.192 -14.412 6.586 1.00 12.43 O ATOM 1826 CB GLN A 114 -15.931 -15.331 9.073 1.00 1.03 C ATOM 1827 CG GLN A 114 -16.374 -15.579 10.511 1.00 11.12 C ATOM 1828 CD GLN A 114 -16.686 -14.305 11.272 1.00 70.04 C ATOM 1829 OE1 GLN A 114 -17.820 -13.838 11.293 1.00 23.21 O ATOM 1830 NE2 GLN A 114 -15.684 -13.731 11.903 1.00 65.25 N ATOM 0 H GLN A 114 -18.106 -16.375 8.106 1.00 3.21 H new ATOM 0 HA GLN A 114 -17.184 -13.623 8.621 1.00 44.02 H new ATOM 0 HB2 GLN A 114 -15.691 -16.288 8.610 1.00 1.03 H new ATOM 0 HB3 GLN A 114 -15.013 -14.743 9.085 1.00 1.03 H new ATOM 0 HG2 GLN A 114 -17.258 -16.217 10.506 1.00 11.12 H new ATOM 0 HG3 GLN A 114 -15.590 -16.125 11.036 1.00 11.12 H new ATOM 0 HE21 GLN A 114 -14.753 -14.146 11.865 1.00 65.25 H new ATOM 0 HE22 GLN A 114 -15.838 -12.871 12.430 1.00 65.25 H new ATOM 1839 N GLU A 115 -17.290 -14.203 5.800 1.00 63.20 N ATOM 1840 CA GLU A 115 -16.868 -14.073 4.395 1.00 33.20 C ATOM 1841 C GLU A 115 -15.879 -12.905 4.208 1.00 11.21 C ATOM 1842 O GLU A 115 -14.977 -12.970 3.371 1.00 71.20 O ATOM 1843 CB GLU A 115 -18.091 -13.894 3.477 1.00 1.34 C ATOM 1844 CG GLU A 115 -17.772 -14.030 1.989 1.00 50.15 C ATOM 1845 CD GLU A 115 -19.001 -13.884 1.099 1.00 64.21 C ATOM 1846 OE1 GLU A 115 -19.984 -14.628 1.303 1.00 53.34 O ATOM 1847 OE2 GLU A 115 -18.988 -13.036 0.179 1.00 61.34 O ATOM 0 H GLU A 115 -18.296 -14.121 5.947 1.00 63.20 H new ATOM 0 HA GLU A 115 -16.353 -14.993 4.118 1.00 33.20 H new ATOM 0 HB2 GLU A 115 -18.846 -14.633 3.746 1.00 1.34 H new ATOM 0 HB3 GLU A 115 -18.528 -12.912 3.657 1.00 1.34 H new ATOM 0 HG2 GLU A 115 -17.037 -13.275 1.710 1.00 50.15 H new ATOM 0 HG3 GLU A 115 -17.314 -15.002 1.809 1.00 50.15 H new ATOM 1854 N SER A 116 -16.045 -11.845 5.005 1.00 2.13 N ATOM 1855 CA SER A 116 -15.101 -10.713 5.010 1.00 60.31 C ATOM 1856 C SER A 116 -13.658 -11.189 5.241 1.00 13.53 C ATOM 1857 O SER A 116 -12.726 -10.722 4.588 1.00 22.33 O ATOM 1858 CB SER A 116 -15.468 -9.698 6.105 1.00 4.22 C ATOM 1859 OG SER A 116 -16.773 -9.163 5.923 1.00 61.31 O ATOM 0 H SER A 116 -16.823 -11.743 5.657 1.00 2.13 H new ATOM 0 HA SER A 116 -15.169 -10.237 4.032 1.00 60.31 H new ATOM 0 HB2 SER A 116 -15.407 -10.180 7.081 1.00 4.22 H new ATOM 0 HB3 SER A 116 -14.741 -8.886 6.105 1.00 4.22 H new ATOM 0 HG SER A 116 -16.968 -8.524 6.640 1.00 61.31 H new ATOM 1865 N SER A 117 -13.495 -12.142 6.162 1.00 45.42 N ATOM 1866 CA SER A 117 -12.171 -12.657 6.552 1.00 0.12 C ATOM 1867 C SER A 117 -11.372 -13.213 5.361 1.00 25.33 C ATOM 1868 O SER A 117 -10.141 -13.218 5.382 1.00 74.12 O ATOM 1869 CB SER A 117 -12.313 -13.747 7.623 1.00 41.35 C ATOM 1870 OG SER A 117 -12.948 -13.247 8.788 1.00 24.20 O ATOM 0 H SER A 117 -14.271 -12.580 6.659 1.00 45.42 H new ATOM 0 HA SER A 117 -11.617 -11.808 6.953 1.00 0.12 H new ATOM 0 HB2 SER A 117 -12.889 -14.581 7.222 1.00 41.35 H new ATOM 0 HB3 SER A 117 -11.328 -14.136 7.882 1.00 41.35 H new ATOM 0 HG SER A 117 -13.026 -13.964 9.451 1.00 24.20 H new ATOM 1876 N ILE A 118 -12.071 -13.687 4.330 1.00 34.42 N ATOM 1877 CA ILE A 118 -11.415 -14.280 3.155 1.00 42.44 C ATOM 1878 C ILE A 118 -10.432 -13.298 2.477 1.00 4.14 C ATOM 1879 O ILE A 118 -9.394 -13.709 1.954 1.00 41.23 O ATOM 1880 CB ILE A 118 -12.463 -14.756 2.115 1.00 32.21 C ATOM 1881 CG1 ILE A 118 -13.449 -15.751 2.760 1.00 35.05 C ATOM 1882 CG2 ILE A 118 -11.774 -15.386 0.902 1.00 5.11 C ATOM 1883 CD1 ILE A 118 -14.554 -16.211 1.828 1.00 43.44 C ATOM 0 H ILE A 118 -13.090 -13.674 4.280 1.00 34.42 H new ATOM 0 HA ILE A 118 -10.846 -15.136 3.518 1.00 42.44 H new ATOM 0 HB ILE A 118 -13.026 -13.888 1.772 1.00 32.21 H new ATOM 0 HG12 ILE A 118 -12.895 -16.622 3.109 1.00 35.05 H new ATOM 0 HG13 ILE A 118 -13.897 -15.286 3.638 1.00 35.05 H new ATOM 0 HG21 ILE A 118 -12.527 -15.713 0.185 1.00 5.11 H new ATOM 0 HG22 ILE A 118 -11.121 -14.651 0.432 1.00 5.11 H new ATOM 0 HG23 ILE A 118 -11.183 -16.243 1.224 1.00 5.11 H new ATOM 0 HD11 ILE A 118 -15.206 -16.908 2.353 1.00 43.44 H new ATOM 0 HD12 ILE A 118 -15.134 -15.349 1.499 1.00 43.44 H new ATOM 0 HD13 ILE A 118 -14.116 -16.706 0.961 1.00 43.44 H new ATOM 1895 N GLU A 119 -10.751 -12.003 2.505 1.00 53.43 N ATOM 1896 CA GLU A 119 -9.919 -10.985 1.840 1.00 11.24 C ATOM 1897 C GLU A 119 -8.581 -10.742 2.576 1.00 53.43 C ATOM 1898 O GLU A 119 -7.519 -10.850 1.959 1.00 72.40 O ATOM 1899 CB GLU A 119 -10.712 -9.682 1.659 1.00 3.33 C ATOM 1900 CG GLU A 119 -11.860 -9.827 0.668 1.00 30.11 C ATOM 1901 CD GLU A 119 -12.790 -8.627 0.639 1.00 52.31 C ATOM 1902 OE1 GLU A 119 -12.401 -7.577 0.092 1.00 71.33 O ATOM 1903 OE2 GLU A 119 -13.928 -8.743 1.146 1.00 43.43 O ATOM 0 H GLU A 119 -11.575 -11.630 2.977 1.00 53.43 H new ATOM 0 HA GLU A 119 -9.656 -11.368 0.854 1.00 11.24 H new ATOM 0 HB2 GLU A 119 -11.108 -9.365 2.624 1.00 3.33 H new ATOM 0 HB3 GLU A 119 -10.039 -8.896 1.317 1.00 3.33 H new ATOM 0 HG2 GLU A 119 -11.450 -9.984 -0.330 1.00 30.11 H new ATOM 0 HG3 GLU A 119 -12.436 -10.717 0.919 1.00 30.11 H new ATOM 1910 N PRO A 120 -8.584 -10.416 3.896 1.00 14.53 N ATOM 1911 CA PRO A 120 -7.334 -10.337 4.673 1.00 72.12 C ATOM 1912 C PRO A 120 -6.577 -11.679 4.677 1.00 5.20 C ATOM 1913 O PRO A 120 -5.353 -11.718 4.824 1.00 41.45 O ATOM 1914 CB PRO A 120 -7.795 -9.948 6.092 1.00 61.41 C ATOM 1915 CG PRO A 120 -9.254 -10.259 6.130 1.00 63.12 C ATOM 1916 CD PRO A 120 -9.757 -10.070 4.724 1.00 50.44 C ATOM 0 HA PRO A 120 -6.633 -9.618 4.250 1.00 72.12 H new ATOM 0 HB2 PRO A 120 -7.252 -10.512 6.851 1.00 61.41 H new ATOM 0 HB3 PRO A 120 -7.613 -8.892 6.289 1.00 61.41 H new ATOM 0 HG2 PRO A 120 -9.426 -11.280 6.472 1.00 63.12 H new ATOM 0 HG3 PRO A 120 -9.776 -9.599 6.823 1.00 63.12 H new ATOM 0 HD2 PRO A 120 -10.606 -10.719 4.510 1.00 50.44 H new ATOM 0 HD3 PRO A 120 -10.086 -9.046 4.548 1.00 50.44 H new ATOM 1924 N LEU A 121 -7.316 -12.781 4.509 1.00 53.02 N ATOM 1925 CA LEU A 121 -6.706 -14.108 4.355 1.00 14.22 C ATOM 1926 C LEU A 121 -5.918 -14.165 3.037 1.00 45.14 C ATOM 1927 O LEU A 121 -4.774 -14.622 3.002 1.00 72.32 O ATOM 1928 CB LEU A 121 -7.795 -15.202 4.404 1.00 41.14 C ATOM 1929 CG LEU A 121 -7.308 -16.657 4.613 1.00 10.21 C ATOM 1930 CD1 LEU A 121 -8.465 -17.548 5.056 1.00 4.31 C ATOM 1931 CD2 LEU A 121 -6.676 -17.233 3.348 1.00 74.52 C ATOM 0 H LEU A 121 -8.335 -12.781 4.476 1.00 53.02 H new ATOM 0 HA LEU A 121 -6.013 -14.288 5.177 1.00 14.22 H new ATOM 0 HB2 LEU A 121 -8.489 -14.956 5.208 1.00 41.14 H new ATOM 0 HB3 LEU A 121 -8.360 -15.162 3.473 1.00 41.14 H new ATOM 0 HG LEU A 121 -6.546 -16.632 5.392 1.00 10.21 H new ATOM 0 HD11 LEU A 121 -8.106 -18.567 5.198 1.00 4.31 H new ATOM 0 HD12 LEU A 121 -8.874 -17.173 5.994 1.00 4.31 H new ATOM 0 HD13 LEU A 121 -9.243 -17.541 4.292 1.00 4.31 H new ATOM 0 HD21 LEU A 121 -6.348 -18.255 3.538 1.00 74.52 H new ATOM 0 HD22 LEU A 121 -7.409 -17.231 2.542 1.00 74.52 H new ATOM 0 HD23 LEU A 121 -5.819 -16.624 3.060 1.00 74.52 H new ATOM 1943 N ALA A 122 -6.536 -13.679 1.958 1.00 75.11 N ATOM 1944 CA ALA A 122 -5.864 -13.567 0.659 1.00 73.23 C ATOM 1945 C ALA A 122 -4.606 -12.691 0.769 1.00 12.43 C ATOM 1946 O ALA A 122 -3.544 -13.042 0.250 1.00 52.44 O ATOM 1947 CB ALA A 122 -6.821 -13.003 -0.387 1.00 24.55 C ATOM 0 H ALA A 122 -7.503 -13.356 1.957 1.00 75.11 H new ATOM 0 HA ALA A 122 -5.556 -14.564 0.345 1.00 73.23 H new ATOM 0 HB1 ALA A 122 -6.308 -12.926 -1.346 1.00 24.55 H new ATOM 0 HB2 ALA A 122 -7.681 -13.665 -0.488 1.00 24.55 H new ATOM 0 HB3 ALA A 122 -7.159 -12.015 -0.076 1.00 24.55 H new ATOM 1953 N GLU A 123 -4.731 -11.556 1.464 1.00 32.20 N ATOM 1954 CA GLU A 123 -3.582 -10.682 1.729 1.00 0.35 C ATOM 1955 C GLU A 123 -2.484 -11.428 2.495 1.00 24.02 C ATOM 1956 O GLU A 123 -1.303 -11.248 2.223 1.00 71.33 O ATOM 1957 CB GLU A 123 -4.010 -9.441 2.522 1.00 11.25 C ATOM 1958 CG GLU A 123 -4.934 -8.506 1.754 1.00 54.51 C ATOM 1959 CD GLU A 123 -5.253 -7.242 2.535 1.00 0.23 C ATOM 1960 OE1 GLU A 123 -4.427 -6.301 2.519 1.00 34.04 O ATOM 1961 OE2 GLU A 123 -6.319 -7.185 3.180 1.00 43.43 O ATOM 0 H GLU A 123 -5.613 -11.221 1.852 1.00 32.20 H new ATOM 0 HA GLU A 123 -3.184 -10.367 0.765 1.00 0.35 H new ATOM 0 HB2 GLU A 123 -4.511 -9.761 3.436 1.00 11.25 H new ATOM 0 HB3 GLU A 123 -3.119 -8.889 2.823 1.00 11.25 H new ATOM 0 HG2 GLU A 123 -4.469 -8.237 0.806 1.00 54.51 H new ATOM 0 HG3 GLU A 123 -5.861 -9.028 1.517 1.00 54.51 H new ATOM 1968 N SER A 124 -2.886 -12.267 3.450 1.00 61.41 N ATOM 1969 CA SER A 124 -1.934 -13.095 4.209 1.00 62.10 C ATOM 1970 C SER A 124 -1.180 -14.057 3.281 1.00 60.45 C ATOM 1971 O SER A 124 0.032 -14.248 3.415 1.00 20.54 O ATOM 1972 CB SER A 124 -2.660 -13.894 5.306 1.00 23.24 C ATOM 1973 OG SER A 124 -3.226 -13.036 6.286 1.00 13.15 O ATOM 0 H SER A 124 -3.861 -12.395 3.720 1.00 61.41 H new ATOM 0 HA SER A 124 -1.214 -12.424 4.677 1.00 62.10 H new ATOM 0 HB2 SER A 124 -3.445 -14.502 4.856 1.00 23.24 H new ATOM 0 HB3 SER A 124 -1.959 -14.580 5.782 1.00 23.24 H new ATOM 0 HG SER A 124 -3.967 -12.532 5.890 1.00 13.15 H new ATOM 1979 N ILE A 125 -1.907 -14.655 2.335 1.00 25.43 N ATOM 1980 CA ILE A 125 -1.308 -15.551 1.339 1.00 23.34 C ATOM 1981 C ILE A 125 -0.261 -14.809 0.489 1.00 31.32 C ATOM 1982 O ILE A 125 0.896 -15.228 0.393 1.00 41.43 O ATOM 1983 CB ILE A 125 -2.394 -16.141 0.395 1.00 74.53 C ATOM 1984 CG1 ILE A 125 -3.449 -16.926 1.193 1.00 3.20 C ATOM 1985 CG2 ILE A 125 -1.759 -17.032 -0.673 1.00 1.34 C ATOM 1986 CD1 ILE A 125 -2.909 -18.166 1.871 1.00 64.52 C ATOM 0 H ILE A 125 -2.915 -14.535 2.236 1.00 25.43 H new ATOM 0 HA ILE A 125 -0.824 -16.361 1.885 1.00 23.34 H new ATOM 0 HB ILE A 125 -2.892 -15.309 -0.103 1.00 74.53 H new ATOM 0 HG12 ILE A 125 -3.881 -16.270 1.949 1.00 3.20 H new ATOM 0 HG13 ILE A 125 -4.258 -17.214 0.521 1.00 3.20 H new ATOM 0 HG21 ILE A 125 -2.537 -17.434 -1.322 1.00 1.34 H new ATOM 0 HG22 ILE A 125 -1.059 -16.445 -1.267 1.00 1.34 H new ATOM 0 HG23 ILE A 125 -1.228 -17.853 -0.193 1.00 1.34 H new ATOM 0 HD11 ILE A 125 -3.713 -18.664 2.413 1.00 64.52 H new ATOM 0 HD12 ILE A 125 -2.503 -18.844 1.120 1.00 64.52 H new ATOM 0 HD13 ILE A 125 -2.121 -17.885 2.569 1.00 64.52 H new ATOM 1998 N THR A 126 -0.675 -13.694 -0.108 1.00 10.32 N ATOM 1999 CA THR A 126 0.203 -12.900 -0.975 1.00 63.13 C ATOM 2000 C THR A 126 1.336 -12.225 -0.187 1.00 53.20 C ATOM 2001 O THR A 126 2.441 -12.069 -0.701 1.00 43.13 O ATOM 2002 CB THR A 126 -0.595 -11.822 -1.751 1.00 72.21 C ATOM 2003 OG1 THR A 126 -1.726 -12.424 -2.394 1.00 71.14 O ATOM 2004 CG2 THR A 126 0.272 -11.140 -2.808 1.00 44.32 C ATOM 0 H THR A 126 -1.617 -13.315 -0.009 1.00 10.32 H new ATOM 0 HA THR A 126 0.645 -13.599 -1.685 1.00 63.13 H new ATOM 0 HB THR A 126 -0.924 -11.071 -1.033 1.00 72.21 H new ATOM 0 HG1 THR A 126 -2.403 -12.650 -1.722 1.00 71.14 H new ATOM 0 HG21 THR A 126 -0.318 -10.390 -3.334 1.00 44.32 H new ATOM 0 HG22 THR A 126 1.123 -10.660 -2.326 1.00 44.32 H new ATOM 0 HG23 THR A 126 0.631 -11.884 -3.520 1.00 44.32 H new ATOM 2012 N ASP A 127 1.067 -11.829 1.059 1.00 13.41 N ATOM 2013 CA ASP A 127 2.092 -11.199 1.901 1.00 24.32 C ATOM 2014 C ASP A 127 3.269 -12.151 2.128 1.00 10.44 C ATOM 2015 O ASP A 127 4.416 -11.798 1.868 1.00 53.43 O ATOM 2016 CB ASP A 127 1.503 -10.767 3.252 1.00 64.54 C ATOM 2017 CG ASP A 127 2.539 -10.115 4.161 1.00 22.11 C ATOM 2018 OD1 ASP A 127 2.834 -8.915 3.971 1.00 31.22 O ATOM 2019 OD2 ASP A 127 3.073 -10.800 5.058 1.00 32.45 O ATOM 0 H ASP A 127 0.156 -11.931 1.507 1.00 13.41 H new ATOM 0 HA ASP A 127 2.452 -10.313 1.378 1.00 24.32 H new ATOM 0 HB2 ASP A 127 0.684 -10.068 3.081 1.00 64.54 H new ATOM 0 HB3 ASP A 127 1.080 -11.637 3.755 1.00 64.54 H new ATOM 2024 N VAL A 128 2.975 -13.368 2.584 1.00 53.51 N ATOM 2025 CA VAL A 128 4.017 -14.379 2.798 1.00 72.12 C ATOM 2026 C VAL A 128 4.680 -14.775 1.470 1.00 21.04 C ATOM 2027 O VAL A 128 5.896 -14.969 1.397 1.00 72.14 O ATOM 2028 CB VAL A 128 3.445 -15.646 3.487 1.00 30.14 C ATOM 2029 CG1 VAL A 128 4.530 -16.705 3.688 1.00 21.43 C ATOM 2030 CG2 VAL A 128 2.790 -15.283 4.819 1.00 34.10 C ATOM 0 H VAL A 128 2.031 -13.679 2.812 1.00 53.51 H new ATOM 0 HA VAL A 128 4.766 -13.933 3.453 1.00 72.12 H new ATOM 0 HB VAL A 128 2.684 -16.070 2.832 1.00 30.14 H new ATOM 0 HG11 VAL A 128 4.098 -17.581 4.173 1.00 21.43 H new ATOM 0 HG12 VAL A 128 4.942 -16.992 2.721 1.00 21.43 H new ATOM 0 HG13 VAL A 128 5.324 -16.298 4.314 1.00 21.43 H new ATOM 0 HG21 VAL A 128 2.395 -16.184 5.288 1.00 34.10 H new ATOM 0 HG22 VAL A 128 3.530 -14.827 5.476 1.00 34.10 H new ATOM 0 HG23 VAL A 128 1.977 -14.578 4.645 1.00 34.10 H new ATOM 2040 N LEU A 129 3.868 -14.883 0.422 1.00 2.24 N ATOM 2041 CA LEU A 129 4.353 -15.226 -0.917 1.00 45.00 C ATOM 2042 C LEU A 129 5.392 -14.208 -1.424 1.00 51.34 C ATOM 2043 O LEU A 129 6.507 -14.571 -1.800 1.00 72.43 O ATOM 2044 CB LEU A 129 3.162 -15.280 -1.888 1.00 31.01 C ATOM 2045 CG LEU A 129 3.484 -15.751 -3.315 1.00 2.00 C ATOM 2046 CD1 LEU A 129 3.975 -17.196 -3.307 1.00 65.24 C ATOM 2047 CD2 LEU A 129 2.263 -15.598 -4.222 1.00 2.15 C ATOM 0 H LEU A 129 2.860 -14.737 0.473 1.00 2.24 H new ATOM 0 HA LEU A 129 4.841 -16.199 -0.864 1.00 45.00 H new ATOM 0 HB2 LEU A 129 2.405 -15.943 -1.469 1.00 31.01 H new ATOM 0 HB3 LEU A 129 2.718 -14.286 -1.945 1.00 31.01 H new ATOM 0 HG LEU A 129 4.282 -15.123 -3.711 1.00 2.00 H new ATOM 0 HD11 LEU A 129 4.197 -17.510 -4.327 1.00 65.24 H new ATOM 0 HD12 LEU A 129 4.877 -17.270 -2.699 1.00 65.24 H new ATOM 0 HD13 LEU A 129 3.202 -17.841 -2.889 1.00 65.24 H new ATOM 0 HD21 LEU A 129 2.512 -15.937 -5.228 1.00 2.15 H new ATOM 0 HD22 LEU A 129 1.441 -16.197 -3.830 1.00 2.15 H new ATOM 0 HD23 LEU A 129 1.964 -14.550 -4.256 1.00 2.15 H new ATOM 2059 N VAL A 130 5.028 -12.929 -1.403 1.00 52.23 N ATOM 2060 CA VAL A 130 5.900 -11.861 -1.907 1.00 32.24 C ATOM 2061 C VAL A 130 7.038 -11.532 -0.920 1.00 34.43 C ATOM 2062 O VAL A 130 8.152 -11.210 -1.331 1.00 65.22 O ATOM 2063 CB VAL A 130 5.082 -10.576 -2.208 1.00 1.23 C ATOM 2064 CG1 VAL A 130 5.983 -9.447 -2.706 1.00 33.40 C ATOM 2065 CG2 VAL A 130 3.974 -10.867 -3.222 1.00 44.41 C ATOM 0 H VAL A 130 4.132 -12.601 -1.042 1.00 52.23 H new ATOM 0 HA VAL A 130 6.348 -12.228 -2.831 1.00 32.24 H new ATOM 0 HB VAL A 130 4.622 -10.249 -1.276 1.00 1.23 H new ATOM 0 HG11 VAL A 130 5.380 -8.562 -2.908 1.00 33.40 H new ATOM 0 HG12 VAL A 130 6.727 -9.213 -1.945 1.00 33.40 H new ATOM 0 HG13 VAL A 130 6.486 -9.760 -3.621 1.00 33.40 H new ATOM 0 HG21 VAL A 130 3.412 -9.954 -3.419 1.00 44.41 H new ATOM 0 HG22 VAL A 130 4.416 -11.229 -4.150 1.00 44.41 H new ATOM 0 HG23 VAL A 130 3.303 -11.626 -2.820 1.00 44.41 H new ATOM 2075 N ARG A 131 6.756 -11.643 0.379 1.00 52.42 N ATOM 2076 CA ARG A 131 7.729 -11.306 1.432 1.00 23.32 C ATOM 2077 C ARG A 131 9.072 -12.039 1.242 1.00 73.34 C ATOM 2078 O ARG A 131 10.132 -11.507 1.574 1.00 12.53 O ATOM 2079 CB ARG A 131 7.145 -11.657 2.811 1.00 22.22 C ATOM 2080 CG ARG A 131 7.966 -11.155 3.994 1.00 32.24 C ATOM 2081 CD ARG A 131 7.899 -9.634 4.127 1.00 41.41 C ATOM 2082 NE ARG A 131 6.540 -9.158 4.402 1.00 71.30 N ATOM 2083 CZ ARG A 131 6.258 -7.956 4.831 1.00 2.44 C ATOM 2084 NH1 ARG A 131 7.198 -7.080 5.014 1.00 52.43 N ATOM 2085 NH2 ARG A 131 5.030 -7.625 5.066 1.00 12.51 N ATOM 0 H ARG A 131 5.856 -11.966 0.734 1.00 52.42 H new ATOM 0 HA ARG A 131 7.923 -10.236 1.365 1.00 23.32 H new ATOM 0 HB2 ARG A 131 6.139 -11.242 2.881 1.00 22.22 H new ATOM 0 HB3 ARG A 131 7.049 -12.740 2.886 1.00 22.22 H new ATOM 0 HG2 ARG A 131 7.601 -11.616 4.912 1.00 32.24 H new ATOM 0 HG3 ARG A 131 9.004 -11.464 3.873 1.00 32.24 H new ATOM 0 HD2 ARG A 131 8.563 -9.312 4.929 1.00 41.41 H new ATOM 0 HD3 ARG A 131 8.263 -9.175 3.208 1.00 41.41 H new ATOM 0 HE ARG A 131 5.766 -9.805 4.249 1.00 71.30 H new ATOM 0 HH11 ARG A 131 8.169 -7.326 4.823 1.00 52.43 H new ATOM 0 HH12 ARG A 131 6.966 -6.145 5.349 1.00 52.43 H new ATOM 0 HH21 ARG A 131 4.282 -8.302 4.917 1.00 12.51 H new ATOM 0 HH22 ARG A 131 4.810 -6.687 5.401 1.00 12.51 H new ATOM 2099 N THR A 132 9.021 -13.262 0.713 1.00 43.33 N ATOM 2100 CA THR A 132 10.232 -14.093 0.566 1.00 22.05 C ATOM 2101 C THR A 132 10.402 -14.696 -0.843 1.00 65.41 C ATOM 2102 O THR A 132 11.527 -14.940 -1.279 1.00 62.51 O ATOM 2103 CB THR A 132 10.261 -15.230 1.625 1.00 60.23 C ATOM 2104 OG1 THR A 132 11.092 -16.323 1.189 1.00 41.53 O ATOM 2105 CG2 THR A 132 8.856 -15.735 1.938 1.00 32.41 C ATOM 0 H THR A 132 8.164 -13.703 0.379 1.00 43.33 H new ATOM 0 HA THR A 132 11.070 -13.415 0.727 1.00 22.05 H new ATOM 0 HB THR A 132 10.686 -14.811 2.537 1.00 60.23 H new ATOM 0 HG1 THR A 132 11.609 -16.664 1.949 1.00 41.53 H new ATOM 0 HG21 THR A 132 8.912 -16.530 2.682 1.00 32.41 H new ATOM 0 HG22 THR A 132 8.253 -14.915 2.328 1.00 32.41 H new ATOM 0 HG23 THR A 132 8.397 -16.122 1.028 1.00 32.41 H new ATOM 2113 N LYS A 133 9.301 -14.941 -1.559 1.00 33.00 N ATOM 2114 CA LYS A 133 9.378 -15.570 -2.893 1.00 33.32 C ATOM 2115 C LYS A 133 9.160 -14.563 -4.041 1.00 12.12 C ATOM 2116 O LYS A 133 9.046 -14.967 -5.200 1.00 24.22 O ATOM 2117 CB LYS A 133 8.363 -16.729 -3.010 1.00 33.50 C ATOM 2118 CG LYS A 133 8.801 -18.030 -2.331 1.00 45.15 C ATOM 2119 CD LYS A 133 8.967 -17.873 -0.821 1.00 3.53 C ATOM 2120 CE LYS A 133 9.514 -19.137 -0.166 1.00 43.23 C ATOM 2121 NZ LYS A 133 9.783 -18.939 1.284 1.00 73.54 N ATOM 0 H LYS A 133 8.355 -14.719 -1.248 1.00 33.00 H new ATOM 0 HA LYS A 133 10.391 -15.961 -2.992 1.00 33.32 H new ATOM 0 HB2 LYS A 133 7.415 -16.410 -2.577 1.00 33.50 H new ATOM 0 HB3 LYS A 133 8.180 -16.929 -4.066 1.00 33.50 H new ATOM 0 HG2 LYS A 133 8.065 -18.808 -2.534 1.00 45.15 H new ATOM 0 HG3 LYS A 133 9.744 -18.363 -2.765 1.00 45.15 H new ATOM 0 HD2 LYS A 133 9.639 -17.040 -0.616 1.00 3.53 H new ATOM 0 HD3 LYS A 133 8.004 -17.623 -0.376 1.00 3.53 H new ATOM 0 HE2 LYS A 133 8.800 -19.951 -0.295 1.00 43.23 H new ATOM 0 HE3 LYS A 133 10.434 -19.437 -0.668 1.00 43.23 H new ATOM 0 HZ1 LYS A 133 10.394 -19.706 1.632 1.00 73.54 H new ATOM 0 HZ2 LYS A 133 10.259 -18.025 1.427 1.00 73.54 H new ATOM 0 HZ3 LYS A 133 8.885 -18.947 1.808 1.00 73.54 H new ATOM 2135 N ARG A 134 9.127 -13.261 -3.728 1.00 43.41 N ATOM 2136 CA ARG A 134 8.961 -12.216 -4.760 1.00 70.24 C ATOM 2137 C ARG A 134 9.954 -12.382 -5.921 1.00 42.34 C ATOM 2138 O ARG A 134 9.565 -12.415 -7.094 1.00 13.13 O ATOM 2139 CB ARG A 134 9.128 -10.810 -4.156 1.00 51.20 C ATOM 2140 CG ARG A 134 9.353 -9.728 -5.212 1.00 52.43 C ATOM 2141 CD ARG A 134 9.338 -8.314 -4.637 1.00 23.10 C ATOM 2142 NE ARG A 134 9.635 -7.322 -5.673 1.00 52.41 N ATOM 2143 CZ ARG A 134 9.024 -6.176 -5.809 1.00 71.52 C ATOM 2144 NH1 ARG A 134 8.132 -5.790 -4.956 1.00 62.23 N ATOM 2145 NH2 ARG A 134 9.322 -5.409 -6.807 1.00 45.31 N ATOM 0 H ARG A 134 9.212 -12.903 -2.777 1.00 43.41 H new ATOM 0 HA ARG A 134 7.950 -12.331 -5.151 1.00 70.24 H new ATOM 0 HB2 ARG A 134 8.240 -10.563 -3.574 1.00 51.20 H new ATOM 0 HB3 ARG A 134 9.971 -10.816 -3.465 1.00 51.20 H new ATOM 0 HG2 ARG A 134 10.310 -9.903 -5.704 1.00 52.43 H new ATOM 0 HG3 ARG A 134 8.581 -9.810 -5.977 1.00 52.43 H new ATOM 0 HD2 ARG A 134 8.362 -8.106 -4.199 1.00 23.10 H new ATOM 0 HD3 ARG A 134 10.071 -8.237 -3.834 1.00 23.10 H new ATOM 0 HE ARG A 134 10.375 -7.543 -6.339 1.00 52.41 H new ATOM 0 HH11 ARG A 134 7.896 -6.384 -4.161 1.00 62.23 H new ATOM 0 HH12 ARG A 134 7.665 -4.892 -5.078 1.00 62.23 H new ATOM 0 HH21 ARG A 134 10.030 -5.701 -7.481 1.00 45.31 H new ATOM 0 HH22 ARG A 134 8.849 -4.512 -6.920 1.00 45.31 H new ATOM 2159 N ASP A 135 11.235 -12.466 -5.584 1.00 65.31 N ATOM 2160 CA ASP A 135 12.293 -12.585 -6.583 1.00 61.34 C ATOM 2161 C ASP A 135 12.067 -13.778 -7.519 1.00 2.42 C ATOM 2162 O ASP A 135 12.149 -13.641 -8.734 1.00 23.32 O ATOM 2163 CB ASP A 135 13.644 -12.702 -5.886 1.00 11.13 C ATOM 2164 CG ASP A 135 13.931 -11.498 -5.015 1.00 44.31 C ATOM 2165 OD1 ASP A 135 13.561 -11.522 -3.824 1.00 52.33 O ATOM 2166 OD2 ASP A 135 14.518 -10.519 -5.521 1.00 40.42 O ATOM 0 H ASP A 135 11.569 -12.454 -4.620 1.00 65.31 H new ATOM 0 HA ASP A 135 12.277 -11.686 -7.200 1.00 61.34 H new ATOM 0 HB2 ASP A 135 13.662 -13.605 -5.276 1.00 11.13 H new ATOM 0 HB3 ASP A 135 14.431 -12.807 -6.633 1.00 11.13 H new ATOM 2171 N TRP A 136 11.769 -14.941 -6.956 1.00 52.15 N ATOM 2172 CA TRP A 136 11.506 -16.137 -7.762 1.00 11.24 C ATOM 2173 C TRP A 136 10.260 -15.958 -8.644 1.00 74.12 C ATOM 2174 O TRP A 136 10.229 -16.419 -9.787 1.00 24.24 O ATOM 2175 CB TRP A 136 11.366 -17.367 -6.859 1.00 40.22 C ATOM 2176 CG TRP A 136 12.633 -17.682 -6.115 1.00 50.33 C ATOM 2177 CD1 TRP A 136 12.855 -17.562 -4.772 1.00 0.45 C ATOM 2178 CD2 TRP A 136 13.861 -18.149 -6.685 1.00 31.11 C ATOM 2179 NE1 TRP A 136 14.144 -17.934 -4.474 1.00 65.34 N ATOM 2180 CE2 TRP A 136 14.781 -18.297 -5.631 1.00 5.43 C ATOM 2181 CE3 TRP A 136 14.269 -18.459 -7.986 1.00 62.12 C ATOM 2182 CZ2 TRP A 136 16.084 -18.740 -5.839 1.00 54.35 C ATOM 2183 CZ3 TRP A 136 15.563 -18.899 -8.190 1.00 54.33 C ATOM 2184 CH2 TRP A 136 16.457 -19.036 -7.122 1.00 4.43 C ATOM 0 H TRP A 136 11.702 -15.087 -5.949 1.00 52.15 H new ATOM 0 HA TRP A 136 12.356 -16.289 -8.427 1.00 11.24 H new ATOM 0 HB2 TRP A 136 10.561 -17.199 -6.144 1.00 40.22 H new ATOM 0 HB3 TRP A 136 11.080 -18.227 -7.464 1.00 40.22 H new ATOM 0 HD1 TRP A 136 12.125 -17.225 -4.051 1.00 0.45 H new ATOM 0 HE1 TRP A 136 14.559 -17.939 -3.542 1.00 65.34 H new ATOM 0 HE3 TRP A 136 13.586 -18.356 -8.816 1.00 62.12 H new ATOM 0 HZ2 TRP A 136 16.776 -18.846 -5.017 1.00 54.35 H new ATOM 0 HZ3 TRP A 136 15.890 -19.141 -9.190 1.00 54.33 H new ATOM 0 HH2 TRP A 136 17.462 -19.382 -7.314 1.00 4.43 H new ATOM 2195 N LEU A 137 9.246 -15.270 -8.112 1.00 70.21 N ATOM 2196 CA LEU A 137 8.031 -14.955 -8.876 1.00 24.31 C ATOM 2197 C LEU A 137 8.359 -14.177 -10.161 1.00 22.11 C ATOM 2198 O LEU A 137 7.913 -14.539 -11.244 1.00 53.33 O ATOM 2199 CB LEU A 137 7.048 -14.141 -8.018 1.00 43.31 C ATOM 2200 CG LEU A 137 6.322 -14.920 -6.907 1.00 24.54 C ATOM 2201 CD1 LEU A 137 5.580 -13.960 -5.981 1.00 4.54 C ATOM 2202 CD2 LEU A 137 5.355 -15.939 -7.506 1.00 61.23 C ATOM 0 H LEU A 137 9.240 -14.919 -7.154 1.00 70.21 H new ATOM 0 HA LEU A 137 7.569 -15.902 -9.155 1.00 24.31 H new ATOM 0 HB2 LEU A 137 7.593 -13.316 -7.560 1.00 43.31 H new ATOM 0 HB3 LEU A 137 6.299 -13.702 -8.676 1.00 43.31 H new ATOM 0 HG LEU A 137 7.068 -15.459 -6.323 1.00 24.54 H new ATOM 0 HD11 LEU A 137 5.072 -14.527 -5.201 1.00 4.54 H new ATOM 0 HD12 LEU A 137 6.291 -13.272 -5.525 1.00 4.54 H new ATOM 0 HD13 LEU A 137 4.846 -13.395 -6.555 1.00 4.54 H new ATOM 0 HD21 LEU A 137 4.852 -16.479 -6.704 1.00 61.23 H new ATOM 0 HD22 LEU A 137 4.614 -15.422 -8.116 1.00 61.23 H new ATOM 0 HD23 LEU A 137 5.908 -16.644 -8.127 1.00 61.23 H new ATOM 2214 N VAL A 138 9.129 -13.101 -10.042 1.00 63.31 N ATOM 2215 CA VAL A 138 9.475 -12.282 -11.211 1.00 73.32 C ATOM 2216 C VAL A 138 10.589 -12.921 -12.073 1.00 44.22 C ATOM 2217 O VAL A 138 10.520 -12.899 -13.302 1.00 2.14 O ATOM 2218 CB VAL A 138 9.884 -10.841 -10.799 1.00 24.34 C ATOM 2219 CG1 VAL A 138 11.118 -10.847 -9.894 1.00 31.44 C ATOM 2220 CG2 VAL A 138 10.115 -9.973 -12.038 1.00 33.00 C ATOM 0 H VAL A 138 9.525 -12.773 -9.161 1.00 63.31 H new ATOM 0 HA VAL A 138 8.572 -12.230 -11.819 1.00 73.32 H new ATOM 0 HB VAL A 138 9.063 -10.410 -10.227 1.00 24.34 H new ATOM 0 HG11 VAL A 138 11.377 -9.823 -9.625 1.00 31.44 H new ATOM 0 HG12 VAL A 138 10.903 -11.417 -8.990 1.00 31.44 H new ATOM 0 HG13 VAL A 138 11.954 -11.306 -10.422 1.00 31.44 H new ATOM 0 HG21 VAL A 138 10.401 -8.967 -11.730 1.00 33.00 H new ATOM 0 HG22 VAL A 138 10.911 -10.407 -12.643 1.00 33.00 H new ATOM 0 HG23 VAL A 138 9.198 -9.926 -12.625 1.00 33.00 H new ATOM 2230 N LYS A 139 11.604 -13.498 -11.425 1.00 63.22 N ATOM 2231 CA LYS A 139 12.749 -14.101 -12.134 1.00 11.34 C ATOM 2232 C LYS A 139 12.328 -15.287 -13.017 1.00 25.31 C ATOM 2233 O LYS A 139 12.573 -15.290 -14.224 1.00 72.13 O ATOM 2234 CB LYS A 139 13.827 -14.561 -11.134 1.00 23.33 C ATOM 2235 CG LYS A 139 14.593 -13.421 -10.457 1.00 12.24 C ATOM 2236 CD LYS A 139 15.344 -12.552 -11.467 1.00 31.44 C ATOM 2237 CE LYS A 139 16.270 -11.544 -10.787 1.00 0.02 C ATOM 2238 NZ LYS A 139 15.543 -10.643 -9.849 1.00 50.45 N ATOM 0 H LYS A 139 11.662 -13.563 -10.409 1.00 63.22 H new ATOM 0 HA LYS A 139 13.159 -13.327 -12.783 1.00 11.34 H new ATOM 0 HB2 LYS A 139 13.354 -15.171 -10.365 1.00 23.33 H new ATOM 0 HB3 LYS A 139 14.539 -15.201 -11.655 1.00 23.33 H new ATOM 0 HG2 LYS A 139 13.896 -12.801 -9.894 1.00 12.24 H new ATOM 0 HG3 LYS A 139 15.301 -13.836 -9.740 1.00 12.24 H new ATOM 0 HD2 LYS A 139 15.929 -13.191 -12.129 1.00 31.44 H new ATOM 0 HD3 LYS A 139 14.626 -12.020 -12.090 1.00 31.44 H new ATOM 0 HE2 LYS A 139 17.047 -12.080 -10.242 1.00 0.02 H new ATOM 0 HE3 LYS A 139 16.770 -10.944 -11.548 1.00 0.02 H new ATOM 0 HZ1 LYS A 139 16.209 -9.957 -9.440 1.00 50.45 H new ATOM 0 HZ2 LYS A 139 14.796 -10.135 -10.364 1.00 50.45 H new ATOM 0 HZ3 LYS A 139 15.116 -11.207 -9.087 1.00 50.45 H new ATOM 2252 N GLN A 140 11.701 -16.294 -12.413 1.00 35.01 N ATOM 2253 CA GLN A 140 11.293 -17.504 -13.147 1.00 43.31 C ATOM 2254 C GLN A 140 9.929 -17.310 -13.831 1.00 53.43 C ATOM 2255 O GLN A 140 9.462 -18.185 -14.565 1.00 62.54 O ATOM 2256 CB GLN A 140 11.216 -18.710 -12.191 1.00 23.31 C ATOM 2257 CG GLN A 140 12.451 -18.912 -11.311 1.00 75.11 C ATOM 2258 CD GLN A 140 13.716 -19.242 -12.092 1.00 33.44 C ATOM 2259 OE1 GLN A 140 14.021 -20.402 -12.348 1.00 73.42 O ATOM 2260 NE2 GLN A 140 14.472 -18.227 -12.460 1.00 75.25 N ATOM 0 H GLN A 140 11.462 -16.303 -11.421 1.00 35.01 H new ATOM 0 HA GLN A 140 12.044 -17.692 -13.914 1.00 43.31 H new ATOM 0 HB2 GLN A 140 10.344 -18.590 -11.547 1.00 23.31 H new ATOM 0 HB3 GLN A 140 11.056 -19.613 -12.780 1.00 23.31 H new ATOM 0 HG2 GLN A 140 12.621 -18.007 -10.727 1.00 75.11 H new ATOM 0 HG3 GLN A 140 12.253 -19.716 -10.602 1.00 75.11 H new ATOM 0 HE21 GLN A 140 14.191 -17.273 -12.232 1.00 75.25 H new ATOM 0 HE22 GLN A 140 15.338 -18.395 -12.973 1.00 75.25 H new ATOM 2269 N ARG A 141 9.314 -16.150 -13.592 1.00 51.12 N ATOM 2270 CA ARG A 141 7.949 -15.861 -14.048 1.00 1.40 C ATOM 2271 C ARG A 141 6.946 -16.835 -13.402 1.00 30.03 C ATOM 2272 O ARG A 141 6.654 -17.902 -13.938 1.00 21.52 O ATOM 2273 CB ARG A 141 7.853 -15.899 -15.582 1.00 34.34 C ATOM 2274 CG ARG A 141 8.887 -15.020 -16.284 1.00 23.04 C ATOM 2275 CD ARG A 141 8.552 -14.830 -17.760 1.00 45.40 C ATOM 2276 NE ARG A 141 9.573 -14.056 -18.464 1.00 24.42 N ATOM 2277 CZ ARG A 141 9.427 -12.813 -18.839 1.00 44.15 C ATOM 2278 NH1 ARG A 141 8.344 -12.159 -18.560 1.00 63.03 N ATOM 2279 NH2 ARG A 141 10.376 -12.222 -19.485 1.00 12.43 N ATOM 0 H ARG A 141 9.747 -15.383 -13.077 1.00 51.12 H new ATOM 0 HA ARG A 141 7.693 -14.850 -13.731 1.00 1.40 H new ATOM 0 HB2 ARG A 141 7.975 -16.928 -15.919 1.00 34.34 H new ATOM 0 HB3 ARG A 141 6.855 -15.581 -15.883 1.00 34.34 H new ATOM 0 HG2 ARG A 141 8.933 -14.048 -15.793 1.00 23.04 H new ATOM 0 HG3 ARG A 141 9.874 -15.472 -16.189 1.00 23.04 H new ATOM 0 HD2 ARG A 141 8.446 -15.805 -18.235 1.00 45.40 H new ATOM 0 HD3 ARG A 141 7.590 -14.326 -17.850 1.00 45.40 H new ATOM 0 HE ARG A 141 10.458 -14.517 -18.676 1.00 24.42 H new ATOM 0 HH11 ARG A 141 7.593 -12.614 -18.042 1.00 63.03 H new ATOM 0 HH12 ARG A 141 8.243 -11.189 -18.859 1.00 63.03 H new ATOM 0 HH21 ARG A 141 11.236 -12.725 -19.701 1.00 12.43 H new ATOM 0 HH22 ARG A 141 10.265 -11.252 -19.779 1.00 12.43 H new ATOM 2293 N GLY A 142 6.429 -16.443 -12.239 1.00 74.00 N ATOM 2294 CA GLY A 142 5.625 -17.332 -11.413 1.00 62.03 C ATOM 2295 C GLY A 142 4.379 -17.867 -12.102 1.00 3.13 C ATOM 2296 O GLY A 142 4.247 -19.070 -12.307 1.00 33.31 O ATOM 0 H GLY A 142 6.556 -15.509 -11.849 1.00 74.00 H new ATOM 0 HA2 GLY A 142 6.242 -18.174 -11.098 1.00 62.03 H new ATOM 0 HA3 GLY A 142 5.327 -16.800 -10.510 1.00 62.03 H new ATOM 2300 N TRP A 143 3.472 -16.972 -12.477 1.00 23.04 N ATOM 2301 CA TRP A 143 2.173 -17.379 -13.028 1.00 54.53 C ATOM 2302 C TRP A 143 2.301 -17.963 -14.446 1.00 61.24 C ATOM 2303 O TRP A 143 1.392 -18.628 -14.936 1.00 31.13 O ATOM 2304 CB TRP A 143 1.196 -16.195 -12.995 1.00 71.52 C ATOM 2305 CG TRP A 143 1.052 -15.605 -11.620 1.00 53.34 C ATOM 2306 CD1 TRP A 143 1.176 -14.289 -11.273 1.00 63.01 C ATOM 2307 CD2 TRP A 143 0.787 -16.319 -10.401 1.00 52.44 C ATOM 2308 NE1 TRP A 143 0.993 -14.139 -9.919 1.00 20.33 N ATOM 2309 CE2 TRP A 143 0.756 -15.371 -9.363 1.00 3.01 C ATOM 2310 CE3 TRP A 143 0.573 -17.667 -10.087 1.00 34.50 C ATOM 2311 CZ2 TRP A 143 0.516 -15.725 -8.038 1.00 42.42 C ATOM 2312 CZ3 TRP A 143 0.337 -18.016 -8.770 1.00 60.04 C ATOM 2313 CH2 TRP A 143 0.312 -17.048 -7.760 1.00 31.13 C ATOM 0 H TRP A 143 3.606 -15.963 -12.412 1.00 23.04 H new ATOM 0 HA TRP A 143 1.777 -18.178 -12.401 1.00 54.53 H new ATOM 0 HB2 TRP A 143 1.542 -15.424 -13.683 1.00 71.52 H new ATOM 0 HB3 TRP A 143 0.219 -16.524 -13.350 1.00 71.52 H new ATOM 0 HD1 TRP A 143 1.387 -13.484 -11.962 1.00 63.01 H new ATOM 0 HE1 TRP A 143 1.028 -13.256 -9.410 1.00 20.33 H new ATOM 0 HE3 TRP A 143 0.592 -18.421 -10.860 1.00 34.50 H new ATOM 0 HZ2 TRP A 143 0.492 -14.980 -7.257 1.00 42.42 H new ATOM 0 HZ3 TRP A 143 0.169 -19.052 -8.517 1.00 60.04 H new ATOM 0 HH2 TRP A 143 0.128 -17.352 -6.740 1.00 31.13 H new ATOM 2324 N ASP A 144 3.435 -17.716 -15.096 1.00 64.20 N ATOM 2325 CA ASP A 144 3.735 -18.341 -16.388 1.00 75.04 C ATOM 2326 C ASP A 144 4.260 -19.775 -16.193 1.00 63.42 C ATOM 2327 O ASP A 144 3.681 -20.740 -16.705 1.00 32.42 O ATOM 2328 CB ASP A 144 4.768 -17.506 -17.149 1.00 33.54 C ATOM 2329 CG ASP A 144 4.303 -16.078 -17.364 1.00 22.22 C ATOM 2330 OD1 ASP A 144 3.643 -15.808 -18.391 1.00 1.31 O ATOM 2331 OD2 ASP A 144 4.592 -15.220 -16.506 1.00 13.01 O ATOM 0 H ASP A 144 4.163 -17.089 -14.753 1.00 64.20 H new ATOM 0 HA ASP A 144 2.813 -18.387 -16.968 1.00 75.04 H new ATOM 0 HB2 ASP A 144 5.707 -17.501 -16.596 1.00 33.54 H new ATOM 0 HB3 ASP A 144 4.968 -17.971 -18.114 1.00 33.54 H new ATOM 2336 N GLY A 145 5.357 -19.897 -15.440 1.00 63.14 N ATOM 2337 CA GLY A 145 5.955 -21.199 -15.156 1.00 3.15 C ATOM 2338 C GLY A 145 5.011 -22.143 -14.417 1.00 22.52 C ATOM 2339 O GLY A 145 5.030 -23.354 -14.637 1.00 65.30 O ATOM 0 H GLY A 145 5.847 -19.108 -15.017 1.00 63.14 H new ATOM 0 HA2 GLY A 145 6.263 -21.663 -16.093 1.00 3.15 H new ATOM 0 HA3 GLY A 145 6.856 -21.056 -14.560 1.00 3.15 H new ATOM 2343 N PHE A 146 4.186 -21.578 -13.544 1.00 22.05 N ATOM 2344 CA PHE A 146 3.182 -22.336 -12.788 1.00 51.24 C ATOM 2345 C PHE A 146 2.261 -23.142 -13.723 1.00 3.04 C ATOM 2346 O PHE A 146 2.056 -24.343 -13.535 1.00 41.33 O ATOM 2347 CB PHE A 146 2.356 -21.349 -11.946 1.00 71.15 C ATOM 2348 CG PHE A 146 1.306 -21.978 -11.070 1.00 10.23 C ATOM 2349 CD1 PHE A 146 1.660 -22.607 -9.885 1.00 74.42 C ATOM 2350 CD2 PHE A 146 -0.037 -21.923 -11.419 1.00 62.32 C ATOM 2351 CE1 PHE A 146 0.698 -23.167 -9.071 1.00 54.50 C ATOM 2352 CE2 PHE A 146 -1.001 -22.485 -10.607 1.00 1.22 C ATOM 2353 CZ PHE A 146 -0.634 -23.108 -9.433 1.00 44.13 C ATOM 0 H PHE A 146 4.190 -20.579 -13.336 1.00 22.05 H new ATOM 0 HA PHE A 146 3.690 -23.051 -12.141 1.00 51.24 H new ATOM 0 HB2 PHE A 146 3.036 -20.775 -11.316 1.00 71.15 H new ATOM 0 HB3 PHE A 146 1.870 -20.641 -12.618 1.00 71.15 H new ATOM 0 HD1 PHE A 146 2.700 -22.659 -9.597 1.00 74.42 H new ATOM 0 HD2 PHE A 146 -0.330 -21.435 -12.337 1.00 62.32 H new ATOM 0 HE1 PHE A 146 0.986 -23.652 -8.150 1.00 54.50 H new ATOM 0 HE2 PHE A 146 -2.042 -22.437 -10.891 1.00 1.22 H new ATOM 0 HZ PHE A 146 -1.387 -23.549 -8.797 1.00 44.13 H new ATOM 2363 N VAL A 147 1.732 -22.474 -14.744 1.00 14.13 N ATOM 2364 CA VAL A 147 0.786 -23.096 -15.677 1.00 53.11 C ATOM 2365 C VAL A 147 1.466 -24.134 -16.591 1.00 32.21 C ATOM 2366 O VAL A 147 0.920 -25.217 -16.834 1.00 20.42 O ATOM 2367 CB VAL A 147 0.092 -22.020 -16.550 1.00 30.10 C ATOM 2368 CG1 VAL A 147 -0.918 -22.650 -17.508 1.00 72.31 C ATOM 2369 CG2 VAL A 147 -0.580 -20.968 -15.671 1.00 41.43 C ATOM 0 H VAL A 147 1.941 -21.497 -14.950 1.00 14.13 H new ATOM 0 HA VAL A 147 0.043 -23.614 -15.071 1.00 53.11 H new ATOM 0 HB VAL A 147 0.858 -21.530 -17.151 1.00 30.10 H new ATOM 0 HG11 VAL A 147 -1.388 -21.869 -18.106 1.00 72.31 H new ATOM 0 HG12 VAL A 147 -0.406 -23.353 -18.166 1.00 72.31 H new ATOM 0 HG13 VAL A 147 -1.681 -23.178 -16.936 1.00 72.31 H new ATOM 0 HG21 VAL A 147 -1.062 -20.221 -16.302 1.00 41.43 H new ATOM 0 HG22 VAL A 147 -1.328 -21.446 -15.039 1.00 41.43 H new ATOM 0 HG23 VAL A 147 0.170 -20.485 -15.044 1.00 41.43 H new ATOM 2379 N GLU A 148 2.653 -23.803 -17.099 1.00 21.33 N ATOM 2380 CA GLU A 148 3.383 -24.704 -18.003 1.00 12.43 C ATOM 2381 C GLU A 148 3.986 -25.906 -17.253 1.00 63.44 C ATOM 2382 O GLU A 148 4.164 -26.979 -17.829 1.00 75.44 O ATOM 2383 CB GLU A 148 4.474 -23.939 -18.769 1.00 64.32 C ATOM 2384 CG GLU A 148 5.527 -23.296 -17.879 1.00 31.10 C ATOM 2385 CD GLU A 148 6.535 -22.470 -18.663 1.00 14.32 C ATOM 2386 OE1 GLU A 148 6.230 -21.303 -18.993 1.00 64.53 O ATOM 2387 OE2 GLU A 148 7.634 -22.984 -18.958 1.00 52.43 O ATOM 0 H GLU A 148 3.131 -22.923 -16.904 1.00 21.33 H new ATOM 0 HA GLU A 148 2.663 -25.097 -18.721 1.00 12.43 H new ATOM 0 HB2 GLU A 148 4.967 -24.625 -19.458 1.00 64.32 H new ATOM 0 HB3 GLU A 148 4.002 -23.164 -19.373 1.00 64.32 H new ATOM 0 HG2 GLU A 148 5.035 -22.659 -17.144 1.00 31.10 H new ATOM 0 HG3 GLU A 148 6.053 -24.074 -17.326 1.00 31.10 H new ATOM 2394 N PHE A 149 4.290 -25.726 -15.968 1.00 32.01 N ATOM 2395 CA PHE A 149 4.795 -26.824 -15.130 1.00 42.24 C ATOM 2396 C PHE A 149 3.741 -27.933 -14.987 1.00 63.33 C ATOM 2397 O PHE A 149 4.042 -29.121 -15.122 1.00 52.24 O ATOM 2398 CB PHE A 149 5.198 -26.300 -13.743 1.00 32.21 C ATOM 2399 CG PHE A 149 5.783 -27.356 -12.834 1.00 30.43 C ATOM 2400 CD1 PHE A 149 7.116 -27.732 -12.950 1.00 12.13 C ATOM 2401 CD2 PHE A 149 5.002 -27.971 -11.864 1.00 15.41 C ATOM 2402 CE1 PHE A 149 7.654 -28.697 -12.119 1.00 22.53 C ATOM 2403 CE2 PHE A 149 5.537 -28.935 -11.032 1.00 0.13 C ATOM 2404 CZ PHE A 149 6.864 -29.298 -11.159 1.00 21.33 C ATOM 0 H PHE A 149 4.197 -24.834 -15.481 1.00 32.01 H new ATOM 0 HA PHE A 149 5.674 -27.244 -15.618 1.00 42.24 H new ATOM 0 HB2 PHE A 149 5.925 -25.498 -13.866 1.00 32.21 H new ATOM 0 HB3 PHE A 149 4.322 -25.865 -13.261 1.00 32.21 H new ATOM 0 HD1 PHE A 149 7.739 -27.265 -13.698 1.00 12.13 H new ATOM 0 HD2 PHE A 149 3.964 -27.692 -11.759 1.00 15.41 H new ATOM 0 HE1 PHE A 149 8.691 -28.981 -12.221 1.00 22.53 H new ATOM 0 HE2 PHE A 149 4.918 -29.405 -10.282 1.00 0.13 H new ATOM 0 HZ PHE A 149 7.283 -30.051 -10.508 1.00 21.33 H new ATOM 2414 N PHE A 150 2.500 -27.534 -14.715 1.00 24.54 N ATOM 2415 CA PHE A 150 1.385 -28.482 -14.625 1.00 10.41 C ATOM 2416 C PHE A 150 0.831 -28.837 -16.016 1.00 62.13 C ATOM 2417 O PHE A 150 -0.158 -29.565 -16.135 1.00 22.40 O ATOM 2418 CB PHE A 150 0.281 -27.920 -13.721 1.00 33.30 C ATOM 2419 CG PHE A 150 0.694 -27.832 -12.272 1.00 2.45 C ATOM 2420 CD1 PHE A 150 0.678 -28.962 -11.465 1.00 53.13 C ATOM 2421 CD2 PHE A 150 1.112 -26.629 -11.720 1.00 72.51 C ATOM 2422 CE1 PHE A 150 1.067 -28.891 -10.140 1.00 53.34 C ATOM 2423 CE2 PHE A 150 1.503 -26.554 -10.397 1.00 44.30 C ATOM 2424 CZ PHE A 150 1.480 -27.686 -9.606 1.00 62.43 C ATOM 0 H PHE A 150 2.239 -26.562 -14.553 1.00 24.54 H new ATOM 0 HA PHE A 150 1.762 -29.404 -14.182 1.00 10.41 H new ATOM 0 HB2 PHE A 150 -0.000 -26.928 -14.074 1.00 33.30 H new ATOM 0 HB3 PHE A 150 -0.604 -28.550 -13.803 1.00 33.30 H new ATOM 0 HD1 PHE A 150 0.358 -29.908 -11.877 1.00 53.13 H new ATOM 0 HD2 PHE A 150 1.132 -25.740 -12.333 1.00 72.51 H new ATOM 0 HE1 PHE A 150 1.048 -29.777 -9.523 1.00 53.34 H new ATOM 0 HE2 PHE A 150 1.826 -25.611 -9.982 1.00 44.30 H new ATOM 0 HZ PHE A 150 1.785 -27.629 -8.571 1.00 62.43 H new ATOM 2434 N HIS A 151 1.477 -28.302 -17.060 1.00 22.23 N ATOM 2435 CA HIS A 151 1.176 -28.653 -18.454 1.00 10.21 C ATOM 2436 C HIS A 151 -0.292 -28.356 -18.822 1.00 3.22 C ATOM 2437 O HIS A 151 -0.915 -29.089 -19.592 1.00 43.15 O ATOM 2438 CB HIS A 151 1.514 -30.137 -18.691 1.00 1.12 C ATOM 2439 CG HIS A 151 1.891 -30.463 -20.106 1.00 1.21 C ATOM 2440 ND1 HIS A 151 3.109 -31.009 -20.450 1.00 20.11 N ATOM 2441 CD2 HIS A 151 1.207 -30.323 -21.266 1.00 10.42 C ATOM 2442 CE1 HIS A 151 3.157 -31.190 -21.753 1.00 11.44 C ATOM 2443 NE2 HIS A 151 2.017 -30.785 -22.271 1.00 1.12 N ATOM 0 H HIS A 151 2.223 -27.614 -16.962 1.00 22.23 H new ATOM 0 HA HIS A 151 1.792 -28.032 -19.104 1.00 10.21 H new ATOM 0 HB2 HIS A 151 2.336 -30.420 -18.033 1.00 1.12 H new ATOM 0 HB3 HIS A 151 0.654 -30.744 -18.407 1.00 1.12 H new ATOM 0 HD2 HIS A 151 0.210 -29.923 -21.379 1.00 10.42 H new ATOM 0 HE1 HIS A 151 3.990 -31.601 -22.303 1.00 11.44 H new ATOM 0 HE2 HIS A 151 1.775 -30.811 -23.262 1.00 1.12 H new ATOM 2452 N VAL A 152 -0.828 -27.258 -18.294 1.00 64.41 N ATOM 2453 CA VAL A 152 -2.222 -26.869 -18.555 1.00 42.33 C ATOM 2454 C VAL A 152 -2.416 -26.373 -20.002 1.00 55.54 C ATOM 2455 O VAL A 152 -3.064 -27.033 -20.817 1.00 5.53 O ATOM 2456 CB VAL A 152 -2.685 -25.773 -17.563 1.00 33.54 C ATOM 2457 CG1 VAL A 152 -4.142 -25.385 -17.810 1.00 64.14 C ATOM 2458 CG2 VAL A 152 -2.477 -26.237 -16.122 1.00 11.34 C ATOM 0 H VAL A 152 -0.322 -26.618 -17.682 1.00 64.41 H new ATOM 0 HA VAL A 152 -2.832 -27.761 -18.414 1.00 42.33 H new ATOM 0 HB VAL A 152 -2.076 -24.884 -17.728 1.00 33.54 H new ATOM 0 HG11 VAL A 152 -4.439 -24.614 -17.099 1.00 64.14 H new ATOM 0 HG12 VAL A 152 -4.250 -25.003 -18.825 1.00 64.14 H new ATOM 0 HG13 VAL A 152 -4.778 -26.261 -17.682 1.00 64.14 H new ATOM 0 HG21 VAL A 152 -2.807 -25.456 -15.437 1.00 11.34 H new ATOM 0 HG22 VAL A 152 -3.056 -27.144 -15.945 1.00 11.34 H new ATOM 0 HG23 VAL A 152 -1.420 -26.443 -15.955 1.00 11.34 H new