USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1309 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 77 ASN : amide:sc= 0.921 K(o=-12,f=-6.7) USER MOD Set 1.2: A 82 GLN : amide:sc= -3.14! C(o=-12!,f=-8.2!) USER MOD Set 1.3: A 109 ASN : amide:sc= -10.1! K(o=-12!,f=-6.7) USER MOD Set 2.1: A 47 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 95 CYS SG : rot 180:sc= -1.09 USER MOD Set 3.1: A 46 LYS NZ :NH3+ -131:sc= 1.05 (180deg=-0.0373) USER MOD Set 3.2: A 78 GLN : amide:sc= -0.564 K(o=0.34,f=-12!) USER MOD Set 3.3: A 86 ASN : amide:sc= -0.141! C(o=0.34!,f=-12!) USER MOD Set 4.1: A 28 TYR OH : rot -80:sc= 0.00245 USER MOD Set 4.2: A 29 ASN : amide:sc= -3.37! K(o=-13!,f=-7.9) USER MOD Set 4.3: A 32 GLN : amide:sc= -2.89! C(o=-13!,f=-7.5!) USER MOD Set 4.4: A 33 HIS : no HE2:sc= -5.79! C(o=-13!,f=-16!) USER MOD Set 4.5: A 70 THR OG1 : rot 43:sc= -1.29! USER MOD Single : A 11 MET CE :methyl 139:sc= -0.162 (180deg=-0.719) USER MOD Single : A 13 SER OG : rot -30:sc= 0.281 USER MOD Single : A 14 SER OG : rot -138:sc= 0.257 USER MOD Single : A 25 HIS : no HD1:sc= -3.28! C(o=-3.3!,f=-3.3!) USER MOD Single : A 26 LYS NZ :NH3+ 174:sc= 1.1 (180deg=1.04) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 140:sc= 0.289 USER MOD Single : A 41 TYR OH : rot -4:sc= -3.25! USER MOD Single : A 42 ASN : amide:sc= -8.46! C(o=-8.5!,f=-13!) USER MOD Single : A 45 SER OG : rot 47:sc= 0.0245 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -151:sc= 1.78 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 49:sc= 1.2 USER MOD Single : A 56 THR OG1 : rot 81:sc= 0.343 USER MOD Single : A 58 THR OG1 : rot 88:sc= 0.721 USER MOD Single : A 59 THR OG1 : rot 86:sc= 0.81 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 1.1 K(o=1.1,f=-0.063) USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 1.11 (180deg=0.983) USER MOD Single : A 64 TYR OH : rot -146:sc= 1.14 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.997 K(o=-1,f=0) USER MOD Single : A 76 SER OG : rot -116:sc= -2.55! USER MOD Single : A 91 LYS NZ :NH3+ -176:sc= 0.218 (180deg=0.065) USER MOD Single : A 96 THR OG1 : rot 180:sc=0.000271 USER MOD Single : A 97 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0671) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl -115:sc= -6.27! (180deg=-13.2!) USER MOD Single : A 107 LYS NZ :NH3+ 173:sc= 0.146 (180deg=0.0878) USER MOD Single : A 111 ASN : amide:sc= 0.745 K(o=0.74,f=-5.3!) USER MOD Single : A 114 ASN : amide:sc= 0.532 K(o=0.53,f=-0.16) USER MOD Single : A 116 HIS : no HD1:sc= -4.48! C(o=-4.5!,f=-11!) USER MOD Single : A 119 TYR OH : rot 82:sc= -7.87! USER MOD Single : A 121 TYR OH : rot 23:sc= -0.106 USER MOD Single : A 122 MET CE :methyl -109:sc= -9.87! (180deg=-13.8!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 167:sc= 0.971 (180deg=0.845) USER MOD Single : A 125 THR OG1 : rot 48:sc= 1.22 USER MOD Single : A 126 LYS NZ :NH3+ -168:sc=-0.00429 (180deg=-0.11) USER MOD Single : A 132 THR OG1 : rot -87:sc= -1.88! USER MOD Single : A 133 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0731) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= -0.218 K(o=-0.22,f=-2.7!) USER MOD Single : A 140 THR OG1 : rot 58:sc= -0.667! USER MOD Single : A 141 SER OG : rot -87:sc= 1.94 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot -59:sc= 1.19 USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 157:sc= 1.04 (180deg=0.103!) USER MOD Single : A 173 SER OG : rot -52:sc= 0.474 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -1.055 19.042 -0.788 1.00 5.22 N ATOM 2 CA GLY A 10 -2.069 18.163 -1.413 1.00 4.42 C ATOM 3 C GLY A 10 -3.202 17.830 -0.467 1.00 3.29 C ATOM 4 O GLY A 10 -2.983 17.261 0.607 1.00 3.60 O ATOM 0 HA2 GLY A 10 -2.471 18.651 -2.301 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -1.592 17.240 -1.744 1.00 4.42 H new ATOM 10 N MET A 11 -4.410 18.210 -0.856 1.00 2.49 N ATOM 11 CA MET A 11 -5.605 17.910 -0.078 1.00 1.84 C ATOM 12 C MET A 11 -6.505 16.951 -0.845 1.00 1.40 C ATOM 13 O MET A 11 -6.221 16.603 -1.989 1.00 2.20 O ATOM 14 CB MET A 11 -6.385 19.188 0.243 1.00 2.43 C ATOM 15 CG MET A 11 -5.612 20.194 1.078 1.00 3.11 C ATOM 16 SD MET A 11 -6.586 21.658 1.485 1.00 4.02 S ATOM 17 CE MET A 11 -7.892 20.929 2.476 1.00 4.85 C ATOM 0 H MET A 11 -4.590 18.732 -1.714 1.00 2.49 H new ATOM 0 HA MET A 11 -5.289 17.447 0.856 1.00 1.84 H new ATOM 0 HB2 MET A 11 -6.685 19.662 -0.692 1.00 2.43 H new ATOM 0 HB3 MET A 11 -7.299 18.919 0.772 1.00 2.43 H new ATOM 0 HG2 MET A 11 -5.280 19.716 2.000 1.00 3.11 H new ATOM 0 HG3 MET A 11 -4.716 20.498 0.536 1.00 3.11 H new ATOM 0 HE1 MET A 11 -8.105 21.574 3.329 1.00 4.85 H new ATOM 0 HE2 MET A 11 -8.791 20.821 1.870 1.00 4.85 H new ATOM 0 HE3 MET A 11 -7.574 19.949 2.832 1.00 4.85 H new ATOM 27 N GLY A 12 -7.591 16.537 -0.216 1.00 0.92 N ATOM 28 CA GLY A 12 -8.530 15.652 -0.867 1.00 0.85 C ATOM 29 C GLY A 12 -9.457 14.999 0.131 1.00 0.79 C ATOM 30 O GLY A 12 -9.300 15.190 1.338 1.00 1.55 O ATOM 0 H GLY A 12 -7.840 16.799 0.738 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -9.115 16.213 -1.596 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.987 14.884 -1.417 1.00 0.85 H new ATOM 34 N SER A 13 -10.431 14.251 -0.359 1.00 0.52 N ATOM 35 CA SER A 13 -11.335 13.522 0.516 1.00 0.53 C ATOM 36 C SER A 13 -11.183 12.021 0.299 1.00 0.41 C ATOM 37 O SER A 13 -11.758 11.212 1.030 1.00 0.53 O ATOM 38 CB SER A 13 -12.781 13.959 0.264 1.00 0.79 C ATOM 39 OG SER A 13 -13.684 13.332 1.163 1.00 1.58 O ATOM 0 H SER A 13 -10.616 14.132 -1.355 1.00 0.52 H new ATOM 0 HA SER A 13 -11.081 13.748 1.552 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.857 15.041 0.368 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.061 13.716 -0.761 1.00 0.79 H new ATOM 0 HG SER A 13 -13.336 12.451 1.415 1.00 1.58 H new ATOM 45 N SER A 14 -10.367 11.660 -0.685 1.00 0.32 N ATOM 46 CA SER A 14 -10.146 10.297 -1.056 1.00 0.22 C ATOM 47 C SER A 14 -8.834 10.274 -1.779 1.00 0.21 C ATOM 48 O SER A 14 -8.417 11.262 -2.387 1.00 0.35 O ATOM 49 CB SER A 14 -11.260 9.759 -1.963 1.00 0.25 C ATOM 50 OG SER A 14 -12.549 10.093 -1.472 1.00 1.17 O ATOM 0 H SER A 14 -9.840 12.329 -1.247 1.00 0.32 H new ATOM 0 HA SER A 14 -10.140 9.659 -0.172 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.138 10.164 -2.968 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.171 8.676 -2.043 1.00 0.25 H new ATOM 0 HG SER A 14 -13.145 9.321 -1.567 1.00 1.17 H new ATOM 56 N ILE A 15 -8.196 9.150 -1.691 1.00 0.18 N ATOM 57 CA ILE A 15 -6.878 8.953 -2.215 1.00 0.18 C ATOM 58 C ILE A 15 -6.834 9.148 -3.729 1.00 0.17 C ATOM 59 O ILE A 15 -5.772 9.353 -4.309 1.00 0.19 O ATOM 60 CB ILE A 15 -6.431 7.540 -1.852 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.438 6.520 -2.380 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.296 7.417 -0.342 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.818 5.195 -2.746 1.00 0.38 C ATOM 0 H ILE A 15 -8.586 8.321 -1.242 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.207 9.694 -1.780 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.463 7.341 -2.311 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.207 6.356 -1.625 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.936 6.934 -3.257 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.977 6.407 -0.086 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.557 8.133 0.017 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.258 7.623 0.127 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.591 4.520 -3.113 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.069 5.346 -3.524 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.344 4.759 -1.866 1.00 0.38 H new ATOM 75 N PHE A 16 -8.003 9.131 -4.353 1.00 0.18 N ATOM 76 CA PHE A 16 -8.114 9.194 -5.803 1.00 0.19 C ATOM 77 C PHE A 16 -7.823 10.577 -6.362 1.00 0.21 C ATOM 78 O PHE A 16 -7.987 10.813 -7.561 1.00 0.30 O ATOM 79 CB PHE A 16 -9.500 8.790 -6.235 1.00 0.20 C ATOM 80 CG PHE A 16 -9.847 7.386 -5.897 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.078 6.350 -6.377 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.963 7.099 -5.144 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.418 5.047 -6.122 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.300 5.793 -4.875 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.527 4.769 -5.372 1.00 0.19 C ATOM 0 H PHE A 16 -8.899 9.073 -3.870 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.365 8.506 -6.196 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.225 9.456 -5.768 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.589 8.927 -7.313 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.196 6.567 -6.962 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.576 7.902 -4.763 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.812 4.243 -6.512 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.170 5.572 -4.275 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.797 3.743 -5.169 1.00 0.19 H new ATOM 95 N ASP A 17 -7.400 11.489 -5.511 1.00 0.21 N ATOM 96 CA ASP A 17 -7.010 12.808 -5.966 1.00 0.26 C ATOM 97 C ASP A 17 -5.615 12.706 -6.523 1.00 0.25 C ATOM 98 O ASP A 17 -5.157 13.551 -7.290 1.00 0.32 O ATOM 99 CB ASP A 17 -7.026 13.816 -4.819 1.00 0.32 C ATOM 100 CG ASP A 17 -6.751 15.231 -5.293 1.00 1.13 C ATOM 101 OD1 ASP A 17 -7.666 15.877 -5.842 1.00 1.30 O ATOM 102 OD2 ASP A 17 -5.610 15.710 -5.111 1.00 2.11 O ATOM 0 H ASP A 17 -7.318 11.343 -4.505 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.714 13.154 -6.723 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -7.996 13.783 -4.323 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.279 13.532 -4.078 1.00 0.32 H new ATOM 107 N PHE A 18 -4.961 11.620 -6.145 1.00 0.22 N ATOM 108 CA PHE A 18 -3.566 11.444 -6.426 1.00 0.23 C ATOM 109 C PHE A 18 -3.341 10.338 -7.418 1.00 0.26 C ATOM 110 O PHE A 18 -3.664 9.174 -7.174 1.00 0.29 O ATOM 111 CB PHE A 18 -2.817 11.185 -5.139 1.00 0.21 C ATOM 112 CG PHE A 18 -2.912 12.351 -4.213 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.437 13.589 -4.589 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.458 12.200 -2.951 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.510 14.656 -3.725 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.527 13.265 -2.079 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.125 14.537 -2.523 1.00 0.31 C ATOM 0 H PHE A 18 -5.389 10.845 -5.638 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.184 12.359 -6.878 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.222 10.297 -4.652 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.770 10.978 -5.360 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.004 13.722 -5.570 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.835 11.235 -2.645 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.071 15.602 -4.008 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -3.885 13.125 -1.070 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.304 15.410 -1.913 1.00 0.31 H new ATOM 127 N GLU A 19 -2.829 10.745 -8.557 1.00 0.35 N ATOM 128 CA GLU A 19 -2.421 9.827 -9.604 1.00 0.43 C ATOM 129 C GLU A 19 -1.514 8.738 -9.044 1.00 0.34 C ATOM 130 O GLU A 19 -0.671 8.983 -8.173 1.00 0.37 O ATOM 131 CB GLU A 19 -1.699 10.580 -10.731 1.00 0.63 C ATOM 132 CG GLU A 19 -0.396 11.235 -10.300 1.00 1.08 C ATOM 133 CD GLU A 19 0.159 12.190 -11.336 1.00 2.04 C ATOM 134 OE1 GLU A 19 0.868 11.737 -12.259 1.00 2.86 O ATOM 135 OE2 GLU A 19 -0.102 13.408 -11.224 1.00 2.30 O ATOM 0 H GLU A 19 -2.682 11.728 -8.788 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.318 9.360 -10.010 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -1.493 9.885 -11.545 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -2.365 11.346 -11.127 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -0.559 11.775 -9.367 1.00 1.08 H new ATOM 0 HG3 GLU A 19 0.343 10.460 -10.096 1.00 1.08 H new ATOM 142 N VAL A 20 -1.700 7.546 -9.557 1.00 0.29 N ATOM 143 CA VAL A 20 -0.886 6.410 -9.194 1.00 0.26 C ATOM 144 C VAL A 20 -0.067 6.020 -10.399 1.00 0.25 C ATOM 145 O VAL A 20 -0.393 6.415 -11.510 1.00 0.28 O ATOM 146 CB VAL A 20 -1.767 5.230 -8.707 1.00 0.31 C ATOM 147 CG1 VAL A 20 -1.006 3.916 -8.643 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.324 5.564 -7.348 1.00 0.49 C ATOM 0 H VAL A 20 -2.425 7.335 -10.243 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.225 6.671 -8.367 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.570 5.094 -9.431 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.672 3.126 -8.296 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.631 3.664 -9.635 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.169 4.014 -7.952 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.945 4.740 -6.997 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.504 5.724 -6.648 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -2.927 6.470 -7.414 1.00 0.49 H new ATOM 158 N LEU A 21 1.024 5.321 -10.191 1.00 0.28 N ATOM 159 CA LEU A 21 1.853 4.915 -11.297 1.00 0.35 C ATOM 160 C LEU A 21 2.102 3.422 -11.280 1.00 0.38 C ATOM 161 O LEU A 21 2.376 2.841 -10.235 1.00 0.58 O ATOM 162 CB LEU A 21 3.177 5.675 -11.242 1.00 0.45 C ATOM 163 CG LEU A 21 3.028 7.191 -11.278 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.341 7.878 -10.982 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.519 7.601 -12.629 1.00 0.68 C ATOM 0 H LEU A 21 1.355 5.024 -9.273 1.00 0.28 H new ATOM 0 HA LEU A 21 1.334 5.151 -12.226 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.707 5.395 -10.332 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.798 5.362 -12.081 1.00 0.45 H new ATOM 0 HG LEU A 21 2.318 7.493 -10.508 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.202 8.959 -11.015 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.688 7.587 -9.991 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.081 7.585 -11.726 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.410 8.685 -12.663 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.226 7.283 -13.396 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.552 7.133 -12.811 1.00 0.68 H new ATOM 177 N ASP A 22 1.978 2.794 -12.437 1.00 0.33 N ATOM 178 CA ASP A 22 2.510 1.457 -12.602 1.00 0.37 C ATOM 179 C ASP A 22 4.017 1.577 -12.438 1.00 0.35 C ATOM 180 O ASP A 22 4.553 2.675 -12.574 1.00 0.40 O ATOM 181 CB ASP A 22 2.131 0.879 -13.973 1.00 0.50 C ATOM 182 CG ASP A 22 2.828 -0.435 -14.271 1.00 1.16 C ATOM 183 OD1 ASP A 22 2.354 -1.483 -13.787 1.00 1.48 O ATOM 184 OD2 ASP A 22 3.849 -0.424 -14.993 1.00 1.87 O ATOM 0 H ASP A 22 1.521 3.182 -13.262 1.00 0.33 H new ATOM 0 HA ASP A 22 2.096 0.770 -11.864 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.052 0.730 -14.013 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.382 1.602 -14.749 1.00 0.50 H new ATOM 189 N ALA A 23 4.689 0.474 -12.129 1.00 0.39 N ATOM 190 CA ALA A 23 6.081 0.501 -11.669 1.00 0.42 C ATOM 191 C ALA A 23 7.050 1.181 -12.650 1.00 0.47 C ATOM 192 O ALA A 23 8.232 1.330 -12.339 1.00 0.59 O ATOM 193 CB ALA A 23 6.548 -0.913 -11.359 1.00 0.52 C ATOM 0 H ALA A 23 4.290 -0.463 -12.188 1.00 0.39 H new ATOM 0 HA ALA A 23 6.096 1.111 -10.766 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.583 -0.888 -11.018 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.919 -1.341 -10.579 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.477 -1.525 -12.258 1.00 0.52 H new ATOM 199 N ASP A 24 6.559 1.589 -13.814 1.00 0.46 N ATOM 200 CA ASP A 24 7.386 2.286 -14.794 1.00 0.54 C ATOM 201 C ASP A 24 7.154 3.810 -14.746 1.00 0.51 C ATOM 202 O ASP A 24 7.754 4.556 -15.517 1.00 0.62 O ATOM 203 CB ASP A 24 7.085 1.740 -16.190 1.00 0.69 C ATOM 204 CG ASP A 24 8.113 2.160 -17.220 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.277 1.719 -17.119 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.766 2.944 -18.124 1.00 2.34 O ATOM 0 H ASP A 24 5.591 1.449 -14.103 1.00 0.46 H new ATOM 0 HA ASP A 24 8.434 2.110 -14.553 1.00 0.54 H new ATOM 0 HB2 ASP A 24 7.043 0.652 -16.148 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.100 2.085 -16.505 1.00 0.69 H new ATOM 211 N HIS A 25 6.260 4.258 -13.845 1.00 0.43 N ATOM 212 CA HIS A 25 5.955 5.688 -13.638 1.00 0.44 C ATOM 213 C HIS A 25 4.991 6.155 -14.702 1.00 0.47 C ATOM 214 O HIS A 25 4.864 7.344 -14.984 1.00 0.54 O ATOM 215 CB HIS A 25 7.204 6.597 -13.602 1.00 0.54 C ATOM 216 CG HIS A 25 7.981 6.529 -12.320 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.665 7.264 -11.189 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.057 5.786 -11.988 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.513 6.963 -10.219 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.368 6.072 -10.680 1.00 1.26 N ATOM 0 H HIS A 25 5.726 3.637 -13.237 1.00 0.43 H new ATOM 0 HA HIS A 25 5.502 5.773 -12.650 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.862 6.323 -14.427 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.893 7.628 -13.771 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.578 5.093 -12.632 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.506 7.376 -9.221 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.137 5.661 -10.151 1.00 1.26 H new ATOM 229 N LYS A 26 4.318 5.188 -15.292 1.00 0.48 N ATOM 230 CA LYS A 26 3.263 5.453 -16.237 1.00 0.53 C ATOM 231 C LYS A 26 1.938 5.403 -15.506 1.00 0.41 C ATOM 232 O LYS A 26 1.630 4.410 -14.844 1.00 0.38 O ATOM 233 CB LYS A 26 3.325 4.436 -17.369 1.00 0.67 C ATOM 234 CG LYS A 26 4.670 4.456 -18.071 1.00 1.00 C ATOM 235 CD LYS A 26 5.010 5.856 -18.555 1.00 2.12 C ATOM 236 CE LYS A 26 6.485 6.173 -18.379 1.00 3.15 C ATOM 237 NZ LYS A 26 7.354 5.289 -19.199 1.00 4.25 N ATOM 0 H LYS A 26 4.491 4.196 -15.127 1.00 0.48 H new ATOM 0 HA LYS A 26 3.377 6.443 -16.679 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.137 3.438 -16.972 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.535 4.646 -18.090 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.445 4.104 -17.390 1.00 1.00 H new ATOM 0 HG3 LYS A 26 4.653 3.769 -18.917 1.00 1.00 H new ATOM 0 HD2 LYS A 26 4.741 5.952 -19.607 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.414 6.585 -18.006 1.00 2.12 H new ATOM 0 HE2 LYS A 26 6.666 7.212 -18.653 1.00 3.15 H new ATOM 0 HE3 LYS A 26 6.754 6.069 -17.328 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 8.341 5.607 -19.125 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 7.279 4.311 -18.854 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 7.051 5.329 -20.193 1.00 4.25 H new ATOM 251 N PRO A 27 1.166 6.496 -15.583 1.00 0.41 N ATOM 252 CA PRO A 27 -0.008 6.702 -14.734 1.00 0.37 C ATOM 253 C PRO A 27 -0.957 5.517 -14.687 1.00 0.32 C ATOM 254 O PRO A 27 -1.583 5.134 -15.679 1.00 0.36 O ATOM 255 CB PRO A 27 -0.674 7.923 -15.366 1.00 0.46 C ATOM 256 CG PRO A 27 0.472 8.685 -15.925 1.00 0.54 C ATOM 257 CD PRO A 27 1.389 7.641 -16.488 1.00 0.50 C ATOM 0 HA PRO A 27 0.273 6.834 -13.689 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.384 7.637 -16.142 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -1.225 8.508 -14.629 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.145 9.382 -16.697 1.00 0.54 H new ATOM 0 HG3 PRO A 27 0.969 9.274 -15.154 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.140 7.396 -17.521 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.429 7.968 -16.480 1.00 0.50 H new ATOM 265 N TYR A 28 -1.023 4.955 -13.499 1.00 0.28 N ATOM 266 CA TYR A 28 -1.999 3.950 -13.128 1.00 0.26 C ATOM 267 C TYR A 28 -3.300 4.619 -12.700 1.00 0.25 C ATOM 268 O TYR A 28 -3.290 5.605 -11.957 1.00 0.37 O ATOM 269 CB TYR A 28 -1.439 3.141 -11.967 1.00 0.30 C ATOM 270 CG TYR A 28 -2.055 1.787 -11.763 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.489 1.064 -12.853 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.228 1.243 -10.499 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.075 -0.167 -12.706 1.00 0.64 C ATOM 274 CE2 TYR A 28 -2.814 0.005 -10.336 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.143 -0.725 -11.332 1.00 0.92 C ATOM 276 OH TYR A 28 -3.817 -1.938 -11.295 1.00 1.20 O ATOM 0 H TYR A 28 -0.381 5.191 -12.742 1.00 0.28 H new ATOM 0 HA TYR A 28 -2.202 3.301 -13.979 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.367 3.014 -12.120 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.564 3.719 -11.051 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.365 1.476 -13.844 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.900 1.796 -9.631 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.470 -0.707 -13.553 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.000 -0.358 -9.336 1.00 1.10 H new ATOM 0 HH TYR A 28 -4.783 -1.776 -11.305 1.00 1.20 H new ATOM 286 N ASN A 29 -4.415 4.079 -13.155 1.00 0.34 N ATOM 287 CA ASN A 29 -5.718 4.622 -12.803 1.00 0.42 C ATOM 288 C ASN A 29 -6.164 4.117 -11.431 1.00 0.34 C ATOM 289 O ASN A 29 -6.912 3.147 -11.315 1.00 0.44 O ATOM 290 CB ASN A 29 -6.766 4.315 -13.894 1.00 0.67 C ATOM 291 CG ASN A 29 -6.767 2.872 -14.381 1.00 0.73 C ATOM 292 OD1 ASN A 29 -7.052 2.600 -15.545 1.00 1.18 O ATOM 293 ND2 ASN A 29 -6.459 1.936 -13.502 1.00 1.51 N ATOM 0 H ASN A 29 -4.447 3.265 -13.769 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.628 5.707 -12.742 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -7.756 4.555 -13.507 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.589 4.972 -14.745 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -6.453 0.955 -13.782 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -6.227 2.194 -12.543 1.00 1.51 H new ATOM 300 N LEU A 30 -5.687 4.780 -10.386 1.00 0.25 N ATOM 301 CA LEU A 30 -6.054 4.433 -9.015 1.00 0.20 C ATOM 302 C LEU A 30 -7.567 4.330 -8.881 1.00 0.19 C ATOM 303 O LEU A 30 -8.094 3.436 -8.216 1.00 0.19 O ATOM 304 CB LEU A 30 -5.535 5.505 -8.053 1.00 0.22 C ATOM 305 CG LEU A 30 -5.974 5.377 -6.600 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.437 4.100 -5.989 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.503 6.580 -5.807 1.00 0.28 C ATOM 0 H LEU A 30 -5.041 5.566 -10.460 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.607 3.470 -8.769 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.445 5.494 -8.084 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.854 6.480 -8.422 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.063 5.338 -6.569 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.762 4.028 -4.951 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.814 3.243 -6.547 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.348 4.108 -6.028 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.822 6.479 -4.769 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.415 6.640 -5.848 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -5.933 7.487 -6.232 1.00 0.28 H new ATOM 319 N VAL A 31 -8.243 5.225 -9.582 1.00 0.20 N ATOM 320 CA VAL A 31 -9.685 5.405 -9.475 1.00 0.19 C ATOM 321 C VAL A 31 -10.480 4.234 -10.049 1.00 0.20 C ATOM 322 O VAL A 31 -11.705 4.254 -10.026 1.00 0.23 O ATOM 323 CB VAL A 31 -10.135 6.701 -10.173 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.252 7.850 -9.198 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.156 7.071 -11.252 1.00 0.87 C ATOM 0 H VAL A 31 -7.802 5.856 -10.251 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.894 5.462 -8.407 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.118 6.514 -10.605 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -10.572 8.747 -9.729 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -10.985 7.602 -8.430 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.284 8.031 -8.731 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.483 7.989 -11.740 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.171 7.225 -10.812 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.104 6.268 -11.987 1.00 0.87 H new ATOM 335 N GLN A 32 -9.805 3.219 -10.571 1.00 0.21 N ATOM 336 CA GLN A 32 -10.506 2.012 -10.992 1.00 0.23 C ATOM 337 C GLN A 32 -10.973 1.263 -9.756 1.00 0.22 C ATOM 338 O GLN A 32 -11.884 0.439 -9.808 1.00 0.28 O ATOM 339 CB GLN A 32 -9.615 1.103 -11.845 1.00 0.26 C ATOM 340 CG GLN A 32 -8.433 0.525 -11.082 1.00 0.29 C ATOM 341 CD GLN A 32 -7.721 -0.584 -11.831 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.143 -1.480 -11.220 1.00 1.02 O ATOM 343 NE2 GLN A 32 -7.750 -0.525 -13.150 1.00 0.75 N ATOM 0 H GLN A 32 -8.795 3.204 -10.711 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.357 2.303 -11.607 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.217 0.285 -12.241 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.244 1.669 -12.700 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.723 1.323 -10.867 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.781 0.141 -10.123 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.242 0.237 -13.616 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.280 -1.242 -13.703 1.00 0.75 H new ATOM 352 N HIS A 33 -10.334 1.570 -8.634 1.00 0.17 N ATOM 353 CA HIS A 33 -10.704 0.977 -7.355 1.00 0.16 C ATOM 354 C HIS A 33 -11.716 1.853 -6.650 1.00 0.16 C ATOM 355 O HIS A 33 -11.846 1.838 -5.433 1.00 0.17 O ATOM 356 CB HIS A 33 -9.451 0.720 -6.509 1.00 0.16 C ATOM 357 CG HIS A 33 -8.527 -0.210 -7.212 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.897 -1.496 -7.515 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.298 -0.026 -7.767 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.958 -2.067 -8.225 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.971 -1.201 -8.405 1.00 0.28 N ATOM 0 H HIS A 33 -9.556 2.227 -8.584 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.179 0.010 -7.521 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -8.943 1.663 -6.307 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.736 0.298 -5.545 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.770 -1.939 -7.230 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.696 0.869 -7.717 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.983 -3.079 -8.603 1.00 0.27 H new ATOM 370 N LYS A 34 -12.430 2.623 -7.452 1.00 0.19 N ATOM 371 CA LYS A 34 -13.575 3.363 -6.980 1.00 0.19 C ATOM 372 C LYS A 34 -14.803 2.473 -7.038 1.00 0.21 C ATOM 373 O LYS A 34 -15.301 2.157 -8.120 1.00 0.33 O ATOM 374 CB LYS A 34 -13.806 4.599 -7.838 1.00 0.22 C ATOM 375 CG LYS A 34 -12.869 5.747 -7.539 1.00 0.28 C ATOM 376 CD LYS A 34 -13.411 7.049 -8.083 1.00 0.69 C ATOM 377 CE LYS A 34 -13.780 6.894 -9.536 1.00 1.01 C ATOM 378 NZ LYS A 34 -14.418 8.114 -10.093 1.00 1.56 N ATOM 0 H LYS A 34 -12.229 2.749 -8.444 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.390 3.680 -5.954 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.701 4.323 -8.887 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -14.833 4.937 -7.698 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.725 5.831 -6.462 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -11.891 5.546 -7.977 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.286 7.355 -7.509 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -12.665 7.836 -7.972 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -12.885 6.661 -10.112 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -14.460 6.049 -9.647 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -14.653 7.957 -11.094 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -15.287 8.324 -9.562 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -13.761 8.916 -10.013 1.00 1.56 H new ATOM 392 N GLY A 35 -15.283 2.080 -5.881 1.00 0.18 N ATOM 393 CA GLY A 35 -16.415 1.195 -5.814 1.00 0.20 C ATOM 394 C GLY A 35 -16.188 0.071 -4.835 1.00 0.17 C ATOM 395 O GLY A 35 -17.076 -0.270 -4.056 1.00 0.20 O ATOM 0 H GLY A 35 -14.905 2.361 -4.976 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.301 1.759 -5.521 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.613 0.782 -6.803 1.00 0.20 H new ATOM 399 N SER A 36 -14.998 -0.509 -4.859 1.00 0.16 N ATOM 400 CA SER A 36 -14.626 -1.476 -3.867 1.00 0.16 C ATOM 401 C SER A 36 -13.314 -1.060 -3.258 1.00 0.14 C ATOM 402 O SER A 36 -12.416 -0.604 -3.963 1.00 0.16 O ATOM 403 CB SER A 36 -14.503 -2.869 -4.472 1.00 0.20 C ATOM 404 OG SER A 36 -15.749 -3.316 -4.986 1.00 0.29 O ATOM 0 H SER A 36 -14.281 -0.319 -5.559 1.00 0.16 H new ATOM 0 HA SER A 36 -15.401 -1.517 -3.102 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.760 -2.858 -5.270 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.147 -3.567 -3.715 1.00 0.20 H new ATOM 0 HG SER A 36 -15.604 -3.783 -5.835 1.00 0.29 H new ATOM 410 N PRO A 37 -13.220 -1.168 -1.934 1.00 0.12 N ATOM 411 CA PRO A 37 -12.006 -0.907 -1.183 1.00 0.12 C ATOM 412 C PRO A 37 -10.775 -1.479 -1.845 1.00 0.12 C ATOM 413 O PRO A 37 -10.840 -2.447 -2.598 1.00 0.15 O ATOM 414 CB PRO A 37 -12.269 -1.599 0.166 1.00 0.15 C ATOM 415 CG PRO A 37 -13.552 -2.321 -0.010 1.00 0.18 C ATOM 416 CD PRO A 37 -14.298 -1.548 -1.040 1.00 0.15 C ATOM 0 HA PRO A 37 -11.802 0.161 -1.099 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.462 -2.286 0.420 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.334 -0.872 0.975 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.384 -3.348 -0.334 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.108 -2.369 0.926 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.056 -2.151 -1.540 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.808 -0.682 -0.617 1.00 0.15 H new ATOM 424 N LEU A 38 -9.672 -0.849 -1.556 1.00 0.14 N ATOM 425 CA LEU A 38 -8.383 -1.221 -2.073 1.00 0.13 C ATOM 426 C LEU A 38 -7.383 -1.052 -0.944 1.00 0.13 C ATOM 427 O LEU A 38 -7.510 -0.153 -0.138 1.00 0.20 O ATOM 428 CB LEU A 38 -7.993 -0.353 -3.280 1.00 0.16 C ATOM 429 CG LEU A 38 -8.146 1.162 -3.126 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.415 1.872 -4.245 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.609 1.585 -3.137 1.00 0.26 C ATOM 0 H LEU A 38 -9.642 -0.039 -0.937 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.401 -2.253 -2.424 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.953 -0.565 -3.527 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.594 -0.669 -4.133 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.717 1.438 -2.163 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.529 2.950 -4.128 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.357 1.613 -4.210 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.832 1.565 -5.204 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.676 2.667 -3.025 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.066 1.289 -4.081 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.134 1.102 -2.312 1.00 0.26 H new ATOM 443 N LEU A 39 -6.436 -1.931 -0.843 1.00 0.18 N ATOM 444 CA LEU A 39 -5.419 -1.818 0.169 1.00 0.19 C ATOM 445 C LEU A 39 -4.136 -1.413 -0.496 1.00 0.18 C ATOM 446 O LEU A 39 -3.582 -2.161 -1.297 1.00 0.21 O ATOM 447 CB LEU A 39 -5.198 -3.137 0.887 1.00 0.23 C ATOM 448 CG LEU A 39 -5.919 -3.356 2.225 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.160 -2.699 3.361 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.344 -2.836 2.180 1.00 1.19 C ATOM 0 H LEU A 39 -6.341 -2.744 -1.452 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.739 -1.079 0.903 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.495 -3.939 0.212 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.128 -3.247 1.062 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.955 -4.431 2.402 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.690 -2.868 4.298 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.160 -3.128 3.427 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.083 -1.628 3.176 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.824 -3.007 3.143 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.335 -1.768 1.964 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.898 -3.359 1.400 1.00 1.19 H new ATOM 462 N ILE A 40 -3.684 -0.226 -0.215 1.00 0.19 N ATOM 463 CA ILE A 40 -2.450 0.232 -0.796 1.00 0.20 C ATOM 464 C ILE A 40 -1.315 0.102 0.211 1.00 0.18 C ATOM 465 O ILE A 40 -1.401 0.601 1.331 1.00 0.20 O ATOM 466 CB ILE A 40 -2.602 1.664 -1.307 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.992 1.834 -1.905 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.557 1.977 -2.363 1.00 0.37 C ATOM 469 CD1 ILE A 40 -4.127 3.110 -2.673 1.00 0.35 C ATOM 0 H ILE A 40 -4.144 0.439 0.407 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.201 -0.394 -1.653 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.463 2.350 -0.472 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.208 0.992 -2.563 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.734 1.813 -1.107 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.687 3.002 -2.711 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.561 1.862 -1.935 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.672 1.292 -3.203 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -5.136 3.185 -3.080 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.939 3.955 -2.011 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.405 3.121 -3.489 1.00 0.35 H new ATOM 481 N TYR A 41 -0.281 -0.615 -0.197 1.00 0.18 N ATOM 482 CA TYR A 41 0.811 -0.994 0.671 1.00 0.19 C ATOM 483 C TYR A 41 2.091 -0.243 0.291 1.00 0.20 C ATOM 484 O TYR A 41 2.523 -0.313 -0.852 1.00 0.27 O ATOM 485 CB TYR A 41 1.098 -2.516 0.548 1.00 0.20 C ATOM 486 CG TYR A 41 -0.008 -3.472 0.966 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.341 -3.195 0.659 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.259 -4.618 1.687 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.363 -4.035 1.067 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.756 -5.458 2.087 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.002 -5.273 1.683 1.00 0.33 C ATOM 492 OH TYR A 41 -3.059 -5.999 2.205 1.00 0.42 O ATOM 0 H TYR A 41 -0.179 -0.953 -1.154 1.00 0.18 H new ATOM 0 HA TYR A 41 0.520 -0.744 1.691 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.352 -2.728 -0.491 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.982 -2.742 1.145 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.580 -2.308 0.092 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.280 -4.860 1.942 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.399 -3.764 0.925 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.530 -6.285 2.744 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.887 -5.483 2.113 1.00 0.42 H new ATOM 502 N ASN A 42 2.702 0.458 1.235 1.00 0.28 N ATOM 503 CA ASN A 42 4.041 1.020 1.030 1.00 0.34 C ATOM 504 C ASN A 42 5.052 -0.096 1.271 1.00 0.37 C ATOM 505 O ASN A 42 5.427 -0.401 2.392 1.00 0.54 O ATOM 506 CB ASN A 42 4.279 2.203 1.977 1.00 0.46 C ATOM 507 CG ASN A 42 4.277 1.830 3.446 1.00 1.50 C ATOM 508 OD1 ASN A 42 3.225 1.624 4.036 1.00 2.27 O ATOM 509 ND2 ASN A 42 5.453 1.782 4.051 1.00 2.35 N ATOM 0 H ASN A 42 2.298 0.654 2.151 1.00 0.28 H new ATOM 0 HA ASN A 42 4.146 1.402 0.014 1.00 0.34 H new ATOM 0 HB2 ASN A 42 5.236 2.664 1.732 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.509 2.954 1.803 1.00 0.46 H new ATOM 0 HD21 ASN A 42 5.506 1.567 5.047 1.00 2.35 H new ATOM 0 HD22 ASN A 42 6.306 1.960 3.522 1.00 2.35 H new ATOM 516 N VAL A 43 5.492 -0.727 0.216 1.00 0.36 N ATOM 517 CA VAL A 43 6.186 -1.984 0.363 1.00 0.38 C ATOM 518 C VAL A 43 7.682 -1.830 0.154 1.00 0.42 C ATOM 519 O VAL A 43 8.130 -1.058 -0.677 1.00 0.50 O ATOM 520 CB VAL A 43 5.615 -3.028 -0.621 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.799 -2.575 -2.050 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.247 -4.385 -0.412 1.00 0.98 C ATOM 0 H VAL A 43 5.386 -0.400 -0.744 1.00 0.36 H new ATOM 0 HA VAL A 43 6.029 -2.329 1.385 1.00 0.38 H new ATOM 0 HB VAL A 43 4.547 -3.120 -0.421 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.389 -3.326 -2.725 1.00 1.03 H new ATOM 0 HG12 VAL A 43 5.280 -1.629 -2.201 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.861 -2.443 -2.256 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.823 -5.097 -1.120 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.323 -4.313 -0.570 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.051 -4.725 0.605 1.00 0.98 H new ATOM 532 N ALA A 44 8.454 -2.541 0.944 1.00 0.50 N ATOM 533 CA ALA A 44 9.882 -2.575 0.743 1.00 0.59 C ATOM 534 C ALA A 44 10.234 -3.699 -0.215 1.00 0.58 C ATOM 535 O ALA A 44 10.113 -4.873 0.131 1.00 0.88 O ATOM 536 CB ALA A 44 10.610 -2.738 2.066 1.00 0.83 C ATOM 0 H ALA A 44 8.118 -3.101 1.728 1.00 0.50 H new ATOM 0 HA ALA A 44 10.202 -1.629 0.307 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.685 -2.761 1.889 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.368 -1.901 2.720 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.300 -3.670 2.539 1.00 0.83 H new ATOM 542 N SER A 45 10.582 -3.318 -1.438 1.00 0.57 N ATOM 543 CA SER A 45 11.110 -4.246 -2.433 1.00 0.63 C ATOM 544 C SER A 45 12.152 -5.161 -1.803 1.00 1.01 C ATOM 545 O SER A 45 13.246 -4.719 -1.458 1.00 1.78 O ATOM 546 CB SER A 45 11.724 -3.462 -3.594 1.00 0.73 C ATOM 547 OG SER A 45 12.444 -2.333 -3.124 1.00 1.62 O ATOM 0 H SER A 45 10.506 -2.356 -1.769 1.00 0.57 H new ATOM 0 HA SER A 45 10.295 -4.863 -2.812 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.390 -4.111 -4.163 1.00 0.73 H new ATOM 0 HB3 SER A 45 10.937 -3.138 -4.274 1.00 0.73 H new ATOM 0 HG SER A 45 13.020 -2.600 -2.378 1.00 1.62 H new ATOM 553 N LYS A 46 11.797 -6.425 -1.625 1.00 1.32 N ATOM 554 CA LYS A 46 12.659 -7.358 -0.927 1.00 1.69 C ATOM 555 C LYS A 46 12.682 -8.717 -1.610 1.00 1.14 C ATOM 556 O LYS A 46 11.770 -9.072 -2.360 1.00 1.47 O ATOM 557 CB LYS A 46 12.209 -7.500 0.527 1.00 2.68 C ATOM 558 CG LYS A 46 12.622 -6.338 1.418 1.00 3.45 C ATOM 559 CD LYS A 46 11.999 -6.448 2.800 1.00 4.39 C ATOM 560 CE LYS A 46 12.519 -5.380 3.746 1.00 5.19 C ATOM 561 NZ LYS A 46 13.960 -5.566 4.059 1.00 5.84 N ATOM 0 H LYS A 46 10.918 -6.825 -1.955 1.00 1.32 H new ATOM 0 HA LYS A 46 13.674 -6.960 -0.951 1.00 1.69 H new ATOM 0 HB2 LYS A 46 11.124 -7.597 0.553 1.00 2.68 H new ATOM 0 HB3 LYS A 46 12.621 -8.423 0.936 1.00 2.68 H new ATOM 0 HG2 LYS A 46 13.708 -6.315 1.508 1.00 3.45 H new ATOM 0 HG3 LYS A 46 12.321 -5.398 0.955 1.00 3.45 H new ATOM 0 HD2 LYS A 46 10.916 -6.362 2.717 1.00 4.39 H new ATOM 0 HD3 LYS A 46 12.210 -7.434 3.215 1.00 4.39 H new ATOM 0 HE2 LYS A 46 12.369 -4.397 3.300 1.00 5.19 H new ATOM 0 HE3 LYS A 46 11.942 -5.402 4.670 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 14.101 -5.513 5.088 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 14.273 -6.496 3.713 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 14.515 -4.819 3.595 1.00 5.84 H new ATOM 575 N CYS A 47 13.741 -9.464 -1.344 1.00 1.21 N ATOM 576 CA CYS A 47 13.915 -10.795 -1.891 1.00 1.53 C ATOM 577 C CYS A 47 14.084 -11.779 -0.748 1.00 1.99 C ATOM 578 O CYS A 47 15.030 -11.670 0.032 1.00 2.46 O ATOM 579 CB CYS A 47 15.142 -10.824 -2.807 1.00 2.04 C ATOM 580 SG CYS A 47 15.497 -12.445 -3.531 1.00 3.55 S ATOM 0 H CYS A 47 14.505 -9.161 -0.740 1.00 1.21 H new ATOM 0 HA CYS A 47 13.040 -11.072 -2.479 1.00 1.53 H new ATOM 0 HB2 CYS A 47 14.996 -10.104 -3.612 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.012 -10.495 -2.239 1.00 2.04 H new ATOM 0 HG CYS A 47 16.550 -12.361 -4.289 1.00 3.55 H new ATOM 586 N GLY A 48 13.160 -12.722 -0.636 1.00 2.39 N ATOM 587 CA GLY A 48 13.179 -13.641 0.487 1.00 2.91 C ATOM 588 C GLY A 48 12.827 -12.933 1.779 1.00 2.40 C ATOM 589 O GLY A 48 13.206 -13.371 2.869 1.00 2.46 O ATOM 0 H GLY A 48 12.399 -12.868 -1.299 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.472 -14.452 0.309 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.167 -14.093 0.574 1.00 2.91 H new ATOM 593 N TYR A 49 12.112 -11.824 1.647 1.00 2.15 N ATOM 594 CA TYR A 49 11.712 -11.021 2.789 1.00 1.79 C ATOM 595 C TYR A 49 10.223 -10.687 2.729 1.00 1.42 C ATOM 596 O TYR A 49 9.684 -10.343 1.677 1.00 1.67 O ATOM 597 CB TYR A 49 12.545 -9.737 2.875 1.00 2.10 C ATOM 598 CG TYR A 49 13.811 -9.865 3.688 1.00 2.40 C ATOM 599 CD1 TYR A 49 14.983 -10.355 3.125 1.00 3.01 C ATOM 600 CD2 TYR A 49 13.836 -9.477 5.020 1.00 2.66 C ATOM 601 CE1 TYR A 49 16.142 -10.453 3.868 1.00 3.74 C ATOM 602 CE2 TYR A 49 14.989 -9.574 5.770 1.00 3.26 C ATOM 603 CZ TYR A 49 16.139 -10.061 5.190 1.00 3.76 C ATOM 604 OH TYR A 49 17.291 -10.149 5.936 1.00 4.63 O ATOM 0 H TYR A 49 11.795 -11.459 0.749 1.00 2.15 H new ATOM 0 HA TYR A 49 11.894 -11.609 3.688 1.00 1.79 H new ATOM 0 HB2 TYR A 49 12.807 -9.421 1.865 1.00 2.10 H new ATOM 0 HB3 TYR A 49 11.929 -8.948 3.307 1.00 2.10 H new ATOM 0 HD1 TYR A 49 14.987 -10.664 2.090 1.00 3.01 H new ATOM 0 HD2 TYR A 49 12.936 -9.092 5.477 1.00 2.66 H new ATOM 0 HE1 TYR A 49 17.046 -10.834 3.417 1.00 3.74 H new ATOM 0 HE2 TYR A 49 14.990 -9.270 6.806 1.00 3.26 H new ATOM 0 HH TYR A 49 17.116 -9.831 6.846 1.00 4.63 H new ATOM 614 N THR A 50 9.581 -10.804 3.878 1.00 1.05 N ATOM 615 CA THR A 50 8.152 -10.574 4.044 1.00 0.81 C ATOM 616 C THR A 50 7.860 -10.665 5.546 1.00 0.77 C ATOM 617 O THR A 50 8.700 -11.152 6.304 1.00 1.44 O ATOM 618 CB THR A 50 7.310 -11.644 3.297 1.00 1.09 C ATOM 619 OG1 THR A 50 5.905 -11.427 3.523 1.00 1.93 O ATOM 620 CG2 THR A 50 7.685 -13.050 3.748 1.00 1.87 C ATOM 0 H THR A 50 10.049 -11.068 4.745 1.00 1.05 H new ATOM 0 HA THR A 50 7.886 -9.601 3.631 1.00 0.81 H new ATOM 0 HB THR A 50 7.524 -11.549 2.232 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.429 -12.282 3.471 1.00 1.93 H new ATOM 0 HG21 THR A 50 7.080 -13.779 3.209 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.740 -13.230 3.540 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.504 -13.149 4.818 1.00 1.87 H new ATOM 628 N LYS A 51 6.712 -10.180 5.986 1.00 0.61 N ATOM 629 CA LYS A 51 6.284 -10.354 7.363 1.00 0.56 C ATOM 630 C LYS A 51 4.912 -11.015 7.354 1.00 0.76 C ATOM 631 O LYS A 51 4.240 -11.128 8.377 1.00 1.55 O ATOM 632 CB LYS A 51 6.225 -9.001 8.076 1.00 0.59 C ATOM 633 CG LYS A 51 6.138 -9.105 9.589 1.00 1.22 C ATOM 634 CD LYS A 51 7.488 -9.389 10.213 1.00 1.39 C ATOM 635 CE LYS A 51 8.458 -8.254 9.938 1.00 1.46 C ATOM 636 NZ LYS A 51 9.632 -8.298 10.848 1.00 2.01 N ATOM 0 H LYS A 51 6.055 -9.659 5.405 1.00 0.61 H new ATOM 0 HA LYS A 51 6.994 -10.982 7.901 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.111 -8.423 7.812 1.00 0.59 H new ATOM 0 HB3 LYS A 51 5.361 -8.446 7.710 1.00 0.59 H new ATOM 0 HG2 LYS A 51 5.739 -8.175 9.995 1.00 1.22 H new ATOM 0 HG3 LYS A 51 5.439 -9.897 9.859 1.00 1.22 H new ATOM 0 HD2 LYS A 51 7.375 -9.525 11.289 1.00 1.39 H new ATOM 0 HD3 LYS A 51 7.889 -10.321 9.815 1.00 1.39 H new ATOM 0 HE2 LYS A 51 8.798 -8.309 8.904 1.00 1.46 H new ATOM 0 HE3 LYS A 51 7.944 -7.300 10.054 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 10.271 -7.507 10.629 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 9.310 -8.220 11.834 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 10.138 -9.198 10.719 1.00 2.01 H new ATOM 650 N GLY A 52 4.517 -11.456 6.165 1.00 0.45 N ATOM 651 CA GLY A 52 3.195 -12.005 5.968 1.00 0.51 C ATOM 652 C GLY A 52 2.396 -11.186 4.978 1.00 0.41 C ATOM 653 O GLY A 52 1.599 -11.726 4.214 1.00 0.41 O ATOM 0 H GLY A 52 5.099 -11.441 5.327 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.276 -13.032 5.611 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.669 -12.040 6.922 1.00 0.51 H new ATOM 657 N GLY A 53 2.636 -9.878 4.983 1.00 0.44 N ATOM 658 CA GLY A 53 1.902 -8.960 4.123 1.00 0.50 C ATOM 659 C GLY A 53 2.121 -9.185 2.635 1.00 0.36 C ATOM 660 O GLY A 53 1.360 -8.674 1.830 1.00 0.32 O ATOM 0 H GLY A 53 3.335 -9.431 5.575 1.00 0.44 H new ATOM 0 HA2 GLY A 53 0.838 -9.051 4.339 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.192 -7.939 4.371 1.00 0.50 H new ATOM 664 N TYR A 54 3.156 -9.925 2.255 1.00 0.37 N ATOM 665 CA TYR A 54 3.385 -10.232 0.853 1.00 0.36 C ATOM 666 C TYR A 54 2.360 -11.257 0.387 1.00 0.26 C ATOM 667 O TYR A 54 1.606 -11.010 -0.553 1.00 0.25 O ATOM 668 CB TYR A 54 4.799 -10.769 0.678 1.00 0.45 C ATOM 669 CG TYR A 54 5.278 -10.907 -0.751 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.439 -10.720 -1.854 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.598 -11.232 -0.982 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.921 -10.859 -3.148 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.086 -11.373 -2.252 1.00 0.65 C ATOM 674 CZ TYR A 54 6.253 -11.187 -3.339 1.00 0.56 C ATOM 675 OH TYR A 54 6.753 -11.338 -4.612 1.00 0.70 O ATOM 0 H TYR A 54 3.845 -10.320 2.895 1.00 0.37 H new ATOM 0 HA TYR A 54 3.277 -9.330 0.251 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.486 -10.111 1.210 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.858 -11.746 1.157 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.402 -10.464 -1.697 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.261 -11.378 -0.142 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.266 -10.713 -3.995 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.124 -11.630 -2.406 1.00 0.65 H new ATOM 0 HH TYR A 54 6.492 -10.568 -5.160 1.00 0.70 H new ATOM 685 N GLU A 55 2.326 -12.397 1.071 1.00 0.25 N ATOM 686 CA GLU A 55 1.334 -13.437 0.803 1.00 0.27 C ATOM 687 C GLU A 55 -0.051 -12.883 1.024 1.00 0.22 C ATOM 688 O GLU A 55 -1.032 -13.325 0.422 1.00 0.25 O ATOM 689 CB GLU A 55 1.540 -14.632 1.733 1.00 0.36 C ATOM 690 CG GLU A 55 2.970 -15.104 1.779 1.00 1.14 C ATOM 691 CD GLU A 55 3.788 -14.429 2.862 1.00 1.92 C ATOM 692 OE1 GLU A 55 4.359 -13.348 2.598 1.00 2.61 O ATOM 693 OE2 GLU A 55 3.862 -14.977 3.980 1.00 2.39 O ATOM 0 H GLU A 55 2.979 -12.626 1.821 1.00 0.25 H new ATOM 0 HA GLU A 55 1.450 -13.764 -0.230 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.220 -14.361 2.739 1.00 0.36 H new ATOM 0 HB3 GLU A 55 0.903 -15.454 1.406 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.985 -16.182 1.940 1.00 1.14 H new ATOM 0 HG3 GLU A 55 3.438 -14.920 0.812 1.00 1.14 H new ATOM 700 N THR A 56 -0.104 -11.886 1.877 1.00 0.25 N ATOM 701 CA THR A 56 -1.342 -11.292 2.270 1.00 0.24 C ATOM 702 C THR A 56 -1.856 -10.416 1.153 1.00 0.21 C ATOM 703 O THR A 56 -2.962 -10.604 0.658 1.00 0.22 O ATOM 704 CB THR A 56 -1.165 -10.481 3.573 1.00 0.26 C ATOM 705 OG1 THR A 56 -1.001 -11.382 4.676 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.339 -9.558 3.827 1.00 0.25 C ATOM 0 H THR A 56 0.718 -11.469 2.314 1.00 0.25 H new ATOM 0 HA THR A 56 -2.072 -12.077 2.466 1.00 0.24 H new ATOM 0 HB THR A 56 -0.277 -9.858 3.466 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.074 -11.699 4.705 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.175 -9.006 4.753 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.436 -8.856 2.999 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.253 -10.146 3.913 1.00 0.25 H new ATOM 714 N ALA A 57 -1.009 -9.502 0.738 1.00 0.19 N ATOM 715 CA ALA A 57 -1.298 -8.620 -0.362 1.00 0.20 C ATOM 716 C ALA A 57 -1.612 -9.417 -1.621 1.00 0.19 C ATOM 717 O ALA A 57 -2.560 -9.109 -2.344 1.00 0.22 O ATOM 718 CB ALA A 57 -0.103 -7.720 -0.585 1.00 0.22 C ATOM 0 H ALA A 57 -0.093 -9.351 1.160 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.174 -8.016 -0.128 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.306 -7.045 -1.416 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.088 -7.138 0.317 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.772 -8.328 -0.817 1.00 0.22 H new ATOM 724 N THR A 58 -0.816 -10.453 -1.863 1.00 0.17 N ATOM 725 CA THR A 58 -0.984 -11.291 -3.038 1.00 0.17 C ATOM 726 C THR A 58 -2.384 -11.917 -3.061 1.00 0.17 C ATOM 727 O THR A 58 -3.151 -11.742 -4.013 1.00 0.19 O ATOM 728 CB THR A 58 0.068 -12.414 -3.081 1.00 0.20 C ATOM 729 OG1 THR A 58 1.386 -11.852 -3.043 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.080 -13.264 -4.335 1.00 0.26 C ATOM 0 H THR A 58 -0.045 -10.731 -1.256 1.00 0.17 H new ATOM 0 HA THR A 58 -0.854 -10.651 -3.911 1.00 0.17 H new ATOM 0 HB THR A 58 -0.089 -13.051 -2.211 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.667 -11.739 -2.111 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.678 -14.048 -4.335 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.071 -13.717 -4.352 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.047 -12.636 -5.217 1.00 0.26 H new ATOM 738 N THR A 59 -2.712 -12.624 -1.983 1.00 0.16 N ATOM 739 CA THR A 59 -3.967 -13.354 -1.886 1.00 0.17 C ATOM 740 C THR A 59 -5.168 -12.413 -1.794 1.00 0.16 C ATOM 741 O THR A 59 -6.216 -12.680 -2.380 1.00 0.19 O ATOM 742 CB THR A 59 -3.953 -14.292 -0.665 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.827 -15.173 -0.752 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.235 -15.110 -0.585 1.00 0.46 C ATOM 0 H THR A 59 -2.118 -12.705 -1.158 1.00 0.16 H new ATOM 0 HA THR A 59 -4.067 -13.943 -2.798 1.00 0.17 H new ATOM 0 HB THR A 59 -3.880 -13.682 0.235 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.038 -14.734 -0.371 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.196 -15.763 0.287 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.090 -14.439 -0.498 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.338 -15.714 -1.486 1.00 0.46 H new ATOM 752 N LEU A 60 -5.003 -11.301 -1.091 1.00 0.13 N ATOM 753 CA LEU A 60 -6.088 -10.368 -0.871 1.00 0.13 C ATOM 754 C LEU A 60 -6.529 -9.763 -2.173 1.00 0.13 C ATOM 755 O LEU A 60 -7.719 -9.706 -2.480 1.00 0.15 O ATOM 756 CB LEU A 60 -5.642 -9.283 0.080 1.00 0.13 C ATOM 757 CG LEU A 60 -5.786 -9.657 1.537 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.220 -8.568 2.421 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.250 -9.897 1.855 1.00 0.35 C ATOM 0 H LEU A 60 -4.119 -11.026 -0.662 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.931 -10.903 -0.434 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.599 -9.041 -0.123 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.222 -8.381 -0.114 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.226 -10.572 1.729 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.332 -8.854 3.467 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.163 -8.428 2.194 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.757 -7.637 2.240 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.355 -10.167 2.906 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.819 -8.989 1.655 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.629 -10.708 1.233 1.00 0.35 H new ATOM 771 N TYR A 61 -5.552 -9.333 -2.942 1.00 0.14 N ATOM 772 CA TYR A 61 -5.808 -8.759 -4.236 1.00 0.15 C ATOM 773 C TYR A 61 -6.555 -9.743 -5.120 1.00 0.17 C ATOM 774 O TYR A 61 -7.597 -9.435 -5.633 1.00 0.22 O ATOM 775 CB TYR A 61 -4.509 -8.366 -4.909 1.00 0.17 C ATOM 776 CG TYR A 61 -4.756 -7.694 -6.223 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.866 -6.894 -6.394 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.885 -7.839 -7.275 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.101 -6.253 -7.588 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.105 -7.207 -8.479 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.219 -6.411 -8.633 1.00 0.23 C ATOM 782 OH TYR A 61 -5.447 -5.767 -9.827 1.00 0.28 O ATOM 0 H TYR A 61 -4.565 -9.373 -2.686 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.422 -7.870 -4.093 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.947 -7.697 -4.257 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.894 -9.253 -5.062 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.562 -6.769 -5.578 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.010 -8.461 -7.156 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.974 -5.628 -7.705 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.410 -7.334 -9.296 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.729 -5.984 -10.458 1.00 0.28 H new ATOM 792 N ASN A 62 -6.035 -10.941 -5.238 1.00 0.18 N ATOM 793 CA ASN A 62 -6.558 -11.929 -6.167 1.00 0.22 C ATOM 794 C ASN A 62 -7.910 -12.433 -5.711 1.00 0.20 C ATOM 795 O ASN A 62 -8.726 -12.868 -6.524 1.00 0.24 O ATOM 796 CB ASN A 62 -5.583 -13.097 -6.330 1.00 0.27 C ATOM 797 CG ASN A 62 -4.424 -12.756 -7.244 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.500 -12.955 -8.454 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.341 -12.246 -6.680 1.00 1.12 N ATOM 0 H ASN A 62 -5.235 -11.265 -4.694 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.678 -11.445 -7.136 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.198 -13.385 -5.352 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.116 -13.959 -6.730 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -2.533 -12.004 -7.254 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.314 -12.095 -5.672 1.00 1.12 H new ATOM 806 N LYS A 63 -8.164 -12.363 -4.412 1.00 0.18 N ATOM 807 CA LYS A 63 -9.399 -12.873 -3.883 1.00 0.20 C ATOM 808 C LYS A 63 -10.464 -11.807 -4.008 1.00 0.18 C ATOM 809 O LYS A 63 -11.654 -12.109 -4.063 1.00 0.22 O ATOM 810 CB LYS A 63 -9.219 -13.306 -2.420 1.00 0.26 C ATOM 811 CG LYS A 63 -10.448 -13.959 -1.802 1.00 0.29 C ATOM 812 CD LYS A 63 -10.092 -14.790 -0.574 1.00 0.64 C ATOM 813 CE LYS A 63 -9.605 -13.928 0.579 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.328 -14.728 1.803 1.00 1.54 N ATOM 0 H LYS A 63 -7.532 -11.961 -3.720 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.706 -13.752 -4.450 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.383 -14.003 -2.360 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.949 -12.433 -1.826 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.167 -13.189 -1.523 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -10.933 -14.595 -2.543 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -10.966 -15.359 -0.256 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.319 -15.512 -0.837 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.699 -13.401 0.279 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.355 -13.170 0.805 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -8.951 -14.106 2.546 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.209 -15.170 2.136 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.631 -15.468 1.584 1.00 1.54 H new ATOM 828 N TYR A 64 -10.043 -10.546 -4.086 1.00 0.16 N ATOM 829 CA TYR A 64 -11.015 -9.480 -4.018 1.00 0.16 C ATOM 830 C TYR A 64 -10.974 -8.464 -5.150 1.00 0.17 C ATOM 831 O TYR A 64 -11.854 -7.602 -5.227 1.00 0.17 O ATOM 832 CB TYR A 64 -10.944 -8.831 -2.657 1.00 0.15 C ATOM 833 CG TYR A 64 -11.450 -9.766 -1.599 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.731 -10.288 -1.641 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.630 -10.107 -0.536 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.178 -11.131 -0.645 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.063 -10.944 0.457 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.427 -11.521 0.302 1.00 0.24 C ATOM 839 OH TYR A 64 -12.785 -12.294 1.395 1.00 0.31 O ATOM 0 H TYR A 64 -9.072 -10.253 -4.192 1.00 0.16 H new ATOM 0 HA TYR A 64 -11.989 -9.949 -4.162 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.915 -8.547 -2.437 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.535 -7.915 -2.654 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.386 -10.033 -2.461 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.629 -9.704 -0.490 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.203 -11.471 -0.671 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.445 -11.175 1.312 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.261 -12.019 2.176 1.00 0.31 H new ATOM 849 N LYS A 65 -10.016 -8.575 -6.052 1.00 0.20 N ATOM 850 CA LYS A 65 -10.043 -7.755 -7.257 1.00 0.23 C ATOM 851 C LYS A 65 -11.253 -8.136 -8.050 1.00 0.20 C ATOM 852 O LYS A 65 -11.824 -7.324 -8.775 1.00 0.22 O ATOM 853 CB LYS A 65 -8.775 -7.899 -8.109 1.00 0.34 C ATOM 854 CG LYS A 65 -8.329 -9.327 -8.369 1.00 0.29 C ATOM 855 CD LYS A 65 -7.016 -9.354 -9.131 1.00 0.38 C ATOM 856 CE LYS A 65 -7.243 -9.432 -10.631 1.00 0.80 C ATOM 857 NZ LYS A 65 -5.964 -9.467 -11.394 1.00 1.35 N ATOM 0 H LYS A 65 -9.222 -9.211 -5.980 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.084 -6.707 -6.959 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.943 -7.408 -9.067 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.962 -7.366 -7.615 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.216 -9.855 -7.422 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.095 -9.854 -8.938 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.439 -8.460 -8.896 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.424 -10.210 -8.807 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -7.826 -10.323 -10.862 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.832 -8.573 -10.952 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.169 -9.520 -12.412 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.417 -8.605 -11.195 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.412 -10.301 -11.108 1.00 1.35 H new ATOM 871 N SER A 66 -11.657 -9.382 -7.857 1.00 0.23 N ATOM 872 CA SER A 66 -12.896 -9.886 -8.439 1.00 0.26 C ATOM 873 C SER A 66 -14.064 -8.917 -8.177 1.00 0.25 C ATOM 874 O SER A 66 -14.943 -8.756 -9.023 1.00 0.31 O ATOM 875 CB SER A 66 -13.226 -11.273 -7.883 1.00 0.32 C ATOM 876 OG SER A 66 -14.337 -11.839 -8.558 1.00 1.28 O ATOM 0 H SER A 66 -11.145 -10.066 -7.300 1.00 0.23 H new ATOM 0 HA SER A 66 -12.752 -9.965 -9.517 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.360 -11.927 -7.988 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.442 -11.200 -6.817 1.00 0.32 H new ATOM 0 HG SER A 66 -14.528 -12.726 -8.187 1.00 1.28 H new ATOM 882 N GLN A 67 -14.070 -8.266 -7.009 1.00 0.21 N ATOM 883 CA GLN A 67 -15.086 -7.256 -6.711 1.00 0.20 C ATOM 884 C GLN A 67 -14.623 -5.840 -7.093 1.00 0.20 C ATOM 885 O GLN A 67 -15.431 -5.012 -7.514 1.00 0.27 O ATOM 886 CB GLN A 67 -15.470 -7.307 -5.232 1.00 0.21 C ATOM 887 CG GLN A 67 -16.168 -8.600 -4.842 1.00 0.38 C ATOM 888 CD GLN A 67 -16.602 -8.622 -3.392 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.701 -8.184 -3.054 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.744 -9.140 -2.526 1.00 0.46 N ATOM 0 H GLN A 67 -13.391 -8.419 -6.264 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.962 -7.488 -7.317 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.572 -7.188 -4.625 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.123 -6.465 -5.003 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.041 -8.742 -5.479 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.498 -9.439 -5.028 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.843 -9.492 -2.849 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.984 -9.187 -1.536 1.00 0.46 H new ATOM 899 N GLY A 68 -13.324 -5.579 -6.967 1.00 0.17 N ATOM 900 CA GLY A 68 -12.786 -4.258 -7.229 1.00 0.18 C ATOM 901 C GLY A 68 -11.587 -3.954 -6.346 1.00 0.15 C ATOM 902 O GLY A 68 -10.930 -2.924 -6.505 1.00 0.17 O ATOM 0 H GLY A 68 -12.629 -6.270 -6.684 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.494 -4.185 -8.277 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.561 -3.510 -7.061 1.00 0.18 H new ATOM 906 N PHE A 69 -11.301 -4.867 -5.421 1.00 0.14 N ATOM 907 CA PHE A 69 -10.204 -4.709 -4.468 1.00 0.13 C ATOM 908 C PHE A 69 -8.852 -4.823 -5.153 1.00 0.14 C ATOM 909 O PHE A 69 -8.690 -5.568 -6.105 1.00 0.18 O ATOM 910 CB PHE A 69 -10.305 -5.775 -3.373 1.00 0.14 C ATOM 911 CG PHE A 69 -9.290 -5.618 -2.293 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.089 -4.387 -1.742 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.538 -6.688 -1.831 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.173 -4.193 -0.763 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.604 -6.506 -0.832 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.417 -5.252 -0.299 1.00 0.14 C ATOM 0 H PHE A 69 -11.822 -5.737 -5.311 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.287 -3.715 -4.029 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.301 -5.738 -2.932 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.193 -6.760 -3.825 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.672 -3.549 -2.094 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.685 -7.670 -2.256 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -8.033 -3.207 -0.344 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.024 -7.342 -0.471 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.683 -5.096 0.478 1.00 0.14 H new ATOM 926 N THR A 70 -7.896 -4.053 -4.680 1.00 0.13 N ATOM 927 CA THR A 70 -6.544 -4.149 -5.130 1.00 0.12 C ATOM 928 C THR A 70 -5.654 -4.121 -3.941 1.00 0.12 C ATOM 929 O THR A 70 -5.997 -3.554 -2.918 1.00 0.19 O ATOM 930 CB THR A 70 -6.180 -2.987 -6.055 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.112 -3.356 -6.921 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.789 -1.747 -5.273 1.00 0.19 C ATOM 0 H THR A 70 -8.047 -3.340 -3.966 1.00 0.13 H new ATOM 0 HA THR A 70 -6.424 -5.077 -5.690 1.00 0.12 H new ATOM 0 HB THR A 70 -7.067 -2.755 -6.645 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.261 -4.265 -7.255 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.538 -0.944 -5.966 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.623 -1.436 -4.644 1.00 0.19 H new ATOM 0 HG23 THR A 70 -4.925 -1.969 -4.646 1.00 0.19 H new ATOM 940 N VAL A 71 -4.549 -4.763 -4.052 1.00 0.13 N ATOM 941 CA VAL A 71 -3.459 -4.419 -3.222 1.00 0.13 C ATOM 942 C VAL A 71 -2.451 -3.692 -4.059 1.00 0.13 C ATOM 943 O VAL A 71 -1.699 -4.292 -4.813 1.00 0.15 O ATOM 944 CB VAL A 71 -2.832 -5.634 -2.560 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.501 -5.253 -1.930 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.782 -6.203 -1.522 1.00 0.17 C ATOM 0 H VAL A 71 -4.378 -5.526 -4.707 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.817 -3.783 -2.412 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.646 -6.401 -3.312 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.058 -6.130 -1.457 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.828 -4.877 -2.701 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.662 -4.479 -1.180 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.327 -7.074 -1.051 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.988 -5.447 -0.764 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.714 -6.497 -2.004 1.00 0.17 H new ATOM 956 N LEU A 72 -2.464 -2.392 -3.951 1.00 0.17 N ATOM 957 CA LEU A 72 -1.498 -1.601 -4.662 1.00 0.22 C ATOM 958 C LEU A 72 -0.259 -1.525 -3.816 1.00 0.19 C ATOM 959 O LEU A 72 -0.315 -0.996 -2.732 1.00 0.28 O ATOM 960 CB LEU A 72 -2.007 -0.180 -4.881 1.00 0.43 C ATOM 961 CG LEU A 72 -2.915 0.060 -6.067 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.904 1.165 -5.768 1.00 1.04 C ATOM 963 CD2 LEU A 72 -2.076 0.437 -7.256 1.00 1.00 C ATOM 0 H LEU A 72 -3.126 -1.862 -3.384 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.306 -2.059 -5.632 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -2.539 0.129 -3.981 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.142 0.476 -4.981 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.474 -0.852 -6.278 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.547 1.322 -6.634 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -4.514 0.885 -4.909 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.365 2.086 -5.546 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -2.722 0.612 -8.116 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -1.515 1.345 -7.033 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -1.381 -0.372 -7.482 1.00 1.00 H new ATOM 975 N ALA A 73 0.853 -2.013 -4.287 1.00 0.22 N ATOM 976 CA ALA A 73 2.060 -1.908 -3.503 1.00 0.30 C ATOM 977 C ALA A 73 3.006 -0.890 -4.100 1.00 0.23 C ATOM 978 O ALA A 73 3.560 -1.075 -5.177 1.00 0.32 O ATOM 979 CB ALA A 73 2.728 -3.253 -3.343 1.00 0.51 C ATOM 0 H ALA A 73 0.954 -2.478 -5.189 1.00 0.22 H new ATOM 0 HA ALA A 73 1.783 -1.561 -2.508 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.634 -3.141 -2.748 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.047 -3.940 -2.841 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.986 -3.650 -4.325 1.00 0.51 H new ATOM 985 N PHE A 74 3.172 0.188 -3.373 1.00 0.29 N ATOM 986 CA PHE A 74 4.080 1.250 -3.730 1.00 0.33 C ATOM 987 C PHE A 74 5.419 0.990 -3.046 1.00 0.35 C ATOM 988 O PHE A 74 5.581 1.280 -1.863 1.00 0.37 O ATOM 989 CB PHE A 74 3.485 2.589 -3.285 1.00 0.44 C ATOM 990 CG PHE A 74 2.401 3.143 -4.187 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.410 2.334 -4.755 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.389 4.496 -4.476 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.452 2.878 -5.587 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.428 5.043 -5.312 1.00 0.43 C ATOM 995 CZ PHE A 74 0.457 4.226 -5.869 1.00 0.35 C ATOM 0 H PHE A 74 2.670 0.355 -2.501 1.00 0.29 H new ATOM 0 HA PHE A 74 4.234 1.285 -4.809 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.076 2.471 -2.282 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.289 3.322 -3.217 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.395 1.276 -4.541 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.142 5.138 -4.042 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.306 2.242 -6.020 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.436 6.101 -5.528 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.294 4.645 -6.522 1.00 0.35 H new ATOM 1005 N PRO A 75 6.396 0.432 -3.777 1.00 0.37 N ATOM 1006 CA PRO A 75 7.612 -0.099 -3.181 1.00 0.46 C ATOM 1007 C PRO A 75 8.665 0.954 -2.935 1.00 0.61 C ATOM 1008 O PRO A 75 9.496 1.203 -3.789 1.00 1.30 O ATOM 1009 CB PRO A 75 8.088 -1.113 -4.214 1.00 0.54 C ATOM 1010 CG PRO A 75 7.617 -0.575 -5.521 1.00 0.44 C ATOM 1011 CD PRO A 75 6.408 0.299 -5.238 1.00 0.38 C ATOM 0 HA PRO A 75 7.426 -0.523 -2.194 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.173 -1.216 -4.197 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.671 -2.101 -4.020 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.404 0.003 -6.005 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.354 -1.387 -6.199 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.495 1.270 -5.726 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.490 -0.160 -5.604 1.00 0.38 H new ATOM 1019 N SER A 76 8.639 1.490 -1.722 1.00 0.41 N ATOM 1020 CA SER A 76 9.444 2.632 -1.295 1.00 0.37 C ATOM 1021 C SER A 76 10.723 2.827 -2.053 1.00 0.50 C ATOM 1022 O SER A 76 11.495 1.898 -2.308 1.00 0.74 O ATOM 1023 CB SER A 76 9.741 2.506 0.201 1.00 0.53 C ATOM 1024 OG SER A 76 8.551 2.422 0.964 1.00 1.44 O ATOM 0 H SER A 76 8.037 1.131 -0.981 1.00 0.41 H new ATOM 0 HA SER A 76 8.846 3.517 -1.512 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.351 1.620 0.378 1.00 0.53 H new ATOM 0 HB3 SER A 76 10.325 3.366 0.530 1.00 0.53 H new ATOM 0 HG SER A 76 8.486 3.201 1.555 1.00 1.44 H new ATOM 1030 N ASN A 77 10.925 4.087 -2.384 1.00 0.52 N ATOM 1031 CA ASN A 77 12.074 4.516 -3.122 1.00 0.72 C ATOM 1032 C ASN A 77 13.264 4.423 -2.212 1.00 0.70 C ATOM 1033 O ASN A 77 13.669 5.408 -1.603 1.00 0.75 O ATOM 1034 CB ASN A 77 11.894 5.949 -3.629 1.00 0.93 C ATOM 1035 CG ASN A 77 13.033 6.402 -4.524 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.623 5.604 -5.249 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.359 7.682 -4.462 1.00 1.46 N ATOM 0 H ASN A 77 10.284 4.842 -2.141 1.00 0.52 H new ATOM 0 HA ASN A 77 12.215 3.881 -3.996 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.955 6.020 -4.179 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.816 6.624 -2.777 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.127 8.041 -5.030 1.00 1.46 H new ATOM 0 HD22 ASN A 77 12.843 8.311 -3.846 1.00 1.46 H new ATOM 1044 N GLN A 78 13.803 3.210 -2.128 1.00 0.85 N ATOM 1045 CA GLN A 78 14.960 2.880 -1.297 1.00 0.98 C ATOM 1046 C GLN A 78 16.089 3.865 -1.520 1.00 0.98 C ATOM 1047 O GLN A 78 17.036 3.957 -0.741 1.00 1.12 O ATOM 1048 CB GLN A 78 15.428 1.467 -1.630 1.00 1.35 C ATOM 1049 CG GLN A 78 14.311 0.438 -1.559 1.00 2.07 C ATOM 1050 CD GLN A 78 13.659 0.378 -0.196 1.00 2.74 C ATOM 1051 OE1 GLN A 78 14.309 0.598 0.821 1.00 3.34 O ATOM 1052 NE2 GLN A 78 12.370 0.090 -0.168 1.00 3.30 N ATOM 0 H GLN A 78 13.440 2.410 -2.647 1.00 0.85 H new ATOM 0 HA GLN A 78 14.667 2.937 -0.249 1.00 0.98 H new ATOM 0 HB2 GLN A 78 15.858 1.459 -2.632 1.00 1.35 H new ATOM 0 HB3 GLN A 78 16.222 1.181 -0.940 1.00 1.35 H new ATOM 0 HG2 GLN A 78 13.556 0.675 -2.308 1.00 2.07 H new ATOM 0 HG3 GLN A 78 14.711 -0.544 -1.809 1.00 2.07 H new ATOM 0 HE21 GLN A 78 11.868 -0.086 -1.038 1.00 3.30 H new ATOM 0 HE22 GLN A 78 11.877 0.044 0.724 1.00 3.30 H new ATOM 1061 N PHE A 79 15.941 4.617 -2.581 1.00 0.98 N ATOM 1062 CA PHE A 79 16.955 5.540 -3.025 1.00 1.19 C ATOM 1063 C PHE A 79 16.885 6.848 -2.236 1.00 1.20 C ATOM 1064 O PHE A 79 17.812 7.660 -2.277 1.00 1.54 O ATOM 1065 CB PHE A 79 16.763 5.794 -4.511 1.00 1.32 C ATOM 1066 CG PHE A 79 17.897 6.538 -5.151 1.00 1.57 C ATOM 1067 CD1 PHE A 79 19.153 5.961 -5.223 1.00 1.82 C ATOM 1068 CD2 PHE A 79 17.709 7.803 -5.680 1.00 2.02 C ATOM 1069 CE1 PHE A 79 20.206 6.633 -5.812 1.00 2.25 C ATOM 1070 CE2 PHE A 79 18.757 8.482 -6.270 1.00 2.64 C ATOM 1071 CZ PHE A 79 20.007 7.897 -6.337 1.00 2.68 C ATOM 0 H PHE A 79 15.106 4.606 -3.166 1.00 0.98 H new ATOM 0 HA PHE A 79 17.941 5.110 -2.852 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.635 4.838 -5.020 1.00 1.32 H new ATOM 0 HB3 PHE A 79 15.842 6.359 -4.657 1.00 1.32 H new ATOM 0 HD1 PHE A 79 19.311 4.974 -4.814 1.00 1.82 H new ATOM 0 HD2 PHE A 79 16.733 8.264 -5.631 1.00 2.02 H new ATOM 0 HE1 PHE A 79 21.182 6.173 -5.862 1.00 2.25 H new ATOM 0 HE2 PHE A 79 18.600 9.469 -6.679 1.00 2.64 H new ATOM 0 HZ PHE A 79 20.828 8.426 -6.799 1.00 2.68 H new ATOM 1081 N GLY A 80 15.792 7.047 -1.510 1.00 1.10 N ATOM 1082 CA GLY A 80 15.642 8.246 -0.718 1.00 1.22 C ATOM 1083 C GLY A 80 16.473 8.189 0.546 1.00 1.24 C ATOM 1084 O GLY A 80 16.885 9.218 1.080 1.00 1.98 O ATOM 0 H GLY A 80 15.008 6.397 -1.458 1.00 1.10 H new ATOM 0 HA2 GLY A 80 15.938 9.112 -1.309 1.00 1.22 H new ATOM 0 HA3 GLY A 80 14.592 8.381 -0.458 1.00 1.22 H new ATOM 1088 N GLY A 81 16.722 6.975 1.017 1.00 1.18 N ATOM 1089 CA GLY A 81 17.522 6.789 2.210 1.00 1.21 C ATOM 1090 C GLY A 81 16.740 7.057 3.478 1.00 1.14 C ATOM 1091 O GLY A 81 17.315 7.432 4.501 1.00 1.49 O ATOM 0 H GLY A 81 16.382 6.112 0.592 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.905 5.769 2.232 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.386 7.453 2.172 1.00 1.21 H new ATOM 1095 N GLN A 82 15.426 6.890 3.409 1.00 0.86 N ATOM 1096 CA GLN A 82 14.573 7.043 4.580 1.00 0.82 C ATOM 1097 C GLN A 82 13.463 6.030 4.558 1.00 0.77 C ATOM 1098 O GLN A 82 12.372 6.291 5.040 1.00 0.91 O ATOM 1099 CB GLN A 82 13.965 8.453 4.652 1.00 0.80 C ATOM 1100 CG GLN A 82 13.481 8.978 3.305 1.00 0.75 C ATOM 1101 CD GLN A 82 11.976 8.929 3.140 1.00 1.09 C ATOM 1102 OE1 GLN A 82 11.261 9.857 3.524 1.00 1.74 O ATOM 1103 NE2 GLN A 82 11.496 7.864 2.520 1.00 1.14 N ATOM 0 H GLN A 82 14.927 6.648 2.553 1.00 0.86 H new ATOM 0 HA GLN A 82 15.198 6.886 5.459 1.00 0.82 H new ATOM 0 HB2 GLN A 82 13.129 8.444 5.351 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.709 9.140 5.054 1.00 0.80 H new ATOM 0 HG2 GLN A 82 13.818 10.007 3.183 1.00 0.75 H new ATOM 0 HG3 GLN A 82 13.944 8.395 2.509 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.127 7.121 2.220 1.00 1.14 H new ATOM 0 HE22 GLN A 82 10.495 7.786 2.341 1.00 1.14 H new ATOM 1112 N GLU A 83 13.755 4.873 4.026 1.00 0.75 N ATOM 1113 CA GLU A 83 12.720 3.925 3.693 1.00 0.74 C ATOM 1114 C GLU A 83 12.413 3.011 4.877 1.00 0.72 C ATOM 1115 O GLU A 83 13.282 2.721 5.701 1.00 0.88 O ATOM 1116 CB GLU A 83 13.158 3.159 2.454 1.00 0.87 C ATOM 1117 CG GLU A 83 13.742 4.076 1.389 1.00 1.16 C ATOM 1118 CD GLU A 83 12.921 5.330 1.176 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.739 5.224 0.787 1.00 3.07 O ATOM 1120 OE2 GLU A 83 13.471 6.429 1.399 1.00 2.83 O ATOM 0 H GLU A 83 14.703 4.562 3.813 1.00 0.75 H new ATOM 0 HA GLU A 83 11.786 4.442 3.470 1.00 0.74 H new ATOM 0 HB2 GLU A 83 13.900 2.411 2.734 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.305 2.622 2.040 1.00 0.87 H new ATOM 0 HG2 GLU A 83 14.756 4.356 1.674 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.815 3.531 0.448 1.00 1.16 H new ATOM 1127 N PRO A 84 11.158 2.563 4.982 1.00 0.63 N ATOM 1128 CA PRO A 84 10.658 1.853 6.157 1.00 0.75 C ATOM 1129 C PRO A 84 11.073 0.379 6.202 1.00 1.00 C ATOM 1130 O PRO A 84 10.472 -0.477 5.549 1.00 1.75 O ATOM 1131 CB PRO A 84 9.148 2.012 6.003 1.00 1.02 C ATOM 1132 CG PRO A 84 8.919 2.023 4.539 1.00 0.72 C ATOM 1133 CD PRO A 84 10.119 2.707 3.943 1.00 0.61 C ATOM 0 HA PRO A 84 11.059 2.249 7.090 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.613 1.192 6.482 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.798 2.935 6.466 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.814 1.010 4.152 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.001 2.556 4.290 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.422 2.239 3.006 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.915 3.755 3.724 1.00 0.61 H new ATOM 1141 N GLY A 85 12.123 0.094 6.967 1.00 1.45 N ATOM 1142 CA GLY A 85 12.569 -1.276 7.149 1.00 1.82 C ATOM 1143 C GLY A 85 13.515 -1.731 6.055 1.00 1.61 C ATOM 1144 O GLY A 85 13.864 -2.913 5.967 1.00 2.20 O ATOM 0 H GLY A 85 12.675 0.791 7.466 1.00 1.45 H new ATOM 0 HA2 GLY A 85 13.066 -1.367 8.115 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.702 -1.936 7.173 1.00 1.82 H new ATOM 1148 N ASN A 86 13.938 -0.792 5.226 1.00 1.49 N ATOM 1149 CA ASN A 86 14.813 -1.100 4.108 1.00 2.04 C ATOM 1150 C ASN A 86 15.536 0.166 3.678 1.00 1.94 C ATOM 1151 O ASN A 86 15.080 1.264 3.982 1.00 2.70 O ATOM 1152 CB ASN A 86 13.986 -1.658 2.947 1.00 2.78 C ATOM 1153 CG ASN A 86 14.801 -2.519 2.005 1.00 3.58 C ATOM 1154 OD1 ASN A 86 14.872 -3.730 2.170 1.00 4.07 O ATOM 1155 ND2 ASN A 86 15.418 -1.906 1.010 1.00 4.20 N ATOM 0 H ASN A 86 13.688 0.194 5.307 1.00 1.49 H new ATOM 0 HA ASN A 86 15.547 -1.849 4.407 1.00 2.04 H new ATOM 0 HB2 ASN A 86 13.159 -2.246 3.346 1.00 2.78 H new ATOM 0 HB3 ASN A 86 13.548 -0.831 2.388 1.00 2.78 H new ATOM 0 HD21 ASN A 86 15.977 -2.444 0.348 1.00 4.20 H new ATOM 0 HD22 ASN A 86 15.336 -0.895 0.904 1.00 4.20 H new ATOM 1162 N GLU A 87 16.659 0.025 2.987 1.00 1.52 N ATOM 1163 CA GLU A 87 17.388 1.186 2.500 1.00 1.46 C ATOM 1164 C GLU A 87 18.375 0.786 1.404 1.00 1.60 C ATOM 1165 O GLU A 87 18.290 1.271 0.279 1.00 2.15 O ATOM 1166 CB GLU A 87 18.137 1.880 3.642 1.00 1.61 C ATOM 1167 CG GLU A 87 18.745 3.215 3.235 1.00 2.19 C ATOM 1168 CD GLU A 87 19.393 3.947 4.389 1.00 2.58 C ATOM 1169 OE1 GLU A 87 18.670 4.573 5.185 1.00 2.84 O ATOM 1170 OE2 GLU A 87 20.638 3.911 4.504 1.00 3.02 O ATOM 0 H GLU A 87 17.081 -0.874 2.753 1.00 1.52 H new ATOM 0 HA GLU A 87 16.661 1.883 2.083 1.00 1.46 H new ATOM 0 HB2 GLU A 87 17.451 2.039 4.474 1.00 1.61 H new ATOM 0 HB3 GLU A 87 18.928 1.222 4.002 1.00 1.61 H new ATOM 0 HG2 GLU A 87 19.488 3.047 2.456 1.00 2.19 H new ATOM 0 HG3 GLU A 87 17.968 3.845 2.803 1.00 2.19 H new ATOM 1177 N GLU A 88 19.288 -0.132 1.721 1.00 1.57 N ATOM 1178 CA GLU A 88 20.417 -0.398 0.838 1.00 1.77 C ATOM 1179 C GLU A 88 20.741 -1.900 0.735 1.00 1.62 C ATOM 1180 O GLU A 88 21.857 -2.272 0.371 1.00 1.62 O ATOM 1181 CB GLU A 88 21.641 0.376 1.351 1.00 2.18 C ATOM 1182 CG GLU A 88 22.706 0.641 0.294 1.00 2.68 C ATOM 1183 CD GLU A 88 22.282 1.687 -0.717 1.00 3.33 C ATOM 1184 OE1 GLU A 88 21.127 1.644 -1.183 1.00 3.66 O ATOM 1185 OE2 GLU A 88 23.114 2.549 -1.076 1.00 3.92 O ATOM 0 H GLU A 88 19.267 -0.696 2.571 1.00 1.57 H new ATOM 0 HA GLU A 88 20.150 -0.066 -0.165 1.00 1.77 H new ATOM 0 HB2 GLU A 88 21.307 1.330 1.760 1.00 2.18 H new ATOM 0 HB3 GLU A 88 22.092 -0.183 2.171 1.00 2.18 H new ATOM 0 HG2 GLU A 88 23.624 0.966 0.783 1.00 2.68 H new ATOM 0 HG3 GLU A 88 22.934 -0.289 -0.226 1.00 2.68 H new ATOM 1192 N GLU A 89 19.782 -2.769 1.050 1.00 1.62 N ATOM 1193 CA GLU A 89 20.014 -4.212 0.910 1.00 1.59 C ATOM 1194 C GLU A 89 19.656 -4.672 -0.496 1.00 1.49 C ATOM 1195 O GLU A 89 20.074 -5.741 -0.944 1.00 1.59 O ATOM 1196 CB GLU A 89 19.222 -5.023 1.951 1.00 1.70 C ATOM 1197 CG GLU A 89 17.706 -4.987 1.781 1.00 1.75 C ATOM 1198 CD GLU A 89 16.982 -5.672 2.926 1.00 2.11 C ATOM 1199 OE1 GLU A 89 17.235 -5.321 4.093 1.00 2.45 O ATOM 1200 OE2 GLU A 89 16.155 -6.572 2.665 1.00 2.65 O ATOM 0 H GLU A 89 18.858 -2.512 1.396 1.00 1.62 H new ATOM 0 HA GLU A 89 21.074 -4.391 1.088 1.00 1.59 H new ATOM 0 HB2 GLU A 89 19.552 -6.061 1.909 1.00 1.70 H new ATOM 0 HB3 GLU A 89 19.470 -4.650 2.945 1.00 1.70 H new ATOM 0 HG2 GLU A 89 17.375 -3.951 1.713 1.00 1.75 H new ATOM 0 HG3 GLU A 89 17.436 -5.471 0.842 1.00 1.75 H new ATOM 1207 N ILE A 90 18.887 -3.847 -1.190 1.00 1.43 N ATOM 1208 CA ILE A 90 18.430 -4.167 -2.530 1.00 1.39 C ATOM 1209 C ILE A 90 19.514 -3.937 -3.579 1.00 1.49 C ATOM 1210 O ILE A 90 20.700 -3.900 -3.258 1.00 1.57 O ATOM 1211 CB ILE A 90 17.206 -3.328 -2.921 1.00 1.45 C ATOM 1212 CG1 ILE A 90 17.510 -1.833 -2.808 1.00 1.74 C ATOM 1213 CG2 ILE A 90 16.010 -3.690 -2.057 1.00 1.76 C ATOM 1214 CD1 ILE A 90 16.672 -0.985 -3.737 1.00 2.15 C ATOM 0 H ILE A 90 18.565 -2.944 -0.842 1.00 1.43 H new ATOM 0 HA ILE A 90 18.168 -5.225 -2.508 1.00 1.39 H new ATOM 0 HB ILE A 90 16.964 -3.551 -3.960 1.00 1.45 H new ATOM 0 HG12 ILE A 90 17.341 -1.511 -1.780 1.00 1.74 H new ATOM 0 HG13 ILE A 90 18.565 -1.665 -3.025 1.00 1.74 H new ATOM 0 HG21 ILE A 90 15.153 -3.084 -2.350 1.00 1.76 H new ATOM 0 HG22 ILE A 90 15.771 -4.745 -2.190 1.00 1.76 H new ATOM 0 HG23 ILE A 90 16.247 -3.501 -1.010 1.00 1.76 H new ATOM 0 HD11 ILE A 90 16.936 0.065 -3.608 1.00 2.15 H new ATOM 0 HD12 ILE A 90 16.859 -1.282 -4.769 1.00 2.15 H new ATOM 0 HD13 ILE A 90 15.616 -1.125 -3.505 1.00 2.15 H new ATOM 1226 N LYS A 91 19.054 -3.801 -4.833 1.00 1.71 N ATOM 1227 CA LYS A 91 19.872 -3.505 -6.027 1.00 1.89 C ATOM 1228 C LYS A 91 21.019 -4.498 -6.248 1.00 1.98 C ATOM 1229 O LYS A 91 20.987 -5.276 -7.199 1.00 2.17 O ATOM 1230 CB LYS A 91 20.368 -2.039 -6.056 1.00 2.00 C ATOM 1231 CG LYS A 91 21.199 -1.596 -4.862 1.00 2.10 C ATOM 1232 CD LYS A 91 21.587 -0.134 -4.958 1.00 2.33 C ATOM 1233 CE LYS A 91 22.340 0.311 -3.718 1.00 2.39 C ATOM 1234 NZ LYS A 91 22.717 1.745 -3.782 1.00 2.79 N ATOM 0 H LYS A 91 18.063 -3.898 -5.055 1.00 1.71 H new ATOM 0 HA LYS A 91 19.197 -3.635 -6.873 1.00 1.89 H new ATOM 0 HB2 LYS A 91 20.959 -1.894 -6.960 1.00 2.00 H new ATOM 0 HB3 LYS A 91 19.501 -1.384 -6.134 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.635 -1.763 -3.944 1.00 2.10 H new ATOM 0 HG3 LYS A 91 22.099 -2.208 -4.798 1.00 2.10 H new ATOM 0 HD2 LYS A 91 22.207 0.024 -5.841 1.00 2.33 H new ATOM 0 HD3 LYS A 91 20.692 0.476 -5.083 1.00 2.33 H new ATOM 0 HE2 LYS A 91 21.722 0.137 -2.837 1.00 2.39 H new ATOM 0 HE3 LYS A 91 23.238 -0.295 -3.602 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 23.287 1.992 -2.948 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 23.271 1.920 -4.645 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 21.857 2.330 -3.798 1.00 2.79 H new ATOM 1248 N GLU A 92 22.012 -4.491 -5.378 1.00 2.07 N ATOM 1249 CA GLU A 92 23.186 -5.334 -5.547 1.00 2.27 C ATOM 1250 C GLU A 92 22.996 -6.680 -4.858 1.00 2.10 C ATOM 1251 O GLU A 92 23.934 -7.470 -4.739 1.00 2.26 O ATOM 1252 CB GLU A 92 24.420 -4.628 -4.982 1.00 2.54 C ATOM 1253 CG GLU A 92 24.270 -4.225 -3.522 1.00 2.47 C ATOM 1254 CD GLU A 92 25.513 -3.563 -2.969 1.00 2.96 C ATOM 1255 OE1 GLU A 92 26.390 -4.279 -2.446 1.00 3.29 O ATOM 1256 OE2 GLU A 92 25.618 -2.322 -3.055 1.00 3.20 O ATOM 0 H GLU A 92 22.030 -3.908 -4.541 1.00 2.07 H new ATOM 0 HA GLU A 92 23.328 -5.513 -6.613 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.284 -5.285 -5.083 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.625 -3.738 -5.578 1.00 2.54 H new ATOM 0 HG2 GLU A 92 23.425 -3.543 -3.422 1.00 2.47 H new ATOM 0 HG3 GLU A 92 24.039 -5.109 -2.927 1.00 2.47 H new ATOM 1263 N PHE A 93 21.778 -6.936 -4.406 1.00 1.86 N ATOM 1264 CA PHE A 93 21.482 -8.154 -3.669 1.00 1.75 C ATOM 1265 C PHE A 93 19.985 -8.432 -3.679 1.00 1.59 C ATOM 1266 O PHE A 93 19.496 -9.283 -4.420 1.00 1.69 O ATOM 1267 CB PHE A 93 21.972 -8.011 -2.228 1.00 1.73 C ATOM 1268 CG PHE A 93 21.872 -9.277 -1.423 1.00 2.09 C ATOM 1269 CD1 PHE A 93 22.594 -10.403 -1.781 1.00 2.34 C ATOM 1270 CD2 PHE A 93 21.053 -9.339 -0.308 1.00 2.65 C ATOM 1271 CE1 PHE A 93 22.502 -11.567 -1.042 1.00 2.87 C ATOM 1272 CE2 PHE A 93 20.956 -10.500 0.435 1.00 3.40 C ATOM 1273 CZ PHE A 93 21.696 -11.618 0.064 1.00 3.42 C ATOM 0 H PHE A 93 20.979 -6.316 -4.537 1.00 1.86 H new ATOM 0 HA PHE A 93 21.994 -8.989 -4.148 1.00 1.75 H new ATOM 0 HB2 PHE A 93 23.010 -7.680 -2.239 1.00 1.73 H new ATOM 0 HB3 PHE A 93 21.394 -7.231 -1.733 1.00 1.73 H new ATOM 0 HD1 PHE A 93 23.237 -10.371 -2.648 1.00 2.34 H new ATOM 0 HD2 PHE A 93 20.483 -8.469 -0.016 1.00 2.65 H new ATOM 0 HE1 PHE A 93 23.067 -12.439 -1.337 1.00 2.87 H new ATOM 0 HE2 PHE A 93 20.309 -10.539 1.299 1.00 3.40 H new ATOM 0 HZ PHE A 93 21.635 -12.525 0.647 1.00 3.42 H new ATOM 1283 N VAL A 94 19.271 -7.692 -2.849 1.00 1.62 N ATOM 1284 CA VAL A 94 17.827 -7.809 -2.735 1.00 1.68 C ATOM 1285 C VAL A 94 17.146 -7.197 -3.962 1.00 1.54 C ATOM 1286 O VAL A 94 17.702 -6.318 -4.620 1.00 1.74 O ATOM 1287 CB VAL A 94 17.338 -7.147 -1.423 1.00 2.11 C ATOM 1288 CG1 VAL A 94 15.827 -7.058 -1.359 1.00 2.63 C ATOM 1289 CG2 VAL A 94 17.862 -7.922 -0.224 1.00 2.56 C ATOM 0 H VAL A 94 19.678 -6.989 -2.232 1.00 1.62 H new ATOM 0 HA VAL A 94 17.556 -8.864 -2.697 1.00 1.68 H new ATOM 0 HB VAL A 94 17.729 -6.130 -1.404 1.00 2.11 H new ATOM 0 HG11 VAL A 94 15.530 -6.587 -0.422 1.00 2.63 H new ATOM 0 HG12 VAL A 94 15.462 -6.463 -2.196 1.00 2.63 H new ATOM 0 HG13 VAL A 94 15.401 -8.060 -1.413 1.00 2.63 H new ATOM 0 HG21 VAL A 94 17.514 -7.450 0.695 1.00 2.56 H new ATOM 0 HG22 VAL A 94 17.497 -8.948 -0.266 1.00 2.56 H new ATOM 0 HG23 VAL A 94 18.952 -7.924 -0.240 1.00 2.56 H new ATOM 1299 N CYS A 95 15.951 -7.677 -4.270 1.00 1.47 N ATOM 1300 CA CYS A 95 15.264 -7.322 -5.502 1.00 1.46 C ATOM 1301 C CYS A 95 14.549 -5.995 -5.393 1.00 1.37 C ATOM 1302 O CYS A 95 13.714 -5.792 -4.512 1.00 1.52 O ATOM 1303 CB CYS A 95 14.222 -8.383 -5.838 1.00 1.77 C ATOM 1304 SG CYS A 95 14.904 -10.006 -6.246 1.00 2.83 S ATOM 0 H CYS A 95 15.431 -8.322 -3.675 1.00 1.47 H new ATOM 0 HA CYS A 95 16.025 -7.253 -6.279 1.00 1.46 H new ATOM 0 HB2 CYS A 95 13.546 -8.491 -4.990 1.00 1.77 H new ATOM 0 HB3 CYS A 95 13.624 -8.033 -6.680 1.00 1.77 H new ATOM 0 HG CYS A 95 13.934 -10.830 -6.512 1.00 2.83 H new ATOM 1310 N THR A 96 14.884 -5.101 -6.303 1.00 1.52 N ATOM 1311 CA THR A 96 14.119 -3.893 -6.484 1.00 1.59 C ATOM 1312 C THR A 96 12.773 -4.267 -7.094 1.00 1.08 C ATOM 1313 O THR A 96 12.656 -5.306 -7.747 1.00 1.31 O ATOM 1314 CB THR A 96 14.847 -2.900 -7.407 1.00 2.27 C ATOM 1315 OG1 THR A 96 16.253 -2.918 -7.125 1.00 2.76 O ATOM 1316 CG2 THR A 96 14.316 -1.485 -7.218 1.00 2.98 C ATOM 0 H THR A 96 15.685 -5.193 -6.928 1.00 1.52 H new ATOM 0 HA THR A 96 13.985 -3.408 -5.517 1.00 1.59 H new ATOM 0 HB THR A 96 14.669 -3.204 -8.439 1.00 2.27 H new ATOM 0 HG1 THR A 96 16.713 -2.286 -7.716 1.00 2.76 H new ATOM 0 HG21 THR A 96 14.849 -0.805 -7.883 1.00 2.98 H new ATOM 0 HG22 THR A 96 13.252 -1.462 -7.452 1.00 2.98 H new ATOM 0 HG23 THR A 96 14.467 -1.175 -6.184 1.00 2.98 H new ATOM 1324 N LYS A 97 11.772 -3.436 -6.843 1.00 1.14 N ATOM 1325 CA LYS A 97 10.393 -3.663 -7.290 1.00 1.11 C ATOM 1326 C LYS A 97 9.686 -4.688 -6.412 1.00 1.04 C ATOM 1327 O LYS A 97 8.524 -4.512 -6.072 1.00 1.76 O ATOM 1328 CB LYS A 97 10.311 -4.137 -8.747 1.00 1.47 C ATOM 1329 CG LYS A 97 10.686 -3.091 -9.783 1.00 1.47 C ATOM 1330 CD LYS A 97 10.631 -3.679 -11.186 1.00 1.89 C ATOM 1331 CE LYS A 97 10.910 -2.635 -12.256 1.00 2.34 C ATOM 1332 NZ LYS A 97 9.816 -1.634 -12.360 1.00 2.72 N ATOM 0 H LYS A 97 11.890 -2.571 -6.316 1.00 1.14 H new ATOM 0 HA LYS A 97 9.899 -2.695 -7.210 1.00 1.11 H new ATOM 0 HB2 LYS A 97 10.965 -5.000 -8.870 1.00 1.47 H new ATOM 0 HB3 LYS A 97 9.295 -4.477 -8.946 1.00 1.47 H new ATOM 0 HG2 LYS A 97 10.006 -2.242 -9.712 1.00 1.47 H new ATOM 0 HG3 LYS A 97 11.689 -2.714 -9.580 1.00 1.47 H new ATOM 0 HD2 LYS A 97 11.359 -4.486 -11.269 1.00 1.89 H new ATOM 0 HD3 LYS A 97 9.648 -4.118 -11.356 1.00 1.89 H new ATOM 0 HE2 LYS A 97 11.846 -2.125 -12.029 1.00 2.34 H new ATOM 0 HE3 LYS A 97 11.041 -3.129 -13.219 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 9.971 -1.036 -13.196 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 8.904 -2.125 -12.450 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 9.807 -1.040 -11.506 1.00 2.72 H new ATOM 1346 N PHE A 98 10.408 -5.762 -6.078 1.00 0.89 N ATOM 1347 CA PHE A 98 9.883 -6.917 -5.337 1.00 0.92 C ATOM 1348 C PHE A 98 8.947 -7.733 -6.226 1.00 1.11 C ATOM 1349 O PHE A 98 9.084 -8.954 -6.289 1.00 2.12 O ATOM 1350 CB PHE A 98 9.253 -6.505 -3.980 1.00 1.15 C ATOM 1351 CG PHE A 98 7.752 -6.609 -3.847 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.130 -7.836 -3.668 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.966 -5.470 -3.862 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.756 -7.915 -3.517 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.597 -5.550 -3.707 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.994 -6.775 -3.537 1.00 0.45 C ATOM 0 H PHE A 98 11.395 -5.856 -6.319 1.00 0.89 H new ATOM 0 HA PHE A 98 10.716 -7.568 -5.070 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.703 -7.119 -3.200 1.00 1.15 H new ATOM 0 HB3 PHE A 98 9.538 -5.473 -3.777 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.723 -8.738 -3.646 1.00 1.02 H new ATOM 0 HD2 PHE A 98 7.431 -4.504 -3.997 1.00 0.96 H new ATOM 0 HE1 PHE A 98 5.283 -8.877 -3.383 1.00 0.94 H new ATOM 0 HE2 PHE A 98 4.999 -4.651 -3.719 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.922 -6.839 -3.420 1.00 0.45 H new ATOM 1366 N LYS A 99 8.046 -7.053 -6.937 1.00 0.80 N ATOM 1367 CA LYS A 99 7.196 -7.676 -7.954 1.00 0.78 C ATOM 1368 C LYS A 99 6.245 -8.711 -7.362 1.00 0.79 C ATOM 1369 O LYS A 99 6.645 -9.658 -6.692 1.00 1.43 O ATOM 1370 CB LYS A 99 8.050 -8.295 -9.062 1.00 1.02 C ATOM 1371 CG LYS A 99 8.759 -7.255 -9.919 1.00 1.34 C ATOM 1372 CD LYS A 99 9.737 -7.895 -10.889 1.00 1.63 C ATOM 1373 CE LYS A 99 10.938 -8.481 -10.165 1.00 2.05 C ATOM 1374 NZ LYS A 99 11.832 -9.224 -11.092 1.00 2.69 N ATOM 0 H LYS A 99 7.885 -6.052 -6.824 1.00 0.80 H new ATOM 0 HA LYS A 99 6.578 -6.887 -8.384 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.792 -8.956 -8.614 1.00 1.02 H new ATOM 0 HB3 LYS A 99 7.417 -8.912 -9.699 1.00 1.02 H new ATOM 0 HG2 LYS A 99 8.020 -6.678 -10.475 1.00 1.34 H new ATOM 0 HG3 LYS A 99 9.291 -6.555 -9.275 1.00 1.34 H new ATOM 0 HD2 LYS A 99 9.232 -8.680 -11.452 1.00 1.63 H new ATOM 0 HD3 LYS A 99 10.074 -7.151 -11.611 1.00 1.63 H new ATOM 0 HE2 LYS A 99 11.499 -7.680 -9.683 1.00 2.05 H new ATOM 0 HE3 LYS A 99 10.596 -9.150 -9.375 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 12.640 -9.609 -10.562 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 11.304 -10.004 -11.533 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 12.179 -8.580 -11.831 1.00 2.69 H new ATOM 1388 N ALA A 100 4.972 -8.529 -7.638 1.00 0.51 N ATOM 1389 CA ALA A 100 3.946 -9.359 -7.047 1.00 0.43 C ATOM 1390 C ALA A 100 2.819 -9.600 -8.017 1.00 0.40 C ATOM 1391 O ALA A 100 2.862 -9.140 -9.158 1.00 0.55 O ATOM 1392 CB ALA A 100 3.405 -8.673 -5.820 1.00 0.43 C ATOM 0 H ALA A 100 4.622 -7.810 -8.271 1.00 0.51 H new ATOM 0 HA ALA A 100 4.386 -10.321 -6.784 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.630 -9.293 -5.368 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.212 -8.520 -5.103 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.981 -7.709 -6.100 1.00 0.43 H new ATOM 1398 N GLU A 101 1.798 -10.304 -7.554 1.00 0.34 N ATOM 1399 CA GLU A 101 0.616 -10.515 -8.359 1.00 0.40 C ATOM 1400 C GLU A 101 -0.438 -9.461 -8.039 1.00 0.43 C ATOM 1401 O GLU A 101 -1.640 -9.714 -8.126 1.00 0.67 O ATOM 1402 CB GLU A 101 0.048 -11.919 -8.168 1.00 0.50 C ATOM 1403 CG GLU A 101 0.987 -13.019 -8.630 1.00 0.67 C ATOM 1404 CD GLU A 101 0.314 -14.373 -8.684 1.00 1.24 C ATOM 1405 OE1 GLU A 101 -0.637 -14.540 -9.470 1.00 1.57 O ATOM 1406 OE2 GLU A 101 0.724 -15.275 -7.924 1.00 1.99 O ATOM 0 H GLU A 101 1.768 -10.735 -6.630 1.00 0.34 H new ATOM 0 HA GLU A 101 0.904 -10.418 -9.406 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.183 -12.069 -7.113 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.891 -12.000 -8.715 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.374 -12.770 -9.618 1.00 0.67 H new ATOM 0 HG3 GLU A 101 1.842 -13.069 -7.956 1.00 0.67 H new ATOM 1413 N PHE A 102 0.037 -8.288 -7.648 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.802 -7.142 -7.399 1.00 0.40 C ATOM 1415 C PHE A 102 -0.057 -5.897 -7.867 1.00 0.45 C ATOM 1416 O PHE A 102 1.158 -5.943 -8.059 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.209 -7.060 -5.920 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.115 -7.272 -4.948 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.657 -6.215 -4.549 1.00 0.62 C ATOM 1420 CD2 PHE A 102 0.146 -8.525 -4.456 1.00 0.52 C ATOM 1421 CE1 PHE A 102 1.691 -6.395 -3.660 1.00 0.58 C ATOM 1422 CE2 PHE A 102 1.181 -8.725 -3.568 1.00 0.59 C ATOM 1423 CZ PHE A 102 1.895 -7.685 -3.105 1.00 0.44 C ATOM 0 H PHE A 102 1.030 -8.111 -7.495 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.734 -7.229 -7.958 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.651 -6.081 -5.736 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -1.987 -7.801 -5.733 1.00 0.84 H new ATOM 0 HD1 PHE A 102 0.452 -5.228 -4.937 1.00 0.62 H new ATOM 0 HD2 PHE A 102 -0.464 -9.361 -4.766 1.00 0.52 H new ATOM 0 HE1 PHE A 102 2.335 -5.571 -3.390 1.00 0.58 H new ATOM 0 HE2 PHE A 102 1.420 -9.726 -3.241 1.00 0.59 H new ATOM 0 HZ PHE A 102 2.619 -7.830 -2.316 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.780 -4.796 -8.091 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.238 -3.561 -8.690 1.00 0.39 C ATOM 1435 C PRO A 103 0.913 -2.940 -7.916 1.00 0.41 C ATOM 1436 O PRO A 103 0.705 -2.114 -7.029 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.443 -2.623 -8.699 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.331 -3.172 -7.651 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.202 -4.647 -7.777 1.00 0.27 C ATOM 0 HA PRO A 103 0.192 -3.762 -9.671 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.151 -1.596 -8.478 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.933 -2.612 -9.672 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -2.030 -2.832 -6.660 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.362 -2.851 -7.799 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.474 -5.162 -6.855 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.839 -5.048 -8.565 1.00 0.27 H new ATOM 1447 N ILE A 104 2.132 -3.338 -8.261 1.00 0.35 N ATOM 1448 CA ILE A 104 3.310 -2.691 -7.716 1.00 0.35 C ATOM 1449 C ILE A 104 3.557 -1.399 -8.479 1.00 0.33 C ATOM 1450 O ILE A 104 3.675 -1.383 -9.707 1.00 0.44 O ATOM 1451 CB ILE A 104 4.589 -3.566 -7.763 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.392 -4.930 -7.075 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.749 -2.810 -7.118 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.364 -4.925 -5.984 1.00 1.34 C ATOM 0 H ILE A 104 2.326 -4.100 -8.911 1.00 0.35 H new ATOM 0 HA ILE A 104 3.107 -2.504 -6.662 1.00 0.35 H new ATOM 0 HB ILE A 104 4.814 -3.768 -8.810 1.00 0.41 H new ATOM 0 HG12 ILE A 104 4.104 -5.665 -7.827 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.345 -5.256 -6.659 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.648 -3.426 -7.151 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.925 -1.881 -7.661 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.503 -2.583 -6.081 1.00 0.45 H new ATOM 0 HD11 ILE A 104 3.287 -5.923 -5.552 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.658 -4.216 -5.210 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.398 -4.632 -6.396 1.00 1.34 H new ATOM 1466 N MET A 105 3.597 -0.327 -7.729 1.00 0.29 N ATOM 1467 CA MET A 105 3.769 1.011 -8.251 1.00 0.30 C ATOM 1468 C MET A 105 5.226 1.271 -8.629 1.00 0.27 C ATOM 1469 O MET A 105 6.115 0.486 -8.309 1.00 0.35 O ATOM 1470 CB MET A 105 3.286 1.968 -7.164 1.00 0.43 C ATOM 1471 CG MET A 105 4.022 3.286 -7.049 1.00 1.50 C ATOM 1472 SD MET A 105 3.395 4.548 -8.168 1.00 2.49 S ATOM 1473 CE MET A 105 4.713 5.754 -8.114 1.00 3.03 C ATOM 0 H MET A 105 3.509 -0.358 -6.713 1.00 0.29 H new ATOM 0 HA MET A 105 3.194 1.153 -9.166 1.00 0.30 H new ATOM 0 HB2 MET A 105 2.232 2.180 -7.340 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.352 1.455 -6.204 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.947 3.649 -6.024 1.00 1.50 H new ATOM 0 HG3 MET A 105 5.080 3.123 -7.252 1.00 1.50 H new ATOM 0 HE1 MET A 105 4.344 6.677 -7.666 1.00 3.03 H new ATOM 0 HE2 MET A 105 5.538 5.365 -7.516 1.00 3.03 H new ATOM 0 HE3 MET A 105 5.063 5.956 -9.126 1.00 3.03 H new ATOM 1483 N ALA A 106 5.454 2.390 -9.306 1.00 0.33 N ATOM 1484 CA ALA A 106 6.786 2.812 -9.730 1.00 0.52 C ATOM 1485 C ALA A 106 7.661 3.226 -8.560 1.00 0.66 C ATOM 1486 O ALA A 106 8.735 3.788 -8.757 1.00 1.46 O ATOM 1487 CB ALA A 106 6.649 3.962 -10.694 1.00 0.70 C ATOM 0 H ALA A 106 4.714 3.037 -9.579 1.00 0.33 H new ATOM 0 HA ALA A 106 7.272 1.962 -10.209 1.00 0.52 H new ATOM 0 HB1 ALA A 106 7.638 4.286 -11.017 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.070 3.643 -11.561 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.139 4.790 -10.202 1.00 0.70 H new ATOM 1493 N LYS A 107 7.177 2.918 -7.364 1.00 0.40 N ATOM 1494 CA LYS A 107 7.787 3.297 -6.098 1.00 0.36 C ATOM 1495 C LYS A 107 7.734 4.773 -5.868 1.00 0.38 C ATOM 1496 O LYS A 107 7.839 5.604 -6.772 1.00 0.59 O ATOM 1497 CB LYS A 107 9.234 2.814 -5.949 1.00 0.49 C ATOM 1498 CG LYS A 107 10.299 3.804 -6.395 1.00 0.84 C ATOM 1499 CD LYS A 107 11.683 3.189 -6.329 1.00 0.83 C ATOM 1500 CE LYS A 107 11.742 1.910 -7.141 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.459 2.163 -8.578 1.00 1.76 N ATOM 0 H LYS A 107 6.319 2.379 -7.245 1.00 0.40 H new ATOM 0 HA LYS A 107 7.188 2.792 -5.340 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.410 2.563 -4.903 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.353 1.894 -6.522 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.092 4.130 -7.414 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.262 4.691 -5.763 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.420 3.899 -6.706 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.944 2.979 -5.292 1.00 0.83 H new ATOM 0 HE2 LYS A 107 12.728 1.457 -7.038 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.020 1.194 -6.747 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 11.623 1.292 -9.123 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.469 2.460 -8.690 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.087 2.914 -8.929 1.00 1.76 H new ATOM 1515 N ILE A 108 7.535 5.058 -4.624 1.00 0.31 N ATOM 1516 CA ILE A 108 7.540 6.376 -4.109 1.00 0.35 C ATOM 1517 C ILE A 108 8.327 6.332 -2.823 1.00 0.36 C ATOM 1518 O ILE A 108 8.503 5.262 -2.245 1.00 0.42 O ATOM 1519 CB ILE A 108 6.104 6.811 -3.824 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.493 5.849 -2.810 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.297 6.799 -5.118 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.099 6.197 -2.383 1.00 0.64 C ATOM 0 H ILE A 108 7.358 4.347 -3.915 1.00 0.31 H new ATOM 0 HA ILE A 108 7.980 7.081 -4.814 1.00 0.35 H new ATOM 0 HB ILE A 108 6.092 7.823 -3.418 1.00 0.48 H new ATOM 0 HG12 ILE A 108 5.489 4.846 -3.237 1.00 0.82 H new ATOM 0 HG13 ILE A 108 6.132 5.817 -1.928 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.273 7.110 -4.911 1.00 0.68 H new ATOM 0 HG22 ILE A 108 5.747 7.487 -5.834 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.293 5.792 -5.535 1.00 0.68 H new ATOM 0 HD11 ILE A 108 3.745 5.460 -1.662 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.095 7.185 -1.923 1.00 0.64 H new ATOM 0 HD13 ILE A 108 3.442 6.199 -3.253 1.00 0.64 H new ATOM 1534 N ASN A 109 8.815 7.456 -2.391 1.00 0.38 N ATOM 1535 CA ASN A 109 9.520 7.544 -1.124 1.00 0.44 C ATOM 1536 C ASN A 109 8.549 7.419 0.034 1.00 0.47 C ATOM 1537 O ASN A 109 8.374 8.367 0.796 1.00 0.76 O ATOM 1538 CB ASN A 109 10.237 8.878 -1.042 1.00 0.53 C ATOM 1539 CG ASN A 109 11.732 8.759 -1.193 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.273 8.882 -2.287 1.00 1.73 O ATOM 1541 ND2 ASN A 109 12.408 8.526 -0.090 1.00 1.16 N ATOM 0 H ASN A 109 8.742 8.340 -2.895 1.00 0.38 H new ATOM 0 HA ASN A 109 10.242 6.730 -1.064 1.00 0.44 H new ATOM 0 HB2 ASN A 109 9.851 9.539 -1.818 1.00 0.53 H new ATOM 0 HB3 ASN A 109 10.011 9.346 -0.084 1.00 0.53 H new ATOM 0 HD21 ASN A 109 13.424 8.441 -0.123 1.00 1.16 H new ATOM 0 HD22 ASN A 109 11.917 8.431 0.799 1.00 1.16 H new ATOM 1548 N VAL A 110 7.901 6.262 0.170 1.00 0.41 N ATOM 1549 CA VAL A 110 6.903 6.118 1.209 1.00 0.42 C ATOM 1550 C VAL A 110 7.574 5.984 2.550 1.00 0.44 C ATOM 1551 O VAL A 110 7.917 4.884 2.982 1.00 0.48 O ATOM 1552 CB VAL A 110 6.015 4.882 0.999 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.576 5.302 0.862 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.438 4.072 -0.208 1.00 0.77 C ATOM 0 H VAL A 110 8.048 5.437 -0.412 1.00 0.41 H new ATOM 0 HA VAL A 110 6.277 7.010 1.168 1.00 0.42 H new ATOM 0 HB VAL A 110 6.130 4.243 1.875 1.00 0.43 H new ATOM 0 HG11 VAL A 110 3.952 4.421 0.713 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.261 5.821 1.767 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.472 5.969 0.006 1.00 0.60 H new ATOM 0 HG21 VAL A 110 5.781 3.209 -0.315 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.373 4.691 -1.103 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.465 3.732 -0.076 1.00 0.77 H new ATOM 1564 N ASN A 111 7.739 7.126 3.189 1.00 0.48 N ATOM 1565 CA ASN A 111 8.175 7.226 4.561 1.00 0.56 C ATOM 1566 C ASN A 111 8.380 8.687 4.871 1.00 0.62 C ATOM 1567 O ASN A 111 8.172 9.531 3.995 1.00 0.67 O ATOM 1568 CB ASN A 111 9.474 6.465 4.822 1.00 0.65 C ATOM 1569 CG ASN A 111 9.409 5.695 6.130 1.00 1.20 C ATOM 1570 OD1 ASN A 111 8.330 5.347 6.606 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.557 5.425 6.723 1.00 1.72 N ATOM 0 H ASN A 111 7.568 8.032 2.753 1.00 0.48 H new ATOM 0 HA ASN A 111 7.414 6.779 5.200 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.665 5.775 4.000 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.309 7.165 4.851 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.567 4.912 7.605 1.00 1.72 H new ATOM 0 HD22 ASN A 111 11.434 5.729 6.300 1.00 1.72 H new ATOM 1578 N GLY A 112 8.762 8.963 6.108 1.00 0.73 N ATOM 1579 CA GLY A 112 9.381 10.227 6.468 1.00 0.85 C ATOM 1580 C GLY A 112 8.858 11.455 5.744 1.00 0.93 C ATOM 1581 O GLY A 112 7.763 11.942 6.029 1.00 1.47 O ATOM 0 H GLY A 112 8.651 8.317 6.890 1.00 0.73 H new ATOM 0 HA2 GLY A 112 9.253 10.379 7.540 1.00 0.85 H new ATOM 0 HA3 GLY A 112 10.452 10.150 6.283 1.00 0.85 H new ATOM 1585 N GLU A 113 9.657 11.942 4.798 1.00 0.88 N ATOM 1586 CA GLU A 113 9.478 13.284 4.261 1.00 1.23 C ATOM 1587 C GLU A 113 8.932 13.323 2.835 1.00 1.10 C ATOM 1588 O GLU A 113 8.324 14.317 2.440 1.00 1.39 O ATOM 1589 CB GLU A 113 10.805 14.036 4.330 1.00 1.61 C ATOM 1590 CG GLU A 113 11.930 13.361 3.564 1.00 1.83 C ATOM 1591 CD GLU A 113 13.271 14.007 3.826 1.00 2.29 C ATOM 1592 OE1 GLU A 113 13.436 15.197 3.489 1.00 2.65 O ATOM 1593 OE2 GLU A 113 14.171 13.319 4.347 1.00 2.81 O ATOM 0 H GLU A 113 10.435 11.425 4.388 1.00 0.88 H new ATOM 0 HA GLU A 113 8.721 13.765 4.881 1.00 1.23 H new ATOM 0 HB2 GLU A 113 10.663 15.043 3.937 1.00 1.61 H new ATOM 0 HB3 GLU A 113 11.100 14.140 5.374 1.00 1.61 H new ATOM 0 HG2 GLU A 113 11.976 12.308 3.843 1.00 1.83 H new ATOM 0 HG3 GLU A 113 11.713 13.399 2.496 1.00 1.83 H new ATOM 1600 N ASN A 114 9.126 12.263 2.062 1.00 0.79 N ATOM 1601 CA ASN A 114 8.916 12.362 0.626 1.00 0.79 C ATOM 1602 C ASN A 114 7.822 11.408 0.207 1.00 0.79 C ATOM 1603 O ASN A 114 7.724 11.020 -0.958 1.00 1.22 O ATOM 1604 CB ASN A 114 10.215 12.065 -0.128 1.00 0.87 C ATOM 1605 CG ASN A 114 10.315 12.756 -1.486 1.00 1.45 C ATOM 1606 OD1 ASN A 114 11.394 13.181 -1.893 1.00 2.06 O ATOM 1607 ND2 ASN A 114 9.208 12.860 -2.210 1.00 2.16 N ATOM 0 H ASN A 114 9.421 11.345 2.395 1.00 0.79 H new ATOM 0 HA ASN A 114 8.610 13.379 0.379 1.00 0.79 H new ATOM 0 HB2 ASN A 114 11.060 12.373 0.488 1.00 0.87 H new ATOM 0 HB3 ASN A 114 10.302 10.988 -0.272 1.00 0.87 H new ATOM 0 HD21 ASN A 114 9.239 13.301 -3.129 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.326 12.498 -1.848 1.00 2.16 H new ATOM 1614 N ALA A 115 7.016 11.015 1.180 1.00 0.59 N ATOM 1615 CA ALA A 115 5.844 10.217 0.914 1.00 0.61 C ATOM 1616 C ALA A 115 5.033 10.873 -0.190 1.00 0.68 C ATOM 1617 O ALA A 115 4.799 12.081 -0.174 1.00 1.26 O ATOM 1618 CB ALA A 115 5.023 10.048 2.179 1.00 0.86 C ATOM 0 H ALA A 115 7.159 11.240 2.165 1.00 0.59 H new ATOM 0 HA ALA A 115 6.143 9.223 0.583 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.142 9.444 1.963 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.625 9.552 2.940 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.711 11.027 2.544 1.00 0.86 H new ATOM 1624 N HIS A 116 4.620 10.073 -1.147 1.00 0.42 N ATOM 1625 CA HIS A 116 4.009 10.567 -2.351 1.00 0.35 C ATOM 1626 C HIS A 116 2.658 11.141 -2.025 1.00 0.29 C ATOM 1627 O HIS A 116 1.983 10.599 -1.166 1.00 0.29 O ATOM 1628 CB HIS A 116 3.924 9.384 -3.315 1.00 0.35 C ATOM 1629 CG HIS A 116 2.933 9.511 -4.412 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.608 9.463 -4.151 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.049 9.690 -5.751 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.937 9.629 -5.247 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.776 9.770 -6.250 1.00 0.32 N ATOM 0 H HIS A 116 4.701 9.057 -1.108 1.00 0.42 H new ATOM 0 HA HIS A 116 4.585 11.369 -2.812 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.908 9.229 -3.757 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.688 8.488 -2.740 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.968 9.757 -6.315 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.140 9.648 -5.325 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.523 9.914 -7.228 1.00 0.32 H new ATOM 1642 N PRO A 117 2.269 12.242 -2.702 1.00 0.31 N ATOM 1643 CA PRO A 117 0.988 12.922 -2.526 1.00 0.31 C ATOM 1644 C PRO A 117 -0.136 12.014 -2.021 1.00 0.26 C ATOM 1645 O PRO A 117 -0.858 12.377 -1.108 1.00 0.27 O ATOM 1646 CB PRO A 117 0.697 13.410 -3.945 1.00 0.37 C ATOM 1647 CG PRO A 117 2.033 13.573 -4.609 1.00 0.40 C ATOM 1648 CD PRO A 117 3.071 12.947 -3.709 1.00 0.38 C ATOM 0 HA PRO A 117 1.039 13.703 -1.767 1.00 0.31 H new ATOM 0 HB2 PRO A 117 0.078 12.693 -4.485 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.152 14.354 -3.929 1.00 0.37 H new ATOM 0 HG2 PRO A 117 2.035 13.093 -5.587 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.253 14.628 -4.771 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.718 12.263 -4.258 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.715 13.700 -3.254 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.248 10.823 -2.608 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.256 9.843 -2.224 1.00 0.23 C ATOM 1658 C LEU A 118 -1.050 9.326 -0.794 1.00 0.27 C ATOM 1659 O LEU A 118 -1.972 9.338 0.009 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.224 8.686 -3.209 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.105 7.503 -2.862 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.558 7.901 -2.964 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.802 6.325 -3.773 1.00 0.27 C ATOM 0 H LEU A 118 0.361 10.512 -3.365 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.230 10.332 -2.247 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.519 9.060 -4.190 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.195 8.336 -3.297 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.897 7.195 -1.837 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.188 7.047 -2.714 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.761 8.717 -2.271 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.776 8.226 -3.981 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.445 5.485 -3.508 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.985 6.610 -4.809 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.758 6.034 -3.656 1.00 0.27 H new ATOM 1675 N TYR A 119 0.164 8.884 -0.477 1.00 0.32 N ATOM 1676 CA TYR A 119 0.441 8.298 0.827 1.00 0.42 C ATOM 1677 C TYR A 119 0.644 9.376 1.829 1.00 0.40 C ATOM 1678 O TYR A 119 0.353 9.216 3.005 1.00 0.41 O ATOM 1679 CB TYR A 119 1.669 7.429 0.803 1.00 0.57 C ATOM 1680 CG TYR A 119 1.401 6.041 0.329 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.208 5.783 -1.016 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.292 5.006 1.227 1.00 1.09 C ATOM 1683 CE1 TYR A 119 0.897 4.518 -1.452 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.002 3.738 0.807 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.019 3.460 -0.554 1.00 2.20 C ATOM 1686 OH TYR A 119 0.451 2.249 -0.969 1.00 3.04 O ATOM 0 H TYR A 119 0.968 8.921 -1.104 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.416 7.679 1.093 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.418 7.888 0.157 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.095 7.387 1.805 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.303 6.586 -1.732 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.438 5.198 2.280 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.566 4.348 -2.466 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.763 2.964 1.522 1.00 1.88 H new ATOM 0 HH TYR A 119 1.074 1.783 -1.565 1.00 3.04 H new ATOM 1696 N GLU A 120 1.189 10.469 1.349 1.00 0.40 N ATOM 1697 CA GLU A 120 1.300 11.650 2.141 1.00 0.42 C ATOM 1698 C GLU A 120 -0.095 12.034 2.514 1.00 0.37 C ATOM 1699 O GLU A 120 -0.358 12.436 3.637 1.00 0.43 O ATOM 1700 CB GLU A 120 1.985 12.755 1.335 1.00 0.50 C ATOM 1701 CG GLU A 120 2.553 13.868 2.182 1.00 0.76 C ATOM 1702 CD GLU A 120 1.496 14.808 2.745 1.00 1.58 C ATOM 1703 OE1 GLU A 120 0.779 15.455 1.946 1.00 2.44 O ATOM 1704 OE2 GLU A 120 1.379 14.910 3.984 1.00 1.93 O ATOM 0 H GLU A 120 1.563 10.555 0.404 1.00 0.40 H new ATOM 0 HA GLU A 120 1.904 11.488 3.034 1.00 0.42 H new ATOM 0 HB2 GLU A 120 2.788 12.315 0.744 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.267 13.177 0.632 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.117 13.433 3.007 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.258 14.445 1.583 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.004 11.830 1.575 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.410 12.036 1.886 1.00 0.28 C ATOM 1713 C TYR A 121 -2.905 10.974 2.866 1.00 0.27 C ATOM 1714 O TYR A 121 -3.775 11.229 3.689 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.288 12.034 0.634 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.752 12.059 0.972 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.361 13.230 1.393 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.516 10.903 0.912 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.692 13.251 1.738 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.844 10.914 1.263 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.433 12.091 1.674 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.759 12.103 2.036 1.00 0.56 O ATOM 0 H TYR A 121 -0.805 11.531 0.620 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.490 13.021 2.346 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.043 12.900 0.018 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.069 11.148 0.039 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.782 14.140 1.451 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.060 9.980 0.584 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.155 14.173 2.058 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.424 10.004 1.217 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.111 13.014 1.957 1.00 0.56 H new ATOM 1732 N MET A 122 -2.318 9.799 2.791 1.00 0.27 N ATOM 1733 CA MET A 122 -2.814 8.644 3.524 1.00 0.29 C ATOM 1734 C MET A 122 -2.465 8.719 4.995 1.00 0.33 C ATOM 1735 O MET A 122 -3.342 8.642 5.853 1.00 0.35 O ATOM 1736 CB MET A 122 -2.287 7.360 2.912 1.00 0.33 C ATOM 1737 CG MET A 122 -3.019 7.004 1.647 1.00 0.71 C ATOM 1738 SD MET A 122 -2.377 5.540 0.846 1.00 0.56 S ATOM 1739 CE MET A 122 -3.616 5.379 -0.420 1.00 0.55 C ATOM 0 H MET A 122 -1.489 9.613 2.226 1.00 0.27 H new ATOM 0 HA MET A 122 -3.901 8.648 3.448 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.224 7.468 2.699 1.00 0.33 H new ATOM 0 HB3 MET A 122 -2.387 6.547 3.631 1.00 0.33 H new ATOM 0 HG2 MET A 122 -4.074 6.851 1.876 1.00 0.71 H new ATOM 0 HG3 MET A 122 -2.962 7.843 0.954 1.00 0.71 H new ATOM 0 HE1 MET A 122 -4.247 4.517 -0.204 1.00 0.55 H new ATOM 0 HE2 MET A 122 -4.229 6.280 -0.446 1.00 0.55 H new ATOM 0 HE3 MET A 122 -3.132 5.242 -1.387 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.183 8.868 5.284 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.736 9.006 6.656 1.00 0.45 C ATOM 1751 C LYS A 123 -1.153 10.351 7.226 1.00 0.47 C ATOM 1752 O LYS A 123 -1.256 10.505 8.440 1.00 0.54 O ATOM 1753 CB LYS A 123 0.769 8.746 6.812 1.00 0.53 C ATOM 1754 CG LYS A 123 1.621 9.148 5.625 1.00 0.48 C ATOM 1755 CD LYS A 123 2.092 10.597 5.704 1.00 1.00 C ATOM 1756 CE LYS A 123 3.095 10.808 6.827 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.618 12.201 6.859 1.00 1.46 N ATOM 0 H LYS A 123 -0.437 8.896 4.588 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.232 8.232 7.242 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.125 9.282 7.692 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.920 7.684 7.004 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.489 8.491 5.566 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.050 9.005 4.708 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.545 10.884 4.755 1.00 1.00 H new ATOM 0 HD3 LYS A 123 1.233 11.250 5.858 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.623 10.577 7.782 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.925 10.113 6.706 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 4.298 12.299 7.640 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 4.092 12.415 5.958 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.830 12.865 7.001 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.383 11.334 6.359 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.938 12.590 6.827 1.00 0.50 C ATOM 1773 C LYS A 124 -3.411 12.396 7.174 1.00 0.49 C ATOM 1774 O LYS A 124 -3.963 13.111 8.010 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.755 13.722 5.810 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.904 13.887 4.828 1.00 0.59 C ATOM 1777 CD LYS A 124 -2.537 14.846 3.710 1.00 0.97 C ATOM 1778 CE LYS A 124 -2.051 16.171 4.259 1.00 1.41 C ATOM 1779 NZ LYS A 124 -1.569 17.071 3.182 1.00 1.99 N ATOM 0 H LYS A 124 -1.198 11.285 5.357 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.392 12.890 7.721 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.620 14.659 6.350 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.838 13.543 5.248 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -3.168 12.917 4.407 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.785 14.257 5.353 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -1.761 14.402 3.087 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -3.404 15.011 3.070 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -2.860 16.657 4.804 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -1.246 15.995 4.973 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -1.453 18.033 3.559 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -0.655 16.727 2.825 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -2.261 17.085 2.405 1.00 1.99 H new ATOM 1793 N THR A 125 -4.044 11.424 6.517 1.00 0.42 N ATOM 1794 CA THR A 125 -5.400 11.030 6.869 1.00 0.44 C ATOM 1795 C THR A 125 -5.387 10.284 8.204 1.00 0.44 C ATOM 1796 O THR A 125 -6.125 10.624 9.129 1.00 0.56 O ATOM 1797 CB THR A 125 -6.055 10.144 5.788 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.164 10.870 4.559 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.439 9.684 6.224 1.00 0.59 C ATOM 0 H THR A 125 -3.638 10.899 5.742 1.00 0.42 H new ATOM 0 HA THR A 125 -5.994 11.941 6.949 1.00 0.44 H new ATOM 0 HB THR A 125 -5.424 9.267 5.644 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.308 11.302 4.357 1.00 0.57 H new ATOM 0 HG21 THR A 125 -7.878 9.062 5.444 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.357 9.108 7.145 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.074 10.553 6.395 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.519 9.282 8.302 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.387 8.492 9.515 1.00 0.54 C ATOM 1809 C LYS A 126 -2.948 8.004 9.668 1.00 0.57 C ATOM 1810 O LYS A 126 -2.463 7.195 8.875 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.361 7.314 9.475 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.483 6.577 10.797 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.565 5.519 10.735 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.953 6.141 10.666 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.344 6.803 11.940 1.00 1.85 N ATOM 0 H LYS A 126 -3.893 8.999 7.548 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.630 9.112 10.378 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.345 7.678 9.180 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -5.037 6.612 8.707 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -4.529 6.112 11.047 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.709 7.287 11.593 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.406 4.885 9.862 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.497 4.876 11.613 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -7.981 6.871 9.857 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.682 5.368 10.423 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.359 7.030 11.916 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -8.151 6.163 12.737 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -7.796 7.679 12.058 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.252 8.493 10.714 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.826 8.221 10.943 1.00 1.04 C ATOM 1831 C PRO A 127 -0.548 6.772 11.329 1.00 1.27 C ATOM 1832 O PRO A 127 0.194 6.072 10.640 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.450 9.168 12.096 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.589 10.123 12.218 1.00 1.22 C ATOM 1835 CD PRO A 127 -2.801 9.368 11.759 1.00 0.95 C ATOM 0 HA PRO A 127 -0.243 8.381 10.036 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.300 8.616 13.024 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.481 9.693 11.884 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -1.706 10.464 13.247 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.424 11.009 11.605 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.255 8.797 12.569 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.570 10.034 11.368 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.147 6.318 12.420 1.00 1.55 N ATOM 1844 CA GLY A 128 -0.917 4.961 12.868 1.00 1.96 C ATOM 1845 C GLY A 128 -1.828 4.558 14.004 1.00 2.13 C ATOM 1846 O GLY A 128 -2.354 5.409 14.717 1.00 2.59 O ATOM 0 H GLY A 128 -1.785 6.862 13.000 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -1.062 4.277 12.032 1.00 1.96 H new ATOM 0 HA3 GLY A 128 0.120 4.859 13.186 1.00 1.96 H new ATOM 1850 N ILE A 129 -2.023 3.255 14.159 1.00 2.17 N ATOM 1851 CA ILE A 129 -2.845 2.719 15.241 1.00 2.46 C ATOM 1852 C ILE A 129 -1.940 2.242 16.377 1.00 2.36 C ATOM 1853 O ILE A 129 -2.359 2.109 17.525 1.00 2.70 O ATOM 1854 CB ILE A 129 -3.717 1.537 14.748 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -4.494 1.924 13.481 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -4.679 1.079 15.839 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -5.469 3.068 13.677 1.00 3.58 C ATOM 0 H ILE A 129 -1.622 2.545 13.547 1.00 2.17 H new ATOM 0 HA ILE A 129 -3.506 3.510 15.594 1.00 2.46 H new ATOM 0 HB ILE A 129 -3.051 0.708 14.506 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -3.783 2.197 12.701 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -5.041 1.052 13.123 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -5.280 0.249 15.469 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -4.112 0.756 16.712 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -5.334 1.905 16.117 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -5.976 3.279 12.736 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -6.205 2.793 14.433 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -4.927 3.956 14.004 1.00 3.58 H new ATOM 1869 N LEU A 130 -0.684 2.006 16.030 1.00 2.12 N ATOM 1870 CA LEU A 130 0.303 1.482 16.964 1.00 2.29 C ATOM 1871 C LEU A 130 1.388 2.526 17.223 1.00 2.20 C ATOM 1872 O LEU A 130 1.068 3.693 17.438 1.00 2.44 O ATOM 1873 CB LEU A 130 0.912 0.179 16.417 1.00 2.58 C ATOM 1874 CG LEU A 130 1.655 0.262 15.069 1.00 2.89 C ATOM 1875 CD1 LEU A 130 2.512 -0.977 14.872 1.00 3.36 C ATOM 1876 CD2 LEU A 130 0.679 0.399 13.906 1.00 3.47 C ATOM 0 H LEU A 130 -0.319 2.172 15.092 1.00 2.12 H new ATOM 0 HA LEU A 130 -0.187 1.257 17.911 1.00 2.29 H new ATOM 0 HB2 LEU A 130 1.606 -0.209 17.162 1.00 2.58 H new ATOM 0 HB3 LEU A 130 0.110 -0.553 16.317 1.00 2.58 H new ATOM 0 HG LEU A 130 2.290 1.148 15.090 1.00 2.89 H new ATOM 0 HD11 LEU A 130 3.034 -0.911 13.917 1.00 3.36 H new ATOM 0 HD12 LEU A 130 3.241 -1.048 15.680 1.00 3.36 H new ATOM 0 HD13 LEU A 130 1.877 -1.863 14.878 1.00 3.36 H new ATOM 0 HD21 LEU A 130 1.234 0.455 12.970 1.00 3.47 H new ATOM 0 HD22 LEU A 130 0.016 -0.466 13.884 1.00 3.47 H new ATOM 0 HD23 LEU A 130 0.088 1.306 14.032 1.00 3.47 H new ATOM 1888 N ALA A 131 2.655 2.103 17.238 1.00 2.45 N ATOM 1889 CA ALA A 131 3.776 3.041 17.274 1.00 2.67 C ATOM 1890 C ALA A 131 3.689 3.957 16.060 1.00 2.55 C ATOM 1891 O ALA A 131 4.196 3.640 14.983 1.00 3.21 O ATOM 1892 CB ALA A 131 5.101 2.288 17.293 1.00 3.28 C ATOM 0 H ALA A 131 2.928 1.120 17.226 1.00 2.45 H new ATOM 0 HA ALA A 131 3.725 3.641 18.183 1.00 2.67 H new ATOM 0 HB1 ALA A 131 5.925 3.001 17.320 1.00 3.28 H new ATOM 0 HB2 ALA A 131 5.144 1.650 18.176 1.00 3.28 H new ATOM 0 HB3 ALA A 131 5.183 1.673 16.397 1.00 3.28 H new ATOM 1898 N THR A 132 3.035 5.088 16.241 1.00 2.02 N ATOM 1899 CA THR A 132 2.560 5.870 15.123 1.00 2.10 C ATOM 1900 C THR A 132 3.452 7.053 14.794 1.00 1.56 C ATOM 1901 O THR A 132 4.198 7.556 15.637 1.00 2.12 O ATOM 1902 CB THR A 132 1.116 6.341 15.369 1.00 2.73 C ATOM 1903 OG1 THR A 132 0.705 7.264 14.358 1.00 3.34 O ATOM 1904 CG2 THR A 132 0.963 6.976 16.742 1.00 3.56 C ATOM 0 H THR A 132 2.821 5.484 17.156 1.00 2.02 H new ATOM 0 HA THR A 132 2.587 5.211 14.255 1.00 2.10 H new ATOM 0 HB THR A 132 0.476 5.460 15.327 1.00 2.73 H new ATOM 0 HG1 THR A 132 0.968 8.172 14.617 1.00 3.34 H new ATOM 0 HG21 THR A 132 -0.069 7.297 16.881 1.00 3.56 H new ATOM 0 HG22 THR A 132 1.224 6.248 17.511 1.00 3.56 H new ATOM 0 HG23 THR A 132 1.625 7.839 16.820 1.00 3.56 H new ATOM 1912 N LYS A 133 3.326 7.473 13.543 1.00 1.29 N ATOM 1913 CA LYS A 133 4.137 8.508 12.934 1.00 1.47 C ATOM 1914 C LYS A 133 3.903 8.437 11.434 1.00 1.14 C ATOM 1915 O LYS A 133 3.700 9.452 10.763 1.00 1.58 O ATOM 1916 CB LYS A 133 5.621 8.288 13.238 1.00 2.24 C ATOM 1917 CG LYS A 133 6.553 9.257 12.520 1.00 3.04 C ATOM 1918 CD LYS A 133 6.374 10.684 13.023 1.00 3.81 C ATOM 1919 CE LYS A 133 7.151 11.689 12.180 1.00 4.63 C ATOM 1920 NZ LYS A 133 8.594 11.349 12.082 1.00 5.17 N ATOM 0 H LYS A 133 2.631 7.086 12.905 1.00 1.29 H new ATOM 0 HA LYS A 133 3.861 9.485 13.331 1.00 1.47 H new ATOM 0 HB2 LYS A 133 5.778 8.378 14.313 1.00 2.24 H new ATOM 0 HB3 LYS A 133 5.890 7.269 12.961 1.00 2.24 H new ATOM 0 HG2 LYS A 133 7.587 8.945 12.668 1.00 3.04 H new ATOM 0 HG3 LYS A 133 6.360 9.222 11.448 1.00 3.04 H new ATOM 0 HD2 LYS A 133 5.315 10.942 13.011 1.00 3.81 H new ATOM 0 HD3 LYS A 133 6.706 10.747 14.059 1.00 3.81 H new ATOM 0 HE2 LYS A 133 6.721 11.729 11.179 1.00 4.63 H new ATOM 0 HE3 LYS A 133 7.043 12.683 12.613 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 9.109 12.141 11.647 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 8.974 11.170 13.033 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 8.711 10.498 11.496 1.00 5.17 H new ATOM 1934 N ALA A 134 3.899 7.199 10.939 1.00 0.92 N ATOM 1935 CA ALA A 134 3.721 6.905 9.527 1.00 0.77 C ATOM 1936 C ALA A 134 3.666 5.395 9.307 1.00 0.81 C ATOM 1937 O ALA A 134 3.745 4.611 10.256 1.00 1.59 O ATOM 1938 CB ALA A 134 4.862 7.501 8.711 1.00 1.02 C ATOM 0 H ALA A 134 4.021 6.368 11.517 1.00 0.92 H new ATOM 0 HA ALA A 134 2.782 7.350 9.198 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.713 7.272 7.656 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.881 8.582 8.848 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.809 7.076 9.045 1.00 1.02 H new ATOM 1944 N ILE A 135 3.495 5.020 8.048 1.00 0.69 N ATOM 1945 CA ILE A 135 3.699 3.655 7.556 1.00 0.74 C ATOM 1946 C ILE A 135 5.186 3.263 7.703 1.00 1.09 C ATOM 1947 O ILE A 135 5.868 2.983 6.721 1.00 2.00 O ATOM 1948 CB ILE A 135 3.304 3.632 6.080 1.00 0.86 C ATOM 1949 CG1 ILE A 135 3.789 4.916 5.394 1.00 0.88 C ATOM 1950 CG2 ILE A 135 1.802 3.482 5.964 1.00 1.54 C ATOM 1951 CD1 ILE A 135 3.297 5.085 3.979 1.00 0.89 C ATOM 0 H ILE A 135 3.203 5.669 7.317 1.00 0.69 H new ATOM 0 HA ILE A 135 3.097 2.948 8.127 1.00 0.74 H new ATOM 0 HB ILE A 135 3.774 2.784 5.582 1.00 0.86 H new ATOM 0 HG12 ILE A 135 3.466 5.774 5.984 1.00 0.88 H new ATOM 0 HG13 ILE A 135 4.879 4.923 5.391 1.00 0.88 H new ATOM 0 HG21 ILE A 135 1.518 3.465 4.912 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.492 2.551 6.438 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.313 4.322 6.458 1.00 1.54 H new ATOM 0 HD11 ILE A 135 3.685 6.017 3.568 1.00 0.89 H new ATOM 0 HD12 ILE A 135 3.642 4.248 3.371 1.00 0.89 H new ATOM 0 HD13 ILE A 135 2.207 5.112 3.973 1.00 0.89 H new ATOM 1963 N LYS A 136 5.664 3.259 8.946 1.00 0.85 N ATOM 1964 CA LYS A 136 7.097 3.181 9.277 1.00 1.14 C ATOM 1965 C LYS A 136 7.689 1.785 9.027 1.00 0.75 C ATOM 1966 O LYS A 136 8.876 1.546 9.255 1.00 0.78 O ATOM 1967 CB LYS A 136 7.254 3.563 10.754 1.00 1.71 C ATOM 1968 CG LYS A 136 8.684 3.676 11.258 1.00 2.72 C ATOM 1969 CD LYS A 136 8.708 3.666 12.777 1.00 3.21 C ATOM 1970 CE LYS A 136 10.102 3.892 13.335 1.00 4.09 C ATOM 1971 NZ LYS A 136 10.128 3.700 14.811 1.00 4.81 N ATOM 0 H LYS A 136 5.063 3.310 9.768 1.00 0.85 H new ATOM 0 HA LYS A 136 7.644 3.865 8.628 1.00 1.14 H new ATOM 0 HB2 LYS A 136 6.754 4.517 10.918 1.00 1.71 H new ATOM 0 HB3 LYS A 136 6.733 2.822 11.359 1.00 1.71 H new ATOM 0 HG2 LYS A 136 9.280 2.849 10.872 1.00 2.72 H new ATOM 0 HG3 LYS A 136 9.137 4.595 10.886 1.00 2.72 H new ATOM 0 HD2 LYS A 136 8.039 4.440 13.153 1.00 3.21 H new ATOM 0 HD3 LYS A 136 8.326 2.711 13.138 1.00 3.21 H new ATOM 0 HE2 LYS A 136 10.802 3.202 12.863 1.00 4.09 H new ATOM 0 HE3 LYS A 136 10.435 4.901 13.091 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 11.093 3.861 15.165 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 9.477 4.375 15.260 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 9.832 2.730 15.040 1.00 4.81 H new ATOM 1985 N TRP A 137 6.863 0.877 8.554 1.00 0.69 N ATOM 1986 CA TRP A 137 7.267 -0.500 8.333 1.00 0.45 C ATOM 1987 C TRP A 137 7.311 -0.811 6.849 1.00 0.43 C ATOM 1988 O TRP A 137 7.009 0.047 6.029 1.00 0.55 O ATOM 1989 CB TRP A 137 6.301 -1.478 9.007 1.00 0.42 C ATOM 1990 CG TRP A 137 6.405 -1.551 10.495 1.00 0.62 C ATOM 1991 CD1 TRP A 137 6.893 -2.586 11.241 1.00 0.93 C ATOM 1992 CD2 TRP A 137 5.975 -0.556 11.419 1.00 1.00 C ATOM 1993 NE1 TRP A 137 6.823 -2.271 12.575 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.263 -1.029 12.708 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.388 0.701 11.278 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 5.983 -0.290 13.847 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.109 1.435 12.409 1.00 1.97 C ATOM 1998 CH2 TRP A 137 5.408 0.940 13.682 1.00 1.97 C ATOM 0 H TRP A 137 5.891 1.070 8.311 1.00 0.69 H new ATOM 0 HA TRP A 137 8.259 -0.618 8.768 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.282 -1.196 8.743 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.473 -2.473 8.598 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.276 -3.513 10.841 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.137 -2.865 13.342 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.156 1.092 10.298 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.211 -0.672 14.831 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 4.652 2.409 12.311 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.181 1.540 14.551 1.00 1.97 H new ATOM 2009 N ASN A 138 7.772 -2.021 6.541 1.00 0.37 N ATOM 2010 CA ASN A 138 7.586 -2.687 5.235 1.00 0.38 C ATOM 2011 C ASN A 138 6.188 -2.458 4.637 1.00 0.31 C ATOM 2012 O ASN A 138 5.514 -1.507 4.950 1.00 0.30 O ATOM 2013 CB ASN A 138 7.826 -4.195 5.377 1.00 0.41 C ATOM 2014 CG ASN A 138 9.275 -4.545 5.654 1.00 1.06 C ATOM 2015 OD1 ASN A 138 10.187 -3.840 5.239 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.494 -5.649 6.353 1.00 1.40 N ATOM 0 H ASN A 138 8.300 -2.588 7.204 1.00 0.37 H new ATOM 0 HA ASN A 138 8.312 -2.242 4.554 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.205 -4.581 6.185 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.506 -4.695 4.463 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.449 -5.939 6.563 1.00 1.40 H new ATOM 0 HD22 ASN A 138 8.707 -6.209 6.681 1.00 1.40 H new ATOM 2023 N PHE A 139 5.798 -3.345 3.733 1.00 0.34 N ATOM 2024 CA PHE A 139 4.584 -3.220 2.901 1.00 0.36 C ATOM 2025 C PHE A 139 3.363 -2.514 3.559 1.00 0.32 C ATOM 2026 O PHE A 139 2.572 -1.997 2.815 1.00 0.57 O ATOM 2027 CB PHE A 139 4.207 -4.606 2.362 1.00 0.55 C ATOM 2028 CG PHE A 139 4.814 -5.737 3.110 1.00 0.55 C ATOM 2029 CD1 PHE A 139 6.104 -6.131 2.846 1.00 0.61 C ATOM 2030 CD2 PHE A 139 4.087 -6.395 4.095 1.00 1.23 C ATOM 2031 CE1 PHE A 139 6.668 -7.170 3.547 1.00 1.22 C ATOM 2032 CE2 PHE A 139 4.650 -7.432 4.797 1.00 1.93 C ATOM 2033 CZ PHE A 139 5.939 -7.855 4.470 1.00 1.89 C ATOM 0 H PHE A 139 6.323 -4.199 3.544 1.00 0.34 H new ATOM 0 HA PHE A 139 4.849 -2.539 2.092 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.122 -4.710 2.386 1.00 0.55 H new ATOM 0 HB3 PHE A 139 4.510 -4.672 1.317 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.677 -5.622 2.085 1.00 0.61 H new ATOM 0 HD2 PHE A 139 3.074 -6.089 4.309 1.00 1.23 H new ATOM 0 HE1 PHE A 139 7.696 -7.445 3.364 1.00 1.22 H new ATOM 0 HE2 PHE A 139 4.102 -7.915 5.593 1.00 1.93 H new ATOM 0 HZ PHE A 139 6.359 -8.727 4.950 1.00 1.89 H new ATOM 2043 N THR A 140 3.195 -2.523 4.905 1.00 0.25 N ATOM 2044 CA THR A 140 2.242 -1.630 5.635 1.00 0.25 C ATOM 2045 C THR A 140 1.079 -1.098 4.779 1.00 0.22 C ATOM 2046 O THR A 140 1.227 -0.208 3.944 1.00 0.29 O ATOM 2047 CB THR A 140 2.985 -0.440 6.273 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.133 -0.914 6.975 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.095 0.307 7.246 1.00 0.60 C ATOM 0 H THR A 140 3.714 -3.148 5.521 1.00 0.25 H new ATOM 0 HA THR A 140 1.799 -2.265 6.403 1.00 0.25 H new ATOM 0 HB THR A 140 3.279 0.239 5.473 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.714 -1.406 6.358 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.648 1.140 7.679 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.219 0.687 6.720 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.776 -0.368 8.040 1.00 0.60 H new ATOM 2057 N SER A 141 -0.092 -1.596 5.071 1.00 0.19 N ATOM 2058 CA SER A 141 -1.224 -1.520 4.147 1.00 0.20 C ATOM 2059 C SER A 141 -2.272 -0.516 4.597 1.00 0.22 C ATOM 2060 O SER A 141 -2.621 -0.516 5.744 1.00 0.39 O ATOM 2061 CB SER A 141 -1.849 -2.896 4.118 1.00 0.26 C ATOM 2062 OG SER A 141 -0.894 -3.874 4.490 1.00 0.62 O ATOM 0 H SER A 141 -0.302 -2.068 5.951 1.00 0.19 H new ATOM 0 HA SER A 141 -0.869 -1.195 3.169 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.700 -2.931 4.798 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.229 -3.110 3.119 1.00 0.26 H new ATOM 0 HG SER A 141 -0.396 -4.163 3.697 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.842 0.284 3.704 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.909 1.187 4.105 1.00 0.18 C ATOM 2070 C PHE A 142 -5.195 0.602 3.638 1.00 0.18 C ATOM 2071 O PHE A 142 -5.343 0.262 2.479 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.782 2.570 3.465 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.778 3.494 4.081 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -3.135 4.307 5.145 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.497 3.583 3.574 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -2.229 5.191 5.691 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.587 4.460 4.118 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.952 5.265 5.177 1.00 0.57 C ATOM 0 H PHE A 142 -2.589 0.325 2.717 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.858 1.305 5.187 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.527 2.439 2.413 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.758 3.054 3.498 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -4.134 4.247 5.551 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.206 2.958 2.742 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.518 5.823 6.518 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.414 4.518 3.716 1.00 0.55 H new ATOM 0 HZ PHE A 142 -0.237 5.953 5.603 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.133 0.466 4.516 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.404 0.025 4.071 1.00 0.16 C ATOM 2090 C LEU A 143 -8.126 1.202 3.501 1.00 0.15 C ATOM 2091 O LEU A 143 -8.609 2.079 4.209 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.184 -0.622 5.182 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.687 -0.677 4.944 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.053 -1.808 3.997 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.435 -0.793 6.258 1.00 0.43 C ATOM 0 H LEU A 143 -6.046 0.649 5.516 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.284 -0.740 3.304 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.814 -1.637 5.327 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.994 -0.078 6.108 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.988 0.256 4.468 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.132 -1.822 3.847 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.555 -1.656 3.039 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.734 -2.758 4.425 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.507 -0.831 6.064 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.127 -1.703 6.773 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.209 0.071 6.883 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.140 1.212 2.204 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.754 2.250 1.448 1.00 0.14 C ATOM 2109 C ILE A 144 -10.157 1.796 1.113 1.00 0.15 C ATOM 2110 O ILE A 144 -10.361 0.629 0.791 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.959 2.487 0.159 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.489 2.778 0.447 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.585 3.599 -0.644 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.266 3.940 1.359 1.00 0.19 C ATOM 0 H ILE A 144 -7.715 0.482 1.633 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.778 3.181 2.014 1.00 0.14 H new ATOM 0 HB ILE A 144 -7.994 1.570 -0.430 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.033 1.891 0.887 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.975 2.966 -0.496 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.010 3.757 -1.557 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.609 3.329 -0.902 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.589 4.516 -0.055 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.196 4.081 1.514 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.690 4.840 0.913 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.749 3.748 2.317 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.115 2.687 1.193 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.513 2.258 1.102 1.00 0.15 C ATOM 2128 C ASP A 145 -13.026 2.342 -0.329 1.00 0.14 C ATOM 2129 O ASP A 145 -12.262 2.634 -1.244 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.414 3.049 2.067 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.194 4.171 1.402 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.589 5.185 1.023 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.425 4.029 1.250 1.00 0.75 O ATOM 0 H ASP A 145 -10.973 3.689 1.317 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.552 1.212 1.406 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.116 2.362 2.539 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.798 3.470 2.861 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.316 2.066 -0.512 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.932 2.061 -1.833 1.00 0.17 C ATOM 2140 C ARG A 146 -14.653 3.363 -2.571 1.00 0.18 C ATOM 2141 O ARG A 146 -14.352 3.361 -3.761 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.443 1.873 -1.720 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.863 0.682 -0.880 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.365 0.479 -0.941 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.083 1.728 -0.687 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.348 1.951 -1.034 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -21.068 0.996 -1.609 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.895 3.136 -0.808 1.00 2.22 N ATOM 0 H ARG A 146 -14.958 1.841 0.248 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.499 1.231 -2.392 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.879 2.776 -1.292 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.859 1.761 -2.721 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.356 -0.215 -1.235 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.554 0.834 0.154 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.642 0.091 -1.921 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.663 -0.269 -0.207 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.580 2.478 -0.212 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.652 0.082 -1.788 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -22.037 1.176 -1.872 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.347 3.875 -0.369 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.865 3.309 -1.073 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.725 4.473 -1.854 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.548 5.774 -2.469 1.00 0.21 C ATOM 2164 C ASP A 147 -13.131 6.252 -2.239 1.00 0.18 C ATOM 2165 O ASP A 147 -12.855 7.443 -2.299 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.540 6.794 -1.899 1.00 0.28 C ATOM 2167 CG ASP A 147 -16.986 6.431 -2.168 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.431 6.553 -3.331 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.693 6.045 -1.214 1.00 2.00 O ATOM 0 H ASP A 147 -14.904 4.497 -0.850 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.737 5.679 -3.538 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.387 6.879 -0.823 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.332 7.774 -2.329 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.237 5.306 -1.987 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.840 5.620 -1.806 1.00 0.16 C ATOM 2176 C GLY A 148 -10.526 6.416 -0.555 1.00 0.15 C ATOM 2177 O GLY A 148 -9.695 7.314 -0.593 1.00 0.17 O ATOM 0 H GLY A 148 -12.462 4.315 -1.904 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.273 4.689 -1.780 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.492 6.181 -2.674 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.170 6.116 0.553 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.801 6.752 1.804 1.00 0.18 C ATOM 2183 C VAL A 149 -9.938 5.814 2.647 1.00 0.17 C ATOM 2184 O VAL A 149 -10.301 4.669 2.878 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.038 7.211 2.612 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.628 7.806 3.954 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.846 8.220 1.807 1.00 1.12 C ATOM 0 H VAL A 149 -11.938 5.448 0.616 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.224 7.643 1.554 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.659 6.337 2.809 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.518 8.120 4.500 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.091 7.057 4.535 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -10.982 8.668 3.788 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.714 8.536 2.386 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.225 9.087 1.582 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.178 7.760 0.876 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.775 6.291 3.105 1.00 0.21 N ATOM 2198 CA PRO A 150 -7.875 5.504 3.941 1.00 0.20 C ATOM 2199 C PRO A 150 -8.393 5.452 5.373 1.00 0.23 C ATOM 2200 O PRO A 150 -8.371 6.457 6.086 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.555 6.269 3.901 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.839 7.602 3.282 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.288 7.653 2.891 1.00 0.41 C ATOM 0 HA PRO A 150 -7.781 4.475 3.593 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.149 6.389 4.905 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.811 5.724 3.319 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -6.609 8.402 3.986 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.206 7.755 2.408 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.838 8.371 3.499 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -8.408 7.958 1.851 1.00 0.41 H new ATOM 2211 N VAL A 151 -8.853 4.295 5.795 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.506 4.163 7.083 1.00 0.29 C ATOM 2213 C VAL A 151 -8.596 3.426 8.038 1.00 0.32 C ATOM 2214 O VAL A 151 -8.640 3.627 9.247 1.00 0.61 O ATOM 2215 CB VAL A 151 -10.842 3.403 6.959 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.626 3.477 8.257 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.666 3.942 5.799 1.00 1.13 C ATOM 0 H VAL A 151 -8.787 3.427 5.264 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.715 5.163 7.462 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.618 2.356 6.757 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.565 2.934 8.147 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.041 3.031 9.061 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.836 4.519 8.496 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.604 3.390 5.732 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -11.878 4.999 5.963 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -11.108 3.824 4.870 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.755 2.579 7.476 1.00 0.19 N ATOM 2228 CA GLU A 152 -6.811 1.807 8.268 1.00 0.20 C ATOM 2229 C GLU A 152 -5.455 1.815 7.625 1.00 0.20 C ATOM 2230 O GLU A 152 -5.304 2.204 6.474 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.239 0.347 8.388 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.616 0.161 8.955 1.00 0.57 C ATOM 2233 CD GLU A 152 -8.639 0.193 10.470 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.640 1.292 11.051 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -8.684 -0.894 11.083 1.00 1.17 O ATOM 0 H GLU A 152 -7.705 2.406 6.472 1.00 0.19 H new ATOM 0 HA GLU A 152 -6.782 2.270 9.254 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.197 -0.116 7.402 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.523 -0.181 9.018 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.271 0.943 8.570 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.020 -0.791 8.611 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.479 1.426 8.400 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.240 0.927 7.862 1.00 0.24 C ATOM 2244 C ARG A 153 -2.627 -0.100 8.809 1.00 0.25 C ATOM 2245 O ARG A 153 -2.627 0.070 10.031 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.292 2.049 7.418 1.00 0.36 C ATOM 2247 CG ARG A 153 -0.818 1.872 7.744 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.512 2.405 9.128 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.209 3.673 9.382 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.294 3.773 10.153 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.762 2.706 10.794 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.917 4.929 10.273 1.00 1.85 N ATOM 0 H ARG A 153 -4.519 1.445 9.419 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.449 0.395 6.934 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.389 2.168 6.339 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.631 2.980 7.873 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -0.551 0.817 7.687 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.211 2.394 7.005 1.00 0.40 H new ATOM 0 HD2 ARG A 153 -0.808 1.670 9.876 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.563 2.552 9.233 1.00 0.47 H new ATOM 0 HE ARG A 153 -0.845 4.521 8.947 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -2.291 1.806 10.698 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -3.591 2.787 11.382 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.570 5.749 9.776 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.746 5.003 10.863 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.101 -1.147 8.205 1.00 0.24 N ATOM 2267 CA PHE A 154 -1.830 -2.407 8.855 1.00 0.22 C ATOM 2268 C PHE A 154 -0.338 -2.633 8.894 1.00 0.24 C ATOM 2269 O PHE A 154 0.387 -2.137 8.034 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.487 -3.547 8.056 1.00 0.22 C ATOM 2271 CG PHE A 154 -3.993 -3.598 8.100 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.747 -2.888 7.177 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.654 -4.391 9.029 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.127 -2.961 7.183 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.037 -4.473 9.033 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.773 -3.756 8.110 1.00 0.22 C ATOM 0 H PHE A 154 -1.844 -1.141 7.218 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.231 -2.388 9.868 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.176 -3.461 7.015 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.099 -4.496 8.428 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.249 -2.270 6.444 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.084 -4.950 9.756 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.701 -2.396 6.463 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.539 -5.097 9.757 1.00 0.22 H new ATOM 0 HZ PHE A 154 -7.851 -3.817 8.113 1.00 0.22 H new ATOM 2286 N SER A 155 0.112 -3.381 9.873 1.00 0.22 N ATOM 2287 CA SER A 155 1.511 -3.735 9.966 1.00 0.25 C ATOM 2288 C SER A 155 1.856 -4.739 8.868 1.00 0.22 C ATOM 2289 O SER A 155 0.975 -5.422 8.355 1.00 0.26 O ATOM 2290 CB SER A 155 1.787 -4.342 11.340 1.00 0.35 C ATOM 2291 OG SER A 155 1.303 -3.506 12.376 1.00 1.11 O ATOM 0 H SER A 155 -0.472 -3.758 10.620 1.00 0.22 H new ATOM 0 HA SER A 155 2.127 -2.845 9.838 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.314 -5.322 11.409 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.859 -4.496 11.464 1.00 0.35 H new ATOM 0 HG SER A 155 1.491 -3.919 13.245 1.00 1.11 H new ATOM 2297 N PRO A 156 3.136 -4.839 8.478 1.00 0.25 N ATOM 2298 CA PRO A 156 3.593 -5.886 7.562 1.00 0.29 C ATOM 2299 C PRO A 156 3.348 -7.255 8.168 1.00 0.39 C ATOM 2300 O PRO A 156 3.206 -8.255 7.466 1.00 0.78 O ATOM 2301 CB PRO A 156 5.098 -5.616 7.419 1.00 0.34 C ATOM 2302 CG PRO A 156 5.452 -4.754 8.577 1.00 0.36 C ATOM 2303 CD PRO A 156 4.222 -3.946 8.882 1.00 0.33 C ATOM 0 HA PRO A 156 3.073 -5.874 6.604 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.668 -6.545 7.431 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.321 -5.118 6.475 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.746 -5.356 9.436 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.295 -4.106 8.338 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.160 -3.687 9.939 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.205 -3.010 8.323 1.00 0.33 H new ATOM 2311 N GLY A 157 3.328 -7.263 9.489 1.00 0.36 N ATOM 2312 CA GLY A 157 2.995 -8.439 10.252 1.00 0.46 C ATOM 2313 C GLY A 157 1.496 -8.666 10.376 1.00 0.41 C ATOM 2314 O GLY A 157 1.062 -9.530 11.135 1.00 0.50 O ATOM 0 H GLY A 157 3.545 -6.446 10.060 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.451 -9.311 9.782 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.427 -8.352 11.249 1.00 0.46 H new ATOM 2318 N ALA A 158 0.698 -7.880 9.656 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.727 -8.146 9.564 1.00 0.31 C ATOM 2320 C ALA A 158 -0.967 -9.099 8.407 1.00 0.34 C ATOM 2321 O ALA A 158 -0.251 -9.058 7.407 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.515 -6.859 9.374 1.00 0.37 C ATOM 0 H ALA A 158 1.014 -7.063 9.134 1.00 0.34 H new ATOM 0 HA ALA A 158 -1.071 -8.599 10.494 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.578 -7.090 9.308 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.339 -6.196 10.221 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.193 -6.367 8.456 1.00 0.37 H new ATOM 2328 N SER A 159 -1.954 -9.964 8.537 1.00 0.26 N ATOM 2329 CA SER A 159 -2.166 -10.991 7.556 1.00 0.30 C ATOM 2330 C SER A 159 -3.439 -10.735 6.777 1.00 0.23 C ATOM 2331 O SER A 159 -4.168 -9.778 7.055 1.00 0.22 O ATOM 2332 CB SER A 159 -2.234 -12.351 8.247 1.00 0.41 C ATOM 2333 OG SER A 159 -3.396 -12.457 9.057 1.00 1.42 O ATOM 0 H SER A 159 -2.616 -9.970 9.313 1.00 0.26 H new ATOM 0 HA SER A 159 -1.332 -10.984 6.854 1.00 0.30 H new ATOM 0 HB2 SER A 159 -2.236 -13.143 7.498 1.00 0.41 H new ATOM 0 HB3 SER A 159 -1.345 -12.495 8.861 1.00 0.41 H new ATOM 0 HG SER A 159 -3.390 -11.747 9.732 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.686 -11.594 5.805 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.912 -11.579 5.022 1.00 0.20 C ATOM 2341 C VAL A 160 -6.127 -11.396 5.930 1.00 0.21 C ATOM 2342 O VAL A 160 -6.983 -10.556 5.678 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.051 -12.918 4.285 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.315 -12.965 3.443 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.829 -13.196 3.428 1.00 0.26 C ATOM 0 H VAL A 160 -3.035 -12.330 5.533 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.865 -10.751 4.314 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.126 -13.699 5.042 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.379 -13.928 2.936 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.186 -12.835 4.086 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.288 -12.166 2.702 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.953 -14.151 2.917 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.713 -12.402 2.691 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.942 -13.236 4.061 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.155 -12.164 7.018 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.296 -12.188 7.927 1.00 0.31 C ATOM 2357 C LYS A 161 -7.421 -10.869 8.685 1.00 0.26 C ATOM 2358 O LYS A 161 -8.528 -10.368 8.911 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.146 -13.352 8.912 1.00 0.45 C ATOM 2360 CG LYS A 161 -8.276 -13.459 9.925 1.00 1.12 C ATOM 2361 CD LYS A 161 -8.023 -14.571 10.932 1.00 1.80 C ATOM 2362 CE LYS A 161 -8.052 -15.943 10.277 1.00 2.67 C ATOM 2363 NZ LYS A 161 -7.715 -17.024 11.237 1.00 3.46 N ATOM 0 H LYS A 161 -5.392 -12.783 7.292 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.204 -12.325 7.340 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.087 -14.284 8.350 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.203 -13.242 9.447 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -8.386 -12.510 10.450 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.215 -13.646 9.405 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -7.055 -14.416 11.409 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -8.776 -14.528 11.718 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -9.042 -16.125 9.859 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -7.347 -15.963 9.446 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -7.746 -17.943 10.750 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -6.760 -16.866 11.617 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.403 -17.022 12.017 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.276 -10.300 9.047 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.238 -9.068 9.821 1.00 0.27 C ATOM 2379 C ASP A 162 -6.817 -7.936 9.000 1.00 0.22 C ATOM 2380 O ASP A 162 -7.573 -7.102 9.496 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.797 -8.727 10.213 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.204 -9.693 11.213 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.523 -9.578 12.413 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.425 -10.577 10.806 1.00 1.40 O ATOM 0 H ASP A 162 -5.357 -10.677 8.814 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.827 -9.205 10.728 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.177 -8.717 9.317 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.770 -7.721 10.631 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.460 -7.939 7.731 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.900 -6.927 6.794 1.00 0.15 C ATOM 2391 C ILE A 163 -8.335 -7.172 6.341 1.00 0.14 C ATOM 2392 O ILE A 163 -9.143 -6.243 6.322 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.960 -6.892 5.575 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.593 -6.309 5.965 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.583 -6.105 4.427 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.522 -6.554 4.929 1.00 0.21 C ATOM 0 H ILE A 163 -5.853 -8.648 7.320 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.869 -5.963 7.302 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.808 -7.915 5.232 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.696 -5.236 6.125 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.278 -6.744 6.914 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.899 -6.096 3.579 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.521 -6.574 4.131 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.775 -5.082 4.749 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.582 -6.117 5.267 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.393 -7.627 4.786 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.817 -6.095 3.985 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.654 -8.419 5.997 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.977 -8.749 5.477 1.00 0.13 C ATOM 2410 C GLU A 164 -11.083 -8.262 6.390 1.00 0.15 C ATOM 2411 O GLU A 164 -12.094 -7.762 5.926 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.180 -10.255 5.290 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.605 -10.841 4.017 1.00 0.20 C ATOM 2414 CD GLU A 164 -10.105 -12.254 3.766 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.239 -12.410 3.273 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.373 -13.219 4.062 1.00 0.67 O ATOM 0 H GLU A 164 -8.017 -9.213 6.069 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.027 -8.246 4.511 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.734 -10.772 6.140 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.249 -10.465 5.314 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.872 -10.206 3.172 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.517 -10.847 4.079 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.901 -8.415 7.687 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.963 -8.084 8.625 1.00 0.21 C ATOM 2425 C GLU A 165 -12.316 -6.596 8.585 1.00 0.21 C ATOM 2426 O GLU A 165 -13.396 -6.195 9.022 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.592 -8.511 10.046 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.743 -7.512 10.812 1.00 0.47 C ATOM 2429 CD GLU A 165 -10.721 -7.821 12.292 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -11.631 -7.351 13.009 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -9.821 -8.558 12.737 1.00 0.83 O ATOM 0 H GLU A 165 -10.042 -8.761 8.114 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.848 -8.640 8.317 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.509 -8.692 10.607 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.056 -9.459 9.997 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.725 -7.524 10.422 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -11.133 -6.506 10.655 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.413 -5.776 8.065 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.709 -4.365 7.877 1.00 0.20 C ATOM 2440 C LYS A 166 -12.008 -4.086 6.410 1.00 0.19 C ATOM 2441 O LYS A 166 -12.521 -3.030 6.051 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.561 -3.482 8.383 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.278 -3.651 9.871 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.539 -3.472 10.712 1.00 0.58 C ATOM 2445 CE LYS A 166 -12.034 -2.033 10.726 1.00 1.09 C ATOM 2446 NZ LYS A 166 -11.220 -1.167 11.620 1.00 1.71 N ATOM 0 H LYS A 166 -10.479 -6.061 7.769 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.592 -4.118 8.466 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.657 -3.716 7.820 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.800 -2.438 8.183 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.859 -4.641 10.051 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.527 -2.925 10.183 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -12.325 -4.119 10.323 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.338 -3.793 11.734 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -12.008 -1.632 9.713 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -13.074 -2.012 11.051 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -11.316 -0.175 11.324 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -11.553 -1.269 12.600 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -10.221 -1.451 11.563 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.723 -5.077 5.584 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.869 -4.979 4.140 1.00 0.15 C ATOM 2462 C LEU A 167 -13.232 -5.479 3.663 1.00 0.15 C ATOM 2463 O LEU A 167 -13.948 -4.783 2.943 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.785 -5.822 3.475 1.00 0.13 C ATOM 2465 CG LEU A 167 -11.050 -6.139 2.013 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.817 -4.912 1.160 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.200 -7.306 1.548 1.00 0.16 C ATOM 0 H LEU A 167 -11.379 -5.984 5.900 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.779 -3.927 3.868 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.833 -5.297 3.554 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.680 -6.757 4.025 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.094 -6.433 1.905 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.010 -5.153 0.115 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.488 -4.115 1.479 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.784 -4.583 1.271 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.409 -7.513 0.498 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.145 -7.058 1.666 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.434 -8.187 2.145 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.557 -6.704 4.059 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.739 -7.412 3.578 1.00 0.19 C ATOM 2481 C ILE A 168 -16.026 -6.596 3.752 1.00 0.22 C ATOM 2482 O ILE A 168 -16.809 -6.489 2.809 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.887 -8.783 4.266 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.607 -9.604 4.084 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.085 -9.534 3.702 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.610 -10.901 4.856 1.00 0.24 C ATOM 0 H ILE A 168 -13.004 -7.239 4.728 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.589 -7.565 2.509 1.00 0.19 H new ATOM 0 HB ILE A 168 -15.052 -8.624 5.332 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.471 -9.821 3.024 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.752 -9.005 4.399 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.175 -10.500 4.198 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.991 -8.953 3.871 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -15.947 -9.688 2.632 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.674 -11.431 4.681 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.714 -10.691 5.920 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.444 -11.520 4.525 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.279 -6.008 4.945 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.439 -5.133 5.157 1.00 0.29 C ATOM 2500 C PRO A 169 -17.541 -4.023 4.110 1.00 0.29 C ATOM 2501 O PRO A 169 -18.640 -3.585 3.767 1.00 0.41 O ATOM 2502 CB PRO A 169 -17.184 -4.534 6.540 1.00 0.34 C ATOM 2503 CG PRO A 169 -16.367 -5.556 7.241 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.491 -6.169 6.187 1.00 0.24 C ATOM 0 HA PRO A 169 -18.377 -5.683 5.077 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.656 -3.583 6.470 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -18.118 -4.342 7.068 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.769 -5.104 8.032 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -17.000 -6.309 7.710 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.529 -5.661 6.120 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.284 -7.218 6.398 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.394 -3.586 3.595 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.358 -2.537 2.585 1.00 0.22 C ATOM 2514 C LEU A 170 -16.568 -3.115 1.186 1.00 0.20 C ATOM 2515 O LEU A 170 -17.298 -2.537 0.383 1.00 0.23 O ATOM 2516 CB LEU A 170 -15.044 -1.754 2.651 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.824 -0.926 3.910 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.425 -0.327 3.889 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.874 0.170 4.013 1.00 0.69 C ATOM 0 H LEU A 170 -15.477 -3.944 3.863 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.176 -1.848 2.795 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.218 -2.459 2.555 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.997 -1.088 1.789 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.920 -1.571 4.784 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.269 0.265 4.791 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.687 -1.128 3.849 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.316 0.311 3.012 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.704 0.753 4.918 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.806 0.822 3.143 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.866 -0.279 4.052 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.924 -4.245 0.895 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.109 -4.921 -0.394 1.00 0.20 C ATOM 2533 C LEU A 171 -17.553 -5.321 -0.555 1.00 0.27 C ATOM 2534 O LEU A 171 -18.237 -4.939 -1.507 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.269 -6.195 -0.482 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.770 -5.991 -0.462 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.058 -7.327 -0.476 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.337 -5.151 -1.649 1.00 0.31 C ATOM 0 H LEU A 171 -15.274 -4.711 1.528 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.801 -4.224 -1.174 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.540 -6.846 0.349 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.534 -6.721 -1.399 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.503 -5.464 0.454 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.980 -7.165 -0.461 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.350 -7.904 0.401 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.330 -7.875 -1.378 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.256 -5.012 -1.622 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.615 -5.657 -2.574 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.829 -4.179 -1.606 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.986 -6.105 0.406 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.322 -6.626 0.418 1.00 0.39 C ATOM 2552 C GLY A 172 -20.379 -5.545 0.544 1.00 0.66 C ATOM 2553 O GLY A 172 -21.498 -5.705 0.053 1.00 1.12 O ATOM 0 H GLY A 172 -17.416 -6.396 1.200 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.494 -7.190 -0.499 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.426 -7.326 1.247 1.00 0.39 H new ATOM 2557 N SER A 173 -20.020 -4.447 1.208 1.00 0.85 N ATOM 2558 CA SER A 173 -20.929 -3.322 1.416 1.00 1.33 C ATOM 2559 C SER A 173 -22.164 -3.773 2.203 1.00 1.84 C ATOM 2560 O SER A 173 -23.232 -3.162 2.130 1.00 2.43 O ATOM 2561 CB SER A 173 -21.326 -2.707 0.063 1.00 2.03 C ATOM 2562 OG SER A 173 -22.065 -1.508 0.226 1.00 2.64 O ATOM 0 H SER A 173 -19.094 -4.313 1.615 1.00 0.85 H new ATOM 0 HA SER A 173 -20.420 -2.557 2.002 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.429 -2.504 -0.521 1.00 2.03 H new ATOM 0 HB3 SER A 173 -21.919 -3.425 -0.503 1.00 2.03 H new ATOM 0 HG SER A 173 -22.814 -1.666 0.838 1.00 2.64 H new ATOM 2568 N ALA A 174 -21.994 -4.845 2.972 1.00 2.40 N ATOM 2569 CA ALA A 174 -23.085 -5.421 3.743 1.00 3.35 C ATOM 2570 C ALA A 174 -23.337 -4.623 5.012 1.00 3.69 C ATOM 2571 O ALA A 174 -24.380 -4.755 5.649 1.00 4.35 O ATOM 2572 CB ALA A 174 -22.777 -6.870 4.079 1.00 4.30 C ATOM 0 H ALA A 174 -21.104 -5.333 3.076 1.00 2.40 H new ATOM 0 HA ALA A 174 -23.991 -5.383 3.138 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -23.599 -7.292 4.656 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -22.651 -7.438 3.157 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -21.859 -6.920 4.665 1.00 4.30 H new ATOM 2578 N ARG A 175 -22.380 -3.789 5.381 1.00 3.66 N ATOM 2579 CA ARG A 175 -22.527 -2.954 6.562 1.00 4.44 C ATOM 2580 C ARG A 175 -22.920 -1.544 6.148 1.00 4.81 C ATOM 2581 O ARG A 175 -22.490 -0.552 6.738 1.00 5.15 O ATOM 2582 CB ARG A 175 -21.242 -2.960 7.394 1.00 5.16 C ATOM 2583 CG ARG A 175 -20.832 -4.359 7.827 1.00 5.82 C ATOM 2584 CD ARG A 175 -21.961 -5.061 8.567 1.00 6.62 C ATOM 2585 NE ARG A 175 -21.815 -6.515 8.542 1.00 7.03 N ATOM 2586 CZ ARG A 175 -22.792 -7.351 8.176 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -23.987 -6.871 7.850 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -22.581 -8.658 8.143 1.00 8.45 N ATOM 0 H ARG A 175 -21.497 -3.672 4.883 1.00 3.66 H new ATOM 0 HA ARG A 175 -23.320 -3.359 7.191 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -20.435 -2.512 6.813 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -21.383 -2.337 8.277 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -20.548 -4.944 6.952 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -19.954 -4.300 8.470 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -21.985 -4.717 9.601 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -22.915 -4.785 8.118 1.00 6.62 H new ATOM 0 HE ARG A 175 -20.918 -6.914 8.819 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -24.158 -5.866 7.879 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -24.733 -7.508 7.571 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -21.668 -9.034 8.398 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -23.332 -9.289 7.863 1.00 8.45 H new ATOM 2602 N LEU A 176 -23.744 -1.481 5.117 1.00 5.22 N ATOM 2603 CA LEU A 176 -24.255 -0.231 4.596 1.00 6.05 C ATOM 2604 C LEU A 176 -25.666 -0.457 4.073 1.00 6.72 C ATOM 2605 O LEU A 176 -26.625 -0.076 4.767 1.00 7.14 O ATOM 2606 CB LEU A 176 -23.352 0.301 3.477 1.00 6.60 C ATOM 2607 CG LEU A 176 -23.803 1.619 2.847 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -23.803 2.736 3.879 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -22.907 1.974 1.671 1.00 7.60 C ATOM 2610 OXT LEU A 176 -25.805 -1.063 2.990 1.00 7.13 O ATOM 0 H LEU A 176 -24.078 -2.304 4.616 1.00 5.22 H new ATOM 0 HA LEU A 176 -24.271 0.512 5.393 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -22.346 0.433 3.876 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -23.288 -0.454 2.694 1.00 6.60 H new ATOM 0 HG LEU A 176 -24.823 1.497 2.481 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -24.127 3.665 3.410 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -24.485 2.482 4.690 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -22.797 2.863 4.278 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -23.239 2.915 1.231 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -21.878 2.078 2.016 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -22.961 1.184 0.921 1.00 7.60 H new TER 2622 LEU A 176