USER MOD reduce.3.24.130724 H: found=0, std=0, add=1335, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1339 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 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 131 THR OG1 : rot 67:sc= 1.13 USER MOD Set 2.1: A 26 GLN : amide:sc= -2.43 K(o=-3.1,f=-5.6!) USER MOD Set 2.2: A 27 HIS : no HD1:sc= -0.685 K(o=-3.1,f=-4.4) USER MOD Set 3.1: A 11 ASN : amide:sc= -0.77 X(o=-0.84,f=-0.4) USER MOD Set 3.2: A 13 ASN : amide:sc= -0.0731 X(o=-0.84,f=-0.4) USER MOD Set 4.1: A 12 SER OG : rot 46:sc= -0.0616 USER MOD Set 4.2: A 16 THR OG1 : rot 6:sc= 0.756 USER MOD Single : A 3 THR OG1 : rot -14:sc= 0.775 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 10 SER OG : rot 29:sc= -0.0968 USER MOD Single : A 17 HIS : no HD1:sc= -1.15 X(o=-1.1,f=-1.5) USER MOD Single : A 18 SER OG : rot -71:sc= 1.57 USER MOD Single : A 28 ASN : amide:sc= -3.21! C(o=-3.2!,f=-8.8!) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN :FLIP amide:sc= -1.42 F(o=-4.3!,f=-1.4) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 51 THR OG1 : rot 4:sc= -0.0328 USER MOD Single : A 53 HIS : no HD1:sc= -5.46! C(o=-5.5!,f=-5.5!) USER MOD Single : A 54 HIS : no HE2:sc= -0.558 K(o=-0.56,f=-2.2) USER MOD Single : A 64 LYS NZ :NH3+ -168:sc= -0.0174 (180deg=-0.238) USER MOD Single : A 65 LYS NZ :NH3+ -109:sc= -0.857 (180deg=-2.54!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot -43:sc= -3.39! USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -151:sc= -0.316 (180deg=-1.23!) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 84 GLN : amide:sc= 0.515 K(o=0.51,f=-0.48) USER MOD Single : A 87 LYS NZ :NH3+ 140:sc= -1.46 (180deg=-4.27!) USER MOD Single : A 88 HIS : no HD1:sc= 0.0996 K(o=0.1,f=-1.1) USER MOD Single : A 117 HIS : no HD1:sc= -0.0624 X(o=-0.062,f=-0.062) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 126 HIS : no HD1:sc= -4.58! C(o=-4.6!,f=-5.4!) USER MOD Single : A 127 HIS : no HD1:sc= -0.936 X(o=-0.94,f=-0.67) USER MOD Single : A 133 GLN : amide:sc= -0.0654 X(o=-0.065,f=-0.053) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN :FLIP amide:sc= 0 F(o=-0.89,f=0) USER MOD Single : A 145 SER OG : rot 50:sc= -3.23 USER MOD Single : A 149 HIS : no HE2:sc= -2.11 X(o=-2.1,f=-2) USER MOD Single : A 151 ASN : amide:sc= -3.83 K(o=-3.8,f=-9!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot -23:sc= 1.19 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 MET CE :methyl -118:sc= -1.18 (180deg=-4.03!) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.125) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 LYS NZ :NH3+ 178:sc= -0.0135 (180deg=-0.0199) USER MOD Single : A 176 TYR OH : rot 130:sc= -4.39! USER MOD Single : A 177 LYS NZ :NH3+ -153:sc= -1.29! (180deg=-2.33!) USER MOD Single : A 181 HIS : no HE2:sc= -3.97 K(o=-4,f=-4.7!) USER MOD Single : A 182 LYS NZ :NH3+ -157:sc= -0.373 (180deg=-1.24!) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD Single : A 190 ASN :FLIP amide:sc= -1.79 F(o=-5.7,f=-1.8) USER MOD Single : A 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 28 N THR A 3 -2.996 -22.398 24.381 1.00 0.00 N ATOM 29 CA THR A 3 -3.519 -22.145 23.043 1.00 0.00 C ATOM 30 C THR A 3 -5.040 -22.020 23.069 1.00 0.00 C ATOM 31 O THR A 3 -5.699 -22.529 23.976 1.00 0.00 O ATOM 32 CB THR A 3 -3.100 -23.265 22.085 1.00 0.00 C ATOM 33 OG1 THR A 3 -2.322 -24.239 22.757 1.00 0.00 O ATOM 34 CG2 THR A 3 -2.293 -22.770 20.904 1.00 0.00 C ATOM 0 HA THR A 3 -3.101 -21.203 22.689 1.00 0.00 H new ATOM 0 HB THR A 3 -4.033 -23.692 21.717 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.030 -23.884 23.623 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.028 -23.613 20.265 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.885 -22.054 20.334 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.384 -22.286 21.262 1.00 0.00 H new ATOM 42 N LEU A 4 -5.590 -21.340 22.068 1.00 0.00 N ATOM 43 CA LEU A 4 -7.033 -21.149 21.974 1.00 0.00 C ATOM 44 C LEU A 4 -7.585 -21.812 20.717 1.00 0.00 C ATOM 45 O LEU A 4 -8.437 -22.697 20.793 1.00 0.00 O ATOM 46 CB LEU A 4 -7.380 -19.656 21.970 1.00 0.00 C ATOM 47 CG LEU A 4 -6.411 -18.751 22.739 1.00 0.00 C ATOM 48 CD1 LEU A 4 -6.091 -19.338 24.107 1.00 0.00 C ATOM 49 CD2 LEU A 4 -5.136 -18.534 21.936 1.00 0.00 C ATOM 0 H LEU A 4 -5.058 -20.912 21.310 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.491 -21.616 22.846 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.426 -19.314 20.936 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.378 -19.532 22.391 1.00 0.00 H new ATOM 0 HG LEU A 4 -6.893 -17.785 22.891 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -5.402 -18.678 24.634 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.010 -19.438 24.684 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.632 -20.319 23.984 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -4.459 -17.889 22.496 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.654 -19.494 21.752 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.381 -18.063 20.984 1.00 0.00 H new ATOM 61 N GLY A 5 -7.092 -21.378 19.562 1.00 0.00 N ATOM 62 CA GLY A 5 -7.545 -21.940 18.303 1.00 0.00 C ATOM 63 C GLY A 5 -9.040 -21.782 18.100 1.00 0.00 C ATOM 64 O GLY A 5 -9.822 -22.641 18.507 1.00 0.00 O ATOM 0 H GLY A 5 -6.386 -20.647 19.475 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -7.017 -21.455 17.482 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.287 -22.998 18.268 1.00 0.00 H new ATOM 68 N GLY A 6 -9.437 -20.682 17.469 1.00 0.00 N ATOM 69 CA GLY A 6 -10.845 -20.435 17.224 1.00 0.00 C ATOM 70 C GLY A 6 -11.299 -19.086 17.746 1.00 0.00 C ATOM 71 O GLY A 6 -11.189 -18.806 18.940 1.00 0.00 O ATOM 0 H GLY A 6 -8.808 -19.957 17.123 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -11.039 -20.490 16.153 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -11.435 -21.221 17.696 1.00 0.00 H new ATOM 75 N VAL A 7 -11.810 -18.248 16.850 1.00 0.00 N ATOM 76 CA VAL A 7 -12.283 -16.920 17.223 1.00 0.00 C ATOM 77 C VAL A 7 -13.287 -16.992 18.371 1.00 0.00 C ATOM 78 O VAL A 7 -14.133 -17.886 18.413 1.00 0.00 O ATOM 79 CB VAL A 7 -12.940 -16.198 16.028 1.00 0.00 C ATOM 80 CG1 VAL A 7 -13.294 -14.765 16.396 1.00 0.00 C ATOM 81 CG2 VAL A 7 -12.026 -16.232 14.811 1.00 0.00 C ATOM 0 H VAL A 7 -11.907 -18.466 15.858 1.00 0.00 H new ATOM 0 HA VAL A 7 -11.408 -16.355 17.544 1.00 0.00 H new ATOM 0 HB VAL A 7 -13.862 -16.723 15.776 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -13.756 -14.273 15.540 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -13.991 -14.766 17.234 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.389 -14.228 16.678 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -12.508 -15.718 13.980 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -11.085 -15.736 15.049 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -11.830 -17.267 14.532 1.00 0.00 H new ATOM 91 N HIS A 8 -13.186 -16.045 19.298 1.00 0.00 N ATOM 92 CA HIS A 8 -14.085 -16.001 20.446 1.00 0.00 C ATOM 93 C HIS A 8 -13.790 -14.788 21.323 1.00 0.00 C ATOM 94 O HIS A 8 -12.801 -14.764 22.055 1.00 0.00 O ATOM 95 CB HIS A 8 -13.957 -17.283 21.271 1.00 0.00 C ATOM 96 CG HIS A 8 -15.254 -17.753 21.853 1.00 0.00 C ATOM 97 ND1 HIS A 8 -16.329 -18.140 21.081 1.00 0.00 N ATOM 98 CD2 HIS A 8 -15.647 -17.897 23.141 1.00 0.00 C ATOM 99 CE1 HIS A 8 -17.327 -18.501 21.868 1.00 0.00 C ATOM 100 NE2 HIS A 8 -16.939 -18.364 23.122 1.00 0.00 N ATOM 0 H HIS A 8 -12.491 -15.298 19.277 1.00 0.00 H new ATOM 0 HA HIS A 8 -15.106 -15.918 20.072 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -13.544 -18.071 20.641 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -13.245 -17.116 22.079 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -15.055 -17.684 24.019 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -18.296 -18.849 21.541 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.506 -18.571 23.944 1.00 0.00 H new ATOM 109 N ASP A 9 -14.657 -13.783 21.244 1.00 0.00 N ATOM 110 CA ASP A 9 -14.491 -12.566 22.032 1.00 0.00 C ATOM 111 C ASP A 9 -14.810 -12.823 23.501 1.00 0.00 C ATOM 112 O ASP A 9 -15.244 -13.914 23.871 1.00 0.00 O ATOM 113 CB ASP A 9 -15.392 -11.456 21.488 1.00 0.00 C ATOM 114 CG ASP A 9 -16.863 -11.816 21.563 1.00 0.00 C ATOM 115 OD1 ASP A 9 -17.354 -12.074 22.682 1.00 0.00 O ATOM 116 OD2 ASP A 9 -17.523 -11.839 20.503 1.00 0.00 O1- ATOM 0 H ASP A 9 -15.481 -13.787 20.643 1.00 0.00 H new ATOM 0 HA ASP A 9 -13.451 -12.250 21.955 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.216 -10.540 22.052 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.124 -11.249 20.452 1.00 0.00 H new ATOM 121 N SER A 10 -14.592 -11.811 24.335 1.00 0.00 N ATOM 122 CA SER A 10 -14.857 -11.928 25.764 1.00 0.00 C ATOM 123 C SER A 10 -14.598 -10.605 26.477 1.00 0.00 C ATOM 124 O SER A 10 -14.196 -9.622 25.855 1.00 0.00 O ATOM 125 CB SER A 10 -13.990 -13.029 26.376 1.00 0.00 C ATOM 126 OG SER A 10 -12.785 -13.194 25.648 1.00 0.00 O ATOM 0 H SER A 10 -14.233 -10.901 24.046 1.00 0.00 H new ATOM 0 HA SER A 10 -15.908 -12.189 25.892 1.00 0.00 H new ATOM 0 HB2 SER A 10 -13.761 -12.782 27.413 1.00 0.00 H new ATOM 0 HB3 SER A 10 -14.543 -13.968 26.387 1.00 0.00 H new ATOM 0 HG SER A 10 -12.531 -12.341 25.238 1.00 0.00 H new ATOM 132 N ASN A 11 -14.831 -10.588 27.785 1.00 0.00 N ATOM 133 CA ASN A 11 -14.622 -9.386 28.584 1.00 0.00 C ATOM 134 C ASN A 11 -13.498 -9.594 29.595 1.00 0.00 C ATOM 135 O ASN A 11 -13.625 -9.229 30.764 1.00 0.00 O ATOM 136 CB ASN A 11 -15.913 -8.999 29.307 1.00 0.00 C ATOM 137 CG ASN A 11 -16.363 -10.056 30.290 1.00 0.00 C ATOM 138 OD1 ASN A 11 -16.189 -9.913 31.501 1.00 0.00 O ATOM 139 ND2 ASN A 11 -16.946 -11.125 29.770 1.00 0.00 N ATOM 0 H ASN A 11 -15.165 -11.393 28.315 1.00 0.00 H new ATOM 0 HA ASN A 11 -14.335 -8.577 27.912 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -15.762 -8.057 29.834 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -16.701 -8.831 28.573 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -17.273 -11.875 30.379 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -17.068 -11.199 28.760 1.00 0.00 H new ATOM 146 N SER A 12 -12.399 -10.184 29.136 1.00 0.00 N ATOM 147 CA SER A 12 -11.254 -10.443 30.001 1.00 0.00 C ATOM 148 C SER A 12 -11.640 -11.370 31.150 1.00 0.00 C ATOM 149 O SER A 12 -11.324 -11.105 32.310 1.00 0.00 O ATOM 150 CB SER A 12 -10.696 -9.128 30.551 1.00 0.00 C ATOM 151 OG SER A 12 -9.723 -9.364 31.554 1.00 0.00 O ATOM 0 H SER A 12 -12.277 -10.491 28.171 1.00 0.00 H new ATOM 0 HA SER A 12 -10.483 -10.934 29.407 1.00 0.00 H new ATOM 0 HB2 SER A 12 -10.253 -8.550 29.740 1.00 0.00 H new ATOM 0 HB3 SER A 12 -11.508 -8.529 30.962 1.00 0.00 H new ATOM 0 HG SER A 12 -9.100 -10.057 31.249 1.00 0.00 H new ATOM 157 N ASN A 13 -12.326 -12.459 30.818 1.00 0.00 N ATOM 158 CA ASN A 13 -12.757 -13.426 31.821 1.00 0.00 C ATOM 159 C ASN A 13 -11.558 -14.003 32.572 1.00 0.00 C ATOM 160 O ASN A 13 -11.449 -13.858 33.789 1.00 0.00 O ATOM 161 CB ASN A 13 -13.556 -14.553 31.163 1.00 0.00 C ATOM 162 CG ASN A 13 -15.052 -14.311 31.221 1.00 0.00 C ATOM 163 OD1 ASN A 13 -15.689 -14.534 32.250 1.00 0.00 O ATOM 164 ND2 ASN A 13 -15.620 -13.851 30.112 1.00 0.00 N ATOM 0 H ASN A 13 -12.595 -12.694 29.863 1.00 0.00 H new ATOM 0 HA ASN A 13 -13.396 -12.910 32.538 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -13.247 -14.654 30.123 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -13.324 -15.496 31.658 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -16.623 -13.668 30.091 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -15.053 -13.680 29.282 1.00 0.00 H new ATOM 171 N PRO A 14 -10.641 -14.668 31.850 1.00 0.00 N ATOM 172 CA PRO A 14 -9.446 -15.269 32.450 1.00 0.00 C ATOM 173 C PRO A 14 -8.408 -14.224 32.844 1.00 0.00 C ATOM 174 O PRO A 14 -8.692 -13.027 32.858 1.00 0.00 O ATOM 175 CB PRO A 14 -8.907 -16.164 31.334 1.00 0.00 C ATOM 176 CG PRO A 14 -9.366 -15.514 30.076 1.00 0.00 C ATOM 177 CD PRO A 14 -10.697 -14.886 30.392 1.00 0.00 C ATOM 0 HA PRO A 14 -9.675 -15.803 33.372 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -7.820 -16.232 31.371 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -9.293 -17.180 31.419 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -8.650 -14.763 29.742 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -9.461 -16.244 29.272 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -10.837 -13.950 29.852 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -11.524 -15.540 30.116 1.00 0.00 H new ATOM 185 N ASP A 15 -7.203 -14.685 33.163 1.00 0.00 N ATOM 186 CA ASP A 15 -6.122 -13.789 33.557 1.00 0.00 C ATOM 187 C ASP A 15 -5.474 -13.149 32.332 1.00 0.00 C ATOM 188 O ASP A 15 -4.285 -13.335 32.075 1.00 0.00 O ATOM 189 CB ASP A 15 -5.071 -14.550 34.368 1.00 0.00 C ATOM 190 CG ASP A 15 -5.675 -15.296 35.541 1.00 0.00 C ATOM 191 OD1 ASP A 15 -6.528 -14.712 36.241 1.00 0.00 O1- ATOM 192 OD2 ASP A 15 -5.294 -16.466 35.761 1.00 0.00 O ATOM 0 H ASP A 15 -6.951 -15.673 33.156 1.00 0.00 H new ATOM 0 HA ASP A 15 -6.545 -12.998 34.177 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -4.556 -15.257 33.718 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -4.321 -13.849 34.734 1.00 0.00 H new ATOM 197 N THR A 16 -6.267 -12.393 31.579 1.00 0.00 N ATOM 198 CA THR A 16 -5.774 -11.724 30.380 1.00 0.00 C ATOM 199 C THR A 16 -4.835 -10.577 30.740 1.00 0.00 C ATOM 200 O THR A 16 -3.956 -10.214 29.959 1.00 0.00 O ATOM 201 CB THR A 16 -6.945 -11.198 29.548 1.00 0.00 C ATOM 202 OG1 THR A 16 -7.791 -10.379 30.334 1.00 0.00 O ATOM 203 CG2 THR A 16 -7.796 -12.298 28.951 1.00 0.00 C ATOM 0 H THR A 16 -7.254 -12.228 31.778 1.00 0.00 H new ATOM 0 HA THR A 16 -5.216 -12.453 29.792 1.00 0.00 H new ATOM 0 HB THR A 16 -6.490 -10.631 28.736 1.00 0.00 H new ATOM 0 HG1 THR A 16 -7.391 -10.250 31.219 1.00 0.00 H new ATOM 0 HG21 THR A 16 -8.608 -11.857 28.373 1.00 0.00 H new ATOM 0 HG22 THR A 16 -7.182 -12.919 28.298 1.00 0.00 H new ATOM 0 HG23 THR A 16 -8.211 -12.912 29.751 1.00 0.00 H new ATOM 211 N HIS A 17 -5.028 -10.007 31.927 1.00 0.00 N ATOM 212 CA HIS A 17 -4.198 -8.899 32.389 1.00 0.00 C ATOM 213 C HIS A 17 -2.716 -9.260 32.328 1.00 0.00 C ATOM 214 O HIS A 17 -1.904 -8.499 31.802 1.00 0.00 O ATOM 215 CB HIS A 17 -4.580 -8.511 33.819 1.00 0.00 C ATOM 216 CG HIS A 17 -4.555 -9.661 34.778 1.00 0.00 C ATOM 217 ND1 HIS A 17 -3.465 -9.958 35.569 1.00 0.00 N ATOM 218 CD2 HIS A 17 -5.495 -10.590 35.072 1.00 0.00 C ATOM 219 CE1 HIS A 17 -3.736 -11.020 36.307 1.00 0.00 C ATOM 220 NE2 HIS A 17 -4.961 -11.422 36.025 1.00 0.00 N ATOM 0 H HIS A 17 -5.752 -10.294 32.586 1.00 0.00 H new ATOM 0 HA HIS A 17 -4.372 -8.050 31.728 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -3.896 -7.739 34.172 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -5.579 -8.074 33.814 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -6.481 -10.663 34.638 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -3.068 -11.481 37.020 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -5.434 -12.221 36.447 1.00 0.00 H new ATOM 229 N SER A 18 -2.373 -10.424 32.868 1.00 0.00 N ATOM 230 CA SER A 18 -0.989 -10.885 32.875 1.00 0.00 C ATOM 231 C SER A 18 -0.471 -11.080 31.453 1.00 0.00 C ATOM 232 O SER A 18 0.683 -10.773 31.155 1.00 0.00 O ATOM 233 CB SER A 18 -0.870 -12.194 33.657 1.00 0.00 C ATOM 234 OG SER A 18 0.339 -12.240 34.395 1.00 0.00 O ATOM 0 H SER A 18 -3.034 -11.066 33.306 1.00 0.00 H new ATOM 0 HA SER A 18 -0.381 -10.122 33.361 1.00 0.00 H new ATOM 0 HB2 SER A 18 -1.717 -12.294 34.335 1.00 0.00 H new ATOM 0 HB3 SER A 18 -0.911 -13.038 32.968 1.00 0.00 H new ATOM 0 HG SER A 18 1.094 -12.354 33.780 1.00 0.00 H new ATOM 240 N LEU A 19 -1.332 -11.594 30.580 1.00 0.00 N ATOM 241 CA LEU A 19 -0.964 -11.832 29.190 1.00 0.00 C ATOM 242 C LEU A 19 -0.452 -10.558 28.526 1.00 0.00 C ATOM 243 O LEU A 19 0.512 -10.588 27.762 1.00 0.00 O ATOM 244 CB LEU A 19 -2.162 -12.378 28.419 1.00 0.00 C ATOM 245 CG LEU A 19 -2.319 -13.897 28.472 1.00 0.00 C ATOM 246 CD1 LEU A 19 -1.320 -14.570 27.544 1.00 0.00 C ATOM 247 CD2 LEU A 19 -2.154 -14.407 29.897 1.00 0.00 C ATOM 0 H LEU A 19 -2.291 -11.854 30.812 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.159 -12.567 29.175 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.069 -11.919 28.812 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.076 -12.072 27.376 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.325 -14.148 28.135 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.447 -15.651 27.595 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.489 -14.233 26.521 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.307 -14.309 27.849 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.270 -15.491 29.911 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.163 -14.143 30.265 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.911 -13.953 30.536 1.00 0.00 H new ATOM 259 N ALA A 20 -1.103 -9.438 28.824 1.00 0.00 N ATOM 260 CA ALA A 20 -0.714 -8.154 28.257 1.00 0.00 C ATOM 261 C ALA A 20 0.646 -7.712 28.789 1.00 0.00 C ATOM 262 O ALA A 20 1.441 -7.111 28.066 1.00 0.00 O ATOM 263 CB ALA A 20 -1.773 -7.103 28.557 1.00 0.00 C ATOM 0 H ALA A 20 -1.903 -9.395 29.456 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.631 -8.268 27.176 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -1.470 -6.148 28.128 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -2.724 -7.411 28.123 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -1.885 -6.997 29.636 1.00 0.00 H new ATOM 269 N ARG A 21 0.907 -8.015 30.057 1.00 0.00 N ATOM 270 CA ARG A 21 2.171 -7.651 30.685 1.00 0.00 C ATOM 271 C ARG A 21 3.347 -8.274 29.939 1.00 0.00 C ATOM 272 O ARG A 21 4.366 -7.623 29.711 1.00 0.00 O ATOM 273 CB ARG A 21 2.186 -8.101 32.147 1.00 0.00 C ATOM 274 CG ARG A 21 1.013 -7.578 32.959 1.00 0.00 C ATOM 275 CD ARG A 21 1.174 -6.103 33.282 1.00 0.00 C ATOM 276 NE ARG A 21 1.576 -5.887 34.670 1.00 0.00 N ATOM 277 CZ ARG A 21 0.737 -5.937 35.702 1.00 0.00 C ATOM 278 NH1 ARG A 21 -0.550 -6.195 35.507 1.00 0.00 N1+ ATOM 279 NH2 ARG A 21 1.185 -5.728 36.932 1.00 0.00 N ATOM 0 H ARG A 21 0.260 -8.512 30.669 1.00 0.00 H new ATOM 0 HA ARG A 21 2.270 -6.566 30.644 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.184 -9.190 32.183 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.115 -7.768 32.611 1.00 0.00 H new ATOM 0 HG2 ARG A 21 0.088 -7.731 32.404 1.00 0.00 H new ATOM 0 HG3 ARG A 21 0.927 -8.147 33.885 1.00 0.00 H new ATOM 0 HD2 ARG A 21 1.918 -5.665 32.617 1.00 0.00 H new ATOM 0 HD3 ARG A 21 0.234 -5.586 33.092 1.00 0.00 H new ATOM 0 HE ARG A 21 2.558 -5.686 34.859 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -0.900 -6.356 34.563 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.189 -6.232 36.301 1.00 0.00 H new ATOM 0 HH21 ARG A 21 2.173 -5.529 37.088 1.00 0.00 H new ATOM 0 HH22 ARG A 21 0.542 -5.766 37.723 1.00 0.00 H new ATOM 293 N PHE A 22 3.196 -9.540 29.564 1.00 0.00 N ATOM 294 CA PHE A 22 4.242 -10.256 28.844 1.00 0.00 C ATOM 295 C PHE A 22 4.482 -9.636 27.472 1.00 0.00 C ATOM 296 O PHE A 22 5.598 -9.666 26.952 1.00 0.00 O ATOM 297 CB PHE A 22 3.865 -11.733 28.687 1.00 0.00 C ATOM 298 CG PHE A 22 3.169 -12.320 29.885 1.00 0.00 C ATOM 299 CD1 PHE A 22 3.447 -11.861 31.163 1.00 0.00 C ATOM 300 CD2 PHE A 22 2.234 -13.330 29.729 1.00 0.00 C ATOM 301 CE1 PHE A 22 2.806 -12.399 32.262 1.00 0.00 C ATOM 302 CE2 PHE A 22 1.589 -13.872 30.825 1.00 0.00 C ATOM 303 CZ PHE A 22 1.875 -13.405 32.093 1.00 0.00 C ATOM 0 H PHE A 22 2.358 -10.092 29.747 1.00 0.00 H new ATOM 0 HA PHE A 22 5.162 -10.181 29.424 1.00 0.00 H new ATOM 0 HB2 PHE A 22 3.219 -11.841 27.816 1.00 0.00 H new ATOM 0 HB3 PHE A 22 4.769 -12.308 28.487 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.173 -11.074 31.301 1.00 0.00 H new ATOM 0 HD2 PHE A 22 2.006 -13.698 28.740 1.00 0.00 H new ATOM 0 HE1 PHE A 22 3.033 -12.033 33.253 1.00 0.00 H new ATOM 0 HE2 PHE A 22 0.862 -14.660 30.690 1.00 0.00 H new ATOM 0 HZ PHE A 22 1.371 -13.826 32.951 1.00 0.00 H new ATOM 313 N ALA A 23 3.427 -9.078 26.887 1.00 0.00 N ATOM 314 CA ALA A 23 3.523 -8.456 25.572 1.00 0.00 C ATOM 315 C ALA A 23 4.247 -7.116 25.646 1.00 0.00 C ATOM 316 O ALA A 23 5.219 -6.886 24.930 1.00 0.00 O ATOM 317 CB ALA A 23 2.136 -8.274 24.973 1.00 0.00 C ATOM 0 H ALA A 23 2.496 -9.044 27.303 1.00 0.00 H new ATOM 0 HA ALA A 23 4.104 -9.117 24.928 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.222 -7.809 23.991 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.653 -9.246 24.873 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.539 -7.637 25.625 1.00 0.00 H new ATOM 323 N VAL A 24 3.766 -6.236 26.514 1.00 0.00 N ATOM 324 CA VAL A 24 4.368 -4.918 26.678 1.00 0.00 C ATOM 325 C VAL A 24 5.822 -5.027 27.123 1.00 0.00 C ATOM 326 O VAL A 24 6.657 -4.196 26.766 1.00 0.00 O ATOM 327 CB VAL A 24 3.592 -4.075 27.707 1.00 0.00 C ATOM 328 CG1 VAL A 24 4.185 -2.680 27.816 1.00 0.00 C ATOM 329 CG2 VAL A 24 2.118 -4.009 27.338 1.00 0.00 C ATOM 0 H VAL A 24 2.961 -6.410 27.116 1.00 0.00 H new ATOM 0 HA VAL A 24 4.325 -4.427 25.706 1.00 0.00 H new ATOM 0 HB VAL A 24 3.679 -4.556 28.681 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.622 -2.101 28.548 1.00 0.00 H new ATOM 0 HG12 VAL A 24 5.226 -2.751 28.132 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.133 -2.186 26.846 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.585 -3.409 28.076 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.009 -3.554 26.354 1.00 0.00 H new ATOM 0 HG23 VAL A 24 1.702 -5.016 27.320 1.00 0.00 H new ATOM 339 N ASP A 25 6.113 -6.050 27.916 1.00 0.00 N ATOM 340 CA ASP A 25 7.461 -6.266 28.428 1.00 0.00 C ATOM 341 C ASP A 25 8.479 -6.439 27.300 1.00 0.00 C ATOM 342 O ASP A 25 9.576 -5.884 27.358 1.00 0.00 O ATOM 343 CB ASP A 25 7.485 -7.490 29.342 1.00 0.00 C ATOM 344 CG ASP A 25 8.839 -7.703 29.991 1.00 0.00 C ATOM 345 OD1 ASP A 25 9.776 -8.129 29.283 1.00 0.00 O ATOM 346 OD2 ASP A 25 8.962 -7.443 31.206 1.00 0.00 O1- ATOM 0 H ASP A 25 5.432 -6.746 28.220 1.00 0.00 H new ATOM 0 HA ASP A 25 7.742 -5.379 28.996 1.00 0.00 H new ATOM 0 HB2 ASP A 25 6.728 -7.375 30.118 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.219 -8.376 28.765 1.00 0.00 H new ATOM 351 N GLN A 26 8.120 -7.217 26.281 1.00 0.00 N ATOM 352 CA GLN A 26 9.024 -7.462 25.157 1.00 0.00 C ATOM 353 C GLN A 26 9.221 -6.207 24.312 1.00 0.00 C ATOM 354 O GLN A 26 10.305 -5.973 23.779 1.00 0.00 O ATOM 355 CB GLN A 26 8.501 -8.606 24.281 1.00 0.00 C ATOM 356 CG GLN A 26 7.122 -8.358 23.699 1.00 0.00 C ATOM 357 CD GLN A 26 6.982 -8.932 22.306 1.00 0.00 C ATOM 358 OE1 GLN A 26 6.436 -10.019 22.120 1.00 0.00 O ATOM 359 NE2 GLN A 26 7.480 -8.204 21.317 1.00 0.00 N ATOM 0 H GLN A 26 7.217 -7.686 26.209 1.00 0.00 H new ATOM 0 HA GLN A 26 9.991 -7.746 25.573 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.203 -8.775 23.465 1.00 0.00 H new ATOM 0 HB3 GLN A 26 8.475 -9.521 24.873 1.00 0.00 H new ATOM 0 HG2 GLN A 26 6.369 -8.801 24.351 1.00 0.00 H new ATOM 0 HG3 GLN A 26 6.928 -7.286 23.670 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.924 -7.308 21.517 1.00 0.00 H new ATOM 0 HE22 GLN A 26 7.419 -8.540 20.356 1.00 0.00 H new ATOM 368 N HIS A 27 8.170 -5.406 24.187 1.00 0.00 N ATOM 369 CA HIS A 27 8.234 -4.180 23.399 1.00 0.00 C ATOM 370 C HIS A 27 8.978 -3.082 24.151 1.00 0.00 C ATOM 371 O HIS A 27 9.888 -2.452 23.612 1.00 0.00 O ATOM 372 CB HIS A 27 6.824 -3.708 23.044 1.00 0.00 C ATOM 373 CG HIS A 27 6.503 -3.819 21.586 1.00 0.00 C ATOM 374 ND1 HIS A 27 7.072 -4.764 20.759 1.00 0.00 N ATOM 375 CD2 HIS A 27 5.663 -3.096 20.806 1.00 0.00 C ATOM 376 CE1 HIS A 27 6.598 -4.617 19.535 1.00 0.00 C ATOM 377 NE2 HIS A 27 5.742 -3.613 19.537 1.00 0.00 N ATOM 0 H HIS A 27 7.264 -5.582 24.620 1.00 0.00 H new ATOM 0 HA HIS A 27 8.782 -4.396 22.482 1.00 0.00 H new ATOM 0 HB2 HIS A 27 6.101 -4.293 23.612 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.709 -2.670 23.355 1.00 0.00 H new ATOM 0 HD2 HIS A 27 5.047 -2.268 21.124 1.00 0.00 H new ATOM 0 HE1 HIS A 27 6.866 -5.217 18.678 1.00 0.00 H new ATOM 0 HE2 HIS A 27 5.223 -3.276 18.726 1.00 0.00 H new ATOM 386 N ASN A 28 8.577 -2.852 25.395 1.00 0.00 N ATOM 387 CA ASN A 28 9.194 -1.823 26.221 1.00 0.00 C ATOM 388 C ASN A 28 10.690 -2.061 26.392 1.00 0.00 C ATOM 389 O ASN A 28 11.477 -1.116 26.438 1.00 0.00 O ATOM 390 CB ASN A 28 8.517 -1.770 27.591 1.00 0.00 C ATOM 391 CG ASN A 28 7.071 -1.325 27.505 1.00 0.00 C ATOM 392 OD1 ASN A 28 6.413 -1.507 26.480 1.00 0.00 O ATOM 393 ND2 ASN A 28 6.566 -0.738 28.584 1.00 0.00 N ATOM 0 H ASN A 28 7.825 -3.366 25.855 1.00 0.00 H new ATOM 0 HA ASN A 28 9.061 -0.868 25.712 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.564 -2.755 28.055 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.067 -1.087 28.238 1.00 0.00 H new ATOM 0 HD21 ASN A 28 5.597 -0.418 28.584 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.147 -0.607 29.412 1.00 0.00 H new ATOM 400 N THR A 29 11.075 -3.325 26.505 1.00 0.00 N ATOM 401 CA THR A 29 12.476 -3.680 26.694 1.00 0.00 C ATOM 402 C THR A 29 13.283 -3.593 25.398 1.00 0.00 C ATOM 403 O THR A 29 14.494 -3.378 25.437 1.00 0.00 O ATOM 404 CB THR A 29 12.585 -5.090 27.275 1.00 0.00 C ATOM 405 OG1 THR A 29 13.928 -5.392 27.609 1.00 0.00 O ATOM 406 CG2 THR A 29 12.095 -6.162 26.330 1.00 0.00 C ATOM 0 H THR A 29 10.438 -4.121 26.469 1.00 0.00 H new ATOM 0 HA THR A 29 12.898 -2.955 27.390 1.00 0.00 H new ATOM 0 HB THR A 29 11.949 -5.089 28.161 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.977 -6.298 27.980 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.199 -7.139 26.802 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.046 -5.985 26.091 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.685 -6.137 25.414 1.00 0.00 H new ATOM 414 N LYS A 30 12.629 -3.791 24.255 1.00 0.00 N ATOM 415 CA LYS A 30 13.340 -3.761 22.978 1.00 0.00 C ATOM 416 C LYS A 30 13.369 -2.372 22.333 1.00 0.00 C ATOM 417 O LYS A 30 14.442 -1.878 21.986 1.00 0.00 O ATOM 418 CB LYS A 30 12.725 -4.772 22.007 1.00 0.00 C ATOM 419 CG LYS A 30 11.305 -4.434 21.584 1.00 0.00 C ATOM 420 CD LYS A 30 10.651 -5.594 20.849 1.00 0.00 C ATOM 421 CE LYS A 30 11.422 -5.963 19.592 1.00 0.00 C ATOM 422 NZ LYS A 30 10.549 -6.609 18.574 1.00 0.00 N1+ ATOM 0 H LYS A 30 11.627 -3.971 24.186 1.00 0.00 H new ATOM 0 HA LYS A 30 14.374 -4.030 23.194 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.353 -4.836 21.118 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.730 -5.758 22.472 1.00 0.00 H new ATOM 0 HG2 LYS A 30 10.713 -4.179 22.463 1.00 0.00 H new ATOM 0 HG3 LYS A 30 11.316 -3.554 20.941 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.595 -6.459 21.510 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.628 -5.328 20.584 1.00 0.00 H new ATOM 0 HE2 LYS A 30 11.873 -5.067 19.167 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.238 -6.638 19.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.113 -6.845 17.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 10.138 -7.478 18.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.785 -5.956 18.307 1.00 0.00 H new ATOM 436 N GLU A 31 12.206 -1.746 22.150 1.00 0.00 N ATOM 437 CA GLU A 31 12.167 -0.425 21.517 1.00 0.00 C ATOM 438 C GLU A 31 11.245 0.560 22.237 1.00 0.00 C ATOM 439 O GLU A 31 11.403 1.773 22.097 1.00 0.00 O ATOM 440 CB GLU A 31 11.728 -0.561 20.058 1.00 0.00 C ATOM 441 CG GLU A 31 10.363 -1.208 19.891 1.00 0.00 C ATOM 442 CD GLU A 31 10.221 -1.935 18.568 1.00 0.00 C ATOM 443 OE1 GLU A 31 10.914 -2.955 18.374 1.00 0.00 O ATOM 444 OE2 GLU A 31 9.416 -1.483 17.726 1.00 0.00 O1- ATOM 0 H GLU A 31 11.297 -2.120 22.423 1.00 0.00 H new ATOM 0 HA GLU A 31 13.177 -0.020 21.577 1.00 0.00 H new ATOM 0 HB2 GLU A 31 11.711 0.427 19.599 1.00 0.00 H new ATOM 0 HB3 GLU A 31 12.469 -1.151 19.518 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.196 -1.911 20.707 1.00 0.00 H new ATOM 0 HG3 GLU A 31 9.591 -0.443 19.966 1.00 0.00 H new ATOM 451 N ASN A 32 10.278 0.050 22.990 1.00 0.00 N ATOM 452 CA ASN A 32 9.342 0.911 23.697 1.00 0.00 C ATOM 453 C ASN A 32 9.870 1.290 25.077 1.00 0.00 C ATOM 454 O ASN A 32 11.051 1.109 25.373 1.00 0.00 O ATOM 455 CB ASN A 32 7.975 0.231 23.813 1.00 0.00 C ATOM 456 CG ASN A 32 6.842 1.136 23.377 1.00 0.00 C ATOM 457 OD1 ASN A 32 6.001 1.523 24.328 1.00 0.00 O flip ATOM 458 ND2 ASN A 32 6.723 1.482 22.201 1.00 0.00 N flip ATOM 0 H ASN A 32 10.123 -0.949 23.126 1.00 0.00 H new ATOM 0 HA ASN A 32 9.229 1.829 23.120 1.00 0.00 H new ATOM 0 HB2 ASN A 32 7.969 -0.673 23.204 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.813 -0.079 24.845 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.394 1.159 21.504 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.953 2.091 21.924 1.00 0.00 H new ATOM 465 N GLY A 33 8.986 1.819 25.917 1.00 0.00 N ATOM 466 CA GLY A 33 9.378 2.218 27.256 1.00 0.00 C ATOM 467 C GLY A 33 8.648 3.461 27.729 1.00 0.00 C ATOM 468 O GLY A 33 9.245 4.339 28.353 1.00 0.00 O ATOM 0 H GLY A 33 8.004 1.979 25.694 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.181 1.399 27.948 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.452 2.401 27.277 1.00 0.00 H new ATOM 472 N LEU A 34 7.354 3.535 27.435 1.00 0.00 N ATOM 473 CA LEU A 34 6.541 4.678 27.837 1.00 0.00 C ATOM 474 C LEU A 34 5.074 4.288 27.968 1.00 0.00 C ATOM 475 O LEU A 34 4.182 5.123 27.826 1.00 0.00 O ATOM 476 CB LEU A 34 6.690 5.823 26.836 1.00 0.00 C ATOM 477 CG LEU A 34 6.733 5.416 25.359 1.00 0.00 C ATOM 478 CD1 LEU A 34 8.085 4.812 25.008 1.00 0.00 C ATOM 479 CD2 LEU A 34 5.609 4.442 25.033 1.00 0.00 C ATOM 0 H LEU A 34 6.845 2.817 26.920 1.00 0.00 H new ATOM 0 HA LEU A 34 6.897 5.013 28.812 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.860 6.515 26.979 1.00 0.00 H new ATOM 0 HB3 LEU A 34 7.604 6.368 27.070 1.00 0.00 H new ATOM 0 HG LEU A 34 6.591 6.313 24.756 1.00 0.00 H new ATOM 0 HD11 LEU A 34 8.095 4.530 23.955 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.870 5.544 25.195 1.00 0.00 H new ATOM 0 HD13 LEU A 34 8.259 3.929 25.622 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.660 4.167 23.979 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.713 3.547 25.647 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.648 4.913 25.239 1.00 0.00 H new ATOM 491 N LEU A 35 4.835 3.013 28.244 1.00 0.00 N ATOM 492 CA LEU A 35 3.479 2.502 28.401 1.00 0.00 C ATOM 493 C LEU A 35 3.269 1.960 29.810 1.00 0.00 C ATOM 494 O LEU A 35 4.137 1.282 30.360 1.00 0.00 O ATOM 495 CB LEU A 35 3.201 1.402 27.376 1.00 0.00 C ATOM 496 CG LEU A 35 3.152 1.869 25.921 1.00 0.00 C ATOM 497 CD1 LEU A 35 3.357 0.693 24.981 1.00 0.00 C ATOM 498 CD2 LEU A 35 1.831 2.564 25.627 1.00 0.00 C ATOM 0 H LEU A 35 5.565 2.311 28.364 1.00 0.00 H new ATOM 0 HA LEU A 35 2.785 3.326 28.235 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.971 0.636 27.470 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.250 0.930 27.622 1.00 0.00 H new ATOM 0 HG LEU A 35 3.958 2.585 25.760 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.319 1.041 23.949 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.328 0.237 25.175 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.571 -0.044 25.144 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.815 2.889 24.587 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.008 1.871 25.804 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.722 3.430 26.280 1.00 0.00 H new ATOM 510 N GLU A 36 2.115 2.266 30.393 1.00 0.00 N ATOM 511 CA GLU A 36 1.803 1.808 31.743 1.00 0.00 C ATOM 512 C GLU A 36 0.459 1.087 31.788 1.00 0.00 C ATOM 513 O GLU A 36 -0.597 1.713 31.715 1.00 0.00 O ATOM 514 CB GLU A 36 1.797 2.991 32.714 1.00 0.00 C ATOM 515 CG GLU A 36 1.393 2.619 34.132 1.00 0.00 C ATOM 516 CD GLU A 36 2.179 3.381 35.181 1.00 0.00 C ATOM 517 OE1 GLU A 36 1.743 4.488 35.562 1.00 0.00 O ATOM 518 OE2 GLU A 36 3.229 2.870 35.623 1.00 0.00 O1- ATOM 0 H GLU A 36 1.383 2.826 29.955 1.00 0.00 H new ATOM 0 HA GLU A 36 2.576 1.101 32.044 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.791 3.437 32.735 1.00 0.00 H new ATOM 0 HB3 GLU A 36 1.113 3.753 32.339 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.329 2.816 34.266 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.540 1.549 34.279 1.00 0.00 H new ATOM 525 N LEU A 37 0.507 -0.235 31.921 1.00 0.00 N ATOM 526 CA LEU A 37 -0.706 -1.041 31.986 1.00 0.00 C ATOM 527 C LEU A 37 -1.619 -0.553 33.107 1.00 0.00 C ATOM 528 O LEU A 37 -1.290 -0.674 34.287 1.00 0.00 O ATOM 529 CB LEU A 37 -0.353 -2.514 32.195 1.00 0.00 C ATOM 530 CG LEU A 37 0.014 -3.277 30.918 1.00 0.00 C ATOM 531 CD1 LEU A 37 1.512 -3.546 30.864 1.00 0.00 C ATOM 532 CD2 LEU A 37 -0.769 -4.580 30.826 1.00 0.00 C ATOM 0 H LEU A 37 1.373 -0.770 31.986 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.238 -0.937 31.040 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.483 -2.577 32.891 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.200 -3.012 32.668 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.253 -2.657 30.062 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.751 -4.089 29.950 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.052 -2.599 30.876 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.806 -4.143 31.728 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.494 -5.106 29.912 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.538 -5.205 31.688 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.837 -4.362 30.812 1.00 0.00 H new ATOM 544 N VAL A 38 -2.760 0.011 32.727 1.00 0.00 N ATOM 545 CA VAL A 38 -3.717 0.533 33.694 1.00 0.00 C ATOM 546 C VAL A 38 -4.767 -0.507 34.068 1.00 0.00 C ATOM 547 O VAL A 38 -4.839 -0.941 35.218 1.00 0.00 O ATOM 548 CB VAL A 38 -4.428 1.790 33.159 1.00 0.00 C ATOM 549 CG1 VAL A 38 -5.249 2.446 34.257 1.00 0.00 C ATOM 550 CG2 VAL A 38 -3.418 2.769 32.578 1.00 0.00 C ATOM 0 H VAL A 38 -3.045 0.118 31.753 1.00 0.00 H new ATOM 0 HA VAL A 38 -3.143 0.794 34.584 1.00 0.00 H new ATOM 0 HB VAL A 38 -5.107 1.490 32.361 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.744 3.332 33.861 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.999 1.743 34.620 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.593 2.734 35.079 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.939 3.651 32.205 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.712 3.066 33.353 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.879 2.293 31.759 1.00 0.00 H new ATOM 560 N ARG A 39 -5.589 -0.901 33.098 1.00 0.00 N ATOM 561 CA ARG A 39 -6.637 -1.887 33.352 1.00 0.00 C ATOM 562 C ARG A 39 -7.096 -2.557 32.061 1.00 0.00 C ATOM 563 O ARG A 39 -7.344 -1.891 31.059 1.00 0.00 O ATOM 564 CB ARG A 39 -7.829 -1.223 34.044 1.00 0.00 C ATOM 565 CG ARG A 39 -8.538 -2.130 35.037 1.00 0.00 C ATOM 566 CD ARG A 39 -9.823 -1.500 35.548 1.00 0.00 C ATOM 567 NE ARG A 39 -9.627 -0.111 35.958 1.00 0.00 N ATOM 568 CZ ARG A 39 -10.618 0.764 36.110 1.00 0.00 C ATOM 569 NH1 ARG A 39 -11.874 0.399 35.887 1.00 0.00 N1+ ATOM 570 NH2 ARG A 39 -10.352 2.008 36.485 1.00 0.00 N ATOM 0 H ARG A 39 -5.551 -0.557 32.138 1.00 0.00 H new ATOM 0 HA ARG A 39 -6.221 -2.655 34.004 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.485 -0.328 34.563 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.543 -0.898 33.287 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -8.764 -3.085 34.562 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.876 -2.340 35.877 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -10.583 -1.544 34.768 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -10.199 -2.078 36.392 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.675 0.206 36.138 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -12.084 -0.556 35.598 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.630 1.074 36.005 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.388 2.294 36.657 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -11.111 2.679 36.602 1.00 0.00 H new ATOM 584 N VAL A 40 -7.208 -3.883 32.099 1.00 0.00 N ATOM 585 CA VAL A 40 -7.636 -4.659 30.937 1.00 0.00 C ATOM 586 C VAL A 40 -8.887 -4.068 30.293 1.00 0.00 C ATOM 587 O VAL A 40 -9.684 -3.402 30.953 1.00 0.00 O ATOM 588 CB VAL A 40 -7.915 -6.126 31.317 1.00 0.00 C ATOM 589 CG1 VAL A 40 -8.184 -6.959 30.073 1.00 0.00 C ATOM 590 CG2 VAL A 40 -6.754 -6.703 32.116 1.00 0.00 C ATOM 0 H VAL A 40 -7.007 -4.445 32.926 1.00 0.00 H new ATOM 0 HA VAL A 40 -6.816 -4.620 30.219 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.806 -6.156 31.944 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.379 -7.992 30.362 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -9.052 -6.559 29.548 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.315 -6.924 29.416 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.970 -7.740 32.375 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -5.844 -6.661 31.518 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.616 -6.122 33.028 1.00 0.00 H new ATOM 600 N VAL A 41 -9.049 -4.322 28.998 1.00 0.00 N ATOM 601 CA VAL A 41 -10.200 -3.823 28.255 1.00 0.00 C ATOM 602 C VAL A 41 -11.117 -4.967 27.834 1.00 0.00 C ATOM 603 O VAL A 41 -12.265 -5.049 28.273 1.00 0.00 O ATOM 604 CB VAL A 41 -9.762 -3.043 26.999 1.00 0.00 C ATOM 605 CG1 VAL A 41 -10.971 -2.503 26.249 1.00 0.00 C ATOM 606 CG2 VAL A 41 -8.816 -1.914 27.374 1.00 0.00 C ATOM 0 H VAL A 41 -8.395 -4.872 28.441 1.00 0.00 H new ATOM 0 HA VAL A 41 -10.741 -3.151 28.921 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.232 -3.730 26.339 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.638 -1.956 25.367 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.609 -3.332 25.943 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -11.533 -1.833 26.900 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.518 -1.375 26.475 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.319 -1.230 28.057 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.932 -2.326 27.860 1.00 0.00 H new ATOM 616 N GLU A 42 -10.605 -5.846 26.978 1.00 0.00 N ATOM 617 CA GLU A 42 -11.381 -6.982 26.495 1.00 0.00 C ATOM 618 C GLU A 42 -10.468 -8.121 26.055 1.00 0.00 C ATOM 619 O GLU A 42 -9.244 -7.987 26.057 1.00 0.00 O ATOM 620 CB GLU A 42 -12.279 -6.554 25.332 1.00 0.00 C ATOM 621 CG GLU A 42 -13.683 -6.159 25.761 1.00 0.00 C ATOM 622 CD GLU A 42 -14.162 -4.887 25.089 1.00 0.00 C ATOM 623 OE1 GLU A 42 -13.872 -3.792 25.615 1.00 0.00 O1- ATOM 624 OE2 GLU A 42 -14.827 -4.986 24.036 1.00 0.00 O ATOM 0 H GLU A 42 -9.657 -5.793 26.605 1.00 0.00 H new ATOM 0 HA GLU A 42 -12.004 -7.339 27.316 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.815 -5.713 24.816 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.344 -7.372 24.614 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.372 -6.971 25.527 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.704 -6.024 26.842 1.00 0.00 H new ATOM 631 N ALA A 43 -11.074 -9.240 25.678 1.00 0.00 N ATOM 632 CA ALA A 43 -10.322 -10.405 25.234 1.00 0.00 C ATOM 633 C ALA A 43 -10.920 -10.993 23.963 1.00 0.00 C ATOM 634 O ALA A 43 -12.035 -11.514 23.967 1.00 0.00 O ATOM 635 CB ALA A 43 -10.271 -11.454 26.334 1.00 0.00 C ATOM 0 H ALA A 43 -12.086 -9.365 25.671 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.305 -10.085 25.009 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -9.705 -12.319 25.986 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.786 -11.034 27.215 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -11.285 -11.763 26.590 1.00 0.00 H new ATOM 641 N ARG A 44 -10.163 -10.903 22.879 1.00 0.00 N ATOM 642 CA ARG A 44 -10.601 -11.421 21.588 1.00 0.00 C ATOM 643 C ARG A 44 -9.653 -12.505 21.087 1.00 0.00 C ATOM 644 O ARG A 44 -8.459 -12.485 21.384 1.00 0.00 O ATOM 645 CB ARG A 44 -10.685 -10.288 20.565 1.00 0.00 C ATOM 646 CG ARG A 44 -11.909 -9.402 20.736 1.00 0.00 C ATOM 647 CD ARG A 44 -11.552 -8.074 21.384 1.00 0.00 C ATOM 648 NE ARG A 44 -10.800 -7.208 20.480 1.00 0.00 N ATOM 649 CZ ARG A 44 -11.324 -6.628 19.402 1.00 0.00 C ATOM 650 NH1 ARG A 44 -12.600 -6.818 19.092 1.00 0.00 N1+ ATOM 651 NH2 ARG A 44 -10.570 -5.855 18.633 1.00 0.00 N ATOM 0 H ARG A 44 -9.238 -10.474 22.867 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.590 -11.861 21.716 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.788 -9.673 20.642 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.693 -10.715 19.562 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -12.367 -9.222 19.764 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -12.650 -9.918 21.347 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -12.465 -7.566 21.697 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -10.964 -8.256 22.284 1.00 0.00 H new ATOM 0 HE ARG A 44 -9.816 -7.037 20.686 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -13.185 -7.411 19.681 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -12.996 -6.371 18.265 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -9.589 -5.705 18.867 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -10.971 -5.411 17.807 1.00 0.00 H new ATOM 665 N GLU A 45 -10.192 -13.453 20.328 1.00 0.00 N ATOM 666 CA GLU A 45 -9.389 -14.546 19.791 1.00 0.00 C ATOM 667 C GLU A 45 -9.668 -14.754 18.305 1.00 0.00 C ATOM 668 O GLU A 45 -10.698 -14.322 17.789 1.00 0.00 O ATOM 669 CB GLU A 45 -9.671 -15.839 20.561 1.00 0.00 C ATOM 670 CG GLU A 45 -8.508 -16.296 21.426 1.00 0.00 C ATOM 671 CD GLU A 45 -8.813 -16.211 22.909 1.00 0.00 C ATOM 672 OE1 GLU A 45 -9.707 -16.949 23.374 1.00 0.00 O ATOM 673 OE2 GLU A 45 -8.158 -15.406 23.604 1.00 0.00 O1- ATOM 0 H GLU A 45 -11.179 -13.487 20.071 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.338 -14.281 19.909 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.547 -15.693 21.192 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -9.918 -16.629 19.851 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.252 -17.324 21.170 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.633 -15.685 21.204 1.00 0.00 H new ATOM 680 N GLN A 46 -8.737 -15.416 17.626 1.00 0.00 N ATOM 681 CA GLN A 46 -8.869 -15.688 16.202 1.00 0.00 C ATOM 682 C GLN A 46 -7.821 -16.698 15.753 1.00 0.00 C ATOM 683 O GLN A 46 -6.701 -16.711 16.261 1.00 0.00 O ATOM 684 CB GLN A 46 -8.722 -14.393 15.408 1.00 0.00 C ATOM 685 CG GLN A 46 -8.821 -14.583 13.903 1.00 0.00 C ATOM 686 CD GLN A 46 -9.581 -13.461 13.222 1.00 0.00 C ATOM 687 OE1 GLN A 46 -9.465 -12.297 13.603 1.00 0.00 O ATOM 688 NE2 GLN A 46 -10.366 -13.808 12.208 1.00 0.00 N ATOM 0 H GLN A 46 -7.878 -15.775 18.043 1.00 0.00 H new ATOM 0 HA GLN A 46 -9.858 -16.109 16.018 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -9.493 -13.692 15.728 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -7.760 -13.939 15.645 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -7.818 -14.645 13.482 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -9.315 -15.532 13.692 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -10.432 -14.786 11.926 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -10.903 -13.097 11.712 1.00 0.00 H new ATOM 697 N VAL A 47 -8.192 -17.546 14.802 1.00 0.00 N ATOM 698 CA VAL A 47 -7.277 -18.560 14.294 1.00 0.00 C ATOM 699 C VAL A 47 -6.568 -18.080 13.030 1.00 0.00 C ATOM 700 O VAL A 47 -7.185 -17.936 11.975 1.00 0.00 O ATOM 701 CB VAL A 47 -8.012 -19.881 13.993 1.00 0.00 C ATOM 702 CG1 VAL A 47 -9.074 -19.676 12.922 1.00 0.00 C ATOM 703 CG2 VAL A 47 -7.025 -20.962 13.577 1.00 0.00 C ATOM 0 H VAL A 47 -9.115 -17.552 14.369 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.537 -18.737 15.074 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.511 -20.209 14.905 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.580 -20.621 12.726 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.801 -18.940 13.266 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.603 -19.320 12.006 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.564 -21.886 13.369 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.492 -20.643 12.681 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -6.311 -21.132 14.383 1.00 0.00 H new ATOM 713 N VAL A 48 -5.266 -17.842 13.147 1.00 0.00 N ATOM 714 CA VAL A 48 -4.465 -17.387 12.017 1.00 0.00 C ATOM 715 C VAL A 48 -3.246 -18.282 11.818 1.00 0.00 C ATOM 716 O VAL A 48 -2.286 -18.221 12.586 1.00 0.00 O ATOM 717 CB VAL A 48 -4.000 -15.929 12.203 1.00 0.00 C ATOM 718 CG1 VAL A 48 -3.151 -15.791 13.457 1.00 0.00 C ATOM 719 CG2 VAL A 48 -3.238 -15.448 10.975 1.00 0.00 C ATOM 0 H VAL A 48 -4.742 -17.957 14.015 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.101 -17.441 11.134 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.882 -15.300 12.322 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.833 -14.754 13.569 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.737 -16.087 14.327 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.274 -16.432 13.375 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.918 -14.417 11.126 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.364 -16.080 10.819 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.886 -15.503 10.100 1.00 0.00 H new ATOM 729 N ALA A 49 -3.290 -19.116 10.784 1.00 0.00 N ATOM 730 CA ALA A 49 -2.189 -20.027 10.485 1.00 0.00 C ATOM 731 C ALA A 49 -1.725 -20.764 11.737 1.00 0.00 C ATOM 732 O ALA A 49 -0.555 -21.122 11.865 1.00 0.00 O ATOM 733 CB ALA A 49 -1.031 -19.268 9.855 1.00 0.00 C ATOM 0 H ALA A 49 -4.077 -19.180 10.138 1.00 0.00 H new ATOM 0 HA ALA A 49 -2.551 -20.770 9.774 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.218 -19.960 9.638 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.364 -18.798 8.930 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.680 -18.501 10.546 1.00 0.00 H new ATOM 739 N GLY A 50 -2.656 -20.981 12.658 1.00 0.00 N ATOM 740 CA GLY A 50 -2.338 -21.668 13.894 1.00 0.00 C ATOM 741 C GLY A 50 -3.185 -21.179 15.052 1.00 0.00 C ATOM 742 O GLY A 50 -4.321 -21.620 15.229 1.00 0.00 O ATOM 0 H GLY A 50 -3.630 -20.692 12.569 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.489 -22.739 13.762 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.284 -21.521 14.129 1.00 0.00 H new ATOM 746 N THR A 51 -2.632 -20.265 15.841 1.00 0.00 N ATOM 747 CA THR A 51 -3.342 -19.714 16.985 1.00 0.00 C ATOM 748 C THR A 51 -2.912 -18.272 17.245 1.00 0.00 C ATOM 749 O THR A 51 -1.721 -17.959 17.255 1.00 0.00 O ATOM 750 CB THR A 51 -3.084 -20.573 18.221 1.00 0.00 C ATOM 751 OG1 THR A 51 -3.717 -21.835 18.094 1.00 0.00 O ATOM 752 CG2 THR A 51 -3.573 -19.942 19.508 1.00 0.00 C ATOM 0 H THR A 51 -1.693 -19.891 15.708 1.00 0.00 H new ATOM 0 HA THR A 51 -4.410 -19.717 16.765 1.00 0.00 H new ATOM 0 HB THR A 51 -2.000 -20.676 18.278 1.00 0.00 H new ATOM 0 HG1 THR A 51 -4.134 -21.904 17.210 1.00 0.00 H new ATOM 0 HG21 THR A 51 -3.357 -20.607 20.344 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.066 -18.989 19.662 1.00 0.00 H new ATOM 0 HG23 THR A 51 -4.648 -19.775 19.446 1.00 0.00 H new ATOM 760 N LEU A 52 -3.892 -17.399 17.451 1.00 0.00 N ATOM 761 CA LEU A 52 -3.625 -15.992 17.706 1.00 0.00 C ATOM 762 C LEU A 52 -4.309 -15.528 18.991 1.00 0.00 C ATOM 763 O LEU A 52 -5.462 -15.870 19.251 1.00 0.00 O ATOM 764 CB LEU A 52 -4.099 -15.157 16.510 1.00 0.00 C ATOM 765 CG LEU A 52 -4.857 -13.868 16.848 1.00 0.00 C ATOM 766 CD1 LEU A 52 -3.962 -12.898 17.605 1.00 0.00 C ATOM 767 CD2 LEU A 52 -5.397 -13.223 15.581 1.00 0.00 C ATOM 0 H LEU A 52 -4.882 -17.644 17.446 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.551 -15.856 17.836 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.229 -14.896 15.907 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.742 -15.781 15.889 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.699 -14.124 17.491 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.521 -11.991 17.834 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -3.626 -13.361 18.533 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.097 -12.646 16.991 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.933 -12.309 15.838 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.569 -12.983 14.914 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -6.077 -13.914 15.082 1.00 0.00 H new ATOM 779 N HIS A 53 -3.591 -14.739 19.784 1.00 0.00 N ATOM 780 CA HIS A 53 -4.131 -14.218 21.036 1.00 0.00 C ATOM 781 C HIS A 53 -4.277 -12.701 20.969 1.00 0.00 C ATOM 782 O HIS A 53 -3.291 -11.969 21.043 1.00 0.00 O ATOM 783 CB HIS A 53 -3.229 -14.605 22.209 1.00 0.00 C ATOM 784 CG HIS A 53 -3.981 -15.070 23.417 1.00 0.00 C ATOM 785 ND1 HIS A 53 -3.866 -16.344 23.932 1.00 0.00 N ATOM 786 CD2 HIS A 53 -4.863 -14.422 24.216 1.00 0.00 C ATOM 787 CE1 HIS A 53 -4.644 -16.460 24.994 1.00 0.00 C ATOM 788 NE2 HIS A 53 -5.259 -15.309 25.187 1.00 0.00 N ATOM 0 H HIS A 53 -2.635 -14.446 19.583 1.00 0.00 H new ATOM 0 HA HIS A 53 -5.117 -14.657 21.190 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -2.549 -15.395 21.888 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -2.615 -13.747 22.482 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -5.193 -13.399 24.109 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -4.757 -17.346 25.601 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -5.922 -15.110 25.936 1.00 0.00 H new ATOM 797 N HIS A 54 -5.514 -12.235 20.826 1.00 0.00 N ATOM 798 CA HIS A 54 -5.788 -10.804 20.746 1.00 0.00 C ATOM 799 C HIS A 54 -6.291 -10.269 22.082 1.00 0.00 C ATOM 800 O HIS A 54 -7.418 -10.548 22.490 1.00 0.00 O ATOM 801 CB HIS A 54 -6.818 -10.523 19.649 1.00 0.00 C ATOM 802 CG HIS A 54 -6.517 -9.294 18.848 1.00 0.00 C ATOM 803 ND1 HIS A 54 -6.889 -9.146 17.528 1.00 0.00 N ATOM 804 CD2 HIS A 54 -5.876 -8.150 19.186 1.00 0.00 C ATOM 805 CE1 HIS A 54 -6.489 -7.966 17.089 1.00 0.00 C ATOM 806 NE2 HIS A 54 -5.873 -7.342 18.076 1.00 0.00 N ATOM 0 H HIS A 54 -6.342 -12.827 20.763 1.00 0.00 H new ATOM 0 HA HIS A 54 -4.856 -10.294 20.501 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -6.866 -11.381 18.979 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -7.803 -10.418 20.104 1.00 0.00 H new ATOM 0 HD1 HIS A 54 -7.394 -9.840 16.977 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -5.447 -7.917 20.149 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -6.640 -7.578 16.093 1.00 0.00 H new ATOM 815 N LEU A 55 -5.448 -9.499 22.760 1.00 0.00 N ATOM 816 CA LEU A 55 -5.809 -8.926 24.052 1.00 0.00 C ATOM 817 C LEU A 55 -5.707 -7.405 24.030 1.00 0.00 C ATOM 818 O LEU A 55 -4.681 -6.846 23.644 1.00 0.00 O ATOM 819 CB LEU A 55 -4.911 -9.497 25.152 1.00 0.00 C ATOM 820 CG LEU A 55 -5.643 -10.282 26.242 1.00 0.00 C ATOM 821 CD1 LEU A 55 -6.618 -11.275 25.627 1.00 0.00 C ATOM 822 CD2 LEU A 55 -4.645 -10.998 27.135 1.00 0.00 C ATOM 0 H LEU A 55 -4.511 -9.257 22.438 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.845 -9.192 24.261 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.169 -10.149 24.692 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.368 -8.676 25.619 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.212 -9.579 26.850 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.128 -11.823 26.420 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.352 -10.739 25.026 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.073 -11.976 24.994 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.179 -11.553 27.906 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.052 -11.689 26.536 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.987 -10.267 27.604 1.00 0.00 H new ATOM 834 N VAL A 56 -6.774 -6.741 24.460 1.00 0.00 N ATOM 835 CA VAL A 56 -6.805 -5.286 24.503 1.00 0.00 C ATOM 836 C VAL A 56 -6.901 -4.805 25.943 1.00 0.00 C ATOM 837 O VAL A 56 -7.698 -5.317 26.729 1.00 0.00 O ATOM 838 CB VAL A 56 -7.981 -4.714 23.683 1.00 0.00 C ATOM 839 CG1 VAL A 56 -9.306 -5.289 24.160 1.00 0.00 C ATOM 840 CG2 VAL A 56 -7.993 -3.192 23.748 1.00 0.00 C ATOM 0 H VAL A 56 -7.631 -7.190 24.784 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.878 -4.925 24.058 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.844 -5.008 22.642 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -10.119 -4.870 23.567 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.294 -6.373 24.046 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -9.456 -5.036 25.210 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.830 -2.809 23.163 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.099 -2.873 24.785 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.059 -2.803 23.342 1.00 0.00 H new ATOM 850 N LEU A 57 -6.067 -3.836 26.287 1.00 0.00 N ATOM 851 CA LEU A 57 -6.041 -3.305 27.644 1.00 0.00 C ATOM 852 C LEU A 57 -5.795 -1.798 27.648 1.00 0.00 C ATOM 853 O LEU A 57 -5.242 -1.247 26.699 1.00 0.00 O ATOM 854 CB LEU A 57 -4.952 -4.022 28.448 1.00 0.00 C ATOM 855 CG LEU A 57 -4.699 -3.476 29.855 1.00 0.00 C ATOM 856 CD1 LEU A 57 -4.365 -4.608 30.815 1.00 0.00 C ATOM 857 CD2 LEU A 57 -3.580 -2.448 29.836 1.00 0.00 C ATOM 0 H LEU A 57 -5.401 -3.401 25.649 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.014 -3.481 28.104 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.220 -5.075 28.530 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.019 -3.973 27.886 1.00 0.00 H new ATOM 0 HG LEU A 57 -5.610 -2.987 30.202 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.188 -4.201 31.810 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.198 -5.310 30.853 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.469 -5.125 30.470 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.415 -2.071 30.845 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.665 -2.913 29.468 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.856 -1.622 29.181 1.00 0.00 H new ATOM 869 N GLU A 58 -6.209 -1.139 28.726 1.00 0.00 N ATOM 870 CA GLU A 58 -6.028 0.302 28.861 1.00 0.00 C ATOM 871 C GLU A 58 -4.669 0.615 29.478 1.00 0.00 C ATOM 872 O GLU A 58 -4.415 0.278 30.636 1.00 0.00 O ATOM 873 CB GLU A 58 -7.135 0.905 29.729 1.00 0.00 C ATOM 874 CG GLU A 58 -8.523 0.379 29.407 1.00 0.00 C ATOM 875 CD GLU A 58 -9.607 1.060 30.220 1.00 0.00 C ATOM 876 OE1 GLU A 58 -10.051 2.155 29.817 1.00 0.00 O ATOM 877 OE2 GLU A 58 -10.012 0.497 31.259 1.00 0.00 O1- ATOM 0 H GLU A 58 -6.673 -1.581 29.520 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.078 0.742 27.865 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.914 0.701 30.777 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.130 1.988 29.607 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.725 0.523 28.346 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.553 -0.694 29.594 1.00 0.00 H new ATOM 884 N VAL A 59 -3.802 1.259 28.699 1.00 0.00 N ATOM 885 CA VAL A 59 -2.467 1.619 29.167 1.00 0.00 C ATOM 886 C VAL A 59 -2.304 3.128 29.278 1.00 0.00 C ATOM 887 O VAL A 59 -3.162 3.896 28.841 1.00 0.00 O ATOM 888 CB VAL A 59 -1.366 1.080 28.231 1.00 0.00 C ATOM 889 CG1 VAL A 59 -1.134 -0.403 28.464 1.00 0.00 C ATOM 890 CG2 VAL A 59 -1.721 1.351 26.776 1.00 0.00 C ATOM 0 H VAL A 59 -4.001 1.542 27.740 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.359 1.163 30.151 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.438 1.604 28.460 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.353 -0.759 27.792 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.826 -0.565 29.497 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -2.057 -0.950 28.271 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -0.932 0.964 26.131 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.663 0.859 26.534 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.822 2.425 26.620 1.00 0.00 H new ATOM 900 N LEU A 60 -1.187 3.539 29.860 1.00 0.00 N ATOM 901 CA LEU A 60 -0.879 4.951 30.034 1.00 0.00 C ATOM 902 C LEU A 60 0.365 5.324 29.234 1.00 0.00 C ATOM 903 O LEU A 60 1.451 4.793 29.476 1.00 0.00 O ATOM 904 CB LEU A 60 -0.666 5.267 31.519 1.00 0.00 C ATOM 905 CG LEU A 60 -1.625 6.303 32.110 1.00 0.00 C ATOM 906 CD1 LEU A 60 -1.283 7.696 31.605 1.00 0.00 C ATOM 907 CD2 LEU A 60 -3.069 5.950 31.778 1.00 0.00 C ATOM 0 H LEU A 60 -0.473 2.908 30.223 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.720 5.539 29.667 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.761 4.342 32.088 1.00 0.00 H new ATOM 0 HB3 LEU A 60 0.356 5.622 31.655 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.513 6.294 33.194 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.975 8.419 32.036 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.264 7.949 31.898 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.364 7.719 30.518 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.735 6.699 32.207 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.198 5.927 30.696 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.309 4.971 32.193 1.00 0.00 H new ATOM 919 N ASP A 61 0.200 6.230 28.277 1.00 0.00 N ATOM 920 CA ASP A 61 1.310 6.667 27.437 1.00 0.00 C ATOM 921 C ASP A 61 1.733 8.091 27.786 1.00 0.00 C ATOM 922 O ASP A 61 1.020 9.050 27.492 1.00 0.00 O ATOM 923 CB ASP A 61 0.920 6.587 25.960 1.00 0.00 C ATOM 924 CG ASP A 61 2.122 6.675 25.040 1.00 0.00 C ATOM 925 OD1 ASP A 61 2.610 7.800 24.806 1.00 0.00 O ATOM 926 OD2 ASP A 61 2.576 5.618 24.553 1.00 0.00 O1- ATOM 0 H ASP A 61 -0.692 6.677 28.063 1.00 0.00 H new ATOM 0 HA ASP A 61 2.154 6.002 27.621 1.00 0.00 H new ATOM 0 HB2 ASP A 61 0.393 5.651 25.776 1.00 0.00 H new ATOM 0 HB3 ASP A 61 0.226 7.395 25.726 1.00 0.00 H new ATOM 931 N ALA A 62 2.899 8.220 28.412 1.00 0.00 N ATOM 932 CA ALA A 62 3.423 9.521 28.801 1.00 0.00 C ATOM 933 C ALA A 62 2.400 10.318 29.605 1.00 0.00 C ATOM 934 O ALA A 62 2.419 11.549 29.604 1.00 0.00 O ATOM 935 CB ALA A 62 3.856 10.302 27.570 1.00 0.00 C ATOM 0 H ALA A 62 3.500 7.434 28.661 1.00 0.00 H new ATOM 0 HA ALA A 62 4.290 9.356 29.440 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.246 11.273 27.874 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.632 9.748 27.042 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.000 10.445 26.910 1.00 0.00 H new ATOM 941 N GLY A 63 1.508 9.609 30.288 1.00 0.00 N ATOM 942 CA GLY A 63 0.490 10.268 31.085 1.00 0.00 C ATOM 943 C GLY A 63 -0.814 10.442 30.331 1.00 0.00 C ATOM 944 O GLY A 63 -1.595 11.346 30.627 1.00 0.00 O ATOM 0 H GLY A 63 1.472 8.590 30.304 1.00 0.00 H new ATOM 0 HA2 GLY A 63 0.309 9.687 31.989 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.856 11.245 31.401 1.00 0.00 H new ATOM 948 N LYS A 64 -1.049 9.573 29.353 1.00 0.00 N ATOM 949 CA LYS A 64 -2.267 9.632 28.552 1.00 0.00 C ATOM 950 C LYS A 64 -2.981 8.289 28.551 1.00 0.00 C ATOM 951 O LYS A 64 -2.388 7.255 28.243 1.00 0.00 O ATOM 952 CB LYS A 64 -1.942 10.055 27.119 1.00 0.00 C ATOM 953 CG LYS A 64 -2.995 10.955 26.496 1.00 0.00 C ATOM 954 CD LYS A 64 -4.237 10.171 26.103 1.00 0.00 C ATOM 955 CE LYS A 64 -5.182 11.010 25.258 1.00 0.00 C ATOM 956 NZ LYS A 64 -5.430 12.347 25.865 1.00 0.00 N1+ ATOM 0 H LYS A 64 -0.412 8.819 29.096 1.00 0.00 H new ATOM 0 HA LYS A 64 -2.930 10.374 28.998 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.983 10.573 27.111 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.828 9.163 26.503 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -3.267 11.740 27.201 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -2.580 11.447 25.616 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -3.945 9.280 25.548 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.754 9.832 27.001 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -4.762 11.136 24.260 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -6.129 10.483 25.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.225 12.807 25.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.660 12.233 26.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.578 12.935 25.769 1.00 0.00 H new ATOM 970 N LYS A 65 -4.259 8.317 28.899 1.00 0.00 N ATOM 971 CA LYS A 65 -5.068 7.107 28.942 1.00 0.00 C ATOM 972 C LYS A 65 -5.469 6.677 27.537 1.00 0.00 C ATOM 973 O LYS A 65 -6.187 7.393 26.839 1.00 0.00 O ATOM 974 CB LYS A 65 -6.316 7.334 29.796 1.00 0.00 C ATOM 975 CG LYS A 65 -6.012 7.584 31.264 1.00 0.00 C ATOM 976 CD LYS A 65 -6.061 6.296 32.070 1.00 0.00 C ATOM 977 CE LYS A 65 -7.491 5.831 32.290 1.00 0.00 C ATOM 978 NZ LYS A 65 -7.935 4.882 31.232 1.00 0.00 N1+ ATOM 0 H LYS A 65 -4.760 9.167 29.157 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.471 6.313 29.390 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -6.868 8.185 29.398 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.967 6.464 29.712 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -5.025 8.037 31.360 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.731 8.296 31.670 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.500 5.519 31.550 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.575 6.450 33.033 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.571 5.351 33.265 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.155 6.695 32.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.633 5.348 30.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.115 4.588 30.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.367 4.046 31.675 1.00 0.00 H new ATOM 992 N LYS A 66 -5.002 5.504 27.128 1.00 0.00 N ATOM 993 CA LYS A 66 -5.313 4.979 25.806 1.00 0.00 C ATOM 994 C LYS A 66 -5.268 3.455 25.803 1.00 0.00 C ATOM 995 O LYS A 66 -4.424 2.849 26.463 1.00 0.00 O ATOM 996 CB LYS A 66 -4.333 5.533 24.770 1.00 0.00 C ATOM 997 CG LYS A 66 -4.630 5.083 23.349 1.00 0.00 C ATOM 998 CD LYS A 66 -5.443 6.122 22.595 1.00 0.00 C ATOM 999 CE LYS A 66 -5.105 6.125 21.113 1.00 0.00 C ATOM 1000 NZ LYS A 66 -5.695 7.298 20.411 1.00 0.00 N1+ ATOM 0 H LYS A 66 -4.407 4.899 27.693 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.323 5.295 25.545 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -4.354 6.622 24.809 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -3.322 5.223 25.036 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -3.694 4.899 22.821 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -5.175 4.139 23.371 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -6.506 5.919 22.727 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -5.252 7.110 23.015 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -4.022 6.134 20.988 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -5.471 5.206 20.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -5.441 7.263 19.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -6.730 7.276 20.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -5.326 8.175 20.830 1.00 0.00 H new ATOM 1014 N LEU A 67 -6.181 2.841 25.058 1.00 0.00 N ATOM 1015 CA LEU A 67 -6.240 1.386 24.974 1.00 0.00 C ATOM 1016 C LEU A 67 -5.369 0.873 23.832 1.00 0.00 C ATOM 1017 O LEU A 67 -5.230 1.532 22.801 1.00 0.00 O ATOM 1018 CB LEU A 67 -7.685 0.910 24.779 1.00 0.00 C ATOM 1019 CG LEU A 67 -8.773 1.844 25.321 1.00 0.00 C ATOM 1020 CD1 LEU A 67 -10.116 1.131 25.347 1.00 0.00 C ATOM 1021 CD2 LEU A 67 -8.409 2.349 26.711 1.00 0.00 C ATOM 0 H LEU A 67 -6.888 3.326 24.505 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.861 0.983 25.913 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -7.858 0.761 23.713 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.795 -0.063 25.259 1.00 0.00 H new ATOM 0 HG LEU A 67 -8.849 2.705 24.657 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -10.879 1.806 25.734 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -10.384 0.822 24.336 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -10.049 0.253 25.989 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.195 3.010 27.075 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.303 1.502 27.389 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.468 2.897 26.664 1.00 0.00 H new ATOM 1033 N TYR A 68 -4.788 -0.306 24.021 1.00 0.00 N ATOM 1034 CA TYR A 68 -3.934 -0.907 23.005 1.00 0.00 C ATOM 1035 C TYR A 68 -4.271 -2.383 22.817 1.00 0.00 C ATOM 1036 O TYR A 68 -4.757 -3.042 23.740 1.00 0.00 O ATOM 1037 CB TYR A 68 -2.456 -0.738 23.379 1.00 0.00 C ATOM 1038 CG TYR A 68 -1.958 -1.732 24.407 1.00 0.00 C ATOM 1039 CD1 TYR A 68 -2.515 -1.786 25.676 1.00 0.00 C ATOM 1040 CD2 TYR A 68 -0.931 -2.615 24.105 1.00 0.00 C ATOM 1041 CE1 TYR A 68 -2.063 -2.692 26.617 1.00 0.00 C ATOM 1042 CE2 TYR A 68 -0.472 -3.525 25.038 1.00 0.00 C ATOM 1043 CZ TYR A 68 -1.042 -3.559 26.293 1.00 0.00 C ATOM 1044 OH TYR A 68 -0.588 -4.463 27.226 1.00 0.00 O ATOM 0 H TYR A 68 -4.893 -0.864 24.868 1.00 0.00 H new ATOM 0 HA TYR A 68 -4.115 -0.393 22.061 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.852 -0.832 22.477 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -2.303 0.271 23.762 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -3.316 -1.108 25.933 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -0.482 -2.591 23.123 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -2.508 -2.720 27.601 1.00 0.00 H new ATOM 0 HE2 TYR A 68 0.328 -4.205 24.786 1.00 0.00 H new ATOM 0 HH TYR A 68 -0.506 -4.021 28.097 1.00 0.00 H new ATOM 1054 N GLU A 69 -4.010 -2.895 21.617 1.00 0.00 N ATOM 1055 CA GLU A 69 -4.284 -4.292 21.305 1.00 0.00 C ATOM 1056 C GLU A 69 -2.987 -5.058 21.074 1.00 0.00 C ATOM 1057 O GLU A 69 -2.100 -4.592 20.359 1.00 0.00 O ATOM 1058 CB GLU A 69 -5.179 -4.395 20.068 1.00 0.00 C ATOM 1059 CG GLU A 69 -6.664 -4.413 20.392 1.00 0.00 C ATOM 1060 CD GLU A 69 -7.532 -4.345 19.150 1.00 0.00 C ATOM 1061 OE1 GLU A 69 -7.129 -4.912 18.113 1.00 0.00 O ATOM 1062 OE2 GLU A 69 -8.614 -3.726 19.216 1.00 0.00 O1- ATOM 0 H GLU A 69 -3.609 -2.362 20.845 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.802 -4.735 22.156 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.970 -3.554 19.407 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.924 -5.302 19.520 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.900 -5.321 20.947 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.901 -3.571 21.043 1.00 0.00 H new ATOM 1069 N ALA A 70 -2.883 -6.232 21.684 1.00 0.00 N ATOM 1070 CA ALA A 70 -1.694 -7.061 21.548 1.00 0.00 C ATOM 1071 C ALA A 70 -2.030 -8.406 20.920 1.00 0.00 C ATOM 1072 O ALA A 70 -3.028 -9.035 21.270 1.00 0.00 O ATOM 1073 CB ALA A 70 -1.035 -7.264 22.904 1.00 0.00 C ATOM 0 H ALA A 70 -3.609 -6.631 22.278 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.997 -6.545 20.888 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.147 -7.886 22.788 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.749 -6.297 23.318 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.736 -7.755 23.579 1.00 0.00 H new ATOM 1079 N LYS A 71 -1.185 -8.845 19.994 1.00 0.00 N ATOM 1080 CA LYS A 71 -1.390 -10.119 19.323 1.00 0.00 C ATOM 1081 C LYS A 71 -0.263 -11.088 19.652 1.00 0.00 C ATOM 1082 O LYS A 71 0.915 -10.762 19.505 1.00 0.00 O ATOM 1083 CB LYS A 71 -1.489 -9.924 17.813 1.00 0.00 C ATOM 1084 CG LYS A 71 -0.181 -9.497 17.184 1.00 0.00 C ATOM 1085 CD LYS A 71 -0.380 -8.383 16.168 1.00 0.00 C ATOM 1086 CE LYS A 71 0.514 -8.571 14.953 1.00 0.00 C ATOM 1087 NZ LYS A 71 -0.139 -9.405 13.907 1.00 0.00 N1+ ATOM 0 H LYS A 71 -0.353 -8.337 19.693 1.00 0.00 H new ATOM 0 HA LYS A 71 -2.329 -10.541 19.682 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -1.820 -10.855 17.353 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.251 -9.174 17.598 1.00 0.00 H new ATOM 0 HG2 LYS A 71 0.504 -9.161 17.962 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.285 -10.354 16.697 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -1.423 -8.358 15.853 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -0.165 -7.421 16.634 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.768 -7.597 14.535 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.449 -9.040 15.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.503 -9.509 13.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -0.358 -10.343 14.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -1.019 -8.946 13.596 1.00 0.00 H new ATOM 1101 N ILE A 72 -0.634 -12.281 20.094 1.00 0.00 N ATOM 1102 CA ILE A 72 0.341 -13.303 20.442 1.00 0.00 C ATOM 1103 C ILE A 72 0.212 -14.502 19.513 1.00 0.00 C ATOM 1104 O ILE A 72 -0.880 -15.030 19.308 1.00 0.00 O ATOM 1105 CB ILE A 72 0.186 -13.752 21.909 1.00 0.00 C ATOM 1106 CG1 ILE A 72 0.276 -12.538 22.836 1.00 0.00 C ATOM 1107 CG2 ILE A 72 1.247 -14.781 22.274 1.00 0.00 C ATOM 1108 CD1 ILE A 72 -0.293 -12.778 24.216 1.00 0.00 C ATOM 0 H ILE A 72 -1.606 -12.565 20.220 1.00 0.00 H new ATOM 0 HA ILE A 72 1.333 -12.867 20.324 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.792 -14.219 22.030 1.00 0.00 H new ATOM 0 HG12 ILE A 72 1.321 -12.242 22.931 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.252 -11.702 22.376 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.118 -15.083 23.313 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.146 -15.653 21.627 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.237 -14.345 22.143 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.193 -11.872 24.814 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.347 -13.044 24.134 1.00 0.00 H new ATOM 0 HD13 ILE A 72 0.250 -13.592 24.697 1.00 0.00 H new ATOM 1120 N TRP A 73 1.336 -14.913 18.940 1.00 0.00 N ATOM 1121 CA TRP A 73 1.361 -16.035 18.012 1.00 0.00 C ATOM 1122 C TRP A 73 1.739 -17.327 18.732 1.00 0.00 C ATOM 1123 O TRP A 73 2.759 -17.390 19.418 1.00 0.00 O ATOM 1124 CB TRP A 73 2.366 -15.753 16.891 1.00 0.00 C ATOM 1125 CG TRP A 73 1.739 -15.405 15.574 1.00 0.00 C ATOM 1126 CD1 TRP A 73 2.148 -15.829 14.345 1.00 0.00 C ATOM 1127 CD2 TRP A 73 0.606 -14.556 15.348 1.00 0.00 C ATOM 1128 NE1 TRP A 73 1.338 -15.306 13.368 1.00 0.00 N ATOM 1129 CE2 TRP A 73 0.383 -14.521 13.957 1.00 0.00 C ATOM 1130 CE3 TRP A 73 -0.245 -13.825 16.181 1.00 0.00 C ATOM 1131 CZ2 TRP A 73 -0.651 -13.786 13.385 1.00 0.00 C ATOM 1132 CZ3 TRP A 73 -1.271 -13.095 15.612 1.00 0.00 C ATOM 1133 CH2 TRP A 73 -1.467 -13.080 14.226 1.00 0.00 C ATOM 0 H TRP A 73 2.246 -14.483 19.103 1.00 0.00 H new ATOM 0 HA TRP A 73 0.364 -16.157 17.588 1.00 0.00 H new ATOM 0 HB2 TRP A 73 3.016 -14.934 17.199 1.00 0.00 H new ATOM 0 HB3 TRP A 73 3.000 -16.630 16.758 1.00 0.00 H new ATOM 0 HD1 TRP A 73 2.989 -16.483 14.166 1.00 0.00 H new ATOM 0 HE1 TRP A 73 1.432 -15.475 12.366 1.00 0.00 H new ATOM 0 HE3 TRP A 73 -0.103 -13.830 17.252 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 -0.804 -13.773 12.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 -1.933 -12.526 16.248 1.00 0.00 H new ATOM 0 HH2 TRP A 73 -2.278 -12.500 13.812 1.00 0.00 H new ATOM 1144 N VAL A 74 0.913 -18.357 18.569 1.00 0.00 N ATOM 1145 CA VAL A 74 1.167 -19.647 19.203 1.00 0.00 C ATOM 1146 C VAL A 74 1.240 -20.761 18.164 1.00 0.00 C ATOM 1147 O VAL A 74 0.811 -20.588 17.023 1.00 0.00 O ATOM 1148 CB VAL A 74 0.078 -20.000 20.237 1.00 0.00 C ATOM 1149 CG1 VAL A 74 0.597 -21.027 21.231 1.00 0.00 C ATOM 1150 CG2 VAL A 74 -0.412 -18.750 20.954 1.00 0.00 C ATOM 0 H VAL A 74 0.064 -18.324 18.005 1.00 0.00 H new ATOM 0 HA VAL A 74 2.125 -19.560 19.716 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.768 -20.437 19.707 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.185 -21.263 21.952 1.00 0.00 H new ATOM 0 HG12 VAL A 74 0.886 -21.934 20.700 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.463 -20.621 21.755 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.179 -19.023 21.678 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.423 -18.276 21.471 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.831 -18.054 20.227 1.00 0.00 H new ATOM 1160 N LYS A 75 1.787 -21.904 18.565 1.00 0.00 N ATOM 1161 CA LYS A 75 1.915 -23.046 17.667 1.00 0.00 C ATOM 1162 C LYS A 75 0.907 -24.136 18.025 1.00 0.00 C ATOM 1163 O LYS A 75 0.617 -24.363 19.199 1.00 0.00 O ATOM 1164 CB LYS A 75 3.336 -23.610 17.726 1.00 0.00 C ATOM 1165 CG LYS A 75 4.319 -22.880 16.825 1.00 0.00 C ATOM 1166 CD LYS A 75 4.493 -23.595 15.495 1.00 0.00 C ATOM 1167 CE LYS A 75 4.623 -22.609 14.346 1.00 0.00 C ATOM 1168 NZ LYS A 75 4.071 -23.158 13.077 1.00 0.00 N1+ ATOM 0 H LYS A 75 2.148 -22.064 19.505 1.00 0.00 H new ATOM 0 HA LYS A 75 1.708 -22.704 16.653 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.694 -23.562 18.754 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.312 -24.663 17.445 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.967 -21.863 16.649 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.284 -22.801 17.326 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.379 -24.228 15.534 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.640 -24.251 15.319 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.101 -21.686 14.599 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.673 -22.353 14.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 4.179 -22.455 12.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.585 -24.025 12.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.063 -23.378 13.204 1.00 0.00 H new ATOM 1182 N PRO A 76 0.355 -24.828 17.011 1.00 0.00 N ATOM 1183 CA PRO A 76 -0.625 -25.895 17.228 1.00 0.00 C ATOM 1184 C PRO A 76 0.018 -27.182 17.733 1.00 0.00 C ATOM 1185 O PRO A 76 -0.491 -27.822 18.654 1.00 0.00 O ATOM 1186 CB PRO A 76 -1.222 -26.106 15.837 1.00 0.00 C ATOM 1187 CG PRO A 76 -0.130 -25.724 14.899 1.00 0.00 C ATOM 1188 CD PRO A 76 0.641 -24.622 15.577 1.00 0.00 C ATOM 0 HA PRO A 76 -1.358 -25.629 17.989 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -1.527 -27.142 15.689 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -2.108 -25.488 15.688 1.00 0.00 H new ATOM 0 HG2 PRO A 76 0.515 -26.576 14.686 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -0.536 -25.385 13.946 1.00 0.00 H new ATOM 0 HD2 PRO A 76 1.708 -24.692 15.367 1.00 0.00 H new ATOM 0 HD3 PRO A 76 0.314 -23.638 15.240 1.00 0.00 H new ATOM 1196 N TRP A 77 1.138 -27.557 17.125 1.00 0.00 N ATOM 1197 CA TRP A 77 1.850 -28.769 17.513 1.00 0.00 C ATOM 1198 C TRP A 77 2.900 -28.469 18.578 1.00 0.00 C ATOM 1199 O TRP A 77 2.924 -29.099 19.635 1.00 0.00 O ATOM 1200 CB TRP A 77 2.514 -29.409 16.293 1.00 0.00 C ATOM 1201 CG TRP A 77 1.639 -30.404 15.594 1.00 0.00 C ATOM 1202 CD1 TRP A 77 0.291 -30.315 15.396 1.00 0.00 C ATOM 1203 CD2 TRP A 77 2.051 -31.641 15.001 1.00 0.00 C ATOM 1204 NE1 TRP A 77 -0.160 -31.420 14.717 1.00 0.00 N ATOM 1205 CE2 TRP A 77 0.902 -32.249 14.462 1.00 0.00 C ATOM 1206 CE3 TRP A 77 3.281 -32.293 14.872 1.00 0.00 C ATOM 1207 CZ2 TRP A 77 0.946 -33.476 13.806 1.00 0.00 C ATOM 1208 CZ3 TRP A 77 3.324 -33.512 14.220 1.00 0.00 C ATOM 1209 CH2 TRP A 77 2.163 -34.092 13.694 1.00 0.00 C ATOM 0 H TRP A 77 1.573 -27.039 16.361 1.00 0.00 H new ATOM 0 HA TRP A 77 1.124 -29.466 17.931 1.00 0.00 H new ATOM 0 HB2 TRP A 77 2.796 -28.626 15.589 1.00 0.00 H new ATOM 0 HB3 TRP A 77 3.434 -29.902 16.606 1.00 0.00 H new ATOM 0 HD1 TRP A 77 -0.330 -29.495 15.725 1.00 0.00 H new ATOM 0 HE1 TRP A 77 -1.128 -31.596 14.446 1.00 0.00 H new ATOM 0 HE3 TRP A 77 4.181 -31.853 15.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.052 -33.926 13.400 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 4.269 -34.025 14.115 1.00 0.00 H new ATOM 0 HH2 TRP A 77 2.229 -35.045 13.190 1.00 0.00 H new ATOM 1220 N MET A 78 3.767 -27.502 18.292 1.00 0.00 N ATOM 1221 CA MET A 78 4.820 -27.118 19.225 1.00 0.00 C ATOM 1222 C MET A 78 4.231 -26.672 20.560 1.00 0.00 C ATOM 1223 O MET A 78 4.853 -26.837 21.609 1.00 0.00 O ATOM 1224 CB MET A 78 5.673 -25.996 18.630 1.00 0.00 C ATOM 1225 CG MET A 78 6.059 -26.229 17.179 1.00 0.00 C ATOM 1226 SD MET A 78 7.534 -25.310 16.697 1.00 0.00 S ATOM 1227 CE MET A 78 8.807 -26.536 16.989 1.00 0.00 C ATOM 0 H MET A 78 3.761 -26.970 17.422 1.00 0.00 H new ATOM 0 HA MET A 78 5.450 -27.990 19.401 1.00 0.00 H new ATOM 0 HB2 MET A 78 5.126 -25.056 18.705 1.00 0.00 H new ATOM 0 HB3 MET A 78 6.580 -25.886 19.225 1.00 0.00 H new ATOM 0 HG2 MET A 78 6.230 -27.293 17.019 1.00 0.00 H new ATOM 0 HG3 MET A 78 5.229 -25.939 16.535 1.00 0.00 H new ATOM 0 HE1 MET A 78 9.781 -26.117 16.736 1.00 0.00 H new ATOM 0 HE2 MET A 78 8.798 -26.826 18.040 1.00 0.00 H new ATOM 0 HE3 MET A 78 8.617 -27.412 16.369 1.00 0.00 H new ATOM 1237 N ASP A 79 3.029 -26.108 20.512 1.00 0.00 N ATOM 1238 CA ASP A 79 2.358 -25.639 21.718 1.00 0.00 C ATOM 1239 C ASP A 79 3.185 -24.565 22.420 1.00 0.00 C ATOM 1240 O ASP A 79 3.125 -24.420 23.640 1.00 0.00 O ATOM 1241 CB ASP A 79 2.101 -26.810 22.670 1.00 0.00 C ATOM 1242 CG ASP A 79 0.662 -27.286 22.627 1.00 0.00 C ATOM 1243 OD1 ASP A 79 -0.234 -26.445 22.406 1.00 0.00 O ATOM 1244 OD2 ASP A 79 0.432 -28.499 22.813 1.00 0.00 O1- ATOM 0 H ASP A 79 2.500 -25.965 19.652 1.00 0.00 H new ATOM 0 HA ASP A 79 1.403 -25.201 21.427 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.762 -27.637 22.411 1.00 0.00 H new ATOM 0 HB3 ASP A 79 2.351 -26.509 23.687 1.00 0.00 H new ATOM 1249 N PHE A 80 3.957 -23.816 21.639 1.00 0.00 N ATOM 1250 CA PHE A 80 4.796 -22.756 22.186 1.00 0.00 C ATOM 1251 C PHE A 80 4.206 -21.383 21.878 1.00 0.00 C ATOM 1252 O PHE A 80 4.241 -20.923 20.737 1.00 0.00 O ATOM 1253 CB PHE A 80 6.213 -22.854 21.618 1.00 0.00 C ATOM 1254 CG PHE A 80 7.133 -23.707 22.443 1.00 0.00 C ATOM 1255 CD1 PHE A 80 7.333 -23.433 23.787 1.00 0.00 C ATOM 1256 CD2 PHE A 80 7.797 -24.782 21.876 1.00 0.00 C ATOM 1257 CE1 PHE A 80 8.179 -24.216 24.549 1.00 0.00 C ATOM 1258 CE2 PHE A 80 8.644 -25.569 22.633 1.00 0.00 C ATOM 1259 CZ PHE A 80 8.835 -25.286 23.971 1.00 0.00 C ATOM 0 H PHE A 80 4.019 -23.923 20.627 1.00 0.00 H new ATOM 0 HA PHE A 80 4.837 -22.880 23.268 1.00 0.00 H new ATOM 0 HB2 PHE A 80 6.163 -23.260 20.608 1.00 0.00 H new ATOM 0 HB3 PHE A 80 6.634 -21.852 21.539 1.00 0.00 H new ATOM 0 HD1 PHE A 80 6.822 -22.598 24.244 1.00 0.00 H new ATOM 0 HD2 PHE A 80 7.651 -25.008 20.830 1.00 0.00 H new ATOM 0 HE1 PHE A 80 8.327 -23.992 25.595 1.00 0.00 H new ATOM 0 HE2 PHE A 80 9.156 -26.404 22.179 1.00 0.00 H new ATOM 0 HZ PHE A 80 9.496 -25.900 24.565 1.00 0.00 H new ATOM 1269 N LYS A 81 3.665 -20.734 22.904 1.00 0.00 N ATOM 1270 CA LYS A 81 3.067 -19.414 22.743 1.00 0.00 C ATOM 1271 C LYS A 81 4.131 -18.324 22.806 1.00 0.00 C ATOM 1272 O LYS A 81 5.063 -18.396 23.608 1.00 0.00 O ATOM 1273 CB LYS A 81 2.009 -19.176 23.823 1.00 0.00 C ATOM 1274 CG LYS A 81 1.348 -17.809 23.737 1.00 0.00 C ATOM 1275 CD LYS A 81 1.395 -17.078 25.070 1.00 0.00 C ATOM 1276 CE LYS A 81 0.217 -17.455 25.954 1.00 0.00 C ATOM 1277 NZ LYS A 81 -1.085 -17.256 25.259 1.00 0.00 N1+ ATOM 0 H LYS A 81 3.629 -21.101 23.855 1.00 0.00 H new ATOM 0 HA LYS A 81 2.591 -19.374 21.763 1.00 0.00 H new ATOM 0 HB2 LYS A 81 1.242 -19.947 23.745 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.472 -19.285 24.804 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.848 -17.210 22.975 1.00 0.00 H new ATOM 0 HG3 LYS A 81 0.311 -17.925 23.422 1.00 0.00 H new ATOM 0 HD2 LYS A 81 2.327 -17.315 25.583 1.00 0.00 H new ATOM 0 HD3 LYS A 81 1.391 -16.002 24.896 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.310 -18.497 26.258 1.00 0.00 H new ATOM 0 HE3 LYS A 81 0.239 -16.854 26.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -1.823 -17.039 25.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.003 -16.467 24.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -1.340 -18.123 24.745 1.00 0.00 H new ATOM 1291 N GLN A 82 3.986 -17.314 21.955 1.00 0.00 N ATOM 1292 CA GLN A 82 4.934 -16.207 21.912 1.00 0.00 C ATOM 1293 C GLN A 82 4.247 -14.921 21.465 1.00 0.00 C ATOM 1294 O GLN A 82 3.573 -14.891 20.436 1.00 0.00 O ATOM 1295 CB GLN A 82 6.092 -16.537 20.969 1.00 0.00 C ATOM 1296 CG GLN A 82 7.266 -17.211 21.659 1.00 0.00 C ATOM 1297 CD GLN A 82 8.605 -16.703 21.161 1.00 0.00 C ATOM 1298 OE1 GLN A 82 8.803 -16.514 19.961 1.00 0.00 O ATOM 1299 NE2 GLN A 82 9.533 -16.478 22.084 1.00 0.00 N ATOM 0 H GLN A 82 3.220 -17.239 21.285 1.00 0.00 H new ATOM 0 HA GLN A 82 5.326 -16.057 22.918 1.00 0.00 H new ATOM 0 HB2 GLN A 82 5.728 -17.187 20.173 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.438 -15.618 20.497 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.195 -17.044 22.734 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.208 -18.288 21.499 1.00 0.00 H new ATOM 0 HE21 GLN A 82 9.325 -16.648 23.068 1.00 0.00 H new ATOM 0 HE22 GLN A 82 10.453 -16.135 21.809 1.00 0.00 H new ATOM 1308 N LEU A 83 4.424 -13.861 22.245 1.00 0.00 N ATOM 1309 CA LEU A 83 3.822 -12.570 21.931 1.00 0.00 C ATOM 1310 C LEU A 83 4.504 -11.934 20.723 1.00 0.00 C ATOM 1311 O LEU A 83 5.732 -11.882 20.649 1.00 0.00 O ATOM 1312 CB LEU A 83 3.913 -11.636 23.141 1.00 0.00 C ATOM 1313 CG LEU A 83 3.714 -12.315 24.501 1.00 0.00 C ATOM 1314 CD1 LEU A 83 4.949 -12.142 25.373 1.00 0.00 C ATOM 1315 CD2 LEU A 83 2.482 -11.762 25.205 1.00 0.00 C ATOM 0 H LEU A 83 4.980 -13.870 23.100 1.00 0.00 H new ATOM 0 HA LEU A 83 2.772 -12.732 21.687 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.889 -11.151 23.134 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.165 -10.850 23.031 1.00 0.00 H new ATOM 0 HG LEU A 83 3.561 -13.380 24.329 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.787 -12.631 26.334 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.810 -12.591 24.878 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.135 -11.080 25.533 1.00 0.00 H new ATOM 0 HD21 LEU A 83 2.360 -12.258 26.168 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.603 -10.690 25.362 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.600 -11.942 24.590 1.00 0.00 H new ATOM 1327 N GLN A 84 3.702 -11.458 19.776 1.00 0.00 N ATOM 1328 CA GLN A 84 4.233 -10.833 18.569 1.00 0.00 C ATOM 1329 C GLN A 84 4.433 -9.332 18.770 1.00 0.00 C ATOM 1330 O GLN A 84 5.565 -8.851 18.821 1.00 0.00 O ATOM 1331 CB GLN A 84 3.297 -11.087 17.384 1.00 0.00 C ATOM 1332 CG GLN A 84 3.552 -12.411 16.677 1.00 0.00 C ATOM 1333 CD GLN A 84 4.421 -12.258 15.446 1.00 0.00 C ATOM 1334 OE1 GLN A 84 5.241 -11.344 15.358 1.00 0.00 O ATOM 1335 NE2 GLN A 84 4.243 -13.157 14.487 1.00 0.00 N ATOM 0 H GLN A 84 2.684 -11.493 19.820 1.00 0.00 H new ATOM 0 HA GLN A 84 5.204 -11.280 18.356 1.00 0.00 H new ATOM 0 HB2 GLN A 84 2.266 -11.066 17.736 1.00 0.00 H new ATOM 0 HB3 GLN A 84 3.406 -10.275 16.666 1.00 0.00 H new ATOM 0 HG2 GLN A 84 4.030 -13.102 17.371 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.599 -12.855 16.391 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.551 -13.897 14.604 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.798 -13.108 13.633 1.00 0.00 H new ATOM 1344 N GLU A 85 3.330 -8.596 18.883 1.00 0.00 N ATOM 1345 CA GLU A 85 3.390 -7.150 19.078 1.00 0.00 C ATOM 1346 C GLU A 85 1.990 -6.560 19.245 1.00 0.00 C ATOM 1347 O GLU A 85 0.993 -7.204 18.919 1.00 0.00 O ATOM 1348 CB GLU A 85 4.101 -6.483 17.896 1.00 0.00 C ATOM 1349 CG GLU A 85 3.299 -6.512 16.605 1.00 0.00 C ATOM 1350 CD GLU A 85 4.125 -6.113 15.397 1.00 0.00 C ATOM 1351 OE1 GLU A 85 4.883 -6.965 14.889 1.00 0.00 O1- ATOM 1352 OE2 GLU A 85 4.013 -4.949 14.960 1.00 0.00 O ATOM 0 H GLU A 85 2.385 -8.977 18.843 1.00 0.00 H new ATOM 0 HA GLU A 85 3.955 -6.957 19.990 1.00 0.00 H new ATOM 0 HB2 GLU A 85 4.321 -5.447 18.153 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.057 -6.980 17.731 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.899 -7.514 16.452 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.446 -5.839 16.696 1.00 0.00 H new ATOM 1359 N PHE A 86 1.923 -5.333 19.754 1.00 0.00 N ATOM 1360 CA PHE A 86 0.644 -4.658 19.962 1.00 0.00 C ATOM 1361 C PHE A 86 0.582 -3.343 19.193 1.00 0.00 C ATOM 1362 O PHE A 86 1.600 -2.681 18.989 1.00 0.00 O ATOM 1363 CB PHE A 86 0.402 -4.395 21.450 1.00 0.00 C ATOM 1364 CG PHE A 86 1.629 -3.974 22.204 1.00 0.00 C ATOM 1365 CD1 PHE A 86 2.544 -4.918 22.636 1.00 0.00 C ATOM 1366 CD2 PHE A 86 1.864 -2.638 22.488 1.00 0.00 C ATOM 1367 CE1 PHE A 86 3.671 -4.539 23.336 1.00 0.00 C ATOM 1368 CE2 PHE A 86 2.989 -2.253 23.189 1.00 0.00 C ATOM 1369 CZ PHE A 86 3.894 -3.204 23.614 1.00 0.00 C ATOM 0 H PHE A 86 2.738 -4.786 20.030 1.00 0.00 H new ATOM 0 HA PHE A 86 -0.137 -5.319 19.586 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -0.358 -3.621 21.552 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -0.000 -5.299 21.907 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.374 -5.963 22.423 1.00 0.00 H new ATOM 0 HD2 PHE A 86 1.159 -1.890 22.157 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.378 -5.285 23.666 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.161 -1.209 23.405 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.775 -2.905 24.163 1.00 0.00 H new ATOM 1379 N LYS A 87 -0.622 -2.969 18.770 1.00 0.00 N ATOM 1380 CA LYS A 87 -0.822 -1.731 18.025 1.00 0.00 C ATOM 1381 C LYS A 87 -1.831 -0.830 18.733 1.00 0.00 C ATOM 1382 O LYS A 87 -2.714 -1.308 19.444 1.00 0.00 O ATOM 1383 CB LYS A 87 -1.291 -2.025 16.595 1.00 0.00 C ATOM 1384 CG LYS A 87 -2.219 -3.227 16.477 1.00 0.00 C ATOM 1385 CD LYS A 87 -3.649 -2.872 16.853 1.00 0.00 C ATOM 1386 CE LYS A 87 -4.208 -1.782 15.952 1.00 0.00 C ATOM 1387 NZ LYS A 87 -5.639 -2.018 15.617 1.00 0.00 N1+ ATOM 0 H LYS A 87 -1.474 -3.506 18.931 1.00 0.00 H new ATOM 0 HA LYS A 87 0.135 -1.211 17.977 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -1.803 -1.145 16.204 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -0.417 -2.192 15.965 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -2.195 -3.607 15.456 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -1.861 -4.028 17.123 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.276 -3.761 16.783 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -3.682 -2.540 17.891 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -4.105 -0.815 16.445 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -3.623 -1.735 15.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -6.153 -1.114 15.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.709 -2.437 14.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -6.056 -2.668 16.314 1.00 0.00 H new ATOM 1401 N HIS A 88 -1.688 0.477 18.536 1.00 0.00 N ATOM 1402 CA HIS A 88 -2.583 1.446 19.157 1.00 0.00 C ATOM 1403 C HIS A 88 -4.002 1.303 18.615 1.00 0.00 C ATOM 1404 O HIS A 88 -4.209 1.202 17.406 1.00 0.00 O ATOM 1405 CB HIS A 88 -2.074 2.868 18.917 1.00 0.00 C ATOM 1406 CG HIS A 88 -1.934 3.217 17.468 1.00 0.00 C ATOM 1407 ND1 HIS A 88 -0.838 2.860 16.710 1.00 0.00 N ATOM 1408 CD2 HIS A 88 -2.759 3.894 16.635 1.00 0.00 C ATOM 1409 CE1 HIS A 88 -0.995 3.303 15.475 1.00 0.00 C ATOM 1410 NE2 HIS A 88 -2.153 3.933 15.404 1.00 0.00 N ATOM 0 H HIS A 88 -0.961 0.889 17.951 1.00 0.00 H new ATOM 0 HA HIS A 88 -2.602 1.250 20.229 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -2.758 3.574 19.388 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -1.107 2.986 19.406 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -3.716 4.324 16.891 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -0.296 3.172 14.663 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -2.536 4.377 14.569 1.00 0.00 H new ATOM 1419 N VAL A 89 -4.976 1.297 19.519 1.00 0.00 N ATOM 1420 CA VAL A 89 -6.376 1.169 19.134 1.00 0.00 C ATOM 1421 C VAL A 89 -7.236 2.215 19.835 1.00 0.00 C ATOM 1422 O VAL A 89 -7.148 2.392 21.050 1.00 0.00 O ATOM 1423 CB VAL A 89 -6.924 -0.233 19.464 1.00 0.00 C ATOM 1424 CG1 VAL A 89 -6.407 -1.257 18.465 1.00 0.00 C ATOM 1425 CG2 VAL A 89 -6.555 -0.630 20.886 1.00 0.00 C ATOM 0 H VAL A 89 -4.821 1.379 20.524 1.00 0.00 H new ATOM 0 HA VAL A 89 -6.423 1.325 18.056 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.011 -0.205 19.390 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.804 -2.241 18.714 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.728 -0.980 17.461 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.318 -1.285 18.503 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -6.950 -1.623 21.101 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.470 -0.641 20.991 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -6.980 0.089 21.586 1.00 0.00 H new ATOM 1435 N ARG A 90 -8.068 2.905 19.061 1.00 0.00 N ATOM 1436 CA ARG A 90 -8.944 3.935 19.608 1.00 0.00 C ATOM 1437 C ARG A 90 -9.883 3.349 20.659 1.00 0.00 C ATOM 1438 O ARG A 90 -10.025 2.131 20.767 1.00 0.00 O ATOM 1439 CB ARG A 90 -9.756 4.590 18.489 1.00 0.00 C ATOM 1440 CG ARG A 90 -9.953 6.086 18.676 1.00 0.00 C ATOM 1441 CD ARG A 90 -11.313 6.536 18.169 1.00 0.00 C ATOM 1442 NE ARG A 90 -11.270 7.885 17.609 1.00 0.00 N ATOM 1443 CZ ARG A 90 -12.348 8.560 17.216 1.00 0.00 C ATOM 1444 NH1 ARG A 90 -13.554 8.016 17.321 1.00 0.00 N1+ ATOM 1445 NH2 ARG A 90 -12.219 9.782 16.718 1.00 0.00 N ATOM 0 H ARG A 90 -8.154 2.770 18.054 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.321 4.691 20.085 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.255 4.414 17.537 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.732 4.108 18.430 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -9.856 6.338 19.732 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.169 6.626 18.146 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -11.665 5.839 17.409 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -12.033 6.506 18.987 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.360 8.336 17.514 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.658 7.077 17.704 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -14.377 8.537 17.018 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.294 10.204 16.636 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.045 10.300 16.417 1.00 0.00 H new ATOM 1459 N ASP A 91 -10.520 4.224 21.429 1.00 0.00 N ATOM 1460 CA ASP A 91 -11.446 3.794 22.471 1.00 0.00 C ATOM 1461 C ASP A 91 -12.661 3.099 21.865 1.00 0.00 C ATOM 1462 O ASP A 91 -13.728 3.698 21.729 1.00 0.00 O ATOM 1463 CB ASP A 91 -11.894 4.991 23.311 1.00 0.00 C ATOM 1464 CG ASP A 91 -12.290 4.594 24.719 1.00 0.00 C ATOM 1465 OD1 ASP A 91 -13.479 4.279 24.935 1.00 0.00 O ATOM 1466 OD2 ASP A 91 -11.411 4.596 25.606 1.00 0.00 O1- ATOM 0 H ASP A 91 -10.412 5.235 21.352 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.926 3.083 23.114 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.087 5.722 23.356 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.738 5.478 22.823 1.00 0.00 H new ATOM 1751 N ARG A 112 12.726 3.408 -14.021 1.00 0.00 N ATOM 1752 CA ARG A 112 12.110 2.123 -14.333 1.00 0.00 C ATOM 1753 C ARG A 112 10.995 2.285 -15.362 1.00 0.00 C ATOM 1754 O ARG A 112 10.407 3.359 -15.491 1.00 0.00 O ATOM 1755 CB ARG A 112 11.558 1.477 -13.061 1.00 0.00 C ATOM 1756 CG ARG A 112 10.715 2.419 -12.216 1.00 0.00 C ATOM 1757 CD ARG A 112 9.228 2.176 -12.423 1.00 0.00 C ATOM 1758 NE ARG A 112 8.468 3.423 -12.453 1.00 0.00 N ATOM 1759 CZ ARG A 112 7.138 3.481 -12.473 1.00 0.00 C ATOM 1760 NH1 ARG A 112 6.419 2.365 -12.466 1.00 0.00 N1+ ATOM 1761 NH2 ARG A 112 6.526 4.657 -12.499 1.00 0.00 N ATOM 0 HA ARG A 112 12.877 1.476 -14.758 1.00 0.00 H new ATOM 0 HB2 ARG A 112 10.956 0.611 -13.335 1.00 0.00 H new ATOM 0 HB3 ARG A 112 12.390 1.109 -12.460 1.00 0.00 H new ATOM 0 HG2 ARG A 112 10.963 2.285 -11.163 1.00 0.00 H new ATOM 0 HG3 ARG A 112 10.955 3.451 -12.471 1.00 0.00 H new ATOM 0 HD2 ARG A 112 9.076 1.636 -13.358 1.00 0.00 H new ATOM 0 HD3 ARG A 112 8.850 1.540 -11.622 1.00 0.00 H new ATOM 0 HE ARG A 112 8.987 4.301 -12.459 1.00 0.00 H new ATOM 0 HH11 ARG A 112 6.885 1.458 -12.445 1.00 0.00 H new ATOM 0 HH12 ARG A 112 5.400 2.415 -12.481 1.00 0.00 H new ATOM 0 HH21 ARG A 112 7.074 5.517 -12.504 1.00 0.00 H new ATOM 0 HH22 ARG A 112 5.507 4.701 -12.514 1.00 0.00 H new ATOM 1775 N PRO A 113 10.688 1.212 -16.112 1.00 0.00 N ATOM 1776 CA PRO A 113 9.638 1.236 -17.136 1.00 0.00 C ATOM 1777 C PRO A 113 8.241 1.357 -16.533 1.00 0.00 C ATOM 1778 O PRO A 113 8.087 1.721 -15.367 1.00 0.00 O ATOM 1779 CB PRO A 113 9.800 -0.111 -17.844 1.00 0.00 C ATOM 1780 CG PRO A 113 10.446 -0.996 -16.836 1.00 0.00 C ATOM 1781 CD PRO A 113 11.342 -0.107 -16.020 1.00 0.00 C ATOM 0 HA PRO A 113 9.736 2.096 -17.799 1.00 0.00 H new ATOM 0 HB2 PRO A 113 8.836 -0.510 -18.161 1.00 0.00 H new ATOM 0 HB3 PRO A 113 10.415 -0.016 -18.739 1.00 0.00 H new ATOM 0 HG2 PRO A 113 9.700 -1.481 -16.207 1.00 0.00 H new ATOM 0 HG3 PRO A 113 11.018 -1.787 -17.321 1.00 0.00 H new ATOM 0 HD2 PRO A 113 11.415 -0.448 -14.987 1.00 0.00 H new ATOM 0 HD3 PRO A 113 12.356 -0.082 -16.420 1.00 0.00 H new ATOM 1789 N VAL A 114 7.225 1.049 -17.335 1.00 0.00 N ATOM 1790 CA VAL A 114 5.842 1.123 -16.881 1.00 0.00 C ATOM 1791 C VAL A 114 4.971 0.096 -17.597 1.00 0.00 C ATOM 1792 O VAL A 114 5.287 -0.335 -18.705 1.00 0.00 O ATOM 1793 CB VAL A 114 5.247 2.524 -17.114 1.00 0.00 C ATOM 1794 CG1 VAL A 114 5.913 3.546 -16.208 1.00 0.00 C ATOM 1795 CG2 VAL A 114 5.385 2.925 -18.575 1.00 0.00 C ATOM 0 H VAL A 114 7.335 0.746 -18.303 1.00 0.00 H new ATOM 0 HA VAL A 114 5.852 0.910 -15.812 1.00 0.00 H new ATOM 0 HB VAL A 114 4.186 2.493 -16.867 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.479 4.529 -16.388 1.00 0.00 H new ATOM 0 HG12 VAL A 114 5.757 3.265 -15.166 1.00 0.00 H new ATOM 0 HG13 VAL A 114 6.982 3.577 -16.419 1.00 0.00 H new ATOM 0 HG21 VAL A 114 4.959 3.918 -18.722 1.00 0.00 H new ATOM 0 HG22 VAL A 114 6.439 2.938 -18.851 1.00 0.00 H new ATOM 0 HG23 VAL A 114 4.855 2.207 -19.201 1.00 0.00 H new ATOM 1805 N PRO A 115 3.853 -0.307 -16.970 1.00 0.00 N ATOM 1806 CA PRO A 115 2.929 -1.285 -17.554 1.00 0.00 C ATOM 1807 C PRO A 115 2.256 -0.759 -18.817 1.00 0.00 C ATOM 1808 O PRO A 115 2.667 0.258 -19.376 1.00 0.00 O ATOM 1809 CB PRO A 115 1.890 -1.504 -16.450 1.00 0.00 C ATOM 1810 CG PRO A 115 1.966 -0.284 -15.601 1.00 0.00 C ATOM 1811 CD PRO A 115 3.399 0.161 -15.648 1.00 0.00 C ATOM 0 HA PRO A 115 3.443 -2.197 -17.859 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.891 -1.632 -16.868 1.00 0.00 H new ATOM 0 HB3 PRO A 115 2.111 -2.401 -15.872 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.303 0.495 -15.976 1.00 0.00 H new ATOM 0 HG3 PRO A 115 1.657 -0.500 -14.578 1.00 0.00 H new ATOM 0 HD2 PRO A 115 3.488 1.243 -15.551 1.00 0.00 H new ATOM 0 HD3 PRO A 115 3.985 -0.280 -14.842 1.00 0.00 H new ATOM 1819 N VAL A 116 1.216 -1.458 -19.261 1.00 0.00 N ATOM 1820 CA VAL A 116 0.481 -1.062 -20.456 1.00 0.00 C ATOM 1821 C VAL A 116 -1.023 -1.111 -20.210 1.00 0.00 C ATOM 1822 O VAL A 116 -1.519 -1.994 -19.511 1.00 0.00 O ATOM 1823 CB VAL A 116 0.823 -1.963 -21.657 1.00 0.00 C ATOM 1824 CG1 VAL A 116 2.168 -1.574 -22.252 1.00 0.00 C ATOM 1825 CG2 VAL A 116 0.816 -3.429 -21.247 1.00 0.00 C ATOM 0 H VAL A 116 0.863 -2.302 -18.810 1.00 0.00 H new ATOM 0 HA VAL A 116 0.780 -0.040 -20.687 1.00 0.00 H new ATOM 0 HB VAL A 116 0.059 -1.821 -22.422 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.392 -2.222 -23.099 1.00 0.00 H new ATOM 0 HG12 VAL A 116 2.131 -0.538 -22.587 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.946 -1.683 -21.496 1.00 0.00 H new ATOM 0 HG21 VAL A 116 1.060 -4.049 -22.110 1.00 0.00 H new ATOM 0 HG22 VAL A 116 1.555 -3.591 -20.463 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.173 -3.698 -20.875 1.00 0.00 H new ATOM 1835 N HIS A 117 -1.744 -0.152 -20.788 1.00 0.00 N ATOM 1836 CA HIS A 117 -3.196 -0.077 -20.634 1.00 0.00 C ATOM 1837 C HIS A 117 -3.586 0.457 -19.254 1.00 0.00 C ATOM 1838 O HIS A 117 -4.770 0.549 -18.931 1.00 0.00 O ATOM 1839 CB HIS A 117 -3.832 -1.452 -20.854 1.00 0.00 C ATOM 1840 CG HIS A 117 -5.294 -1.392 -21.173 1.00 0.00 C ATOM 1841 ND1 HIS A 117 -6.259 -1.999 -20.397 1.00 0.00 N ATOM 1842 CD2 HIS A 117 -5.955 -0.791 -22.191 1.00 0.00 C ATOM 1843 CE1 HIS A 117 -7.450 -1.775 -20.924 1.00 0.00 C ATOM 1844 NE2 HIS A 117 -7.293 -1.044 -22.012 1.00 0.00 N ATOM 0 H HIS A 117 -1.345 0.586 -21.369 1.00 0.00 H new ATOM 0 HA HIS A 117 -3.569 0.616 -21.388 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -3.312 -1.958 -21.667 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -3.688 -2.057 -19.959 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -5.513 -0.220 -22.994 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -8.392 -2.130 -20.531 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -8.044 -0.720 -22.621 1.00 0.00 H new ATOM 1853 N ASP A 118 -2.590 0.809 -18.444 1.00 0.00 N ATOM 1854 CA ASP A 118 -2.842 1.331 -17.107 1.00 0.00 C ATOM 1855 C ASP A 118 -3.404 2.750 -17.174 1.00 0.00 C ATOM 1856 O ASP A 118 -3.372 3.389 -18.226 1.00 0.00 O ATOM 1857 CB ASP A 118 -1.552 1.317 -16.283 1.00 0.00 C ATOM 1858 CG ASP A 118 -1.490 0.142 -15.326 1.00 0.00 C ATOM 1859 OD1 ASP A 118 -2.060 -0.920 -15.653 1.00 0.00 O ATOM 1860 OD2 ASP A 118 -0.872 0.284 -14.251 1.00 0.00 O1- ATOM 0 H ASP A 118 -1.603 0.742 -18.692 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.581 0.691 -16.625 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.695 1.280 -16.955 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -1.474 2.246 -15.719 1.00 0.00 H new ATOM 1865 N PRO A 119 -3.929 3.263 -16.048 1.00 0.00 N ATOM 1866 CA PRO A 119 -4.499 4.613 -15.987 1.00 0.00 C ATOM 1867 C PRO A 119 -3.440 5.697 -16.168 1.00 0.00 C ATOM 1868 O PRO A 119 -3.741 6.802 -16.617 1.00 0.00 O ATOM 1869 CB PRO A 119 -5.106 4.687 -14.583 1.00 0.00 C ATOM 1870 CG PRO A 119 -4.354 3.675 -13.789 1.00 0.00 C ATOM 1871 CD PRO A 119 -4.008 2.571 -14.748 1.00 0.00 C ATOM 0 HA PRO A 119 -5.222 4.784 -16.784 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -4.997 5.684 -14.157 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -6.173 4.463 -14.601 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -3.454 4.110 -13.354 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -4.958 3.300 -12.963 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.063 2.094 -14.488 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.768 1.790 -14.754 1.00 0.00 H new ATOM 1879 N VAL A 120 -2.200 5.372 -15.816 1.00 0.00 N ATOM 1880 CA VAL A 120 -1.098 6.318 -15.940 1.00 0.00 C ATOM 1881 C VAL A 120 -0.528 6.312 -17.356 1.00 0.00 C ATOM 1882 O VAL A 120 -0.196 7.362 -17.906 1.00 0.00 O ATOM 1883 CB VAL A 120 0.030 6.004 -14.937 1.00 0.00 C ATOM 1884 CG1 VAL A 120 0.622 4.628 -15.204 1.00 0.00 C ATOM 1885 CG2 VAL A 120 1.108 7.076 -14.990 1.00 0.00 C ATOM 0 H VAL A 120 -1.934 4.461 -15.443 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.501 7.306 -15.718 1.00 0.00 H new ATOM 0 HB VAL A 120 -0.397 5.999 -13.934 1.00 0.00 H new ATOM 0 HG11 VAL A 120 1.416 4.428 -14.485 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.157 3.872 -15.105 1.00 0.00 H new ATOM 0 HG13 VAL A 120 1.031 4.598 -16.214 1.00 0.00 H new ATOM 0 HG21 VAL A 120 1.895 6.836 -14.275 1.00 0.00 H new ATOM 0 HG22 VAL A 120 1.530 7.118 -15.994 1.00 0.00 H new ATOM 0 HG23 VAL A 120 0.672 8.043 -14.739 1.00 0.00 H new ATOM 1895 N VAL A 121 -0.417 5.123 -17.939 1.00 0.00 N ATOM 1896 CA VAL A 121 0.112 4.982 -19.290 1.00 0.00 C ATOM 1897 C VAL A 121 -0.911 5.428 -20.329 1.00 0.00 C ATOM 1898 O VAL A 121 -0.628 6.287 -21.164 1.00 0.00 O ATOM 1899 CB VAL A 121 0.524 3.527 -19.583 1.00 0.00 C ATOM 1900 CG1 VAL A 121 1.223 3.429 -20.931 1.00 0.00 C ATOM 1901 CG2 VAL A 121 1.414 2.992 -18.471 1.00 0.00 C ATOM 0 H VAL A 121 -0.686 4.244 -17.497 1.00 0.00 H new ATOM 0 HA VAL A 121 0.993 5.621 -19.353 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.377 2.914 -19.624 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.506 2.393 -21.120 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.548 3.769 -21.716 1.00 0.00 H new ATOM 0 HG13 VAL A 121 2.116 4.054 -20.924 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.696 1.963 -18.694 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.311 3.606 -18.396 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.873 3.023 -17.525 1.00 0.00 H new ATOM 1911 N GLN A 122 -2.103 4.841 -20.270 1.00 0.00 N ATOM 1912 CA GLN A 122 -3.170 5.181 -21.205 1.00 0.00 C ATOM 1913 C GLN A 122 -3.457 6.679 -21.181 1.00 0.00 C ATOM 1914 O GLN A 122 -3.836 7.265 -22.195 1.00 0.00 O ATOM 1915 CB GLN A 122 -4.442 4.401 -20.866 1.00 0.00 C ATOM 1916 CG GLN A 122 -4.398 2.947 -21.306 1.00 0.00 C ATOM 1917 CD GLN A 122 -4.835 2.759 -22.745 1.00 0.00 C ATOM 1918 OE1 GLN A 122 -5.971 3.067 -23.107 1.00 0.00 O ATOM 1919 NE2 GLN A 122 -3.933 2.250 -23.577 1.00 0.00 N ATOM 0 H GLN A 122 -2.354 4.128 -19.585 1.00 0.00 H new ATOM 0 HA GLN A 122 -2.841 4.908 -22.208 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -4.607 4.441 -19.789 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -5.295 4.889 -21.338 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -3.384 2.566 -21.186 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -5.041 2.355 -20.655 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -3.003 2.009 -23.235 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -4.171 2.101 -24.558 1.00 0.00 H new ATOM 1928 N ASP A 123 -3.269 7.293 -20.017 1.00 0.00 N ATOM 1929 CA ASP A 123 -3.503 8.724 -19.862 1.00 0.00 C ATOM 1930 C ASP A 123 -2.450 9.527 -20.617 1.00 0.00 C ATOM 1931 O ASP A 123 -2.778 10.412 -21.407 1.00 0.00 O ATOM 1932 CB ASP A 123 -3.490 9.107 -18.381 1.00 0.00 C ATOM 1933 CG ASP A 123 -4.868 9.033 -17.752 1.00 0.00 C ATOM 1934 OD1 ASP A 123 -5.865 9.030 -18.504 1.00 0.00 O ATOM 1935 OD2 ASP A 123 -4.949 8.978 -16.507 1.00 0.00 O1- ATOM 0 H ASP A 123 -2.956 6.822 -19.168 1.00 0.00 H new ATOM 0 HA ASP A 123 -4.483 8.957 -20.280 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -2.812 8.444 -17.843 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -3.099 10.119 -18.274 1.00 0.00 H new ATOM 1940 N ALA A 124 -1.184 9.210 -20.370 1.00 0.00 N ATOM 1941 CA ALA A 124 -0.081 9.899 -21.028 1.00 0.00 C ATOM 1942 C ALA A 124 -0.073 9.611 -22.525 1.00 0.00 C ATOM 1943 O ALA A 124 0.161 10.505 -23.338 1.00 0.00 O ATOM 1944 CB ALA A 124 1.245 9.492 -20.404 1.00 0.00 C ATOM 0 H ALA A 124 -0.896 8.480 -19.718 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.220 10.971 -20.889 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.059 10.015 -20.906 1.00 0.00 H new ATOM 0 HB2 ALA A 124 1.244 9.753 -19.346 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.383 8.416 -20.512 1.00 0.00 H new ATOM 1950 N ALA A 125 -0.331 8.356 -22.883 1.00 0.00 N ATOM 1951 CA ALA A 125 -0.353 7.952 -24.283 1.00 0.00 C ATOM 1952 C ALA A 125 -1.399 8.740 -25.064 1.00 0.00 C ATOM 1953 O ALA A 125 -1.073 9.446 -26.017 1.00 0.00 O ATOM 1954 CB ALA A 125 -0.619 6.459 -24.397 1.00 0.00 C ATOM 0 H ALA A 125 -0.527 7.603 -22.223 1.00 0.00 H new ATOM 0 HA ALA A 125 0.624 8.169 -24.715 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -0.633 6.171 -25.448 1.00 0.00 H new ATOM 0 HB2 ALA A 125 0.167 5.909 -23.880 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -1.583 6.226 -23.944 1.00 0.00 H new ATOM 1960 N HIS A 126 -2.658 8.618 -24.650 1.00 0.00 N ATOM 1961 CA HIS A 126 -3.753 9.323 -25.311 1.00 0.00 C ATOM 1962 C HIS A 126 -3.479 10.823 -25.364 1.00 0.00 C ATOM 1963 O HIS A 126 -3.626 11.454 -26.411 1.00 0.00 O ATOM 1964 CB HIS A 126 -5.072 9.058 -24.580 1.00 0.00 C ATOM 1965 CG HIS A 126 -5.939 8.043 -25.257 1.00 0.00 C ATOM 1966 ND1 HIS A 126 -6.446 8.213 -26.528 1.00 0.00 N ATOM 1967 CD2 HIS A 126 -6.392 6.839 -24.832 1.00 0.00 C ATOM 1968 CE1 HIS A 126 -7.173 7.160 -26.855 1.00 0.00 C ATOM 1969 NE2 HIS A 126 -7.155 6.312 -25.843 1.00 0.00 N ATOM 0 H HIS A 126 -2.945 8.038 -23.861 1.00 0.00 H new ATOM 0 HA HIS A 126 -3.830 8.950 -26.332 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -4.855 8.720 -23.567 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -5.624 9.994 -24.492 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -6.190 6.380 -23.876 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -7.693 7.017 -27.790 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -7.632 5.411 -25.817 1.00 0.00 H new ATOM 1978 N HIS A 127 -3.077 11.387 -24.230 1.00 0.00 N ATOM 1979 CA HIS A 127 -2.778 12.812 -24.150 1.00 0.00 C ATOM 1980 C HIS A 127 -1.681 13.188 -25.140 1.00 0.00 C ATOM 1981 O HIS A 127 -1.696 14.274 -25.717 1.00 0.00 O ATOM 1982 CB HIS A 127 -2.351 13.186 -22.730 1.00 0.00 C ATOM 1983 CG HIS A 127 -3.491 13.266 -21.763 1.00 0.00 C ATOM 1984 ND1 HIS A 127 -4.757 13.677 -22.125 1.00 0.00 N ATOM 1985 CD2 HIS A 127 -3.553 12.984 -20.440 1.00 0.00 C ATOM 1986 CE1 HIS A 127 -5.548 13.645 -21.066 1.00 0.00 C ATOM 1987 NE2 HIS A 127 -4.842 13.227 -20.032 1.00 0.00 N ATOM 0 H HIS A 127 -2.951 10.879 -23.354 1.00 0.00 H new ATOM 0 HA HIS A 127 -3.682 13.365 -24.406 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -1.631 12.451 -22.370 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -1.839 14.148 -22.755 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -2.740 12.633 -19.821 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -6.594 13.915 -21.050 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -5.196 13.104 -19.083 1.00 0.00 H new ATOM 1996 N ALA A 128 -0.732 12.278 -25.334 1.00 0.00 N ATOM 1997 CA ALA A 128 0.370 12.510 -26.258 1.00 0.00 C ATOM 1998 C ALA A 128 -0.111 12.473 -27.704 1.00 0.00 C ATOM 1999 O ALA A 128 0.336 13.259 -28.539 1.00 0.00 O ATOM 2000 CB ALA A 128 1.469 11.481 -26.036 1.00 0.00 C ATOM 0 H ALA A 128 -0.705 11.373 -24.863 1.00 0.00 H new ATOM 0 HA ALA A 128 0.774 13.503 -26.063 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.287 11.666 -26.733 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.839 11.559 -25.014 1.00 0.00 H new ATOM 0 HB3 ALA A 128 1.070 10.481 -26.202 1.00 0.00 H new ATOM 2006 N ILE A 129 -1.029 11.555 -27.995 1.00 0.00 N ATOM 2007 CA ILE A 129 -1.572 11.413 -29.341 1.00 0.00 C ATOM 2008 C ILE A 129 -2.139 12.738 -29.848 1.00 0.00 C ATOM 2009 O ILE A 129 -1.804 13.189 -30.943 1.00 0.00 O ATOM 2010 CB ILE A 129 -2.678 10.335 -29.385 1.00 0.00 C ATOM 2011 CG1 ILE A 129 -2.100 8.965 -29.019 1.00 0.00 C ATOM 2012 CG2 ILE A 129 -3.337 10.287 -30.757 1.00 0.00 C ATOM 2013 CD1 ILE A 129 -1.208 8.374 -30.090 1.00 0.00 C ATOM 0 H ILE A 129 -1.412 10.898 -27.315 1.00 0.00 H new ATOM 0 HA ILE A 129 -0.750 11.106 -29.988 1.00 0.00 H new ATOM 0 HB ILE A 129 -3.441 10.599 -28.653 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.530 9.056 -28.094 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.921 8.276 -28.821 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -4.112 9.520 -30.762 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -3.784 11.256 -30.980 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -2.588 10.050 -31.512 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -0.836 7.404 -29.759 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -1.778 8.249 -31.011 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.366 9.042 -30.272 1.00 0.00 H new ATOM 2025 N LYS A 130 -3.000 13.355 -29.046 1.00 0.00 N ATOM 2026 CA LYS A 130 -3.612 14.626 -29.417 1.00 0.00 C ATOM 2027 C LYS A 130 -2.602 15.768 -29.336 1.00 0.00 C ATOM 2028 O LYS A 130 -2.606 16.671 -30.172 1.00 0.00 O ATOM 2029 CB LYS A 130 -4.811 14.924 -28.514 1.00 0.00 C ATOM 2030 CG LYS A 130 -4.470 14.949 -27.033 1.00 0.00 C ATOM 2031 CD LYS A 130 -4.238 16.367 -26.538 1.00 0.00 C ATOM 2032 CE LYS A 130 -4.479 16.481 -25.042 1.00 0.00 C ATOM 2033 NZ LYS A 130 -3.894 17.729 -24.478 1.00 0.00 N1+ ATOM 0 H LYS A 130 -3.290 12.996 -28.136 1.00 0.00 H new ATOM 0 HA LYS A 130 -3.954 14.544 -30.449 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.236 15.887 -28.796 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.581 14.172 -28.688 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.280 14.492 -26.464 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.577 14.350 -26.854 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -3.217 16.671 -26.767 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.901 17.051 -27.068 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -5.551 16.461 -24.845 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.046 15.617 -24.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -4.080 17.769 -23.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.867 17.737 -24.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -4.325 18.555 -24.941 1.00 0.00 H new ATOM 2047 N THR A 131 -1.742 15.724 -28.323 1.00 0.00 N ATOM 2048 CA THR A 131 -0.732 16.760 -28.133 1.00 0.00 C ATOM 2049 C THR A 131 0.262 16.784 -29.291 1.00 0.00 C ATOM 2050 O THR A 131 0.514 17.835 -29.879 1.00 0.00 O ATOM 2051 CB THR A 131 0.010 16.543 -26.812 1.00 0.00 C ATOM 2052 OG1 THR A 131 -0.887 16.604 -25.718 1.00 0.00 O ATOM 2053 CG2 THR A 131 1.104 17.560 -26.562 1.00 0.00 C ATOM 0 H THR A 131 -1.724 14.983 -27.622 1.00 0.00 H new ATOM 0 HA THR A 131 -1.243 17.722 -28.103 1.00 0.00 H new ATOM 0 HB THR A 131 0.466 15.557 -26.898 1.00 0.00 H new ATOM 0 HG1 THR A 131 -1.504 15.844 -25.758 1.00 0.00 H new ATOM 0 HG21 THR A 131 1.588 17.347 -25.609 1.00 0.00 H new ATOM 0 HG22 THR A 131 1.841 17.506 -27.363 1.00 0.00 H new ATOM 0 HG23 THR A 131 0.671 18.560 -26.533 1.00 0.00 H new ATOM 2061 N ILE A 132 0.827 15.625 -29.613 1.00 0.00 N ATOM 2062 CA ILE A 132 1.797 15.522 -30.700 1.00 0.00 C ATOM 2063 C ILE A 132 1.246 16.119 -31.994 1.00 0.00 C ATOM 2064 O ILE A 132 1.867 16.992 -32.599 1.00 0.00 O ATOM 2065 CB ILE A 132 2.211 14.055 -30.947 1.00 0.00 C ATOM 2066 CG1 ILE A 132 2.871 13.474 -29.696 1.00 0.00 C ATOM 2067 CG2 ILE A 132 3.154 13.954 -32.139 1.00 0.00 C ATOM 2068 CD1 ILE A 132 2.751 11.969 -29.590 1.00 0.00 C ATOM 0 H ILE A 132 0.631 14.744 -29.138 1.00 0.00 H new ATOM 0 HA ILE A 132 2.676 16.090 -30.395 1.00 0.00 H new ATOM 0 HB ILE A 132 1.314 13.478 -31.171 1.00 0.00 H new ATOM 0 HG12 ILE A 132 3.926 13.747 -29.692 1.00 0.00 H new ATOM 0 HG13 ILE A 132 2.421 13.929 -28.814 1.00 0.00 H new ATOM 0 HG21 ILE A 132 3.433 12.912 -32.295 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.655 14.333 -33.031 1.00 0.00 H new ATOM 0 HG23 ILE A 132 4.050 14.544 -31.945 1.00 0.00 H new ATOM 0 HD11 ILE A 132 3.242 11.628 -28.678 1.00 0.00 H new ATOM 0 HD12 ILE A 132 1.698 11.689 -29.561 1.00 0.00 H new ATOM 0 HD13 ILE A 132 3.227 11.504 -30.454 1.00 0.00 H new ATOM 2080 N GLN A 133 0.078 15.643 -32.412 1.00 0.00 N ATOM 2081 CA GLN A 133 -0.551 16.134 -33.633 1.00 0.00 C ATOM 2082 C GLN A 133 -0.955 17.598 -33.488 1.00 0.00 C ATOM 2083 O GLN A 133 -0.960 18.351 -34.461 1.00 0.00 O ATOM 2084 CB GLN A 133 -1.777 15.285 -33.976 1.00 0.00 C ATOM 2085 CG GLN A 133 -1.481 13.796 -34.062 1.00 0.00 C ATOM 2086 CD GLN A 133 -0.358 13.480 -35.030 1.00 0.00 C ATOM 2087 OE1 GLN A 133 -0.521 13.592 -36.245 1.00 0.00 O ATOM 2088 NE2 GLN A 133 0.791 13.083 -34.495 1.00 0.00 N ATOM 0 H GLN A 133 -0.451 14.920 -31.925 1.00 0.00 H new ATOM 0 HA GLN A 133 0.175 16.056 -34.442 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -2.546 15.451 -33.222 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -2.187 15.621 -34.929 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -1.218 13.424 -33.072 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -2.382 13.267 -34.372 1.00 0.00 H new ATOM 0 HE21 GLN A 133 0.882 13.004 -33.482 1.00 0.00 H new ATOM 0 HE22 GLN A 133 1.583 12.857 -35.097 1.00 0.00 H new ATOM 2097 N GLU A 134 -1.294 17.992 -32.265 1.00 0.00 N ATOM 2098 CA GLU A 134 -1.700 19.366 -31.986 1.00 0.00 C ATOM 2099 C GLU A 134 -0.492 20.296 -31.919 1.00 0.00 C ATOM 2100 O GLU A 134 -0.610 21.497 -32.159 1.00 0.00 O ATOM 2101 CB GLU A 134 -2.483 19.434 -30.673 1.00 0.00 C ATOM 2102 CG GLU A 134 -3.929 18.984 -30.803 1.00 0.00 C ATOM 2103 CD GLU A 134 -4.897 20.148 -30.874 1.00 0.00 C ATOM 2104 OE1 GLU A 134 -5.035 20.741 -31.964 1.00 0.00 O ATOM 2105 OE2 GLU A 134 -5.518 20.468 -29.838 1.00 0.00 O1- ATOM 0 H GLU A 134 -1.296 17.379 -31.450 1.00 0.00 H new ATOM 0 HA GLU A 134 -2.341 19.696 -32.803 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -1.983 18.813 -29.929 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -2.462 20.458 -30.300 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -4.036 18.372 -31.699 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -4.187 18.353 -29.953 1.00 0.00 H new ATOM 2112 N ARG A 135 0.667 19.736 -31.587 1.00 0.00 N ATOM 2113 CA ARG A 135 1.892 20.521 -31.482 1.00 0.00 C ATOM 2114 C ARG A 135 2.218 21.208 -32.806 1.00 0.00 C ATOM 2115 O ARG A 135 2.954 22.194 -32.838 1.00 0.00 O ATOM 2116 CB ARG A 135 3.061 19.627 -31.061 1.00 0.00 C ATOM 2117 CG ARG A 135 2.954 19.116 -29.632 1.00 0.00 C ATOM 2118 CD ARG A 135 4.034 19.710 -28.742 1.00 0.00 C ATOM 2119 NE ARG A 135 5.360 19.605 -29.346 1.00 0.00 N ATOM 2120 CZ ARG A 135 6.450 20.185 -28.849 1.00 0.00 C ATOM 2121 NH1 ARG A 135 6.376 20.911 -27.740 1.00 0.00 N1+ ATOM 2122 NH2 ARG A 135 7.617 20.038 -29.461 1.00 0.00 N ATOM 0 H ARG A 135 0.784 18.743 -31.386 1.00 0.00 H new ATOM 0 HA ARG A 135 1.735 21.288 -30.724 1.00 0.00 H new ATOM 0 HB2 ARG A 135 3.119 18.775 -31.739 1.00 0.00 H new ATOM 0 HB3 ARG A 135 3.991 20.185 -31.170 1.00 0.00 H new ATOM 0 HG2 ARG A 135 1.972 19.365 -29.229 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.035 18.029 -29.627 1.00 0.00 H new ATOM 0 HD2 ARG A 135 3.807 20.758 -28.546 1.00 0.00 H new ATOM 0 HD3 ARG A 135 4.033 19.198 -27.779 1.00 0.00 H new ATOM 0 HE ARG A 135 5.456 19.055 -30.199 1.00 0.00 H new ATOM 0 HH11 ARG A 135 5.481 21.026 -27.265 1.00 0.00 H new ATOM 0 HH12 ARG A 135 7.214 21.353 -27.363 1.00 0.00 H new ATOM 0 HH21 ARG A 135 7.679 19.480 -30.313 1.00 0.00 H new ATOM 0 HH22 ARG A 135 8.452 20.483 -29.080 1.00 0.00 H new ATOM 2136 N SER A 136 1.661 20.688 -33.896 1.00 0.00 N ATOM 2137 CA SER A 136 1.891 21.261 -35.216 1.00 0.00 C ATOM 2138 C SER A 136 0.763 22.216 -35.590 1.00 0.00 C ATOM 2139 O SER A 136 1.006 23.342 -36.024 1.00 0.00 O ATOM 2140 CB SER A 136 2.006 20.152 -36.265 1.00 0.00 C ATOM 2141 OG SER A 136 3.219 19.435 -36.117 1.00 0.00 O ATOM 0 H SER A 136 1.048 19.872 -33.890 1.00 0.00 H new ATOM 0 HA SER A 136 2.827 21.820 -35.188 1.00 0.00 H new ATOM 0 HB2 SER A 136 1.162 19.469 -36.171 1.00 0.00 H new ATOM 0 HB3 SER A 136 1.955 20.585 -37.264 1.00 0.00 H new ATOM 0 HG SER A 136 3.268 18.731 -36.797 1.00 0.00 H new ATOM 2147 N ASN A 137 -0.473 21.757 -35.416 1.00 0.00 N ATOM 2148 CA ASN A 137 -1.646 22.566 -35.730 1.00 0.00 C ATOM 2149 C ASN A 137 -2.929 21.804 -35.414 1.00 0.00 C ATOM 2150 O ASN A 137 -2.890 20.628 -35.054 1.00 0.00 O ATOM 2151 CB ASN A 137 -1.633 22.974 -37.206 1.00 0.00 C ATOM 2152 CG ASN A 137 -1.714 21.781 -38.138 1.00 0.00 C ATOM 2153 OD1 ASN A 137 -0.587 21.108 -38.338 1.00 0.00 O flip ATOM 2154 ND2 ASN A 137 -2.778 21.468 -38.673 1.00 0.00 N flip ATOM 0 H ASN A 137 -0.688 20.826 -35.058 1.00 0.00 H new ATOM 0 HA ASN A 137 -1.613 23.464 -35.113 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -2.471 23.642 -37.402 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -0.722 23.535 -37.417 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -3.620 22.014 -38.491 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -2.817 20.663 -39.298 1.00 0.00 H new ATOM 2261 N LEU A 144 -5.362 7.060 -29.529 1.00 0.00 N ATOM 2262 CA LEU A 144 -4.679 5.853 -29.076 1.00 0.00 C ATOM 2263 C LEU A 144 -5.413 4.601 -29.549 1.00 0.00 C ATOM 2264 O LEU A 144 -6.638 4.519 -29.464 1.00 0.00 O ATOM 2265 CB LEU A 144 -4.569 5.846 -27.550 1.00 0.00 C ATOM 2266 CG LEU A 144 -3.343 5.121 -26.992 1.00 0.00 C ATOM 2267 CD1 LEU A 144 -3.327 5.194 -25.473 1.00 0.00 C ATOM 2268 CD2 LEU A 144 -3.323 3.673 -27.458 1.00 0.00 C ATOM 0 HA LEU A 144 -3.678 5.850 -29.506 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.554 6.877 -27.197 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -5.465 5.382 -27.139 1.00 0.00 H new ATOM 0 HG LEU A 144 -2.448 5.616 -27.369 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -2.448 4.673 -25.093 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -3.294 6.237 -25.159 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -4.227 4.724 -25.077 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -2.444 3.172 -27.052 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -4.223 3.166 -27.110 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -3.288 3.642 -28.547 1.00 0.00 H new ATOM 2280 N SER A 145 -4.656 3.629 -30.047 1.00 0.00 N ATOM 2281 CA SER A 145 -5.234 2.382 -30.534 1.00 0.00 C ATOM 2282 C SER A 145 -4.826 1.210 -29.647 1.00 0.00 C ATOM 2283 O SER A 145 -5.656 0.629 -28.947 1.00 0.00 O ATOM 2284 CB SER A 145 -4.798 2.122 -31.977 1.00 0.00 C ATOM 2285 OG SER A 145 -5.838 1.514 -32.722 1.00 0.00 O ATOM 0 H SER A 145 -3.640 3.681 -30.124 1.00 0.00 H new ATOM 0 HA SER A 145 -6.319 2.477 -30.502 1.00 0.00 H new ATOM 0 HB2 SER A 145 -4.510 3.062 -32.448 1.00 0.00 H new ATOM 0 HB3 SER A 145 -3.918 1.479 -31.984 1.00 0.00 H new ATOM 0 HG SER A 145 -6.667 2.022 -32.600 1.00 0.00 H new ATOM 2291 N GLU A 146 -3.542 0.867 -29.681 1.00 0.00 N ATOM 2292 CA GLU A 146 -3.024 -0.236 -28.880 1.00 0.00 C ATOM 2293 C GLU A 146 -1.568 0.008 -28.496 1.00 0.00 C ATOM 2294 O GLU A 146 -0.713 0.205 -29.359 1.00 0.00 O ATOM 2295 CB GLU A 146 -3.148 -1.553 -29.647 1.00 0.00 C ATOM 2296 CG GLU A 146 -2.697 -1.458 -31.095 1.00 0.00 C ATOM 2297 CD GLU A 146 -3.135 -2.651 -31.922 1.00 0.00 C ATOM 2298 OE1 GLU A 146 -4.340 -2.745 -32.237 1.00 0.00 O ATOM 2299 OE2 GLU A 146 -2.273 -3.492 -32.254 1.00 0.00 O1- ATOM 0 H GLU A 146 -2.842 1.337 -30.255 1.00 0.00 H new ATOM 0 HA GLU A 146 -3.616 -0.299 -27.967 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -2.557 -2.316 -29.140 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -4.186 -1.884 -29.619 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -3.099 -0.547 -31.538 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.611 -1.377 -31.129 1.00 0.00 H new ATOM 2306 N VAL A 147 -1.293 -0.006 -27.196 1.00 0.00 N ATOM 2307 CA VAL A 147 0.059 0.215 -26.699 1.00 0.00 C ATOM 2308 C VAL A 147 0.899 -1.053 -26.805 1.00 0.00 C ATOM 2309 O VAL A 147 0.455 -2.139 -26.431 1.00 0.00 O ATOM 2310 CB VAL A 147 0.049 0.690 -25.234 1.00 0.00 C ATOM 2311 CG1 VAL A 147 1.447 1.093 -24.792 1.00 0.00 C ATOM 2312 CG2 VAL A 147 -0.928 1.842 -25.054 1.00 0.00 C ATOM 0 H VAL A 147 -1.989 -0.168 -26.468 1.00 0.00 H new ATOM 0 HA VAL A 147 0.501 0.993 -27.322 1.00 0.00 H new ATOM 0 HB VAL A 147 -0.280 -0.138 -24.605 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.419 1.426 -23.754 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.117 0.238 -24.881 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.808 1.905 -25.423 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -0.922 2.165 -24.013 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -0.632 2.674 -25.694 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -1.931 1.514 -25.326 1.00 0.00 H new ATOM 2322 N VAL A 148 2.117 -0.907 -27.318 1.00 0.00 N ATOM 2323 CA VAL A 148 3.023 -2.038 -27.475 1.00 0.00 C ATOM 2324 C VAL A 148 3.889 -2.222 -26.234 1.00 0.00 C ATOM 2325 O VAL A 148 4.004 -3.326 -25.702 1.00 0.00 O ATOM 2326 CB VAL A 148 3.935 -1.860 -28.704 1.00 0.00 C ATOM 2327 CG1 VAL A 148 4.751 -3.120 -28.952 1.00 0.00 C ATOM 2328 CG2 VAL A 148 3.113 -1.498 -29.931 1.00 0.00 C ATOM 0 H VAL A 148 2.499 -0.015 -27.632 1.00 0.00 H new ATOM 0 HA VAL A 148 2.404 -2.924 -27.618 1.00 0.00 H new ATOM 0 HB VAL A 148 4.627 -1.042 -28.504 1.00 0.00 H new ATOM 0 HG11 VAL A 148 5.389 -2.975 -29.824 1.00 0.00 H new ATOM 0 HG12 VAL A 148 5.371 -3.330 -28.080 1.00 0.00 H new ATOM 0 HG13 VAL A 148 4.079 -3.960 -29.130 1.00 0.00 H new ATOM 0 HG21 VAL A 148 3.774 -1.376 -30.789 1.00 0.00 H new ATOM 0 HG22 VAL A 148 2.395 -2.293 -30.136 1.00 0.00 H new ATOM 0 HG23 VAL A 148 2.579 -0.565 -29.749 1.00 0.00 H new ATOM 2338 N HIS A 149 4.495 -1.131 -25.777 1.00 0.00 N ATOM 2339 CA HIS A 149 5.350 -1.169 -24.597 1.00 0.00 C ATOM 2340 C HIS A 149 5.659 0.243 -24.108 1.00 0.00 C ATOM 2341 O HIS A 149 6.107 1.092 -24.878 1.00 0.00 O ATOM 2342 CB HIS A 149 6.652 -1.911 -24.906 1.00 0.00 C ATOM 2343 CG HIS A 149 7.480 -1.251 -25.964 1.00 0.00 C ATOM 2344 ND1 HIS A 149 8.859 -1.274 -25.964 1.00 0.00 N ATOM 2345 CD2 HIS A 149 7.118 -0.547 -27.063 1.00 0.00 C ATOM 2346 CE1 HIS A 149 9.309 -0.612 -27.015 1.00 0.00 C ATOM 2347 NE2 HIS A 149 8.273 -0.162 -27.698 1.00 0.00 N ATOM 0 H HIS A 149 4.410 -0.210 -26.206 1.00 0.00 H new ATOM 0 HA HIS A 149 4.817 -1.701 -23.809 1.00 0.00 H new ATOM 0 HB2 HIS A 149 7.241 -1.991 -23.992 1.00 0.00 H new ATOM 0 HB3 HIS A 149 6.415 -2.927 -25.222 1.00 0.00 H new ATOM 0 HD1 HIS A 149 9.441 -1.731 -25.262 1.00 0.00 H new ATOM 0 HD2 HIS A 149 6.109 -0.329 -27.381 1.00 0.00 H new ATOM 0 HE1 HIS A 149 10.348 -0.464 -27.272 1.00 0.00 H new ATOM 2356 N ALA A 150 5.413 0.487 -22.825 1.00 0.00 N ATOM 2357 CA ALA A 150 5.663 1.797 -22.236 1.00 0.00 C ATOM 2358 C ALA A 150 6.708 1.714 -21.129 1.00 0.00 C ATOM 2359 O ALA A 150 6.791 0.717 -20.413 1.00 0.00 O ATOM 2360 CB ALA A 150 4.369 2.387 -21.698 1.00 0.00 C ATOM 0 H ALA A 150 5.041 -0.205 -22.174 1.00 0.00 H new ATOM 0 HA ALA A 150 6.053 2.450 -23.017 1.00 0.00 H new ATOM 0 HB1 ALA A 150 4.569 3.365 -21.261 1.00 0.00 H new ATOM 0 HB2 ALA A 150 3.652 2.493 -22.512 1.00 0.00 H new ATOM 0 HB3 ALA A 150 3.957 1.726 -20.935 1.00 0.00 H new ATOM 2366 N ASN A 151 7.502 2.771 -20.995 1.00 0.00 N ATOM 2367 CA ASN A 151 8.540 2.821 -19.973 1.00 0.00 C ATOM 2368 C ASN A 151 8.755 4.252 -19.485 1.00 0.00 C ATOM 2369 O ASN A 151 8.759 5.194 -20.277 1.00 0.00 O ATOM 2370 CB ASN A 151 9.849 2.228 -20.515 1.00 0.00 C ATOM 2371 CG ASN A 151 10.704 3.243 -21.251 1.00 0.00 C ATOM 2372 OD1 ASN A 151 10.642 3.354 -22.476 1.00 0.00 O ATOM 2373 ND2 ASN A 151 11.509 3.988 -20.503 1.00 0.00 N ATOM 0 H ASN A 151 7.446 3.604 -21.581 1.00 0.00 H new ATOM 0 HA ASN A 151 8.215 2.223 -19.122 1.00 0.00 H new ATOM 0 HB2 ASN A 151 10.422 1.812 -19.687 1.00 0.00 H new ATOM 0 HB3 ASN A 151 9.616 1.403 -21.188 1.00 0.00 H new ATOM 0 HD21 ASN A 151 12.109 4.687 -20.940 1.00 0.00 H new ATOM 0 HD22 ASN A 151 11.527 3.861 -19.491 1.00 0.00 H new ATOM 2380 N ALA A 152 8.928 4.406 -18.177 1.00 0.00 N ATOM 2381 CA ALA A 152 9.136 5.719 -17.584 1.00 0.00 C ATOM 2382 C ALA A 152 10.604 5.947 -17.244 1.00 0.00 C ATOM 2383 O ALA A 152 11.373 4.998 -17.089 1.00 0.00 O ATOM 2384 CB ALA A 152 8.278 5.872 -16.338 1.00 0.00 C ATOM 0 H ALA A 152 8.928 3.636 -17.508 1.00 0.00 H new ATOM 0 HA ALA A 152 8.841 6.470 -18.316 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.441 6.858 -15.902 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.227 5.763 -16.604 1.00 0.00 H new ATOM 0 HB3 ALA A 152 8.550 5.105 -15.613 1.00 0.00 H new ATOM 2390 N GLU A 153 10.985 7.215 -17.127 1.00 0.00 N ATOM 2391 CA GLU A 153 12.360 7.576 -16.803 1.00 0.00 C ATOM 2392 C GLU A 153 12.398 8.835 -15.943 1.00 0.00 C ATOM 2393 O GLU A 153 11.509 9.682 -16.026 1.00 0.00 O ATOM 2394 CB GLU A 153 13.169 7.792 -18.083 1.00 0.00 C ATOM 2395 CG GLU A 153 14.594 7.270 -17.997 1.00 0.00 C ATOM 2396 CD GLU A 153 15.358 7.445 -19.295 1.00 0.00 C ATOM 2397 OE1 GLU A 153 14.799 7.114 -20.362 1.00 0.00 O ATOM 2398 OE2 GLU A 153 16.515 7.913 -19.245 1.00 0.00 O1- ATOM 0 H GLU A 153 10.359 8.011 -17.252 1.00 0.00 H new ATOM 0 HA GLU A 153 12.804 6.756 -16.238 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.660 7.300 -18.912 1.00 0.00 H new ATOM 0 HB3 GLU A 153 13.194 8.857 -18.312 1.00 0.00 H new ATOM 0 HG2 GLU A 153 15.120 7.791 -17.197 1.00 0.00 H new ATOM 0 HG3 GLU A 153 14.575 6.213 -17.731 1.00 0.00 H new ATOM 2405 N VAL A 154 13.432 8.951 -15.116 1.00 0.00 N ATOM 2406 CA VAL A 154 13.582 10.106 -14.240 1.00 0.00 C ATOM 2407 C VAL A 154 14.659 11.053 -14.757 1.00 0.00 C ATOM 2408 O VAL A 154 15.840 10.709 -14.790 1.00 0.00 O ATOM 2409 CB VAL A 154 13.940 9.681 -12.804 1.00 0.00 C ATOM 2410 CG1 VAL A 154 13.860 10.870 -11.859 1.00 0.00 C ATOM 2411 CG2 VAL A 154 13.028 8.556 -12.336 1.00 0.00 C ATOM 0 H VAL A 154 14.177 8.260 -15.035 1.00 0.00 H new ATOM 0 HA VAL A 154 12.621 10.620 -14.231 1.00 0.00 H new ATOM 0 HB VAL A 154 14.965 9.312 -12.800 1.00 0.00 H new ATOM 0 HG11 VAL A 154 14.116 10.550 -10.849 1.00 0.00 H new ATOM 0 HG12 VAL A 154 14.559 11.641 -12.184 1.00 0.00 H new ATOM 0 HG13 VAL A 154 12.847 11.273 -11.866 1.00 0.00 H new ATOM 0 HG21 VAL A 154 13.296 8.269 -11.319 1.00 0.00 H new ATOM 0 HG22 VAL A 154 11.992 8.895 -12.356 1.00 0.00 H new ATOM 0 HG23 VAL A 154 13.141 7.697 -12.997 1.00 0.00 H new ATOM 2421 N VAL A 155 14.243 12.250 -15.155 1.00 0.00 N ATOM 2422 CA VAL A 155 15.171 13.251 -15.665 1.00 0.00 C ATOM 2423 C VAL A 155 15.751 14.082 -14.518 1.00 0.00 C ATOM 2424 O VAL A 155 15.450 13.833 -13.351 1.00 0.00 O ATOM 2425 CB VAL A 155 14.490 14.163 -16.717 1.00 0.00 C ATOM 2426 CG1 VAL A 155 13.733 15.314 -16.065 1.00 0.00 C ATOM 2427 CG2 VAL A 155 15.512 14.684 -17.716 1.00 0.00 C ATOM 0 H VAL A 155 13.268 12.550 -15.134 1.00 0.00 H new ATOM 0 HA VAL A 155 15.990 12.729 -16.159 1.00 0.00 H new ATOM 0 HB VAL A 155 13.759 13.557 -17.252 1.00 0.00 H new ATOM 0 HG11 VAL A 155 13.271 15.929 -16.837 1.00 0.00 H new ATOM 0 HG12 VAL A 155 12.960 14.915 -15.408 1.00 0.00 H new ATOM 0 HG13 VAL A 155 14.426 15.922 -15.483 1.00 0.00 H new ATOM 0 HG21 VAL A 155 15.014 15.322 -18.446 1.00 0.00 H new ATOM 0 HG22 VAL A 155 16.274 15.260 -17.190 1.00 0.00 H new ATOM 0 HG23 VAL A 155 15.981 13.844 -18.228 1.00 0.00 H new ATOM 2437 N ASP A 156 16.592 15.057 -14.850 1.00 0.00 N ATOM 2438 CA ASP A 156 17.218 15.906 -13.840 1.00 0.00 C ATOM 2439 C ASP A 156 16.183 16.502 -12.887 1.00 0.00 C ATOM 2440 O ASP A 156 16.445 16.658 -11.695 1.00 0.00 O ATOM 2441 CB ASP A 156 18.012 17.028 -14.511 1.00 0.00 C ATOM 2442 CG ASP A 156 19.215 17.455 -13.693 1.00 0.00 C ATOM 2443 OD1 ASP A 156 19.201 17.243 -12.462 1.00 0.00 O ATOM 2444 OD2 ASP A 156 20.171 18.000 -14.284 1.00 0.00 O1- ATOM 0 H ASP A 156 16.856 15.279 -15.810 1.00 0.00 H new ATOM 0 HA ASP A 156 17.894 15.281 -13.256 1.00 0.00 H new ATOM 0 HB2 ASP A 156 18.344 16.696 -15.495 1.00 0.00 H new ATOM 0 HB3 ASP A 156 17.360 17.887 -14.668 1.00 0.00 H new ATOM 2449 N THR A 157 15.009 16.833 -13.415 1.00 0.00 N ATOM 2450 CA THR A 157 13.945 17.411 -12.599 1.00 0.00 C ATOM 2451 C THR A 157 12.607 16.722 -12.862 1.00 0.00 C ATOM 2452 O THR A 157 11.980 16.194 -11.943 1.00 0.00 O ATOM 2453 CB THR A 157 13.823 18.914 -12.866 1.00 0.00 C ATOM 2454 OG1 THR A 157 12.593 19.413 -12.371 1.00 0.00 O ATOM 2455 CG2 THR A 157 13.907 19.277 -14.333 1.00 0.00 C ATOM 0 H THR A 157 14.770 16.712 -14.399 1.00 0.00 H new ATOM 0 HA THR A 157 14.207 17.255 -11.552 1.00 0.00 H new ATOM 0 HB THR A 157 14.671 19.365 -12.351 1.00 0.00 H new ATOM 0 HG1 THR A 157 12.535 20.375 -12.550 1.00 0.00 H new ATOM 0 HG21 THR A 157 13.813 20.357 -14.447 1.00 0.00 H new ATOM 0 HG22 THR A 157 14.867 18.952 -14.734 1.00 0.00 H new ATOM 0 HG23 THR A 157 13.101 18.784 -14.877 1.00 0.00 H new ATOM 2463 N SER A 158 12.172 16.735 -14.117 1.00 0.00 N ATOM 2464 CA SER A 158 10.905 16.117 -14.496 1.00 0.00 C ATOM 2465 C SER A 158 11.060 14.606 -14.676 1.00 0.00 C ATOM 2466 O SER A 158 12.012 14.006 -14.176 1.00 0.00 O ATOM 2467 CB SER A 158 10.377 16.752 -15.786 1.00 0.00 C ATOM 2468 OG SER A 158 8.996 17.050 -15.680 1.00 0.00 O ATOM 0 H SER A 158 12.678 17.167 -14.890 1.00 0.00 H new ATOM 0 HA SER A 158 10.189 16.289 -13.693 1.00 0.00 H new ATOM 0 HB2 SER A 158 10.934 17.664 -16.000 1.00 0.00 H new ATOM 0 HB3 SER A 158 10.543 16.074 -16.623 1.00 0.00 H new ATOM 0 HG SER A 158 8.592 16.487 -14.987 1.00 0.00 H new ATOM 2474 N ALA A 159 10.118 13.996 -15.391 1.00 0.00 N ATOM 2475 CA ALA A 159 10.151 12.559 -15.635 1.00 0.00 C ATOM 2476 C ALA A 159 9.818 12.247 -17.091 1.00 0.00 C ATOM 2477 O ALA A 159 8.734 12.573 -17.572 1.00 0.00 O ATOM 2478 CB ALA A 159 9.184 11.842 -14.705 1.00 0.00 C ATOM 0 H ALA A 159 9.322 14.476 -15.811 1.00 0.00 H new ATOM 0 HA ALA A 159 11.161 12.202 -15.433 1.00 0.00 H new ATOM 0 HB1 ALA A 159 9.220 10.770 -14.899 1.00 0.00 H new ATOM 0 HB2 ALA A 159 9.466 12.033 -13.670 1.00 0.00 H new ATOM 0 HB3 ALA A 159 8.172 12.209 -14.879 1.00 0.00 H new ATOM 2484 N LYS A 160 10.759 11.619 -17.788 1.00 0.00 N ATOM 2485 CA LYS A 160 10.564 11.269 -19.190 1.00 0.00 C ATOM 2486 C LYS A 160 9.680 10.035 -19.330 1.00 0.00 C ATOM 2487 O LYS A 160 9.601 9.208 -18.421 1.00 0.00 O ATOM 2488 CB LYS A 160 11.913 11.022 -19.869 1.00 0.00 C ATOM 2489 CG LYS A 160 12.978 12.041 -19.498 1.00 0.00 C ATOM 2490 CD LYS A 160 14.177 11.958 -20.428 1.00 0.00 C ATOM 2491 CE LYS A 160 13.785 12.243 -21.869 1.00 0.00 C ATOM 2492 NZ LYS A 160 14.836 13.013 -22.589 1.00 0.00 N1+ ATOM 0 H LYS A 160 11.663 11.342 -17.405 1.00 0.00 H new ATOM 0 HA LYS A 160 10.065 12.106 -19.678 1.00 0.00 H new ATOM 0 HB2 LYS A 160 12.267 10.026 -19.603 1.00 0.00 H new ATOM 0 HB3 LYS A 160 11.773 11.032 -20.950 1.00 0.00 H new ATOM 0 HG2 LYS A 160 12.553 13.044 -19.539 1.00 0.00 H new ATOM 0 HG3 LYS A 160 13.301 11.873 -18.471 1.00 0.00 H new ATOM 0 HD2 LYS A 160 14.937 12.671 -20.109 1.00 0.00 H new ATOM 0 HD3 LYS A 160 14.623 10.966 -20.361 1.00 0.00 H new ATOM 0 HE2 LYS A 160 13.604 11.302 -22.389 1.00 0.00 H new ATOM 0 HE3 LYS A 160 12.849 12.802 -21.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 14.530 13.187 -23.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 14.991 13.922 -22.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 15.722 12.469 -22.595 1.00 0.00 H new ATOM 2506 N PHE A 161 9.017 9.918 -20.476 1.00 0.00 N ATOM 2507 CA PHE A 161 8.137 8.786 -20.741 1.00 0.00 C ATOM 2508 C PHE A 161 8.378 8.231 -22.142 1.00 0.00 C ATOM 2509 O PHE A 161 8.055 8.875 -23.139 1.00 0.00 O ATOM 2510 CB PHE A 161 6.673 9.204 -20.590 1.00 0.00 C ATOM 2511 CG PHE A 161 5.983 8.571 -19.416 1.00 0.00 C ATOM 2512 CD1 PHE A 161 6.134 7.219 -19.154 1.00 0.00 C ATOM 2513 CD2 PHE A 161 5.184 9.329 -18.577 1.00 0.00 C ATOM 2514 CE1 PHE A 161 5.500 6.635 -18.074 1.00 0.00 C ATOM 2515 CE2 PHE A 161 4.546 8.750 -17.496 1.00 0.00 C ATOM 2516 CZ PHE A 161 4.704 7.402 -17.244 1.00 0.00 C ATOM 0 H PHE A 161 9.073 10.595 -21.237 1.00 0.00 H new ATOM 0 HA PHE A 161 8.360 8.005 -20.015 1.00 0.00 H new ATOM 0 HB2 PHE A 161 6.622 10.288 -20.489 1.00 0.00 H new ATOM 0 HB3 PHE A 161 6.134 8.943 -21.501 1.00 0.00 H new ATOM 0 HD1 PHE A 161 6.754 6.615 -19.801 1.00 0.00 H new ATOM 0 HD2 PHE A 161 5.058 10.384 -18.769 1.00 0.00 H new ATOM 0 HE1 PHE A 161 5.626 5.580 -17.879 1.00 0.00 H new ATOM 0 HE2 PHE A 161 3.925 9.352 -16.849 1.00 0.00 H new ATOM 0 HZ PHE A 161 4.207 6.947 -16.400 1.00 0.00 H new ATOM 2526 N ASP A 162 8.947 7.032 -22.209 1.00 0.00 N ATOM 2527 CA ASP A 162 9.228 6.392 -23.489 1.00 0.00 C ATOM 2528 C ASP A 162 8.267 5.235 -23.736 1.00 0.00 C ATOM 2529 O ASP A 162 8.389 4.173 -23.126 1.00 0.00 O ATOM 2530 CB ASP A 162 10.672 5.890 -23.526 1.00 0.00 C ATOM 2531 CG ASP A 162 11.638 6.944 -24.030 1.00 0.00 C ATOM 2532 OD1 ASP A 162 11.322 7.602 -25.044 1.00 0.00 O ATOM 2533 OD2 ASP A 162 12.710 7.111 -23.412 1.00 0.00 O1- ATOM 0 H ASP A 162 9.222 6.485 -21.393 1.00 0.00 H new ATOM 0 HA ASP A 162 9.090 7.132 -24.278 1.00 0.00 H new ATOM 0 HB2 ASP A 162 10.970 5.576 -22.526 1.00 0.00 H new ATOM 0 HB3 ASP A 162 10.732 5.010 -24.167 1.00 0.00 H new ATOM 2538 N MET A 163 7.307 5.447 -24.631 1.00 0.00 N ATOM 2539 CA MET A 163 6.323 4.420 -24.952 1.00 0.00 C ATOM 2540 C MET A 163 6.167 4.262 -26.460 1.00 0.00 C ATOM 2541 O MET A 163 6.722 5.037 -27.239 1.00 0.00 O ATOM 2542 CB MET A 163 4.969 4.762 -24.323 1.00 0.00 C ATOM 2543 CG MET A 163 5.077 5.444 -22.968 1.00 0.00 C ATOM 2544 SD MET A 163 3.521 5.429 -22.057 1.00 0.00 S ATOM 2545 CE MET A 163 3.274 7.181 -21.780 1.00 0.00 C ATOM 0 H MET A 163 7.190 6.320 -25.146 1.00 0.00 H new ATOM 0 HA MET A 163 6.680 3.476 -24.541 1.00 0.00 H new ATOM 0 HB2 MET A 163 4.416 5.411 -25.003 1.00 0.00 H new ATOM 0 HB3 MET A 163 4.388 3.846 -24.213 1.00 0.00 H new ATOM 0 HG2 MET A 163 5.845 4.947 -22.376 1.00 0.00 H new ATOM 0 HG3 MET A 163 5.401 6.475 -23.109 1.00 0.00 H new ATOM 0 HE1 MET A 163 3.271 7.383 -20.709 1.00 0.00 H new ATOM 0 HE2 MET A 163 4.081 7.741 -22.252 1.00 0.00 H new ATOM 0 HE3 MET A 163 2.320 7.486 -22.210 1.00 0.00 H new ATOM 2555 N LEU A 164 5.403 3.252 -26.864 1.00 0.00 N ATOM 2556 CA LEU A 164 5.165 2.987 -28.277 1.00 0.00 C ATOM 2557 C LEU A 164 3.802 2.334 -28.481 1.00 0.00 C ATOM 2558 O LEU A 164 3.512 1.287 -27.902 1.00 0.00 O ATOM 2559 CB LEU A 164 6.265 2.087 -28.844 1.00 0.00 C ATOM 2560 CG LEU A 164 6.670 2.395 -30.286 1.00 0.00 C ATOM 2561 CD1 LEU A 164 7.838 1.519 -30.712 1.00 0.00 C ATOM 2562 CD2 LEU A 164 5.488 2.203 -31.224 1.00 0.00 C ATOM 0 H LEU A 164 4.937 2.602 -26.230 1.00 0.00 H new ATOM 0 HA LEU A 164 5.178 3.939 -28.808 1.00 0.00 H new ATOM 0 HB2 LEU A 164 7.147 2.171 -28.209 1.00 0.00 H new ATOM 0 HB3 LEU A 164 5.931 1.051 -28.789 1.00 0.00 H new ATOM 0 HG LEU A 164 6.986 3.437 -30.339 1.00 0.00 H new ATOM 0 HD11 LEU A 164 8.112 1.753 -31.741 1.00 0.00 H new ATOM 0 HD12 LEU A 164 8.690 1.706 -30.058 1.00 0.00 H new ATOM 0 HD13 LEU A 164 7.550 0.470 -30.642 1.00 0.00 H new ATOM 0 HD21 LEU A 164 5.794 2.427 -32.246 1.00 0.00 H new ATOM 0 HD22 LEU A 164 5.142 1.171 -31.166 1.00 0.00 H new ATOM 0 HD23 LEU A 164 4.680 2.874 -30.933 1.00 0.00 H new ATOM 2574 N LEU A 165 2.969 2.958 -29.305 1.00 0.00 N ATOM 2575 CA LEU A 165 1.636 2.436 -29.581 1.00 0.00 C ATOM 2576 C LEU A 165 1.273 2.612 -31.052 1.00 0.00 C ATOM 2577 O LEU A 165 1.775 3.514 -31.722 1.00 0.00 O ATOM 2578 CB LEU A 165 0.599 3.134 -28.698 1.00 0.00 C ATOM 2579 CG LEU A 165 0.561 4.659 -28.824 1.00 0.00 C ATOM 2580 CD1 LEU A 165 -0.640 5.099 -29.649 1.00 0.00 C ATOM 2581 CD2 LEU A 165 0.531 5.307 -27.447 1.00 0.00 C ATOM 0 H LEU A 165 3.193 3.825 -29.793 1.00 0.00 H new ATOM 0 HA LEU A 165 1.637 1.370 -29.354 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -0.388 2.740 -28.942 1.00 0.00 H new ATOM 0 HB3 LEU A 165 0.797 2.876 -27.658 1.00 0.00 H new ATOM 0 HG LEU A 165 1.466 4.984 -29.338 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -0.649 6.186 -29.727 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -0.575 4.664 -30.646 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -1.557 4.762 -29.165 1.00 0.00 H new ATOM 0 HD21 LEU A 165 0.504 6.391 -27.556 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -0.356 4.974 -26.908 1.00 0.00 H new ATOM 0 HD23 LEU A 165 1.423 5.020 -26.890 1.00 0.00 H new ATOM 2593 N LYS A 166 0.398 1.743 -31.547 1.00 0.00 N ATOM 2594 CA LYS A 166 -0.033 1.800 -32.938 1.00 0.00 C ATOM 2595 C LYS A 166 -1.232 2.729 -33.099 1.00 0.00 C ATOM 2596 O LYS A 166 -2.127 2.756 -32.254 1.00 0.00 O ATOM 2597 CB LYS A 166 -0.388 0.400 -33.441 1.00 0.00 C ATOM 2598 CG LYS A 166 -0.696 0.347 -34.928 1.00 0.00 C ATOM 2599 CD LYS A 166 -1.236 -1.014 -35.337 1.00 0.00 C ATOM 2600 CE LYS A 166 -0.115 -1.966 -35.721 1.00 0.00 C ATOM 2601 NZ LYS A 166 -0.632 -3.312 -36.092 1.00 0.00 N1+ ATOM 0 H LYS A 166 -0.027 0.991 -31.005 1.00 0.00 H new ATOM 0 HA LYS A 166 0.792 2.194 -33.532 1.00 0.00 H new ATOM 0 HB2 LYS A 166 0.440 -0.275 -33.226 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -1.251 0.032 -32.886 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -1.424 1.119 -35.177 1.00 0.00 H new ATOM 0 HG3 LYS A 166 0.208 0.567 -35.496 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -1.811 -1.440 -34.515 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -1.920 -0.898 -36.178 1.00 0.00 H new ATOM 0 HE2 LYS A 166 0.445 -1.549 -36.558 1.00 0.00 H new ATOM 0 HE3 LYS A 166 0.581 -2.062 -34.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 0.164 -3.931 -36.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -1.145 -3.722 -35.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -1.277 -3.225 -36.903 1.00 0.00 H new ATOM 2615 N VAL A 167 -1.244 3.488 -34.189 1.00 0.00 N ATOM 2616 CA VAL A 167 -2.333 4.418 -34.462 1.00 0.00 C ATOM 2617 C VAL A 167 -3.237 3.895 -35.572 1.00 0.00 C ATOM 2618 O VAL A 167 -2.761 3.373 -36.580 1.00 0.00 O ATOM 2619 CB VAL A 167 -1.800 5.806 -34.862 1.00 0.00 C ATOM 2620 CG1 VAL A 167 -1.279 6.551 -33.642 1.00 0.00 C ATOM 2621 CG2 VAL A 167 -0.716 5.678 -35.921 1.00 0.00 C ATOM 0 H VAL A 167 -0.511 3.477 -34.898 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.908 4.510 -33.541 1.00 0.00 H new ATOM 0 HB VAL A 167 -2.623 6.382 -35.286 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -0.907 7.530 -33.945 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -2.086 6.677 -32.921 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -0.470 5.981 -33.185 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -0.352 6.669 -36.191 1.00 0.00 H new ATOM 0 HG22 VAL A 167 0.108 5.083 -35.528 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -1.127 5.190 -36.805 1.00 0.00 H new ATOM 2631 N LYS A 168 -4.545 4.038 -35.381 1.00 0.00 N ATOM 2632 CA LYS A 168 -5.516 3.580 -36.367 1.00 0.00 C ATOM 2633 C LYS A 168 -6.215 4.762 -37.033 1.00 0.00 C ATOM 2634 O LYS A 168 -6.494 5.774 -36.389 1.00 0.00 O ATOM 2635 CB LYS A 168 -6.551 2.665 -35.709 1.00 0.00 C ATOM 2636 CG LYS A 168 -6.197 1.189 -35.793 1.00 0.00 C ATOM 2637 CD LYS A 168 -4.823 0.910 -35.205 1.00 0.00 C ATOM 2638 CE LYS A 168 -4.808 -0.388 -34.414 1.00 0.00 C ATOM 2639 NZ LYS A 168 -4.715 -1.580 -35.303 1.00 0.00 N1+ ATOM 0 H LYS A 168 -4.956 4.467 -34.552 1.00 0.00 H new ATOM 0 HA LYS A 168 -4.981 3.019 -37.133 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -6.658 2.946 -34.661 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -7.519 2.826 -36.183 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -6.947 0.603 -35.261 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -6.220 0.867 -36.834 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -4.087 0.857 -36.007 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -4.529 1.736 -34.557 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -3.964 -0.383 -33.724 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -5.713 -0.455 -33.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -4.405 -2.403 -34.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -5.647 -1.775 -35.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -4.028 -1.395 -36.062 1.00 0.00 H new ATOM 2653 N ARG A 169 -6.493 4.626 -38.325 1.00 0.00 N ATOM 2654 CA ARG A 169 -7.159 5.682 -39.079 1.00 0.00 C ATOM 2655 C ARG A 169 -7.793 5.125 -40.349 1.00 0.00 C ATOM 2656 O ARG A 169 -7.145 5.040 -41.393 1.00 0.00 O ATOM 2657 CB ARG A 169 -6.164 6.788 -39.435 1.00 0.00 C ATOM 2658 CG ARG A 169 -6.809 8.152 -39.615 1.00 0.00 C ATOM 2659 CD ARG A 169 -5.919 9.089 -40.416 1.00 0.00 C ATOM 2660 NE ARG A 169 -6.300 10.488 -40.242 1.00 0.00 N ATOM 2661 CZ ARG A 169 -5.882 11.474 -41.033 1.00 0.00 C ATOM 2662 NH1 ARG A 169 -5.070 11.218 -42.052 1.00 0.00 N1+ ATOM 2663 NH2 ARG A 169 -6.276 12.719 -40.805 1.00 0.00 N ATOM 0 H ARG A 169 -6.268 3.795 -38.872 1.00 0.00 H new ATOM 0 HA ARG A 169 -7.948 6.100 -38.453 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -5.410 6.853 -38.651 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -5.645 6.516 -40.354 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -7.768 8.038 -40.121 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -7.014 8.590 -38.638 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -4.882 8.955 -40.109 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -5.975 8.827 -41.473 1.00 0.00 H new ATOM 0 HE ARG A 169 -6.923 10.724 -39.469 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -4.763 10.262 -42.232 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -4.753 11.977 -42.655 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -6.899 12.922 -40.024 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -5.956 13.474 -41.411 1.00 0.00 H new ATOM 2677 N GLY A 170 -9.062 4.746 -40.254 1.00 0.00 N ATOM 2678 CA GLY A 170 -9.762 4.201 -41.403 1.00 0.00 C ATOM 2679 C GLY A 170 -9.375 2.764 -41.696 1.00 0.00 C ATOM 2680 O GLY A 170 -9.593 2.270 -42.802 1.00 0.00 O ATOM 0 H GLY A 170 -9.619 4.806 -39.402 1.00 0.00 H new ATOM 0 HA2 GLY A 170 -10.837 4.255 -41.228 1.00 0.00 H new ATOM 0 HA3 GLY A 170 -9.550 4.816 -42.278 1.00 0.00 H new ATOM 2684 N GLY A 171 -8.802 2.089 -40.703 1.00 0.00 N ATOM 2685 CA GLY A 171 -8.398 0.707 -40.884 1.00 0.00 C ATOM 2686 C GLY A 171 -6.925 0.565 -41.214 1.00 0.00 C ATOM 2687 O GLY A 171 -6.514 -0.414 -41.838 1.00 0.00 O ATOM 0 H GLY A 171 -8.611 2.474 -39.778 1.00 0.00 H new ATOM 0 HA2 GLY A 171 -8.618 0.147 -39.975 1.00 0.00 H new ATOM 0 HA3 GLY A 171 -8.990 0.262 -41.684 1.00 0.00 H new ATOM 2691 N LYS A 172 -6.126 1.541 -40.795 1.00 0.00 N ATOM 2692 CA LYS A 172 -4.690 1.515 -41.051 1.00 0.00 C ATOM 2693 C LYS A 172 -3.924 1.094 -39.800 1.00 0.00 C ATOM 2694 O LYS A 172 -4.514 0.881 -38.741 1.00 0.00 O ATOM 2695 CB LYS A 172 -4.208 2.888 -41.529 1.00 0.00 C ATOM 2696 CG LYS A 172 -4.161 3.942 -40.430 1.00 0.00 C ATOM 2697 CD LYS A 172 -2.769 4.535 -40.284 1.00 0.00 C ATOM 2698 CE LYS A 172 -2.707 5.536 -39.141 1.00 0.00 C ATOM 2699 NZ LYS A 172 -1.841 6.702 -39.470 1.00 0.00 N1+ ATOM 0 H LYS A 172 -6.448 2.359 -40.277 1.00 0.00 H new ATOM 0 HA LYS A 172 -4.498 0.782 -41.835 1.00 0.00 H new ATOM 0 HB2 LYS A 172 -3.213 2.783 -41.961 1.00 0.00 H new ATOM 0 HB3 LYS A 172 -4.866 3.236 -42.325 1.00 0.00 H new ATOM 0 HG2 LYS A 172 -4.874 4.736 -40.655 1.00 0.00 H new ATOM 0 HG3 LYS A 172 -4.469 3.496 -39.484 1.00 0.00 H new ATOM 0 HD2 LYS A 172 -2.049 3.736 -40.109 1.00 0.00 H new ATOM 0 HD3 LYS A 172 -2.482 5.025 -41.214 1.00 0.00 H new ATOM 0 HE2 LYS A 172 -3.713 5.885 -38.909 1.00 0.00 H new ATOM 0 HE3 LYS A 172 -2.327 5.043 -38.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 172 -1.825 7.361 -38.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 172 -0.874 6.372 -39.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 172 -2.218 7.189 -40.308 1.00 0.00 H new ATOM 2713 N GLU A 173 -2.607 0.978 -39.930 1.00 0.00 N ATOM 2714 CA GLU A 173 -1.762 0.586 -38.809 1.00 0.00 C ATOM 2715 C GLU A 173 -0.347 1.128 -38.976 1.00 0.00 C ATOM 2716 O GLU A 173 0.331 0.830 -39.960 1.00 0.00 O ATOM 2717 CB GLU A 173 -1.726 -0.938 -38.679 1.00 0.00 C ATOM 2718 CG GLU A 173 -1.371 -1.650 -39.974 1.00 0.00 C ATOM 2719 CD GLU A 173 -2.035 -3.009 -40.093 1.00 0.00 C ATOM 2720 OE1 GLU A 173 -3.149 -3.174 -39.554 1.00 0.00 O1- ATOM 2721 OE2 GLU A 173 -1.439 -3.907 -40.725 1.00 0.00 O ATOM 0 H GLU A 173 -2.102 1.150 -40.800 1.00 0.00 H new ATOM 0 HA GLU A 173 -2.188 1.011 -37.900 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -1.001 -1.212 -37.913 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -2.700 -1.288 -38.336 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -1.668 -1.029 -40.819 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -0.289 -1.772 -40.033 1.00 0.00 H new ATOM 2728 N GLU A 174 0.094 1.925 -38.008 1.00 0.00 N ATOM 2729 CA GLU A 174 1.429 2.510 -38.048 1.00 0.00 C ATOM 2730 C GLU A 174 1.925 2.829 -36.641 1.00 0.00 C ATOM 2731 O GLU A 174 1.301 3.600 -35.912 1.00 0.00 O ATOM 2732 CB GLU A 174 1.428 3.779 -38.902 1.00 0.00 C ATOM 2733 CG GLU A 174 1.324 3.508 -40.394 1.00 0.00 C ATOM 2734 CD GLU A 174 2.091 4.518 -41.224 1.00 0.00 C ATOM 2735 OE1 GLU A 174 1.649 5.684 -41.297 1.00 0.00 O ATOM 2736 OE2 GLU A 174 3.134 4.144 -41.801 1.00 0.00 O1- ATOM 0 H GLU A 174 -0.454 2.180 -37.186 1.00 0.00 H new ATOM 0 HA GLU A 174 2.105 1.781 -38.495 1.00 0.00 H new ATOM 0 HB2 GLU A 174 0.594 4.411 -38.597 1.00 0.00 H new ATOM 0 HB3 GLU A 174 2.342 4.340 -38.706 1.00 0.00 H new ATOM 0 HG2 GLU A 174 1.702 2.508 -40.605 1.00 0.00 H new ATOM 0 HG3 GLU A 174 0.275 3.522 -40.690 1.00 0.00 H new ATOM 2743 N LYS A 175 3.052 2.232 -36.268 1.00 0.00 N ATOM 2744 CA LYS A 175 3.635 2.453 -34.949 1.00 0.00 C ATOM 2745 C LYS A 175 4.505 3.706 -34.944 1.00 0.00 C ATOM 2746 O LYS A 175 4.934 4.179 -35.996 1.00 0.00 O ATOM 2747 CB LYS A 175 4.463 1.237 -34.527 1.00 0.00 C ATOM 2748 CG LYS A 175 3.974 0.584 -33.244 1.00 0.00 C ATOM 2749 CD LYS A 175 2.916 -0.470 -33.525 1.00 0.00 C ATOM 2750 CE LYS A 175 3.522 -1.716 -34.150 1.00 0.00 C ATOM 2751 NZ LYS A 175 3.965 -2.695 -33.119 1.00 0.00 N1+ ATOM 0 H LYS A 175 3.580 1.591 -36.860 1.00 0.00 H new ATOM 0 HA LYS A 175 2.823 2.595 -34.236 1.00 0.00 H new ATOM 0 HB2 LYS A 175 4.446 0.500 -35.330 1.00 0.00 H new ATOM 0 HB3 LYS A 175 5.501 1.542 -34.397 1.00 0.00 H new ATOM 0 HG2 LYS A 175 4.815 0.127 -32.723 1.00 0.00 H new ATOM 0 HG3 LYS A 175 3.564 1.345 -32.580 1.00 0.00 H new ATOM 0 HD2 LYS A 175 2.411 -0.736 -32.597 1.00 0.00 H new ATOM 0 HD3 LYS A 175 2.159 -0.058 -34.193 1.00 0.00 H new ATOM 0 HE2 LYS A 175 2.789 -2.186 -34.806 1.00 0.00 H new ATOM 0 HE3 LYS A 175 4.372 -1.434 -34.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 4.341 -3.545 -33.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 4.707 -2.267 -32.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 3.156 -2.958 -32.520 1.00 0.00 H new ATOM 2765 N TYR A 176 4.763 4.239 -33.754 1.00 0.00 N ATOM 2766 CA TYR A 176 5.584 5.436 -33.619 1.00 0.00 C ATOM 2767 C TYR A 176 6.048 5.625 -32.176 1.00 0.00 C ATOM 2768 O TYR A 176 5.351 5.248 -31.234 1.00 0.00 O ATOM 2769 CB TYR A 176 4.808 6.669 -34.098 1.00 0.00 C ATOM 2770 CG TYR A 176 3.909 7.285 -33.046 1.00 0.00 C ATOM 2771 CD1 TYR A 176 2.683 6.714 -32.729 1.00 0.00 C ATOM 2772 CD2 TYR A 176 4.291 8.438 -32.371 1.00 0.00 C ATOM 2773 CE1 TYR A 176 1.863 7.275 -31.768 1.00 0.00 C ATOM 2774 CE2 TYR A 176 3.476 9.004 -31.410 1.00 0.00 C ATOM 2775 CZ TYR A 176 2.265 8.419 -31.112 1.00 0.00 C ATOM 2776 OH TYR A 176 1.452 8.981 -30.154 1.00 0.00 O ATOM 0 H TYR A 176 4.416 3.862 -32.872 1.00 0.00 H new ATOM 0 HA TYR A 176 6.469 5.313 -34.243 1.00 0.00 H new ATOM 0 HB2 TYR A 176 5.519 7.422 -34.438 1.00 0.00 H new ATOM 0 HB3 TYR A 176 4.202 6.390 -34.960 1.00 0.00 H new ATOM 0 HD1 TYR A 176 2.366 5.818 -33.241 1.00 0.00 H new ATOM 0 HD2 TYR A 176 5.240 8.899 -32.601 1.00 0.00 H new ATOM 0 HE1 TYR A 176 0.913 6.820 -31.532 1.00 0.00 H new ATOM 0 HE2 TYR A 176 3.787 9.901 -30.895 1.00 0.00 H new ATOM 0 HH TYR A 176 1.972 9.148 -29.340 1.00 0.00 H new ATOM 2786 N LYS A 177 7.228 6.214 -32.014 1.00 0.00 N ATOM 2787 CA LYS A 177 7.786 6.460 -30.690 1.00 0.00 C ATOM 2788 C LYS A 177 7.229 7.753 -30.103 1.00 0.00 C ATOM 2789 O LYS A 177 6.919 8.693 -30.835 1.00 0.00 O ATOM 2790 CB LYS A 177 9.314 6.539 -30.758 1.00 0.00 C ATOM 2791 CG LYS A 177 9.936 5.565 -31.746 1.00 0.00 C ATOM 2792 CD LYS A 177 9.548 4.129 -31.431 1.00 0.00 C ATOM 2793 CE LYS A 177 10.011 3.715 -30.043 1.00 0.00 C ATOM 2794 NZ LYS A 177 10.834 2.475 -30.078 1.00 0.00 N1+ ATOM 0 H LYS A 177 7.817 6.530 -32.785 1.00 0.00 H new ATOM 0 HA LYS A 177 7.502 5.629 -30.044 1.00 0.00 H new ATOM 0 HB2 LYS A 177 9.604 7.554 -31.031 1.00 0.00 H new ATOM 0 HB3 LYS A 177 9.723 6.346 -29.766 1.00 0.00 H new ATOM 0 HG2 LYS A 177 9.616 5.816 -32.757 1.00 0.00 H new ATOM 0 HG3 LYS A 177 11.021 5.664 -31.722 1.00 0.00 H new ATOM 0 HD2 LYS A 177 8.466 4.020 -31.502 1.00 0.00 H new ATOM 0 HD3 LYS A 177 9.984 3.462 -32.175 1.00 0.00 H new ATOM 0 HE2 LYS A 177 10.591 4.523 -29.598 1.00 0.00 H new ATOM 0 HE3 LYS A 177 9.143 3.556 -29.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 10.750 1.977 -29.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 10.498 1.857 -30.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 11.830 2.724 -30.246 1.00 0.00 H new ATOM 2808 N VAL A 178 7.105 7.795 -28.781 1.00 0.00 N ATOM 2809 CA VAL A 178 6.585 8.976 -28.104 1.00 0.00 C ATOM 2810 C VAL A 178 7.408 9.305 -26.862 1.00 0.00 C ATOM 2811 O VAL A 178 7.732 8.423 -26.067 1.00 0.00 O ATOM 2812 CB VAL A 178 5.108 8.792 -27.702 1.00 0.00 C ATOM 2813 CG1 VAL A 178 4.957 7.641 -26.719 1.00 0.00 C ATOM 2814 CG2 VAL A 178 4.548 10.080 -27.118 1.00 0.00 C ATOM 0 H VAL A 178 7.357 7.027 -28.159 1.00 0.00 H new ATOM 0 HA VAL A 178 6.657 9.803 -28.810 1.00 0.00 H new ATOM 0 HB VAL A 178 4.537 8.548 -28.598 1.00 0.00 H new ATOM 0 HG11 VAL A 178 3.907 7.529 -26.449 1.00 0.00 H new ATOM 0 HG12 VAL A 178 5.314 6.720 -27.180 1.00 0.00 H new ATOM 0 HG13 VAL A 178 5.542 7.849 -25.823 1.00 0.00 H new ATOM 0 HG21 VAL A 178 3.505 9.930 -26.840 1.00 0.00 H new ATOM 0 HG22 VAL A 178 5.122 10.359 -26.234 1.00 0.00 H new ATOM 0 HG23 VAL A 178 4.615 10.875 -27.860 1.00 0.00 H new ATOM 2824 N GLU A 179 7.740 10.582 -26.703 1.00 0.00 N ATOM 2825 CA GLU A 179 8.524 11.032 -25.559 1.00 0.00 C ATOM 2826 C GLU A 179 7.848 12.217 -24.875 1.00 0.00 C ATOM 2827 O GLU A 179 7.872 13.337 -25.384 1.00 0.00 O ATOM 2828 CB GLU A 179 9.937 11.418 -26.003 1.00 0.00 C ATOM 2829 CG GLU A 179 10.780 12.028 -24.894 1.00 0.00 C ATOM 2830 CD GLU A 179 12.244 12.144 -25.272 1.00 0.00 C ATOM 2831 OE1 GLU A 179 12.883 11.096 -25.501 1.00 0.00 O ATOM 2832 OE2 GLU A 179 12.751 13.283 -25.340 1.00 0.00 O1- ATOM 0 H GLU A 179 7.478 11.324 -27.352 1.00 0.00 H new ATOM 0 HA GLU A 179 8.590 10.211 -24.845 1.00 0.00 H new ATOM 0 HB2 GLU A 179 10.443 10.532 -26.386 1.00 0.00 H new ATOM 0 HB3 GLU A 179 9.868 12.128 -26.828 1.00 0.00 H new ATOM 0 HG2 GLU A 179 10.392 13.017 -24.650 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.688 11.418 -23.995 1.00 0.00 H new ATOM 2839 N VAL A 180 7.248 11.961 -23.718 1.00 0.00 N ATOM 2840 CA VAL A 180 6.565 13.004 -22.962 1.00 0.00 C ATOM 2841 C VAL A 180 7.148 13.136 -21.559 1.00 0.00 C ATOM 2842 O VAL A 180 7.622 12.160 -20.978 1.00 0.00 O ATOM 2843 CB VAL A 180 5.051 12.728 -22.862 1.00 0.00 C ATOM 2844 CG1 VAL A 180 4.787 11.433 -22.110 1.00 0.00 C ATOM 2845 CG2 VAL A 180 4.338 13.895 -22.195 1.00 0.00 C ATOM 0 H VAL A 180 7.221 11.039 -23.283 1.00 0.00 H new ATOM 0 HA VAL A 180 6.717 13.939 -23.502 1.00 0.00 H new ATOM 0 HB VAL A 180 4.656 12.618 -23.872 1.00 0.00 H new ATOM 0 HG11 VAL A 180 3.713 11.259 -22.052 1.00 0.00 H new ATOM 0 HG12 VAL A 180 5.261 10.604 -22.635 1.00 0.00 H new ATOM 0 HG13 VAL A 180 5.198 11.507 -21.103 1.00 0.00 H new ATOM 0 HG21 VAL A 180 3.271 13.682 -22.133 1.00 0.00 H new ATOM 0 HG22 VAL A 180 4.738 14.040 -21.191 1.00 0.00 H new ATOM 0 HG23 VAL A 180 4.494 14.800 -22.782 1.00 0.00 H new ATOM 2855 N HIS A 181 7.111 14.349 -21.020 1.00 0.00 N ATOM 2856 CA HIS A 181 7.636 14.608 -19.685 1.00 0.00 C ATOM 2857 C HIS A 181 6.509 14.657 -18.660 1.00 0.00 C ATOM 2858 O HIS A 181 5.372 14.998 -18.986 1.00 0.00 O ATOM 2859 CB HIS A 181 8.419 15.921 -19.661 1.00 0.00 C ATOM 2860 CG HIS A 181 9.879 15.753 -19.945 1.00 0.00 C ATOM 2861 ND1 HIS A 181 10.813 16.737 -19.695 1.00 0.00 N ATOM 2862 CD2 HIS A 181 10.567 14.707 -20.460 1.00 0.00 C ATOM 2863 CE1 HIS A 181 12.011 16.304 -20.045 1.00 0.00 C ATOM 2864 NE2 HIS A 181 11.889 15.075 -20.511 1.00 0.00 N ATOM 0 H HIS A 181 6.723 15.169 -21.487 1.00 0.00 H new ATOM 0 HA HIS A 181 8.309 13.791 -19.424 1.00 0.00 H new ATOM 0 HB2 HIS A 181 7.991 16.603 -20.395 1.00 0.00 H new ATOM 0 HB3 HIS A 181 8.299 16.388 -18.684 1.00 0.00 H new ATOM 0 HD1 HIS A 181 10.610 17.656 -19.301 1.00 0.00 H new ATOM 0 HD2 HIS A 181 10.153 13.760 -20.773 1.00 0.00 H new ATOM 0 HE1 HIS A 181 12.933 16.861 -19.964 1.00 0.00 H new ATOM 2873 N LYS A 182 6.831 14.308 -17.420 1.00 0.00 N ATOM 2874 CA LYS A 182 5.846 14.309 -16.345 1.00 0.00 C ATOM 2875 C LYS A 182 6.106 15.450 -15.367 1.00 0.00 C ATOM 2876 O LYS A 182 7.197 15.564 -14.808 1.00 0.00 O ATOM 2877 CB LYS A 182 5.869 12.970 -15.606 1.00 0.00 C ATOM 2878 CG LYS A 182 4.769 12.019 -16.044 1.00 0.00 C ATOM 2879 CD LYS A 182 3.528 12.169 -15.179 1.00 0.00 C ATOM 2880 CE LYS A 182 3.692 11.465 -13.842 1.00 0.00 C ATOM 2881 NZ LYS A 182 4.226 10.084 -14.003 1.00 0.00 N1+ ATOM 0 H LYS A 182 7.767 14.021 -17.134 1.00 0.00 H new ATOM 0 HA LYS A 182 4.861 14.455 -16.788 1.00 0.00 H new ATOM 0 HB2 LYS A 182 6.836 12.493 -15.765 1.00 0.00 H new ATOM 0 HB3 LYS A 182 5.776 13.153 -14.536 1.00 0.00 H new ATOM 0 HG2 LYS A 182 4.513 12.211 -17.086 1.00 0.00 H new ATOM 0 HG3 LYS A 182 5.131 10.992 -15.989 1.00 0.00 H new ATOM 0 HD2 LYS A 182 3.326 13.227 -15.012 1.00 0.00 H new ATOM 0 HD3 LYS A 182 2.666 11.758 -15.704 1.00 0.00 H new ATOM 0 HE2 LYS A 182 4.365 12.043 -13.208 1.00 0.00 H new ATOM 0 HE3 LYS A 182 2.729 11.425 -13.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 3.968 9.513 -13.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 3.822 9.653 -14.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 5.262 10.120 -14.090 1.00 0.00 H new ATOM 2895 N SER A 183 5.098 16.292 -15.166 1.00 0.00 N ATOM 2896 CA SER A 183 5.218 17.425 -14.256 1.00 0.00 C ATOM 2897 C SER A 183 4.054 17.457 -13.271 1.00 0.00 C ATOM 2898 O SER A 183 2.918 17.744 -13.646 1.00 0.00 O ATOM 2899 CB SER A 183 5.272 18.736 -15.043 1.00 0.00 C ATOM 2900 OG SER A 183 5.448 19.844 -14.177 1.00 0.00 O ATOM 0 H SER A 183 4.189 16.211 -15.621 1.00 0.00 H new ATOM 0 HA SER A 183 6.144 17.310 -13.693 1.00 0.00 H new ATOM 0 HB2 SER A 183 6.090 18.699 -15.762 1.00 0.00 H new ATOM 0 HB3 SER A 183 4.352 18.859 -15.614 1.00 0.00 H new ATOM 0 HG SER A 183 5.481 20.669 -14.704 1.00 0.00 H new ATOM 2964 N PHE A 189 0.623 16.900 -18.773 1.00 0.00 N ATOM 2965 CA PHE A 189 1.782 16.360 -19.474 1.00 0.00 C ATOM 2966 C PHE A 189 2.357 17.385 -20.446 1.00 0.00 C ATOM 2967 O PHE A 189 1.666 18.314 -20.865 1.00 0.00 O ATOM 2968 CB PHE A 189 1.399 15.086 -20.231 1.00 0.00 C ATOM 2969 CG PHE A 189 1.367 13.858 -19.367 1.00 0.00 C ATOM 2970 CD1 PHE A 189 0.220 13.515 -18.670 1.00 0.00 C ATOM 2971 CD2 PHE A 189 2.484 13.045 -19.255 1.00 0.00 C ATOM 2972 CE1 PHE A 189 0.187 12.385 -17.876 1.00 0.00 C ATOM 2973 CE2 PHE A 189 2.457 11.913 -18.461 1.00 0.00 C ATOM 2974 CZ PHE A 189 1.307 11.583 -17.771 1.00 0.00 C ATOM 0 HA PHE A 189 2.543 16.121 -18.732 1.00 0.00 H new ATOM 0 HB2 PHE A 189 0.418 15.225 -20.686 1.00 0.00 H new ATOM 0 HB3 PHE A 189 2.108 14.930 -21.044 1.00 0.00 H new ATOM 0 HD1 PHE A 189 -0.659 14.138 -18.748 1.00 0.00 H new ATOM 0 HD2 PHE A 189 3.385 13.298 -19.794 1.00 0.00 H new ATOM 0 HE1 PHE A 189 -0.714 12.129 -17.338 1.00 0.00 H new ATOM 0 HE2 PHE A 189 3.334 11.288 -18.381 1.00 0.00 H new ATOM 0 HZ PHE A 189 1.283 10.699 -17.150 1.00 0.00 H new ATOM 2984 N ASN A 190 3.623 17.205 -20.805 1.00 0.00 N ATOM 2985 CA ASN A 190 4.291 18.111 -21.735 1.00 0.00 C ATOM 2986 C ASN A 190 5.123 17.329 -22.746 1.00 0.00 C ATOM 2987 O ASN A 190 6.315 17.099 -22.542 1.00 0.00 O ATOM 2988 CB ASN A 190 5.180 19.115 -20.986 1.00 0.00 C ATOM 2989 CG ASN A 190 5.520 18.677 -19.573 1.00 0.00 C ATOM 2990 OD1 ASN A 190 5.970 17.437 -19.429 1.00 0.00 O flip ATOM 2991 ND2 ASN A 190 5.379 19.446 -18.622 1.00 0.00 N flip ATOM 0 H ASN A 190 4.208 16.441 -20.467 1.00 0.00 H new ATOM 0 HA ASN A 190 3.520 18.666 -22.269 1.00 0.00 H new ATOM 0 HB2 ASN A 190 6.104 19.261 -21.546 1.00 0.00 H new ATOM 0 HB3 ASN A 190 4.675 20.080 -20.948 1.00 0.00 H new ATOM 0 HD21 ASN A 190 5.030 20.392 -18.778 1.00 0.00 H new ATOM 0 HD22 ASN A 190 5.611 19.138 -17.678 1.00 0.00 H new ATOM 2998 N LEU A 191 4.482 16.922 -23.838 1.00 0.00 N ATOM 2999 CA LEU A 191 5.151 16.163 -24.891 1.00 0.00 C ATOM 3000 C LEU A 191 6.450 16.841 -25.319 1.00 0.00 C ATOM 3001 O LEU A 191 6.447 17.993 -25.754 1.00 0.00 O ATOM 3002 CB LEU A 191 4.223 16.013 -26.099 1.00 0.00 C ATOM 3003 CG LEU A 191 4.623 14.930 -27.102 1.00 0.00 C ATOM 3004 CD1 LEU A 191 5.926 15.295 -27.796 1.00 0.00 C ATOM 3005 CD2 LEU A 191 4.746 13.581 -26.409 1.00 0.00 C ATOM 0 H LEU A 191 3.495 17.106 -24.017 1.00 0.00 H new ATOM 0 HA LEU A 191 5.394 15.177 -24.494 1.00 0.00 H new ATOM 0 HB2 LEU A 191 3.217 15.797 -25.739 1.00 0.00 H new ATOM 0 HB3 LEU A 191 4.176 16.969 -26.621 1.00 0.00 H new ATOM 0 HG LEU A 191 3.842 14.859 -27.859 1.00 0.00 H new ATOM 0 HD11 LEU A 191 6.192 14.511 -28.505 1.00 0.00 H new ATOM 0 HD12 LEU A 191 5.803 16.239 -28.327 1.00 0.00 H new ATOM 0 HD13 LEU A 191 6.718 15.397 -27.054 1.00 0.00 H new ATOM 0 HD21 LEU A 191 5.031 12.822 -27.138 1.00 0.00 H new ATOM 0 HD22 LEU A 191 5.506 13.640 -25.630 1.00 0.00 H new ATOM 0 HD23 LEU A 191 3.789 13.313 -25.962 1.00 0.00 H new ATOM 3017 N LYS A 192 7.559 16.118 -25.197 1.00 0.00 N ATOM 3018 CA LYS A 192 8.862 16.651 -25.577 1.00 0.00 C ATOM 3019 C LYS A 192 9.117 16.448 -27.068 1.00 0.00 C ATOM 3020 O LYS A 192 9.137 17.407 -27.840 1.00 0.00 O ATOM 3021 CB LYS A 192 9.970 15.982 -24.762 1.00 0.00 C ATOM 3022 CG LYS A 192 9.769 16.085 -23.259 1.00 0.00 C ATOM 3023 CD LYS A 192 9.615 17.530 -22.813 1.00 0.00 C ATOM 3024 CE LYS A 192 10.910 18.308 -22.981 1.00 0.00 C ATOM 3025 NZ LYS A 192 10.670 19.682 -23.501 1.00 0.00 N1+ ATOM 0 H LYS A 192 7.581 15.163 -24.839 1.00 0.00 H new ATOM 0 HA LYS A 192 8.864 17.721 -25.367 1.00 0.00 H new ATOM 0 HB2 LYS A 192 10.029 14.930 -25.041 1.00 0.00 H new ATOM 0 HB3 LYS A 192 10.926 16.435 -25.024 1.00 0.00 H new ATOM 0 HG2 LYS A 192 8.884 15.518 -22.970 1.00 0.00 H new ATOM 0 HG3 LYS A 192 10.618 15.634 -22.746 1.00 0.00 H new ATOM 0 HD2 LYS A 192 8.825 18.008 -23.392 1.00 0.00 H new ATOM 0 HD3 LYS A 192 9.306 17.558 -21.768 1.00 0.00 H new ATOM 0 HE2 LYS A 192 11.424 18.368 -22.022 1.00 0.00 H new ATOM 0 HE3 LYS A 192 11.569 17.772 -23.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 192 11.578 20.179 -23.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 192 10.202 19.626 -24.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 192 10.062 20.203 -22.838 1.00 0.00 H new ATOM 3039 N LYS A 193 9.309 15.195 -27.466 1.00 0.00 N ATOM 3040 CA LYS A 193 9.560 14.866 -28.863 1.00 0.00 C ATOM 3041 C LYS A 193 8.777 13.625 -29.279 1.00 0.00 C ATOM 3042 O LYS A 193 8.139 12.974 -28.452 1.00 0.00 O ATOM 3043 CB LYS A 193 11.056 14.643 -29.093 1.00 0.00 C ATOM 3044 CG LYS A 193 11.665 13.597 -28.175 1.00 0.00 C ATOM 3045 CD LYS A 193 11.601 12.208 -28.791 1.00 0.00 C ATOM 3046 CE LYS A 193 12.896 11.857 -29.506 1.00 0.00 C ATOM 3047 NZ LYS A 193 13.274 10.431 -29.301 1.00 0.00 N1+ ATOM 0 H LYS A 193 9.295 14.390 -26.840 1.00 0.00 H new ATOM 0 HA LYS A 193 9.226 15.704 -29.475 1.00 0.00 H new ATOM 0 HB2 LYS A 193 11.215 14.342 -30.128 1.00 0.00 H new ATOM 0 HB3 LYS A 193 11.581 15.588 -28.952 1.00 0.00 H new ATOM 0 HG2 LYS A 193 12.703 13.856 -27.966 1.00 0.00 H new ATOM 0 HG3 LYS A 193 11.138 13.598 -27.221 1.00 0.00 H new ATOM 0 HD2 LYS A 193 11.403 11.472 -28.012 1.00 0.00 H new ATOM 0 HD3 LYS A 193 10.770 12.159 -29.495 1.00 0.00 H new ATOM 0 HE2 LYS A 193 12.787 12.054 -30.572 1.00 0.00 H new ATOM 0 HE3 LYS A 193 13.697 12.501 -29.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 14.162 10.231 -29.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 13.403 10.249 -28.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 12.521 9.816 -29.670 1.00 0.00 H new ATOM 3061 N VAL A 194 8.828 13.304 -30.568 1.00 0.00 N ATOM 3062 CA VAL A 194 8.122 12.142 -31.095 1.00 0.00 C ATOM 3063 C VAL A 194 8.833 11.576 -32.322 1.00 0.00 C ATOM 3064 O VAL A 194 9.427 12.317 -33.105 1.00 0.00 O ATOM 3065 CB VAL A 194 6.667 12.493 -31.468 1.00 0.00 C ATOM 3066 CG1 VAL A 194 6.632 13.566 -32.547 1.00 0.00 C ATOM 3067 CG2 VAL A 194 5.913 11.249 -31.916 1.00 0.00 C ATOM 0 H VAL A 194 9.351 13.832 -31.266 1.00 0.00 H new ATOM 0 HA VAL A 194 8.114 11.389 -30.307 1.00 0.00 H new ATOM 0 HB VAL A 194 6.172 12.889 -30.581 1.00 0.00 H new ATOM 0 HG11 VAL A 194 5.596 13.799 -32.795 1.00 0.00 H new ATOM 0 HG12 VAL A 194 7.129 14.465 -32.182 1.00 0.00 H new ATOM 0 HG13 VAL A 194 7.146 13.204 -33.437 1.00 0.00 H new ATOM 0 HG21 VAL A 194 4.889 11.518 -32.175 1.00 0.00 H new ATOM 0 HG22 VAL A 194 6.406 10.819 -32.787 1.00 0.00 H new ATOM 0 HG23 VAL A 194 5.903 10.518 -31.107 1.00 0.00 H new ATOM 3077 N ASP A 195 8.768 10.258 -32.481 1.00 0.00 N ATOM 3078 CA ASP A 195 9.405 9.591 -33.612 1.00 0.00 C ATOM 3079 C ASP A 195 8.463 8.569 -34.240 1.00 0.00 C ATOM 3080 O ASP A 195 7.471 8.170 -33.632 1.00 0.00 O ATOM 3081 CB ASP A 195 10.695 8.903 -33.163 1.00 0.00 C ATOM 3082 CG ASP A 195 11.796 9.005 -34.201 1.00 0.00 C ATOM 3083 OD1 ASP A 195 12.552 9.999 -34.170 1.00 0.00 O1- ATOM 3084 OD2 ASP A 195 11.902 8.090 -35.045 1.00 0.00 O ATOM 0 H ASP A 195 8.281 9.630 -31.841 1.00 0.00 H new ATOM 0 HA ASP A 195 9.645 10.346 -34.360 1.00 0.00 H new ATOM 0 HB2 ASP A 195 11.037 9.351 -32.230 1.00 0.00 H new ATOM 0 HB3 ASP A 195 10.490 7.853 -32.956 1.00 0.00 H new ATOM 3089 N LEU A 196 8.781 8.147 -35.459 1.00 0.00 N ATOM 3090 CA LEU A 196 7.964 7.167 -36.166 1.00 0.00 C ATOM 3091 C LEU A 196 8.629 5.793 -36.151 1.00 0.00 C ATOM 3092 O LEU A 196 9.855 5.688 -36.162 1.00 0.00 O ATOM 3093 CB LEU A 196 7.721 7.618 -37.609 1.00 0.00 C ATOM 3094 CG LEU A 196 6.406 8.365 -37.840 1.00 0.00 C ATOM 3095 CD1 LEU A 196 5.219 7.448 -37.587 1.00 0.00 C ATOM 3096 CD2 LEU A 196 6.330 9.597 -36.950 1.00 0.00 C ATOM 0 H LEU A 196 9.598 8.468 -35.978 1.00 0.00 H new ATOM 0 HA LEU A 196 7.005 7.091 -35.653 1.00 0.00 H new ATOM 0 HB2 LEU A 196 8.546 8.261 -37.917 1.00 0.00 H new ATOM 0 HB3 LEU A 196 7.742 6.741 -38.256 1.00 0.00 H new ATOM 0 HG LEU A 196 6.372 8.690 -38.880 1.00 0.00 H new ATOM 0 HD11 LEU A 196 4.293 7.997 -37.756 1.00 0.00 H new ATOM 0 HD12 LEU A 196 5.266 6.597 -38.266 1.00 0.00 H new ATOM 0 HD13 LEU A 196 5.247 7.092 -36.557 1.00 0.00 H new ATOM 0 HD21 LEU A 196 5.388 10.116 -37.127 1.00 0.00 H new ATOM 0 HD22 LEU A 196 6.386 9.294 -35.904 1.00 0.00 H new ATOM 0 HD23 LEU A 196 7.161 10.264 -37.180 1.00 0.00 H new ATOM 3108 N ASP A 197 7.813 4.744 -36.127 1.00 0.00 N ATOM 3109 CA ASP A 197 8.326 3.379 -36.110 1.00 0.00 C ATOM 3110 C ASP A 197 7.582 2.506 -37.116 1.00 0.00 C ATOM 3111 O ASP A 197 6.436 2.118 -36.888 1.00 0.00 O ATOM 3112 CB ASP A 197 8.203 2.782 -34.706 1.00 0.00 C ATOM 3113 CG ASP A 197 9.462 2.055 -34.276 1.00 0.00 C ATOM 3114 OD1 ASP A 197 10.567 2.568 -34.548 1.00 0.00 O1- ATOM 3115 OD2 ASP A 197 9.342 0.971 -33.666 1.00 0.00 O ATOM 0 H ASP A 197 6.795 4.813 -36.119 1.00 0.00 H new ATOM 0 HA ASP A 197 9.379 3.409 -36.392 1.00 0.00 H new ATOM 0 HB2 ASP A 197 7.984 3.577 -33.994 1.00 0.00 H new ATOM 0 HB3 ASP A 197 7.361 2.091 -34.680 1.00 0.00 H new