USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1096 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 70 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 115 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-6.5!) USER MOD Set 2.1: A 9 ASN : amide:sc= -1.63! K(o=-2!,f=-0.65) USER MOD Set 2.2: A 47 HIS : no HD1:sc= -0.383 K(o=-2,f=-0.65) USER MOD Set 3.1: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 20 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 112 ASN : amide:sc= -4.06! C(o=-4.1!,f=-4.9!) USER MOD Set 5.1: A 3 HIS : no HD1:sc=-0.00206 X(o=1.2,f=1.1) USER MOD Set 5.2: A 51 SER OG : rot -42:sc= 1.24 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 CYS SG : rot 110:sc= -2.05 USER MOD Single : A 14 ASN : amide:sc= -1.36 K(o=-1.4,f=-2.4!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl -128:sc= -0.196 (180deg=-0.533) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.28 K(o=-0.28,f=-0.98) USER MOD Single : A 28 SER OG : rot -19:sc= 0.67 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 88:sc= 0.357 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.3 USER MOD Single : A 60 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.13) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.375 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 CYS SG : rot 160:sc= -4.66! USER MOD Single : A 83 GLN : amide:sc= -0.122 K(o=-0.12,f=-1.2) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 53:sc= 0.383 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -50:sc= 0.161 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0.466 K(o=0.47,f=-2.5!) USER MOD Single : A 108 SER OG : rot 172:sc= 0.355 USER MOD Single : A 109 THR OG1 : rot 71:sc= -1.21! USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 130:sc= -0.343 USER MOD Single : A 124 GLN : amide:sc= -0.0727 K(o=-0.073,f=-1.3) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -148:sc= -0.154 (180deg=-1.1) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.811 -9.825 -20.716 1.00 0.00 N ATOM 2 CA GLY A 1 3.643 -9.550 -21.584 1.00 0.00 C ATOM 3 C GLY A 1 2.822 -8.317 -21.158 1.00 0.00 C ATOM 4 O GLY A 1 3.366 -7.317 -20.685 1.00 0.00 O ATOM 0 H1 GLY A 1 5.312 -10.667 -21.065 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.454 -9.008 -20.731 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.488 -9.993 -19.742 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.990 -9.407 -22.608 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.992 -10.424 -21.587 1.00 0.00 H new ATOM 9 N SER A 2 1.510 -8.403 -21.367 1.00 0.00 N ATOM 10 CA SER A 2 0.568 -7.347 -20.949 1.00 0.00 C ATOM 11 C SER A 2 0.113 -7.565 -19.495 1.00 0.00 C ATOM 12 O SER A 2 0.444 -8.570 -18.865 1.00 0.00 O ATOM 13 CB SER A 2 -0.642 -7.290 -21.892 1.00 0.00 C ATOM 14 OG SER A 2 -1.336 -8.541 -21.910 1.00 0.00 O ATOM 0 H SER A 2 1.065 -9.197 -21.827 1.00 0.00 H new ATOM 0 HA SER A 2 1.088 -6.390 -21.004 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.320 -6.498 -21.573 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.311 -7.039 -22.900 1.00 0.00 H new ATOM 0 HG SER A 2 -2.104 -8.480 -22.516 1.00 0.00 H new ATOM 20 N HIS A 3 -0.551 -6.552 -18.953 1.00 0.00 N ATOM 21 CA HIS A 3 -1.135 -6.620 -17.599 1.00 0.00 C ATOM 22 C HIS A 3 -2.670 -6.529 -17.651 1.00 0.00 C ATOM 23 O HIS A 3 -3.266 -6.384 -18.717 1.00 0.00 O ATOM 24 CB HIS A 3 -0.553 -5.524 -16.698 1.00 0.00 C ATOM 25 CG HIS A 3 0.924 -5.755 -16.339 1.00 0.00 C ATOM 26 ND1 HIS A 3 1.956 -5.110 -16.867 1.00 0.00 N ATOM 27 CD2 HIS A 3 1.382 -6.582 -15.408 1.00 0.00 C ATOM 28 CE1 HIS A 3 3.063 -5.542 -16.254 1.00 0.00 C ATOM 29 NE2 HIS A 3 2.706 -6.442 -15.348 1.00 0.00 N ATOM 0 H HIS A 3 -0.705 -5.662 -19.427 1.00 0.00 H new ATOM 0 HA HIS A 3 -0.873 -7.587 -17.170 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -0.652 -4.561 -17.199 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -1.139 -5.468 -15.780 1.00 0.00 H new ATOM 0 HD2 HIS A 3 0.786 -7.251 -14.805 1.00 0.00 H new ATOM 0 HE1 HIS A 3 4.071 -5.215 -16.461 1.00 0.00 H new ATOM 0 HE2 HIS A 3 3.334 -6.939 -14.717 1.00 0.00 H new ATOM 37 N MET A 4 -3.277 -6.711 -16.483 1.00 0.00 N ATOM 38 CA MET A 4 -4.741 -6.638 -16.296 1.00 0.00 C ATOM 39 C MET A 4 -5.231 -5.179 -16.342 1.00 0.00 C ATOM 40 O MET A 4 -4.468 -4.243 -16.094 1.00 0.00 O ATOM 41 CB MET A 4 -5.063 -7.321 -14.962 1.00 0.00 C ATOM 42 CG MET A 4 -6.541 -7.685 -14.809 1.00 0.00 C ATOM 43 SD MET A 4 -6.787 -9.399 -14.222 1.00 0.00 S ATOM 44 CE MET A 4 -7.146 -10.206 -15.769 1.00 0.00 C ATOM 0 H MET A 4 -2.769 -6.916 -15.623 1.00 0.00 H new ATOM 0 HA MET A 4 -5.264 -7.150 -17.104 1.00 0.00 H new ATOM 0 HB2 MET A 4 -4.462 -8.226 -14.871 1.00 0.00 H new ATOM 0 HB3 MET A 4 -4.772 -6.661 -14.145 1.00 0.00 H new ATOM 0 HG2 MET A 4 -7.011 -6.994 -14.109 1.00 0.00 H new ATOM 0 HG3 MET A 4 -7.044 -7.558 -15.768 1.00 0.00 H new ATOM 0 HE1 MET A 4 -7.323 -11.267 -15.593 1.00 0.00 H new ATOM 0 HE2 MET A 4 -8.034 -9.759 -16.215 1.00 0.00 H new ATOM 0 HE3 MET A 4 -6.300 -10.087 -16.446 1.00 0.00 H new ATOM 54 N GLY A 5 -6.531 -5.025 -16.635 1.00 0.00 N ATOM 55 CA GLY A 5 -7.207 -3.712 -16.711 1.00 0.00 C ATOM 56 C GLY A 5 -7.517 -3.115 -15.329 1.00 0.00 C ATOM 57 O GLY A 5 -8.677 -2.883 -14.996 1.00 0.00 O ATOM 0 H GLY A 5 -7.151 -5.811 -16.828 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -6.578 -3.017 -17.268 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -8.136 -3.820 -17.271 1.00 0.00 H new ATOM 61 N ALA A 6 -6.477 -2.989 -14.511 1.00 0.00 N ATOM 62 CA ALA A 6 -6.566 -2.382 -13.170 1.00 0.00 C ATOM 63 C ALA A 6 -5.451 -1.353 -12.962 1.00 0.00 C ATOM 64 O ALA A 6 -4.267 -1.660 -13.084 1.00 0.00 O ATOM 65 CB ALA A 6 -6.517 -3.457 -12.081 1.00 0.00 C ATOM 0 H ALA A 6 -5.538 -3.305 -14.754 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.524 -1.866 -13.097 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.584 -2.985 -11.101 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.353 -4.145 -12.211 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.579 -4.008 -12.155 1.00 0.00 H new ATOM 71 N ALA A 7 -5.892 -0.150 -12.611 1.00 0.00 N ATOM 72 CA ALA A 7 -5.034 1.033 -12.403 1.00 0.00 C ATOM 73 C ALA A 7 -5.818 2.123 -11.663 1.00 0.00 C ATOM 74 O ALA A 7 -6.810 2.655 -12.161 1.00 0.00 O ATOM 75 CB ALA A 7 -4.510 1.588 -13.737 1.00 0.00 C ATOM 0 H ALA A 7 -6.881 0.045 -12.457 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.178 0.725 -11.803 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -3.882 2.458 -13.547 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.924 0.822 -14.245 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -5.352 1.878 -14.366 1.00 0.00 H new ATOM 81 N CYS A 8 -5.524 2.199 -10.372 1.00 0.00 N ATOM 82 CA CYS A 8 -6.126 3.202 -9.470 1.00 0.00 C ATOM 83 C CYS A 8 -5.101 4.243 -8.993 1.00 0.00 C ATOM 84 O CYS A 8 -3.904 4.110 -9.237 1.00 0.00 O ATOM 85 CB CYS A 8 -6.787 2.494 -8.285 1.00 0.00 C ATOM 86 SG CYS A 8 -8.213 1.461 -8.788 1.00 0.00 S ATOM 0 H CYS A 8 -4.864 1.573 -9.910 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.884 3.750 -10.029 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -6.049 1.868 -7.783 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.120 3.238 -7.561 1.00 0.00 H new ATOM 0 HG CYS A 8 -7.907 0.205 -8.655 1.00 0.00 H new ATOM 92 N ASN A 9 -5.617 5.291 -8.358 1.00 0.00 N ATOM 93 CA ASN A 9 -4.803 6.401 -7.827 1.00 0.00 C ATOM 94 C ASN A 9 -4.608 6.328 -6.315 1.00 0.00 C ATOM 95 O ASN A 9 -5.558 6.440 -5.532 1.00 0.00 O ATOM 96 CB ASN A 9 -5.421 7.756 -8.168 1.00 0.00 C ATOM 97 CG ASN A 9 -5.163 8.181 -9.612 1.00 0.00 C ATOM 98 OD1 ASN A 9 -5.103 7.382 -10.531 1.00 0.00 O ATOM 99 ND2 ASN A 9 -5.075 9.474 -9.823 1.00 0.00 N ATOM 0 H ASN A 9 -6.617 5.403 -8.192 1.00 0.00 H new ATOM 0 HA ASN A 9 -3.829 6.299 -8.306 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.496 7.713 -7.994 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -5.019 8.513 -7.495 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.954 9.829 -10.772 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -5.128 10.124 -9.038 1.00 0.00 H new ATOM 106 N VAL A 10 -3.340 6.177 -5.956 1.00 0.00 N ATOM 107 CA VAL A 10 -2.915 6.122 -4.543 1.00 0.00 C ATOM 108 C VAL A 10 -1.721 7.076 -4.330 1.00 0.00 C ATOM 109 O VAL A 10 -1.005 7.419 -5.270 1.00 0.00 O ATOM 110 CB VAL A 10 -2.660 4.677 -4.028 1.00 0.00 C ATOM 111 CG1 VAL A 10 -3.691 3.649 -4.518 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.249 4.136 -4.262 1.00 0.00 C ATOM 0 H VAL A 10 -2.573 6.089 -6.623 1.00 0.00 H new ATOM 0 HA VAL A 10 -3.741 6.470 -3.923 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.777 4.803 -2.952 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.444 2.666 -4.116 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.685 3.941 -4.179 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.676 3.610 -5.607 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.177 3.123 -3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.037 4.124 -5.331 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.526 4.775 -3.756 1.00 0.00 H new ATOM 122 N LEU A 11 -1.600 7.562 -3.107 1.00 0.00 N ATOM 123 CA LEU A 11 -0.453 8.364 -2.650 1.00 0.00 C ATOM 124 C LEU A 11 0.582 7.473 -1.967 1.00 0.00 C ATOM 125 O LEU A 11 0.273 6.745 -1.023 1.00 0.00 O ATOM 126 CB LEU A 11 -0.901 9.480 -1.699 1.00 0.00 C ATOM 127 CG LEU A 11 -1.600 10.635 -2.421 1.00 0.00 C ATOM 128 CD1 LEU A 11 -2.331 11.505 -1.400 1.00 0.00 C ATOM 129 CD2 LEU A 11 -0.594 11.502 -3.177 1.00 0.00 C ATOM 0 H LEU A 11 -2.303 7.414 -2.383 1.00 0.00 H new ATOM 0 HA LEU A 11 0.002 8.827 -3.526 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -1.577 9.064 -0.952 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -0.033 9.865 -1.165 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.305 10.211 -3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.829 12.328 -1.913 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.072 10.904 -0.874 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.614 11.905 -0.683 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -1.119 12.314 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.129 11.917 -2.475 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.073 10.894 -3.917 1.00 0.00 H new ATOM 141 N PHE A 12 1.710 7.387 -2.654 1.00 0.00 N ATOM 142 CA PHE A 12 2.911 6.660 -2.221 1.00 0.00 C ATOM 143 C PHE A 12 3.531 7.414 -1.046 1.00 0.00 C ATOM 144 O PHE A 12 3.889 8.586 -1.174 1.00 0.00 O ATOM 145 CB PHE A 12 3.921 6.602 -3.373 1.00 0.00 C ATOM 146 CG PHE A 12 5.177 5.840 -2.973 1.00 0.00 C ATOM 147 CD1 PHE A 12 5.159 4.447 -3.008 1.00 0.00 C ATOM 148 CD2 PHE A 12 6.320 6.503 -2.532 1.00 0.00 C ATOM 149 CE1 PHE A 12 6.267 3.734 -2.615 1.00 0.00 C ATOM 150 CE2 PHE A 12 7.431 5.787 -2.135 1.00 0.00 C ATOM 151 CZ PHE A 12 7.412 4.392 -2.172 1.00 0.00 C ATOM 0 H PHE A 12 1.827 7.835 -3.563 1.00 0.00 H new ATOM 0 HA PHE A 12 2.647 5.645 -1.925 1.00 0.00 H new ATOM 0 HB2 PHE A 12 3.462 6.122 -4.237 1.00 0.00 H new ATOM 0 HB3 PHE A 12 4.189 7.614 -3.675 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.274 3.927 -3.344 1.00 0.00 H new ATOM 0 HD2 PHE A 12 6.337 7.582 -2.501 1.00 0.00 H new ATOM 0 HE1 PHE A 12 6.249 2.655 -2.650 1.00 0.00 H new ATOM 0 HE2 PHE A 12 8.315 6.306 -1.796 1.00 0.00 H new ATOM 0 HZ PHE A 12 8.278 3.827 -1.860 1.00 0.00 H new ATOM 161 N ILE A 13 3.452 6.765 0.104 1.00 0.00 N ATOM 162 CA ILE A 13 4.029 7.345 1.322 1.00 0.00 C ATOM 163 C ILE A 13 5.521 6.973 1.412 1.00 0.00 C ATOM 164 O ILE A 13 6.376 7.812 1.138 1.00 0.00 O ATOM 165 CB ILE A 13 3.212 6.959 2.569 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.683 7.141 2.453 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.766 7.749 3.744 1.00 0.00 C ATOM 168 CD1 ILE A 13 1.168 8.489 1.934 1.00 0.00 C ATOM 0 H ILE A 13 3.006 5.856 0.228 1.00 0.00 H new ATOM 0 HA ILE A 13 3.974 8.433 1.275 1.00 0.00 H new ATOM 0 HB ILE A 13 3.327 5.884 2.705 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.300 6.359 1.797 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.248 6.972 3.438 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.208 7.499 4.646 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.817 7.500 3.887 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.670 8.816 3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.078 8.475 1.905 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.503 9.286 2.597 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.556 8.665 0.931 1.00 0.00 H new ATOM 180 N ASN A 14 5.788 5.753 1.882 1.00 0.00 N ATOM 181 CA ASN A 14 7.138 5.165 2.012 1.00 0.00 C ATOM 182 C ASN A 14 7.092 3.718 2.517 1.00 0.00 C ATOM 183 O ASN A 14 6.063 3.245 3.007 1.00 0.00 O ATOM 184 CB ASN A 14 8.041 5.964 2.962 1.00 0.00 C ATOM 185 CG ASN A 14 9.244 6.565 2.227 1.00 0.00 C ATOM 186 OD1 ASN A 14 9.610 6.193 1.116 1.00 0.00 O ATOM 187 ND2 ASN A 14 9.944 7.456 2.887 1.00 0.00 N ATOM 0 H ASN A 14 5.052 5.120 2.195 1.00 0.00 H new ATOM 0 HA ASN A 14 7.554 5.195 1.005 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.463 6.762 3.428 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.392 5.314 3.764 1.00 0.00 H new ATOM 0 HD21 ASN A 14 10.795 7.842 2.477 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.638 7.763 3.810 1.00 0.00 H new ATOM 194 N SER A 15 8.220 3.039 2.320 1.00 0.00 N ATOM 195 CA SER A 15 8.424 1.670 2.827 1.00 0.00 C ATOM 196 C SER A 15 9.144 1.747 4.171 1.00 0.00 C ATOM 197 O SER A 15 10.113 2.487 4.351 1.00 0.00 O ATOM 198 CB SER A 15 9.207 0.792 1.838 1.00 0.00 C ATOM 199 OG SER A 15 10.592 0.599 2.142 1.00 0.00 O ATOM 0 H SER A 15 9.019 3.414 1.808 1.00 0.00 H new ATOM 0 HA SER A 15 7.449 1.198 2.951 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.725 -0.185 1.788 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.130 1.237 0.846 1.00 0.00 H new ATOM 0 HG SER A 15 11.000 0.028 1.458 1.00 0.00 H new ATOM 205 N VAL A 16 8.511 1.115 5.144 1.00 0.00 N ATOM 206 CA VAL A 16 9.084 1.049 6.497 1.00 0.00 C ATOM 207 C VAL A 16 9.253 -0.410 6.927 1.00 0.00 C ATOM 208 O VAL A 16 8.319 -1.217 6.889 1.00 0.00 O ATOM 209 CB VAL A 16 8.337 1.949 7.498 1.00 0.00 C ATOM 210 CG1 VAL A 16 8.368 3.415 7.046 1.00 0.00 C ATOM 211 CG2 VAL A 16 6.895 1.514 7.730 1.00 0.00 C ATOM 0 H VAL A 16 7.613 0.644 5.036 1.00 0.00 H new ATOM 0 HA VAL A 16 10.088 1.474 6.482 1.00 0.00 H new ATOM 0 HB VAL A 16 8.864 1.847 8.446 1.00 0.00 H new ATOM 0 HG11 VAL A 16 7.834 4.030 7.770 1.00 0.00 H new ATOM 0 HG12 VAL A 16 9.402 3.752 6.976 1.00 0.00 H new ATOM 0 HG13 VAL A 16 7.890 3.505 6.070 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.422 2.188 8.445 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.349 1.545 6.787 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.880 0.498 8.124 1.00 0.00 H new ATOM 221 N GLU A 17 10.531 -0.774 6.916 1.00 0.00 N ATOM 222 CA GLU A 17 11.002 -2.122 7.280 1.00 0.00 C ATOM 223 C GLU A 17 10.454 -2.538 8.653 1.00 0.00 C ATOM 224 O GLU A 17 10.712 -1.907 9.675 1.00 0.00 O ATOM 225 CB GLU A 17 12.536 -2.199 7.211 1.00 0.00 C ATOM 226 CG GLU A 17 13.250 -1.278 8.212 1.00 0.00 C ATOM 227 CD GLU A 17 14.533 -0.682 7.638 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.396 0.074 6.652 1.00 0.00 O ATOM 229 OE2 GLU A 17 15.604 -0.978 8.206 1.00 0.00 O ATOM 0 H GLU A 17 11.285 -0.139 6.652 1.00 0.00 H new ATOM 0 HA GLU A 17 10.615 -2.837 6.554 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.847 -3.228 7.393 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.858 -1.942 6.202 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.577 -0.472 8.505 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.486 -1.840 9.115 1.00 0.00 H new ATOM 236 N MET A 18 9.499 -3.451 8.584 1.00 0.00 N ATOM 237 CA MET A 18 8.839 -3.953 9.801 1.00 0.00 C ATOM 238 C MET A 18 9.213 -5.409 10.120 1.00 0.00 C ATOM 239 O MET A 18 8.855 -5.919 11.176 1.00 0.00 O ATOM 240 CB MET A 18 7.325 -3.810 9.639 1.00 0.00 C ATOM 241 CG MET A 18 6.690 -3.113 10.846 1.00 0.00 C ATOM 242 SD MET A 18 6.631 -1.290 10.691 1.00 0.00 S ATOM 243 CE MET A 18 7.845 -0.796 11.892 1.00 0.00 C ATOM 0 H MET A 18 9.159 -3.862 7.714 1.00 0.00 H new ATOM 0 HA MET A 18 9.186 -3.356 10.644 1.00 0.00 H new ATOM 0 HB2 MET A 18 7.108 -3.242 8.735 1.00 0.00 H new ATOM 0 HB3 MET A 18 6.878 -4.796 9.511 1.00 0.00 H new ATOM 0 HG2 MET A 18 5.677 -3.491 10.982 1.00 0.00 H new ATOM 0 HG3 MET A 18 7.251 -3.375 11.743 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.410 -0.058 12.566 1.00 0.00 H new ATOM 0 HE2 MET A 18 8.165 -1.666 12.465 1.00 0.00 H new ATOM 0 HE3 MET A 18 8.705 -0.360 11.383 1.00 0.00 H new ATOM 253 N GLU A 19 10.059 -5.997 9.265 1.00 0.00 N ATOM 254 CA GLU A 19 10.451 -7.425 9.285 1.00 0.00 C ATOM 255 C GLU A 19 9.232 -8.322 8.996 1.00 0.00 C ATOM 256 O GLU A 19 8.103 -7.850 8.843 1.00 0.00 O ATOM 257 CB GLU A 19 11.121 -7.841 10.608 1.00 0.00 C ATOM 258 CG GLU A 19 12.336 -6.979 10.969 1.00 0.00 C ATOM 259 CD GLU A 19 12.912 -7.358 12.336 1.00 0.00 C ATOM 260 OE1 GLU A 19 12.204 -7.132 13.343 1.00 0.00 O ATOM 261 OE2 GLU A 19 14.052 -7.867 12.340 1.00 0.00 O ATOM 0 H GLU A 19 10.509 -5.479 8.511 1.00 0.00 H new ATOM 0 HA GLU A 19 11.193 -7.559 8.498 1.00 0.00 H new ATOM 0 HB2 GLU A 19 10.389 -7.780 11.413 1.00 0.00 H new ATOM 0 HB3 GLU A 19 11.432 -8.883 10.538 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.105 -7.095 10.205 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.048 -5.928 10.974 1.00 0.00 H new ATOM 268 N SER A 20 9.501 -9.603 8.773 1.00 0.00 N ATOM 269 CA SER A 20 8.458 -10.601 8.460 1.00 0.00 C ATOM 270 C SER A 20 7.881 -11.151 9.771 1.00 0.00 C ATOM 271 O SER A 20 8.285 -12.193 10.279 1.00 0.00 O ATOM 272 CB SER A 20 9.055 -11.732 7.614 1.00 0.00 C ATOM 273 OG SER A 20 8.034 -12.537 7.026 1.00 0.00 O ATOM 0 H SER A 20 10.444 -9.990 8.802 1.00 0.00 H new ATOM 0 HA SER A 20 7.657 -10.133 7.887 1.00 0.00 H new ATOM 0 HB2 SER A 20 9.684 -11.309 6.830 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.697 -12.354 8.237 1.00 0.00 H new ATOM 0 HG SER A 20 8.445 -13.248 6.492 1.00 0.00 H new ATOM 279 N LEU A 21 7.171 -10.250 10.442 1.00 0.00 N ATOM 280 CA LEU A 21 6.458 -10.561 11.696 1.00 0.00 C ATOM 281 C LEU A 21 5.382 -11.652 11.509 1.00 0.00 C ATOM 282 O LEU A 21 5.662 -12.836 11.644 1.00 0.00 O ATOM 283 CB LEU A 21 5.966 -9.259 12.357 1.00 0.00 C ATOM 284 CG LEU A 21 5.332 -8.257 11.384 1.00 0.00 C ATOM 285 CD1 LEU A 21 3.827 -8.123 11.603 1.00 0.00 C ATOM 286 CD2 LEU A 21 6.013 -6.907 11.559 1.00 0.00 C ATOM 0 H LEU A 21 7.068 -9.281 10.140 1.00 0.00 H new ATOM 0 HA LEU A 21 7.153 -11.016 12.402 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.237 -9.510 13.128 1.00 0.00 H new ATOM 0 HB3 LEU A 21 6.807 -8.779 12.857 1.00 0.00 H new ATOM 0 HG LEU A 21 5.474 -8.623 10.367 1.00 0.00 H new ATOM 0 HD11 LEU A 21 3.419 -7.404 10.893 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.350 -9.092 11.453 1.00 0.00 H new ATOM 0 HD13 LEU A 21 3.637 -7.778 12.619 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.571 -6.185 10.872 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.879 -6.562 12.584 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.077 -7.006 11.346 1.00 0.00 H new ATOM 298 N THR A 22 4.154 -11.224 11.241 1.00 0.00 N ATOM 299 CA THR A 22 2.990 -12.093 10.955 1.00 0.00 C ATOM 300 C THR A 22 2.146 -11.605 9.761 1.00 0.00 C ATOM 301 O THR A 22 1.977 -12.315 8.772 1.00 0.00 O ATOM 302 CB THR A 22 2.141 -12.335 12.226 1.00 0.00 C ATOM 303 OG1 THR A 22 0.944 -13.037 11.889 1.00 0.00 O ATOM 304 CG2 THR A 22 1.786 -11.071 13.024 1.00 0.00 C ATOM 0 H THR A 22 3.920 -10.232 11.213 1.00 0.00 H new ATOM 0 HA THR A 22 3.390 -13.058 10.645 1.00 0.00 H new ATOM 0 HB THR A 22 2.776 -12.930 12.882 1.00 0.00 H new ATOM 0 HG1 THR A 22 0.414 -13.187 12.699 1.00 0.00 H new ATOM 0 HG21 THR A 22 1.191 -11.346 13.895 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.702 -10.578 13.351 1.00 0.00 H new ATOM 0 HG23 THR A 22 1.214 -10.391 12.393 1.00 0.00 H new ATOM 312 N GLY A 23 1.829 -10.302 9.792 1.00 0.00 N ATOM 313 CA GLY A 23 0.942 -9.658 8.804 1.00 0.00 C ATOM 314 C GLY A 23 0.098 -8.572 9.494 1.00 0.00 C ATOM 315 O GLY A 23 0.534 -7.415 9.475 1.00 0.00 O ATOM 0 H GLY A 23 2.180 -9.661 10.504 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.534 -9.217 8.002 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.290 -10.402 8.346 1.00 0.00 H new ATOM 319 N PRO A 24 -0.979 -8.944 10.213 1.00 0.00 N ATOM 320 CA PRO A 24 -1.858 -7.990 10.927 1.00 0.00 C ATOM 321 C PRO A 24 -1.220 -7.417 12.209 1.00 0.00 C ATOM 322 O PRO A 24 -1.583 -7.737 13.337 1.00 0.00 O ATOM 323 CB PRO A 24 -3.134 -8.794 11.194 1.00 0.00 C ATOM 324 CG PRO A 24 -2.607 -10.211 11.422 1.00 0.00 C ATOM 325 CD PRO A 24 -1.474 -10.326 10.402 1.00 0.00 C ATOM 0 HA PRO A 24 -2.054 -7.093 10.339 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.673 -8.419 12.064 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -3.822 -8.750 10.350 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -2.247 -10.348 12.442 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.380 -10.961 11.253 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -0.682 -10.981 10.765 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.831 -10.748 9.463 1.00 0.00 H new ATOM 333 N GLN A 25 -0.198 -6.599 11.972 1.00 0.00 N ATOM 334 CA GLN A 25 0.582 -5.872 12.994 1.00 0.00 C ATOM 335 C GLN A 25 1.537 -4.865 12.332 1.00 0.00 C ATOM 336 O GLN A 25 1.549 -3.695 12.690 1.00 0.00 O ATOM 337 CB GLN A 25 1.398 -6.831 13.875 1.00 0.00 C ATOM 338 CG GLN A 25 1.961 -6.143 15.125 1.00 0.00 C ATOM 339 CD GLN A 25 0.852 -5.843 16.134 1.00 0.00 C ATOM 340 OE1 GLN A 25 0.055 -4.921 15.994 1.00 0.00 O ATOM 341 NE2 GLN A 25 0.772 -6.658 17.159 1.00 0.00 N ATOM 0 H GLN A 25 0.131 -6.410 11.025 1.00 0.00 H new ATOM 0 HA GLN A 25 -0.133 -5.343 13.624 1.00 0.00 H new ATOM 0 HB2 GLN A 25 0.768 -7.667 14.177 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.220 -7.246 13.291 1.00 0.00 H new ATOM 0 HG2 GLN A 25 2.715 -6.781 15.587 1.00 0.00 H new ATOM 0 HG3 GLN A 25 2.459 -5.216 14.841 1.00 0.00 H new ATOM 0 HE21 GLN A 25 1.444 -7.419 17.259 1.00 0.00 H new ATOM 0 HE22 GLN A 25 0.038 -6.530 17.856 1.00 0.00 H new ATOM 350 N ALA A 26 2.219 -5.285 11.268 1.00 0.00 N ATOM 351 CA ALA A 26 3.078 -4.372 10.495 1.00 0.00 C ATOM 352 C ALA A 26 2.283 -3.258 9.821 1.00 0.00 C ATOM 353 O ALA A 26 2.682 -2.115 9.920 1.00 0.00 O ATOM 354 CB ALA A 26 3.852 -5.119 9.428 1.00 0.00 C ATOM 0 H ALA A 26 2.198 -6.243 10.919 1.00 0.00 H new ATOM 0 HA ALA A 26 3.766 -3.928 11.215 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.477 -4.418 8.874 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.482 -5.875 9.897 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.155 -5.602 8.744 1.00 0.00 H new ATOM 360 N ILE A 27 1.055 -3.554 9.403 1.00 0.00 N ATOM 361 CA ILE A 27 0.155 -2.560 8.781 1.00 0.00 C ATOM 362 C ILE A 27 -0.134 -1.390 9.749 1.00 0.00 C ATOM 363 O ILE A 27 -0.052 -0.232 9.342 1.00 0.00 O ATOM 364 CB ILE A 27 -1.119 -3.269 8.286 1.00 0.00 C ATOM 365 CG1 ILE A 27 -0.763 -4.419 7.334 1.00 0.00 C ATOM 366 CG2 ILE A 27 -2.018 -2.282 7.536 1.00 0.00 C ATOM 367 CD1 ILE A 27 -1.649 -5.643 7.573 1.00 0.00 C ATOM 0 H ILE A 27 0.647 -4.486 9.481 1.00 0.00 H new ATOM 0 HA ILE A 27 0.640 -2.111 7.914 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.641 -3.662 9.158 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.873 -4.085 6.302 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.283 -4.694 7.470 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.915 -2.796 7.191 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.300 -1.468 8.203 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -1.479 -1.878 6.679 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.368 -6.437 6.881 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.519 -5.992 8.597 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.693 -5.374 7.411 1.00 0.00 H new ATOM 379 N SER A 28 -0.234 -1.697 11.045 1.00 0.00 N ATOM 380 CA SER A 28 -0.422 -0.675 12.094 1.00 0.00 C ATOM 381 C SER A 28 0.921 -0.110 12.563 1.00 0.00 C ATOM 382 O SER A 28 1.096 1.094 12.480 1.00 0.00 O ATOM 383 CB SER A 28 -1.198 -1.176 13.317 1.00 0.00 C ATOM 384 OG SER A 28 -0.539 -2.305 13.892 1.00 0.00 O ATOM 0 H SER A 28 -0.188 -2.652 11.401 1.00 0.00 H new ATOM 0 HA SER A 28 -1.020 0.104 11.622 1.00 0.00 H new ATOM 0 HB2 SER A 28 -1.280 -0.379 14.056 1.00 0.00 H new ATOM 0 HB3 SER A 28 -2.213 -1.447 13.026 1.00 0.00 H new ATOM 0 HG SER A 28 0.069 -2.700 13.233 1.00 0.00 H new ATOM 390 N LYS A 29 1.895 -0.966 12.870 1.00 0.00 N ATOM 391 CA LYS A 29 3.248 -0.546 13.288 1.00 0.00 C ATOM 392 C LYS A 29 3.927 0.364 12.243 1.00 0.00 C ATOM 393 O LYS A 29 4.591 1.326 12.605 1.00 0.00 O ATOM 394 CB LYS A 29 4.083 -1.797 13.587 1.00 0.00 C ATOM 395 CG LYS A 29 5.267 -1.523 14.520 1.00 0.00 C ATOM 396 CD LYS A 29 4.860 -1.293 15.979 1.00 0.00 C ATOM 397 CE LYS A 29 5.272 0.100 16.459 1.00 0.00 C ATOM 398 NZ LYS A 29 5.516 0.103 17.909 1.00 0.00 N ATOM 0 H LYS A 29 1.775 -1.978 12.838 1.00 0.00 H new ATOM 0 HA LYS A 29 3.167 0.057 14.192 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.442 -2.555 14.037 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.455 -2.210 12.650 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.958 -2.365 14.473 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.807 -0.647 14.160 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.781 -1.410 16.080 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.324 -2.050 16.612 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.172 0.419 15.934 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.490 0.819 16.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.794 1.058 18.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.648 -0.180 18.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.279 -0.567 18.134 1.00 0.00 H new ATOM 412 N ALA A 30 3.615 0.122 10.969 1.00 0.00 N ATOM 413 CA ALA A 30 3.961 0.969 9.815 1.00 0.00 C ATOM 414 C ALA A 30 3.136 2.257 9.775 1.00 0.00 C ATOM 415 O ALA A 30 3.700 3.302 10.043 1.00 0.00 O ATOM 416 CB ALA A 30 3.766 0.195 8.516 1.00 0.00 C ATOM 0 H ALA A 30 3.089 -0.708 10.695 1.00 0.00 H new ATOM 0 HA ALA A 30 5.009 1.249 9.925 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.025 0.832 7.670 1.00 0.00 H new ATOM 0 HB2 ALA A 30 4.408 -0.686 8.517 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.725 -0.116 8.430 1.00 0.00 H new ATOM 422 N VAL A 31 1.804 2.152 9.735 1.00 0.00 N ATOM 423 CA VAL A 31 0.899 3.327 9.764 1.00 0.00 C ATOM 424 C VAL A 31 1.208 4.265 10.948 1.00 0.00 C ATOM 425 O VAL A 31 1.390 5.462 10.758 1.00 0.00 O ATOM 426 CB VAL A 31 -0.562 2.824 9.726 1.00 0.00 C ATOM 427 CG1 VAL A 31 -1.594 3.735 10.403 1.00 0.00 C ATOM 428 CG2 VAL A 31 -0.981 2.656 8.266 1.00 0.00 C ATOM 0 H VAL A 31 1.315 1.258 9.682 1.00 0.00 H new ATOM 0 HA VAL A 31 1.063 3.947 8.883 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.560 1.891 10.290 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.585 3.288 10.318 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.339 3.855 11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.593 4.710 9.916 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.011 2.301 8.221 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.905 3.615 7.753 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.326 1.932 7.781 1.00 0.00 H new ATOM 438 N ALA A 32 1.412 3.666 12.114 1.00 0.00 N ATOM 439 CA ALA A 32 1.750 4.346 13.374 1.00 0.00 C ATOM 440 C ALA A 32 3.144 4.989 13.342 1.00 0.00 C ATOM 441 O ALA A 32 3.277 6.120 13.787 1.00 0.00 O ATOM 442 CB ALA A 32 1.637 3.372 14.549 1.00 0.00 C ATOM 0 H ALA A 32 1.346 2.654 12.220 1.00 0.00 H new ATOM 0 HA ALA A 32 1.031 5.155 13.504 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.890 3.888 15.475 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.617 2.994 14.611 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.324 2.539 14.399 1.00 0.00 H new ATOM 448 N GLU A 33 4.116 4.343 12.692 1.00 0.00 N ATOM 449 CA GLU A 33 5.460 4.937 12.512 1.00 0.00 C ATOM 450 C GLU A 33 5.587 5.832 11.261 1.00 0.00 C ATOM 451 O GLU A 33 6.642 6.403 11.012 1.00 0.00 O ATOM 452 CB GLU A 33 6.549 3.849 12.567 1.00 0.00 C ATOM 453 CG GLU A 33 6.729 3.020 11.290 1.00 0.00 C ATOM 454 CD GLU A 33 8.071 3.331 10.629 1.00 0.00 C ATOM 455 OE1 GLU A 33 8.129 4.362 9.927 1.00 0.00 O ATOM 456 OE2 GLU A 33 8.980 2.484 10.765 1.00 0.00 O ATOM 0 H GLU A 33 4.007 3.416 12.282 1.00 0.00 H new ATOM 0 HA GLU A 33 5.612 5.615 13.352 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.500 4.325 12.806 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.317 3.171 13.388 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.673 1.958 11.529 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.917 3.233 10.595 1.00 0.00 H new ATOM 463 N THR A 34 4.535 5.865 10.449 1.00 0.00 N ATOM 464 CA THR A 34 4.505 6.584 9.160 1.00 0.00 C ATOM 465 C THR A 34 3.602 7.828 9.173 1.00 0.00 C ATOM 466 O THR A 34 3.962 8.851 8.599 1.00 0.00 O ATOM 467 CB THR A 34 4.146 5.566 8.071 1.00 0.00 C ATOM 468 OG1 THR A 34 5.219 4.624 7.974 1.00 0.00 O ATOM 469 CG2 THR A 34 3.893 6.180 6.703 1.00 0.00 C ATOM 0 H THR A 34 3.659 5.388 10.663 1.00 0.00 H new ATOM 0 HA THR A 34 5.489 7.004 8.950 1.00 0.00 H new ATOM 0 HB THR A 34 3.208 5.096 8.366 1.00 0.00 H new ATOM 0 HG1 THR A 34 5.073 3.895 8.613 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.646 5.393 5.991 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.064 6.884 6.768 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.788 6.704 6.368 1.00 0.00 H new ATOM 477 N LEU A 35 2.479 7.766 9.881 1.00 0.00 N ATOM 478 CA LEU A 35 1.635 8.950 10.128 1.00 0.00 C ATOM 479 C LEU A 35 2.330 10.014 10.976 1.00 0.00 C ATOM 480 O LEU A 35 2.199 11.206 10.712 1.00 0.00 O ATOM 481 CB LEU A 35 0.351 8.552 10.841 1.00 0.00 C ATOM 482 CG LEU A 35 -0.706 8.136 9.833 1.00 0.00 C ATOM 483 CD1 LEU A 35 -1.794 7.413 10.605 1.00 0.00 C ATOM 484 CD2 LEU A 35 -1.301 9.358 9.123 1.00 0.00 C ATOM 0 H LEU A 35 2.123 6.907 10.300 1.00 0.00 H new ATOM 0 HA LEU A 35 1.425 9.372 9.145 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.549 7.731 11.530 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.015 9.387 11.438 1.00 0.00 H new ATOM 0 HG LEU A 35 -0.265 7.496 9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.578 7.095 9.918 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.370 6.540 11.101 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -2.217 8.084 11.352 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.055 9.031 8.407 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.761 10.018 9.859 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.511 9.895 8.598 1.00 0.00 H new ATOM 496 N VAL A 36 3.059 9.525 11.973 1.00 0.00 N ATOM 497 CA VAL A 36 3.879 10.391 12.842 1.00 0.00 C ATOM 498 C VAL A 36 5.370 10.349 12.462 1.00 0.00 C ATOM 499 O VAL A 36 6.182 10.950 13.163 1.00 0.00 O ATOM 500 CB VAL A 36 3.672 10.100 14.346 1.00 0.00 C ATOM 501 CG1 VAL A 36 2.203 10.238 14.757 1.00 0.00 C ATOM 502 CG2 VAL A 36 4.248 8.758 14.812 1.00 0.00 C ATOM 0 H VAL A 36 3.105 8.533 12.207 1.00 0.00 H new ATOM 0 HA VAL A 36 3.526 11.407 12.668 1.00 0.00 H new ATOM 0 HB VAL A 36 4.250 10.868 14.861 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.101 10.025 15.821 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.863 11.254 14.556 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.598 9.533 14.187 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.060 8.632 15.878 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.772 7.947 14.261 1.00 0.00 H new ATOM 0 HG23 VAL A 36 5.322 8.740 14.628 1.00 0.00 H new ATOM 512 N ALA A 37 5.697 9.650 11.363 1.00 0.00 N ATOM 513 CA ALA A 37 7.062 9.561 10.805 1.00 0.00 C ATOM 514 C ALA A 37 7.673 10.961 10.774 1.00 0.00 C ATOM 515 O ALA A 37 7.020 11.919 10.377 1.00 0.00 O ATOM 516 CB ALA A 37 7.055 9.023 9.373 1.00 0.00 C ATOM 0 H ALA A 37 5.010 9.121 10.826 1.00 0.00 H new ATOM 0 HA ALA A 37 7.637 8.882 11.434 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.077 8.973 8.998 1.00 0.00 H new ATOM 0 HB2 ALA A 37 6.615 8.026 9.361 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.468 9.687 8.738 1.00 0.00 H new ATOM 522 N ASP A 38 8.689 11.086 11.619 1.00 0.00 N ATOM 523 CA ASP A 38 9.336 12.385 11.814 1.00 0.00 C ATOM 524 C ASP A 38 10.832 12.295 11.487 1.00 0.00 C ATOM 525 O ASP A 38 11.561 11.608 12.204 1.00 0.00 O ATOM 526 CB ASP A 38 9.037 12.911 13.221 1.00 0.00 C ATOM 527 CG ASP A 38 9.004 14.444 13.252 1.00 0.00 C ATOM 528 OD1 ASP A 38 8.610 15.045 12.225 1.00 0.00 O ATOM 529 OD2 ASP A 38 9.427 14.993 14.291 1.00 0.00 O ATOM 0 H ASP A 38 9.079 10.323 12.172 1.00 0.00 H new ATOM 0 HA ASP A 38 8.925 13.117 11.119 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.079 12.518 13.562 1.00 0.00 H new ATOM 0 HB3 ASP A 38 9.795 12.548 13.915 1.00 0.00 H new ATOM 534 N PRO A 39 11.217 12.900 10.355 1.00 0.00 N ATOM 535 CA PRO A 39 10.345 13.634 9.408 1.00 0.00 C ATOM 536 C PRO A 39 9.442 12.720 8.561 1.00 0.00 C ATOM 537 O PRO A 39 9.756 11.547 8.359 1.00 0.00 O ATOM 538 CB PRO A 39 11.320 14.438 8.546 1.00 0.00 C ATOM 539 CG PRO A 39 12.569 13.557 8.510 1.00 0.00 C ATOM 540 CD PRO A 39 12.625 12.949 9.913 1.00 0.00 C ATOM 0 HA PRO A 39 9.631 14.264 9.939 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.923 14.613 7.546 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.530 15.415 8.981 1.00 0.00 H new ATOM 0 HG2 PRO A 39 12.494 12.787 7.743 1.00 0.00 H new ATOM 0 HG3 PRO A 39 13.464 14.140 8.290 1.00 0.00 H new ATOM 0 HD2 PRO A 39 13.070 11.954 9.896 1.00 0.00 H new ATOM 0 HD3 PRO A 39 13.230 13.558 10.585 1.00 0.00 H new ATOM 548 N THR A 40 8.285 13.253 8.172 1.00 0.00 N ATOM 549 CA THR A 40 7.306 12.485 7.370 1.00 0.00 C ATOM 550 C THR A 40 7.637 12.534 5.866 1.00 0.00 C ATOM 551 O THR A 40 8.085 13.576 5.380 1.00 0.00 O ATOM 552 CB THR A 40 5.845 12.871 7.702 1.00 0.00 C ATOM 553 OG1 THR A 40 5.033 11.712 7.512 1.00 0.00 O ATOM 554 CG2 THR A 40 5.255 14.043 6.905 1.00 0.00 C ATOM 0 H THR A 40 7.994 14.206 8.392 1.00 0.00 H new ATOM 0 HA THR A 40 7.395 11.437 7.658 1.00 0.00 H new ATOM 0 HB THR A 40 5.855 13.225 8.733 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.100 11.929 7.718 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.228 14.220 7.225 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.850 14.939 7.082 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.268 13.803 5.842 1.00 0.00 H new ATOM 562 N PRO A 41 7.526 11.400 5.166 1.00 0.00 N ATOM 563 CA PRO A 41 7.719 11.356 3.706 1.00 0.00 C ATOM 564 C PRO A 41 6.587 12.058 2.955 1.00 0.00 C ATOM 565 O PRO A 41 5.447 12.138 3.418 1.00 0.00 O ATOM 566 CB PRO A 41 7.799 9.870 3.363 1.00 0.00 C ATOM 567 CG PRO A 41 6.984 9.201 4.468 1.00 0.00 C ATOM 568 CD PRO A 41 7.287 10.046 5.703 1.00 0.00 C ATOM 0 HA PRO A 41 8.620 11.889 3.403 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.383 9.663 2.377 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.830 9.516 3.355 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.919 9.199 4.235 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.280 8.162 4.611 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.454 10.038 6.405 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.159 9.670 6.238 1.00 0.00 H new ATOM 576 N THR A 42 6.963 12.595 1.800 1.00 0.00 N ATOM 577 CA THR A 42 6.023 13.288 0.900 1.00 0.00 C ATOM 578 C THR A 42 5.108 12.284 0.179 1.00 0.00 C ATOM 579 O THR A 42 5.554 11.258 -0.332 1.00 0.00 O ATOM 580 CB THR A 42 6.747 14.220 -0.092 1.00 0.00 C ATOM 581 OG1 THR A 42 5.770 14.939 -0.847 1.00 0.00 O ATOM 582 CG2 THR A 42 7.761 13.522 -1.009 1.00 0.00 C ATOM 0 H THR A 42 7.922 12.567 1.454 1.00 0.00 H new ATOM 0 HA THR A 42 5.392 13.927 1.518 1.00 0.00 H new ATOM 0 HB THR A 42 7.353 14.904 0.502 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.220 15.536 -1.480 1.00 0.00 H new ATOM 0 HG21 THR A 42 8.219 14.257 -1.671 1.00 0.00 H new ATOM 0 HG22 THR A 42 8.533 13.048 -0.403 1.00 0.00 H new ATOM 0 HG23 THR A 42 7.252 12.765 -1.605 1.00 0.00 H new ATOM 590 N ALA A 43 3.816 12.579 0.250 1.00 0.00 N ATOM 591 CA ALA A 43 2.765 11.790 -0.416 1.00 0.00 C ATOM 592 C ALA A 43 2.730 12.084 -1.927 1.00 0.00 C ATOM 593 O ALA A 43 2.272 13.142 -2.363 1.00 0.00 O ATOM 594 CB ALA A 43 1.419 12.081 0.254 1.00 0.00 C ATOM 0 H ALA A 43 3.456 13.377 0.773 1.00 0.00 H new ATOM 0 HA ALA A 43 2.983 10.727 -0.310 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.636 11.500 -0.234 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.470 11.807 1.308 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.191 13.143 0.166 1.00 0.00 H new ATOM 600 N THR A 44 3.270 11.141 -2.695 1.00 0.00 N ATOM 601 CA THR A 44 3.359 11.250 -4.174 1.00 0.00 C ATOM 602 C THR A 44 2.282 10.412 -4.880 1.00 0.00 C ATOM 603 O THR A 44 2.071 9.244 -4.560 1.00 0.00 O ATOM 604 CB THR A 44 4.790 10.876 -4.615 1.00 0.00 C ATOM 605 OG1 THR A 44 5.668 11.893 -4.133 1.00 0.00 O ATOM 606 CG2 THR A 44 5.003 10.696 -6.125 1.00 0.00 C ATOM 0 H THR A 44 3.662 10.276 -2.324 1.00 0.00 H new ATOM 0 HA THR A 44 3.160 12.279 -4.473 1.00 0.00 H new ATOM 0 HB THR A 44 4.994 9.892 -4.192 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.588 11.683 -4.396 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.044 10.435 -6.317 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.356 9.899 -6.491 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.761 11.626 -6.640 1.00 0.00 H new ATOM 614 N ILE A 45 1.664 11.000 -5.905 1.00 0.00 N ATOM 615 CA ILE A 45 0.614 10.316 -6.688 1.00 0.00 C ATOM 616 C ILE A 45 1.197 9.247 -7.631 1.00 0.00 C ATOM 617 O ILE A 45 2.130 9.486 -8.405 1.00 0.00 O ATOM 618 CB ILE A 45 -0.370 11.320 -7.336 1.00 0.00 C ATOM 619 CG1 ILE A 45 -1.823 10.852 -7.172 1.00 0.00 C ATOM 620 CG2 ILE A 45 -0.100 11.712 -8.796 1.00 0.00 C ATOM 621 CD1 ILE A 45 -2.219 9.530 -7.849 1.00 0.00 C ATOM 0 H ILE A 45 1.867 11.949 -6.219 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.008 9.743 -6.000 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.193 12.238 -6.776 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.029 10.760 -6.106 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.475 11.636 -7.556 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.860 12.419 -9.129 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.884 12.174 -8.873 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.133 10.822 -9.424 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.270 9.321 -7.652 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.060 9.610 -8.924 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.607 8.720 -7.451 1.00 0.00 H new ATOM 633 N VAL A 46 0.679 8.046 -7.422 1.00 0.00 N ATOM 634 CA VAL A 46 1.050 6.834 -8.176 1.00 0.00 C ATOM 635 C VAL A 46 -0.174 6.034 -8.656 1.00 0.00 C ATOM 636 O VAL A 46 -1.249 6.072 -8.049 1.00 0.00 O ATOM 637 CB VAL A 46 2.036 5.938 -7.394 1.00 0.00 C ATOM 638 CG1 VAL A 46 3.386 6.635 -7.208 1.00 0.00 C ATOM 639 CG2 VAL A 46 1.510 5.499 -6.026 1.00 0.00 C ATOM 0 H VAL A 46 -0.029 7.871 -6.709 1.00 0.00 H new ATOM 0 HA VAL A 46 1.567 7.186 -9.069 1.00 0.00 H new ATOM 0 HB VAL A 46 2.156 5.042 -8.004 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.060 5.981 -6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.818 6.859 -8.184 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.243 7.562 -6.653 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.254 4.873 -5.534 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.313 6.378 -5.413 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.588 4.932 -6.155 1.00 0.00 H new ATOM 649 N HIS A 47 0.059 5.273 -9.720 1.00 0.00 N ATOM 650 CA HIS A 47 -0.950 4.364 -10.294 1.00 0.00 C ATOM 651 C HIS A 47 -0.704 2.904 -9.904 1.00 0.00 C ATOM 652 O HIS A 47 0.321 2.310 -10.236 1.00 0.00 O ATOM 653 CB HIS A 47 -1.055 4.495 -11.812 1.00 0.00 C ATOM 654 CG HIS A 47 -1.911 5.701 -12.217 1.00 0.00 C ATOM 655 ND1 HIS A 47 -3.227 5.673 -12.392 1.00 0.00 N ATOM 656 CD2 HIS A 47 -1.451 6.852 -12.682 1.00 0.00 C ATOM 657 CE1 HIS A 47 -3.573 6.805 -13.012 1.00 0.00 C ATOM 658 NE2 HIS A 47 -2.477 7.532 -13.188 1.00 0.00 N ATOM 0 H HIS A 47 0.951 5.263 -10.215 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.903 4.673 -9.864 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.057 4.597 -12.239 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.488 3.585 -12.227 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -0.423 7.182 -12.655 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.572 7.080 -13.317 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.429 8.449 -13.632 1.00 0.00 H new ATOM 666 N PHE A 48 -1.607 2.458 -9.042 1.00 0.00 N ATOM 667 CA PHE A 48 -1.647 1.092 -8.490 1.00 0.00 C ATOM 668 C PHE A 48 -2.255 0.125 -9.517 1.00 0.00 C ATOM 669 O PHE A 48 -3.469 0.102 -9.741 1.00 0.00 O ATOM 670 CB PHE A 48 -2.472 1.107 -7.199 1.00 0.00 C ATOM 671 CG PHE A 48 -1.965 0.096 -6.177 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.336 -1.244 -6.244 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.117 0.508 -5.152 1.00 0.00 C ATOM 674 CE1 PHE A 48 -1.880 -2.145 -5.302 1.00 0.00 C ATOM 675 CE2 PHE A 48 -0.644 -0.388 -4.219 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.025 -1.729 -4.281 1.00 0.00 C ATOM 0 H PHE A 48 -2.361 3.049 -8.690 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.636 0.750 -8.267 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.443 2.106 -6.764 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.514 0.891 -7.434 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -2.985 -1.581 -7.038 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.826 1.546 -5.088 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.187 -3.179 -5.356 1.00 0.00 H new ATOM 0 HE2 PHE A 48 0.023 -0.052 -3.438 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.663 -2.435 -3.549 1.00 0.00 H new ATOM 686 N LYS A 49 -1.357 -0.563 -10.211 1.00 0.00 N ATOM 687 CA LYS A 49 -1.709 -1.539 -11.259 1.00 0.00 C ATOM 688 C LYS A 49 -1.717 -2.949 -10.657 1.00 0.00 C ATOM 689 O LYS A 49 -0.693 -3.445 -10.187 1.00 0.00 O ATOM 690 CB LYS A 49 -0.701 -1.431 -12.409 1.00 0.00 C ATOM 691 CG LYS A 49 -1.124 -2.197 -13.666 1.00 0.00 C ATOM 692 CD LYS A 49 -1.242 -1.221 -14.835 1.00 0.00 C ATOM 693 CE LYS A 49 -1.314 -1.944 -16.180 1.00 0.00 C ATOM 694 NZ LYS A 49 -1.140 -0.983 -17.278 1.00 0.00 N ATOM 0 H LYS A 49 -0.352 -0.465 -10.068 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.703 -1.330 -11.653 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.563 -0.380 -12.663 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.265 -1.807 -12.072 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.393 -2.972 -13.897 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.077 -2.698 -13.497 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.133 -0.607 -14.706 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.386 -0.546 -14.832 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.541 -2.711 -16.231 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.274 -2.451 -16.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.190 -1.483 -18.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.892 -0.266 -17.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.214 -0.518 -17.189 1.00 0.00 H new ATOM 708 N VAL A 50 -2.930 -3.472 -10.523 1.00 0.00 N ATOM 709 CA VAL A 50 -3.154 -4.822 -9.968 1.00 0.00 C ATOM 710 C VAL A 50 -3.450 -5.798 -11.113 1.00 0.00 C ATOM 711 O VAL A 50 -4.432 -5.698 -11.845 1.00 0.00 O ATOM 712 CB VAL A 50 -4.281 -4.881 -8.919 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.320 -6.254 -8.239 1.00 0.00 C ATOM 714 CG2 VAL A 50 -4.152 -3.815 -7.832 1.00 0.00 C ATOM 0 H VAL A 50 -3.786 -2.986 -10.790 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.240 -5.105 -9.446 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.202 -4.695 -9.472 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.123 -6.273 -7.502 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.497 -7.026 -8.988 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.368 -6.441 -7.742 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.977 -3.913 -7.127 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.207 -3.945 -7.305 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.180 -2.825 -8.288 1.00 0.00 H new ATOM 724 N SER A 51 -2.523 -6.728 -11.236 1.00 0.00 N ATOM 725 CA SER A 51 -2.573 -7.828 -12.215 1.00 0.00 C ATOM 726 C SER A 51 -2.415 -9.163 -11.478 1.00 0.00 C ATOM 727 O SER A 51 -2.048 -9.170 -10.301 1.00 0.00 O ATOM 728 CB SER A 51 -1.468 -7.640 -13.259 1.00 0.00 C ATOM 729 OG SER A 51 -0.169 -7.810 -12.688 1.00 0.00 O ATOM 0 H SER A 51 -1.689 -6.752 -10.650 1.00 0.00 H new ATOM 0 HA SER A 51 -3.532 -7.826 -12.733 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.606 -8.356 -14.069 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.546 -6.645 -13.697 1.00 0.00 H new ATOM 0 HG SER A 51 -0.135 -7.367 -11.815 1.00 0.00 H new ATOM 735 N ALA A 52 -2.705 -10.253 -12.191 1.00 0.00 N ATOM 736 CA ALA A 52 -2.613 -11.638 -11.685 1.00 0.00 C ATOM 737 C ALA A 52 -1.238 -11.917 -11.055 1.00 0.00 C ATOM 738 O ALA A 52 -0.218 -12.014 -11.735 1.00 0.00 O ATOM 739 CB ALA A 52 -2.892 -12.613 -12.834 1.00 0.00 C ATOM 0 H ALA A 52 -3.019 -10.204 -13.160 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.358 -11.776 -10.902 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.825 -13.637 -12.467 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.892 -12.433 -13.229 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.157 -12.463 -13.625 1.00 0.00 H new ATOM 745 N GLN A 53 -1.236 -11.776 -9.730 1.00 0.00 N ATOM 746 CA GLN A 53 -0.039 -11.860 -8.870 1.00 0.00 C ATOM 747 C GLN A 53 1.110 -10.906 -9.268 1.00 0.00 C ATOM 748 O GLN A 53 2.287 -11.262 -9.213 1.00 0.00 O ATOM 749 CB GLN A 53 0.420 -13.318 -8.749 1.00 0.00 C ATOM 750 CG GLN A 53 -0.658 -14.173 -8.082 1.00 0.00 C ATOM 751 CD GLN A 53 -0.128 -15.569 -7.777 1.00 0.00 C ATOM 752 OE1 GLN A 53 0.646 -15.791 -6.855 1.00 0.00 O ATOM 753 NE2 GLN A 53 -0.478 -16.521 -8.608 1.00 0.00 N ATOM 0 H GLN A 53 -2.090 -11.594 -9.202 1.00 0.00 H new ATOM 0 HA GLN A 53 -0.339 -11.502 -7.885 1.00 0.00 H new ATOM 0 HB2 GLN A 53 0.646 -13.716 -9.738 1.00 0.00 H new ATOM 0 HB3 GLN A 53 1.341 -13.367 -8.168 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -0.989 -13.695 -7.160 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -1.528 -14.244 -8.735 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -1.124 -16.320 -9.371 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -0.104 -17.463 -8.491 1.00 0.00 H new ATOM 762 N GLY A 54 0.741 -9.628 -9.435 1.00 0.00 N ATOM 763 CA GLY A 54 1.692 -8.570 -9.837 1.00 0.00 C ATOM 764 C GLY A 54 1.107 -7.171 -9.635 1.00 0.00 C ATOM 765 O GLY A 54 0.026 -6.863 -10.137 1.00 0.00 O ATOM 0 H GLY A 54 -0.214 -9.296 -9.298 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.610 -8.667 -9.257 1.00 0.00 H new ATOM 0 HA3 GLY A 54 1.962 -8.703 -10.885 1.00 0.00 H new ATOM 769 N ILE A 55 1.796 -6.404 -8.796 1.00 0.00 N ATOM 770 CA ILE A 55 1.438 -5.008 -8.471 1.00 0.00 C ATOM 771 C ILE A 55 2.535 -4.101 -9.045 1.00 0.00 C ATOM 772 O ILE A 55 3.716 -4.345 -8.826 1.00 0.00 O ATOM 773 CB ILE A 55 1.345 -4.837 -6.936 1.00 0.00 C ATOM 774 CG1 ILE A 55 0.354 -5.809 -6.270 1.00 0.00 C ATOM 775 CG2 ILE A 55 1.111 -3.384 -6.492 1.00 0.00 C ATOM 776 CD1 ILE A 55 -1.078 -5.772 -6.811 1.00 0.00 C ATOM 0 H ILE A 55 2.632 -6.730 -8.311 1.00 0.00 H new ATOM 0 HA ILE A 55 0.471 -4.746 -8.900 1.00 0.00 H new ATOM 0 HB ILE A 55 2.335 -5.111 -6.572 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.738 -6.823 -6.381 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.325 -5.594 -5.202 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.056 -3.340 -5.404 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.935 -2.760 -6.839 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.176 -3.020 -6.917 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.690 -6.495 -6.271 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.493 -4.773 -6.675 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.073 -6.021 -7.872 1.00 0.00 H new ATOM 788 N THR A 56 2.108 -2.998 -9.638 1.00 0.00 N ATOM 789 CA THR A 56 3.035 -2.004 -10.213 1.00 0.00 C ATOM 790 C THR A 56 2.604 -0.596 -9.793 1.00 0.00 C ATOM 791 O THR A 56 1.416 -0.313 -9.634 1.00 0.00 O ATOM 792 CB THR A 56 3.125 -2.176 -11.742 1.00 0.00 C ATOM 793 OG1 THR A 56 3.461 -3.540 -12.018 1.00 0.00 O ATOM 794 CG2 THR A 56 4.189 -1.278 -12.386 1.00 0.00 C ATOM 0 H THR A 56 1.122 -2.757 -9.740 1.00 0.00 H new ATOM 0 HA THR A 56 4.041 -2.163 -9.825 1.00 0.00 H new ATOM 0 HB THR A 56 2.160 -1.892 -12.163 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.522 -3.672 -12.987 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.203 -1.446 -13.463 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.954 -0.233 -12.185 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.167 -1.516 -11.969 1.00 0.00 H new ATOM 802 N LEU A 57 3.620 0.195 -9.480 1.00 0.00 N ATOM 803 CA LEU A 57 3.483 1.594 -9.045 1.00 0.00 C ATOM 804 C LEU A 57 4.315 2.513 -9.940 1.00 0.00 C ATOM 805 O LEU A 57 5.525 2.334 -10.095 1.00 0.00 O ATOM 806 CB LEU A 57 3.919 1.712 -7.584 1.00 0.00 C ATOM 807 CG LEU A 57 2.951 0.990 -6.645 1.00 0.00 C ATOM 808 CD1 LEU A 57 3.643 0.693 -5.317 1.00 0.00 C ATOM 809 CD2 LEU A 57 1.708 1.847 -6.410 1.00 0.00 C ATOM 0 H LEU A 57 4.590 -0.118 -9.520 1.00 0.00 H new ATOM 0 HA LEU A 57 2.441 1.902 -9.129 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.919 1.294 -7.468 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.979 2.764 -7.306 1.00 0.00 H new ATOM 0 HG LEU A 57 2.645 0.050 -7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.949 0.179 -4.652 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.513 0.060 -5.493 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.962 1.628 -4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.026 1.323 -5.740 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.000 2.796 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.210 2.034 -7.361 1.00 0.00 H new ATOM 821 N THR A 58 3.587 3.415 -10.581 1.00 0.00 N ATOM 822 CA THR A 58 4.141 4.383 -11.552 1.00 0.00 C ATOM 823 C THR A 58 3.933 5.814 -11.039 1.00 0.00 C ATOM 824 O THR A 58 2.889 6.135 -10.473 1.00 0.00 O ATOM 825 CB THR A 58 3.450 4.244 -12.920 1.00 0.00 C ATOM 826 OG1 THR A 58 2.052 4.520 -12.795 1.00 0.00 O ATOM 827 CG2 THR A 58 3.637 2.854 -13.538 1.00 0.00 C ATOM 0 H THR A 58 2.580 3.507 -10.449 1.00 0.00 H new ATOM 0 HA THR A 58 5.205 4.175 -11.665 1.00 0.00 H new ATOM 0 HB THR A 58 3.921 4.968 -13.585 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.621 4.431 -13.671 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.129 2.813 -14.501 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.700 2.659 -13.680 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.215 2.100 -12.873 1.00 0.00 H new ATOM 835 N ASP A 59 4.939 6.657 -11.251 1.00 0.00 N ATOM 836 CA ASP A 59 4.861 8.076 -10.852 1.00 0.00 C ATOM 837 C ASP A 59 4.036 8.893 -11.857 1.00 0.00 C ATOM 838 O ASP A 59 4.414 9.016 -13.022 1.00 0.00 O ATOM 839 CB ASP A 59 6.269 8.661 -10.731 1.00 0.00 C ATOM 840 CG ASP A 59 6.300 9.927 -9.872 1.00 0.00 C ATOM 841 OD1 ASP A 59 5.416 10.803 -10.042 1.00 0.00 O ATOM 842 OD2 ASP A 59 7.242 9.998 -9.071 1.00 0.00 O ATOM 0 H ASP A 59 5.819 6.393 -11.695 1.00 0.00 H new ATOM 0 HA ASP A 59 4.362 8.130 -9.884 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.934 7.914 -10.298 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.652 8.890 -11.726 1.00 0.00 H new ATOM 847 N ASN A 60 2.958 9.477 -11.346 1.00 0.00 N ATOM 848 CA ASN A 60 2.119 10.411 -12.127 1.00 0.00 C ATOM 849 C ASN A 60 2.096 11.849 -11.568 1.00 0.00 C ATOM 850 O ASN A 60 1.574 12.758 -12.208 1.00 0.00 O ATOM 851 CB ASN A 60 0.711 9.812 -12.243 1.00 0.00 C ATOM 852 CG ASN A 60 -0.211 10.627 -13.152 1.00 0.00 C ATOM 853 OD1 ASN A 60 -1.084 11.363 -12.706 1.00 0.00 O ATOM 854 ND2 ASN A 60 -0.037 10.502 -14.449 1.00 0.00 N ATOM 0 H ASN A 60 2.634 9.326 -10.391 1.00 0.00 H new ATOM 0 HA ASN A 60 2.562 10.520 -13.117 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.785 8.795 -12.628 1.00 0.00 H new ATOM 0 HB3 ASN A 60 0.267 9.746 -11.250 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -0.632 11.020 -15.096 1.00 0.00 H new ATOM 0 HD22 ASN A 60 0.693 9.887 -14.809 1.00 0.00 H new ATOM 861 N GLN A 61 2.815 12.071 -10.468 1.00 0.00 N ATOM 862 CA GLN A 61 2.840 13.368 -9.766 1.00 0.00 C ATOM 863 C GLN A 61 3.792 14.348 -10.470 1.00 0.00 C ATOM 864 O GLN A 61 3.330 15.313 -11.074 1.00 0.00 O ATOM 865 CB GLN A 61 3.181 13.125 -8.291 1.00 0.00 C ATOM 866 CG GLN A 61 2.702 14.251 -7.368 1.00 0.00 C ATOM 867 CD GLN A 61 3.827 15.229 -7.031 1.00 0.00 C ATOM 868 OE1 GLN A 61 4.772 14.903 -6.325 1.00 0.00 O ATOM 869 NE2 GLN A 61 3.790 16.418 -7.584 1.00 0.00 N ATOM 0 H GLN A 61 3.401 11.359 -10.032 1.00 0.00 H new ATOM 0 HA GLN A 61 1.860 13.844 -9.799 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.731 12.185 -7.971 1.00 0.00 H new ATOM 0 HB3 GLN A 61 4.260 13.013 -8.188 1.00 0.00 H new ATOM 0 HG2 GLN A 61 1.884 14.790 -7.847 1.00 0.00 H new ATOM 0 HG3 GLN A 61 2.306 13.822 -6.448 1.00 0.00 H new ATOM 0 HE21 GLN A 61 2.999 16.683 -8.171 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.552 17.078 -7.427 1.00 0.00 H new ATOM 878 N ARG A 62 5.096 14.099 -10.343 1.00 0.00 N ATOM 879 CA ARG A 62 6.145 14.905 -11.008 1.00 0.00 C ATOM 880 C ARG A 62 7.497 14.157 -11.030 1.00 0.00 C ATOM 881 O ARG A 62 8.548 14.678 -10.663 1.00 0.00 O ATOM 882 CB ARG A 62 6.217 16.255 -10.274 1.00 0.00 C ATOM 883 CG ARG A 62 6.744 17.391 -11.154 1.00 0.00 C ATOM 884 CD ARG A 62 8.212 17.687 -10.855 1.00 0.00 C ATOM 885 NE ARG A 62 8.330 19.084 -10.416 1.00 0.00 N ATOM 886 CZ ARG A 62 9.400 19.652 -9.856 1.00 0.00 C ATOM 887 NH1 ARG A 62 10.477 18.956 -9.521 1.00 0.00 N ATOM 888 NH2 ARG A 62 9.363 20.939 -9.551 1.00 0.00 N ATOM 0 H ARG A 62 5.465 13.334 -9.778 1.00 0.00 H new ATOM 0 HA ARG A 62 5.900 15.078 -12.056 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.224 16.517 -9.910 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.860 16.152 -9.400 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.631 17.123 -12.204 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.148 18.289 -10.988 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.583 17.015 -10.081 1.00 0.00 H new ATOM 0 HD3 ARG A 62 8.820 17.517 -11.743 1.00 0.00 H new ATOM 0 HE ARG A 62 7.513 19.679 -10.553 1.00 0.00 H new ATOM 0 HH11 ARG A 62 10.507 17.950 -9.689 1.00 0.00 H new ATOM 0 HH12 ARG A 62 11.276 19.426 -9.095 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.523 21.485 -9.744 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.174 21.385 -9.123 1.00 0.00 H new ATOM 902 N LYS A 63 7.447 12.886 -11.445 1.00 0.00 N ATOM 903 CA LYS A 63 8.607 11.962 -11.398 1.00 0.00 C ATOM 904 C LYS A 63 9.206 11.896 -9.977 1.00 0.00 C ATOM 905 O LYS A 63 8.521 12.251 -9.017 1.00 0.00 O ATOM 906 CB LYS A 63 9.644 12.330 -12.478 1.00 0.00 C ATOM 907 CG LYS A 63 9.367 11.581 -13.785 1.00 0.00 C ATOM 908 CD LYS A 63 9.817 12.365 -15.023 1.00 0.00 C ATOM 909 CE LYS A 63 11.328 12.370 -15.285 1.00 0.00 C ATOM 910 NZ LYS A 63 11.669 11.487 -16.410 1.00 0.00 N ATOM 0 H LYS A 63 6.602 12.459 -11.826 1.00 0.00 H new ATOM 0 HA LYS A 63 8.264 10.954 -11.630 1.00 0.00 H new ATOM 0 HB2 LYS A 63 9.620 13.405 -12.659 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.646 12.089 -12.122 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.879 10.619 -13.763 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.300 11.372 -13.860 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.315 11.950 -15.897 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.480 13.396 -14.921 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.660 13.385 -15.501 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.857 12.045 -14.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.697 11.507 -16.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.371 10.515 -16.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.180 11.814 -17.268 1.00 0.00 H new ATOM 924 N LEU A 64 10.426 11.363 -9.858 1.00 0.00 N ATOM 925 CA LEU A 64 11.174 11.191 -8.590 1.00 0.00 C ATOM 926 C LEU A 64 10.511 10.096 -7.721 1.00 0.00 C ATOM 927 O LEU A 64 10.031 10.325 -6.613 1.00 0.00 O ATOM 928 CB LEU A 64 11.261 12.548 -7.866 1.00 0.00 C ATOM 929 CG LEU A 64 12.461 12.699 -6.937 1.00 0.00 C ATOM 930 CD1 LEU A 64 13.429 13.722 -7.534 1.00 0.00 C ATOM 931 CD2 LEU A 64 12.000 13.136 -5.544 1.00 0.00 C ATOM 0 H LEU A 64 10.947 11.024 -10.667 1.00 0.00 H new ATOM 0 HA LEU A 64 12.191 10.856 -8.794 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.295 13.341 -8.613 1.00 0.00 H new ATOM 0 HB3 LEU A 64 10.349 12.694 -7.287 1.00 0.00 H new ATOM 0 HG LEU A 64 12.971 11.741 -6.837 1.00 0.00 H new ATOM 0 HD11 LEU A 64 14.290 13.836 -6.875 1.00 0.00 H new ATOM 0 HD12 LEU A 64 13.764 13.378 -8.513 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.924 14.682 -7.640 1.00 0.00 H new ATOM 0 HD21 LEU A 64 12.866 13.240 -4.890 1.00 0.00 H new ATOM 0 HD22 LEU A 64 11.482 14.092 -5.616 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.323 12.387 -5.133 1.00 0.00 H new ATOM 943 N PHE A 65 10.638 8.869 -8.236 1.00 0.00 N ATOM 944 CA PHE A 65 10.000 7.638 -7.704 1.00 0.00 C ATOM 945 C PHE A 65 10.269 6.377 -8.545 1.00 0.00 C ATOM 946 O PHE A 65 10.392 5.285 -7.991 1.00 0.00 O ATOM 947 CB PHE A 65 8.479 7.830 -7.548 1.00 0.00 C ATOM 948 CG PHE A 65 7.691 6.587 -7.174 1.00 0.00 C ATOM 949 CD1 PHE A 65 7.860 5.999 -5.922 1.00 0.00 C ATOM 950 CD2 PHE A 65 6.858 5.973 -8.111 1.00 0.00 C ATOM 951 CE1 PHE A 65 7.219 4.819 -5.635 1.00 0.00 C ATOM 952 CE2 PHE A 65 6.202 4.809 -7.811 1.00 0.00 C ATOM 953 CZ PHE A 65 6.373 4.214 -6.554 1.00 0.00 C ATOM 0 H PHE A 65 11.206 8.688 -9.064 1.00 0.00 H new ATOM 0 HA PHE A 65 10.464 7.475 -6.731 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.304 8.591 -6.787 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.083 8.220 -8.486 1.00 0.00 H new ATOM 0 HD1 PHE A 65 8.491 6.468 -5.182 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.729 6.422 -9.085 1.00 0.00 H new ATOM 0 HE1 PHE A 65 7.376 4.352 -4.674 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.553 4.350 -8.543 1.00 0.00 H new ATOM 0 HZ PHE A 65 5.855 3.300 -6.304 1.00 0.00 H new ATOM 963 N PHE A 66 10.333 6.549 -9.871 1.00 0.00 N ATOM 964 CA PHE A 66 10.501 5.468 -10.869 1.00 0.00 C ATOM 965 C PHE A 66 9.258 4.556 -10.956 1.00 0.00 C ATOM 966 O PHE A 66 8.154 4.968 -10.602 1.00 0.00 O ATOM 967 CB PHE A 66 11.779 4.658 -10.576 1.00 0.00 C ATOM 968 CG PHE A 66 12.827 4.828 -11.662 1.00 0.00 C ATOM 969 CD1 PHE A 66 13.788 5.833 -11.570 1.00 0.00 C ATOM 970 CD2 PHE A 66 12.886 3.909 -12.715 1.00 0.00 C ATOM 971 CE1 PHE A 66 14.792 5.919 -12.512 1.00 0.00 C ATOM 972 CE2 PHE A 66 13.885 3.999 -13.653 1.00 0.00 C ATOM 973 CZ PHE A 66 14.852 5.002 -13.561 1.00 0.00 C ATOM 0 H PHE A 66 10.268 7.472 -10.300 1.00 0.00 H new ATOM 0 HA PHE A 66 10.609 5.936 -11.848 1.00 0.00 H new ATOM 0 HB2 PHE A 66 12.195 4.973 -9.619 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.524 3.602 -10.481 1.00 0.00 H new ATOM 0 HD1 PHE A 66 13.747 6.546 -10.760 1.00 0.00 H new ATOM 0 HD2 PHE A 66 12.145 3.127 -12.790 1.00 0.00 H new ATOM 0 HE1 PHE A 66 15.535 6.700 -12.437 1.00 0.00 H new ATOM 0 HE2 PHE A 66 13.923 3.290 -14.467 1.00 0.00 H new ATOM 0 HZ PHE A 66 15.640 5.067 -14.296 1.00 0.00 H new ATOM 983 N ARG A 67 9.414 3.434 -11.658 1.00 0.00 N ATOM 984 CA ARG A 67 8.373 2.399 -11.755 1.00 0.00 C ATOM 985 C ARG A 67 8.851 1.118 -11.075 1.00 0.00 C ATOM 986 O ARG A 67 9.913 0.577 -11.387 1.00 0.00 O ATOM 987 CB ARG A 67 7.971 2.097 -13.203 1.00 0.00 C ATOM 988 CG ARG A 67 7.193 3.253 -13.837 1.00 0.00 C ATOM 989 CD ARG A 67 8.071 4.163 -14.699 1.00 0.00 C ATOM 990 NE ARG A 67 7.607 4.098 -16.097 1.00 0.00 N ATOM 991 CZ ARG A 67 7.844 3.128 -16.990 1.00 0.00 C ATOM 992 NH1 ARG A 67 8.606 2.076 -16.718 1.00 0.00 N ATOM 993 NH2 ARG A 67 7.323 3.213 -18.203 1.00 0.00 N ATOM 0 H ARG A 67 10.264 3.213 -12.177 1.00 0.00 H new ATOM 0 HA ARG A 67 7.489 2.787 -11.249 1.00 0.00 H new ATOM 0 HB2 ARG A 67 8.865 1.896 -13.793 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.362 1.193 -13.229 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.387 2.849 -14.449 1.00 0.00 H new ATOM 0 HG3 ARG A 67 6.728 3.846 -13.049 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.022 5.189 -14.334 1.00 0.00 H new ATOM 0 HD3 ARG A 67 9.113 3.851 -14.634 1.00 0.00 H new ATOM 0 HE ARG A 67 7.040 4.882 -16.421 1.00 0.00 H new ATOM 0 HH11 ARG A 67 9.038 1.983 -15.799 1.00 0.00 H new ATOM 0 HH12 ARG A 67 8.760 1.360 -17.428 1.00 0.00 H new ATOM 0 HH21 ARG A 67 6.744 4.014 -18.454 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.500 2.477 -18.887 1.00 0.00 H new ATOM 1007 N ARG A 68 8.082 0.749 -10.063 1.00 0.00 N ATOM 1008 CA ARG A 68 8.335 -0.445 -9.240 1.00 0.00 C ATOM 1009 C ARG A 68 7.239 -1.502 -9.417 1.00 0.00 C ATOM 1010 O ARG A 68 6.068 -1.170 -9.594 1.00 0.00 O ATOM 1011 CB ARG A 68 8.416 -0.024 -7.771 1.00 0.00 C ATOM 1012 CG ARG A 68 9.848 0.178 -7.266 1.00 0.00 C ATOM 1013 CD ARG A 68 10.584 -1.158 -7.129 1.00 0.00 C ATOM 1014 NE ARG A 68 11.837 -0.959 -6.381 1.00 0.00 N ATOM 1015 CZ ARG A 68 12.741 -1.897 -6.075 1.00 0.00 C ATOM 1016 NH1 ARG A 68 12.593 -3.171 -6.414 1.00 0.00 N ATOM 1017 NH2 ARG A 68 13.821 -1.566 -5.384 1.00 0.00 N ATOM 0 H ARG A 68 7.252 1.270 -9.779 1.00 0.00 H new ATOM 0 HA ARG A 68 9.275 -0.892 -9.562 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.859 0.903 -7.637 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.927 -0.781 -7.158 1.00 0.00 H new ATOM 0 HG2 ARG A 68 10.391 0.826 -7.955 1.00 0.00 H new ATOM 0 HG3 ARG A 68 9.827 0.685 -6.301 1.00 0.00 H new ATOM 0 HD2 ARG A 68 9.952 -1.881 -6.613 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.799 -1.569 -8.115 1.00 0.00 H new ATOM 0 HE ARG A 68 12.036 -0.010 -6.064 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.764 -3.469 -6.929 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.308 -3.853 -6.160 1.00 0.00 H new ATOM 0 HH21 ARG A 68 13.961 -0.600 -5.088 1.00 0.00 H new ATOM 0 HH22 ARG A 68 14.513 -2.277 -5.148 1.00 0.00 H new ATOM 1031 N HIS A 69 7.667 -2.755 -9.315 1.00 0.00 N ATOM 1032 CA HIS A 69 6.770 -3.922 -9.428 1.00 0.00 C ATOM 1033 C HIS A 69 6.989 -4.864 -8.238 1.00 0.00 C ATOM 1034 O HIS A 69 8.118 -5.223 -7.906 1.00 0.00 O ATOM 1035 CB HIS A 69 6.923 -4.637 -10.779 1.00 0.00 C ATOM 1036 CG HIS A 69 8.279 -5.336 -10.994 1.00 0.00 C ATOM 1037 ND1 HIS A 69 9.396 -4.755 -11.405 1.00 0.00 N ATOM 1038 CD2 HIS A 69 8.523 -6.622 -10.785 1.00 0.00 C ATOM 1039 CE1 HIS A 69 10.352 -5.692 -11.429 1.00 0.00 C ATOM 1040 NE2 HIS A 69 9.812 -6.841 -11.051 1.00 0.00 N ATOM 0 H HIS A 69 8.643 -3.001 -9.152 1.00 0.00 H new ATOM 0 HA HIS A 69 5.739 -3.571 -9.395 1.00 0.00 H new ATOM 0 HB2 HIS A 69 6.130 -5.379 -10.873 1.00 0.00 H new ATOM 0 HB3 HIS A 69 6.775 -3.910 -11.577 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.806 -7.361 -10.458 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.384 -5.538 -11.708 1.00 0.00 H new ATOM 0 HE2 HIS A 69 10.296 -7.736 -10.976 1.00 0.00 H new ATOM 1048 N TYR A 70 5.898 -5.061 -7.519 1.00 0.00 N ATOM 1049 CA TYR A 70 5.815 -5.929 -6.335 1.00 0.00 C ATOM 1050 C TYR A 70 4.785 -7.044 -6.601 1.00 0.00 C ATOM 1051 O TYR A 70 3.583 -6.818 -6.463 1.00 0.00 O ATOM 1052 CB TYR A 70 5.434 -5.092 -5.103 1.00 0.00 C ATOM 1053 CG TYR A 70 6.468 -4.003 -4.815 1.00 0.00 C ATOM 1054 CD1 TYR A 70 7.603 -4.301 -4.072 1.00 0.00 C ATOM 1055 CD2 TYR A 70 6.282 -2.710 -5.302 1.00 0.00 C ATOM 1056 CE1 TYR A 70 8.546 -3.322 -3.811 1.00 0.00 C ATOM 1057 CE2 TYR A 70 7.216 -1.726 -5.027 1.00 0.00 C ATOM 1058 CZ TYR A 70 8.346 -2.025 -4.275 1.00 0.00 C ATOM 1059 OH TYR A 70 9.147 -1.030 -3.826 1.00 0.00 O ATOM 0 H TYR A 70 5.011 -4.611 -7.742 1.00 0.00 H new ATOM 0 HA TYR A 70 6.782 -6.391 -6.137 1.00 0.00 H new ATOM 0 HB2 TYR A 70 4.458 -4.634 -5.263 1.00 0.00 H new ATOM 0 HB3 TYR A 70 5.342 -5.744 -4.235 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.751 -5.302 -3.696 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.409 -2.476 -5.894 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.435 -3.564 -3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 70 7.066 -0.723 -5.398 1.00 0.00 H new ATOM 0 HH TYR A 70 8.882 -0.184 -4.243 1.00 0.00 H new ATOM 1069 N PRO A 71 5.219 -8.168 -7.189 1.00 0.00 N ATOM 1070 CA PRO A 71 4.339 -9.336 -7.400 1.00 0.00 C ATOM 1071 C PRO A 71 3.939 -9.951 -6.052 1.00 0.00 C ATOM 1072 O PRO A 71 4.593 -9.692 -5.042 1.00 0.00 O ATOM 1073 CB PRO A 71 5.170 -10.290 -8.263 1.00 0.00 C ATOM 1074 CG PRO A 71 6.615 -9.958 -7.895 1.00 0.00 C ATOM 1075 CD PRO A 71 6.585 -8.445 -7.677 1.00 0.00 C ATOM 0 HA PRO A 71 3.398 -9.086 -7.891 1.00 0.00 H new ATOM 0 HB2 PRO A 71 4.933 -11.332 -8.048 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.983 -10.133 -9.325 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.933 -10.487 -6.997 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.306 -10.236 -8.690 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.336 -8.134 -6.951 1.00 0.00 H new ATOM 0 HD3 PRO A 71 6.793 -7.907 -8.602 1.00 0.00 H new ATOM 1083 N LEU A 72 2.920 -10.810 -6.066 1.00 0.00 N ATOM 1084 CA LEU A 72 2.462 -11.532 -4.854 1.00 0.00 C ATOM 1085 C LEU A 72 3.573 -12.280 -4.097 1.00 0.00 C ATOM 1086 O LEU A 72 3.562 -12.342 -2.870 1.00 0.00 O ATOM 1087 CB LEU A 72 1.351 -12.522 -5.198 1.00 0.00 C ATOM 1088 CG LEU A 72 -0.006 -12.082 -4.643 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -0.595 -10.901 -5.422 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -0.947 -13.287 -4.614 1.00 0.00 C ATOM 0 H LEU A 72 2.385 -11.032 -6.905 1.00 0.00 H new ATOM 0 HA LEU A 72 2.095 -10.750 -4.189 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.282 -12.627 -6.281 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.604 -13.504 -4.798 1.00 0.00 H new ATOM 0 HG LEU A 72 0.129 -11.718 -3.625 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.557 -10.625 -4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.085 -10.051 -5.364 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.733 -11.186 -6.465 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.916 -12.982 -4.220 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.072 -13.675 -5.625 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.524 -14.064 -3.977 1.00 0.00 H new ATOM 1102 N ASN A 73 4.600 -12.676 -4.852 1.00 0.00 N ATOM 1103 CA ASN A 73 5.889 -13.190 -4.340 1.00 0.00 C ATOM 1104 C ASN A 73 6.497 -12.368 -3.189 1.00 0.00 C ATOM 1105 O ASN A 73 7.395 -12.860 -2.513 1.00 0.00 O ATOM 1106 CB ASN A 73 6.920 -13.219 -5.474 1.00 0.00 C ATOM 1107 CG ASN A 73 6.669 -14.330 -6.490 1.00 0.00 C ATOM 1108 OD1 ASN A 73 6.384 -15.477 -6.169 1.00 0.00 O ATOM 1109 ND2 ASN A 73 6.849 -14.022 -7.752 1.00 0.00 N ATOM 0 H ASN A 73 4.564 -12.650 -5.871 1.00 0.00 H new ATOM 0 HA ASN A 73 5.663 -14.183 -3.951 1.00 0.00 H new ATOM 0 HB2 ASN A 73 6.912 -12.258 -5.988 1.00 0.00 H new ATOM 0 HB3 ASN A 73 7.915 -13.344 -5.048 1.00 0.00 H new ATOM 0 HD21 ASN A 73 6.752 -14.739 -8.471 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.086 -13.065 -8.015 1.00 0.00 H new ATOM 1116 N THR A 74 6.208 -11.068 -3.198 1.00 0.00 N ATOM 1117 CA THR A 74 6.590 -10.122 -2.134 1.00 0.00 C ATOM 1118 C THR A 74 5.381 -9.293 -1.643 1.00 0.00 C ATOM 1119 O THR A 74 5.410 -8.066 -1.656 1.00 0.00 O ATOM 1120 CB THR A 74 7.805 -9.289 -2.601 1.00 0.00 C ATOM 1121 OG1 THR A 74 8.350 -8.558 -1.500 1.00 0.00 O ATOM 1122 CG2 THR A 74 7.537 -8.370 -3.803 1.00 0.00 C ATOM 0 H THR A 74 5.691 -10.627 -3.958 1.00 0.00 H new ATOM 0 HA THR A 74 6.910 -10.667 -1.246 1.00 0.00 H new ATOM 0 HB THR A 74 8.537 -10.009 -2.967 1.00 0.00 H new ATOM 0 HG1 THR A 74 9.120 -8.034 -1.804 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.448 -7.827 -4.056 1.00 0.00 H new ATOM 0 HG22 THR A 74 7.223 -8.970 -4.657 1.00 0.00 H new ATOM 0 HG23 THR A 74 6.750 -7.660 -3.550 1.00 0.00 H new ATOM 1130 N VAL A 75 4.286 -9.990 -1.318 1.00 0.00 N ATOM 1131 CA VAL A 75 3.018 -9.436 -0.773 1.00 0.00 C ATOM 1132 C VAL A 75 2.115 -10.586 -0.278 1.00 0.00 C ATOM 1133 O VAL A 75 1.570 -11.351 -1.069 1.00 0.00 O ATOM 1134 CB VAL A 75 2.348 -8.460 -1.782 1.00 0.00 C ATOM 1135 CG1 VAL A 75 0.821 -8.507 -1.929 1.00 0.00 C ATOM 1136 CG2 VAL A 75 2.650 -7.027 -1.351 1.00 0.00 C ATOM 0 H VAL A 75 4.247 -11.003 -1.429 1.00 0.00 H new ATOM 0 HA VAL A 75 3.223 -8.819 0.102 1.00 0.00 H new ATOM 0 HB VAL A 75 2.766 -8.781 -2.736 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.504 -7.770 -2.667 1.00 0.00 H new ATOM 0 HG12 VAL A 75 0.517 -9.502 -2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.356 -8.283 -0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.186 -6.331 -2.050 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.252 -6.856 -0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.728 -6.869 -1.344 1.00 0.00 H new ATOM 1146 N THR A 76 2.085 -10.753 1.041 1.00 0.00 N ATOM 1147 CA THR A 76 1.229 -11.781 1.687 1.00 0.00 C ATOM 1148 C THR A 76 -0.052 -11.203 2.305 1.00 0.00 C ATOM 1149 O THR A 76 -1.099 -11.845 2.327 1.00 0.00 O ATOM 1150 CB THR A 76 1.962 -12.580 2.776 1.00 0.00 C ATOM 1151 OG1 THR A 76 2.406 -11.724 3.838 1.00 0.00 O ATOM 1152 CG2 THR A 76 3.121 -13.392 2.196 1.00 0.00 C ATOM 0 H THR A 76 2.637 -10.198 1.695 1.00 0.00 H new ATOM 0 HA THR A 76 0.963 -12.447 0.866 1.00 0.00 H new ATOM 0 HB THR A 76 1.248 -13.288 3.196 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.867 -12.258 4.518 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.615 -13.943 2.996 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.739 -14.093 1.454 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.836 -12.719 1.724 1.00 0.00 H new ATOM 1160 N PHE A 77 0.084 -9.999 2.850 1.00 0.00 N ATOM 1161 CA PHE A 77 -1.000 -9.257 3.514 1.00 0.00 C ATOM 1162 C PHE A 77 -1.035 -7.828 2.976 1.00 0.00 C ATOM 1163 O PHE A 77 -0.016 -7.141 3.009 1.00 0.00 O ATOM 1164 CB PHE A 77 -0.686 -9.196 5.009 1.00 0.00 C ATOM 1165 CG PHE A 77 -1.787 -9.768 5.871 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -1.798 -11.132 6.160 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -2.765 -8.933 6.414 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -2.772 -11.652 6.977 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -3.734 -9.453 7.234 1.00 0.00 C ATOM 1170 CZ PHE A 77 -3.752 -10.820 7.524 1.00 0.00 C ATOM 0 H PHE A 77 0.970 -9.493 2.846 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.956 -9.748 3.332 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.238 -9.741 5.202 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.511 -8.159 5.295 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.041 -11.779 5.742 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.759 -7.877 6.188 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -2.780 -12.709 7.198 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.486 -8.803 7.657 1.00 0.00 H new ATOM 0 HZ PHE A 77 -4.518 -11.230 8.166 1.00 0.00 H new ATOM 1180 N CYS A 78 -2.228 -7.403 2.570 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.468 -6.029 2.091 1.00 0.00 C ATOM 1182 C CYS A 78 -3.828 -5.518 2.579 1.00 0.00 C ATOM 1183 O CYS A 78 -4.882 -5.829 2.025 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.368 -5.955 0.565 1.00 0.00 C ATOM 1185 SG CYS A 78 -2.366 -4.225 -0.039 1.00 0.00 S ATOM 0 H CYS A 78 -3.060 -7.994 2.560 1.00 0.00 H new ATOM 0 HA CYS A 78 -1.694 -5.383 2.506 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -1.457 -6.455 0.237 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -3.205 -6.493 0.120 1.00 0.00 H new ATOM 0 HG CYS A 78 -1.865 -4.185 -1.238 1.00 0.00 H new ATOM 1191 N ASP A 79 -3.761 -4.847 3.722 1.00 0.00 N ATOM 1192 CA ASP A 79 -4.952 -4.308 4.399 1.00 0.00 C ATOM 1193 C ASP A 79 -4.750 -2.864 4.877 1.00 0.00 C ATOM 1194 O ASP A 79 -3.637 -2.343 4.865 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.370 -5.255 5.529 1.00 0.00 C ATOM 1196 CG ASP A 79 -6.737 -5.880 5.224 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -6.787 -6.767 4.345 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -7.715 -5.373 5.813 1.00 0.00 O ATOM 0 H ASP A 79 -2.886 -4.657 4.211 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.769 -4.255 3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.623 -6.040 5.650 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -5.414 -4.709 6.472 1.00 0.00 H new ATOM 1203 N LEU A 80 -5.852 -2.161 5.116 1.00 0.00 N ATOM 1204 CA LEU A 80 -5.771 -0.827 5.746 1.00 0.00 C ATOM 1205 C LEU A 80 -5.280 -0.949 7.191 1.00 0.00 C ATOM 1206 O LEU A 80 -5.235 -2.039 7.765 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.106 -0.083 5.780 1.00 0.00 C ATOM 1208 CG LEU A 80 -7.514 0.465 4.420 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -8.564 -0.458 3.822 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.063 1.881 4.575 1.00 0.00 C ATOM 0 H LEU A 80 -6.797 -2.474 4.893 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.075 -0.259 5.128 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.882 -0.757 6.142 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.040 0.739 6.492 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.651 0.509 3.756 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.868 -0.079 2.846 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -8.147 -1.459 3.709 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -9.431 -0.498 4.481 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.353 2.268 3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.933 1.864 5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.295 2.524 5.006 1.00 0.00 H new ATOM 1222 N ASP A 81 -4.963 0.203 7.771 1.00 0.00 N ATOM 1223 CA ASP A 81 -4.602 0.285 9.195 1.00 0.00 C ATOM 1224 C ASP A 81 -5.709 -0.316 10.088 1.00 0.00 C ATOM 1225 O ASP A 81 -6.827 0.201 10.069 1.00 0.00 O ATOM 1226 CB ASP A 81 -4.351 1.740 9.604 1.00 0.00 C ATOM 1227 CG ASP A 81 -5.554 2.692 9.562 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -6.270 2.702 8.537 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -5.704 3.402 10.580 1.00 0.00 O ATOM 0 H ASP A 81 -4.947 1.098 7.282 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.688 -0.293 9.335 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.952 1.743 10.618 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.575 2.146 8.955 1.00 0.00 H new ATOM 1234 N PRO A 82 -5.381 -1.313 10.918 1.00 0.00 N ATOM 1235 CA PRO A 82 -6.323 -1.855 11.916 1.00 0.00 C ATOM 1236 C PRO A 82 -6.653 -0.881 13.066 1.00 0.00 C ATOM 1237 O PRO A 82 -7.389 -1.240 13.977 1.00 0.00 O ATOM 1238 CB PRO A 82 -5.671 -3.154 12.397 1.00 0.00 C ATOM 1239 CG PRO A 82 -4.177 -2.894 12.222 1.00 0.00 C ATOM 1240 CD PRO A 82 -4.100 -2.046 10.950 1.00 0.00 C ATOM 0 HA PRO A 82 -7.304 -2.028 11.474 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.922 -3.367 13.436 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.000 -4.010 11.808 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.760 -2.367 13.080 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.619 -3.824 12.117 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.252 -1.362 10.979 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.977 -2.669 10.064 1.00 0.00 H new ATOM 1248 N GLN A 83 -5.991 0.282 13.077 1.00 0.00 N ATOM 1249 CA GLN A 83 -6.265 1.373 14.034 1.00 0.00 C ATOM 1250 C GLN A 83 -7.579 2.115 13.705 1.00 0.00 C ATOM 1251 O GLN A 83 -8.644 1.533 13.886 1.00 0.00 O ATOM 1252 CB GLN A 83 -5.043 2.300 14.138 1.00 0.00 C ATOM 1253 CG GLN A 83 -3.867 1.651 14.876 1.00 0.00 C ATOM 1254 CD GLN A 83 -2.718 2.628 15.153 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -2.743 3.816 14.847 1.00 0.00 O ATOM 1256 NE2 GLN A 83 -1.669 2.130 15.763 1.00 0.00 N ATOM 0 H GLN A 83 -5.243 0.499 12.419 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.427 0.943 15.023 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -4.724 2.587 13.136 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -5.330 3.216 14.655 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -4.221 1.239 15.821 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -3.491 0.816 14.285 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -1.648 1.142 16.017 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -0.874 2.730 15.983 1.00 0.00 H new ATOM 1265 N GLU A 84 -7.476 3.308 13.105 1.00 0.00 N ATOM 1266 CA GLU A 84 -8.574 4.229 12.706 1.00 0.00 C ATOM 1267 C GLU A 84 -8.078 5.634 12.308 1.00 0.00 C ATOM 1268 O GLU A 84 -8.745 6.653 12.486 1.00 0.00 O ATOM 1269 CB GLU A 84 -9.657 4.393 13.781 1.00 0.00 C ATOM 1270 CG GLU A 84 -10.908 3.597 13.415 1.00 0.00 C ATOM 1271 CD GLU A 84 -12.086 4.026 14.286 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -12.030 3.764 15.507 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -13.028 4.602 13.700 1.00 0.00 O ATOM 0 H GLU A 84 -6.562 3.692 12.864 1.00 0.00 H new ATOM 0 HA GLU A 84 -9.008 3.740 11.834 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.274 4.055 14.744 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.910 5.447 13.891 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.150 3.751 12.363 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.720 2.531 13.546 1.00 0.00 H new ATOM 1280 N ARG A 85 -6.921 5.654 11.667 1.00 0.00 N ATOM 1281 CA ARG A 85 -6.228 6.895 11.297 1.00 0.00 C ATOM 1282 C ARG A 85 -6.159 6.974 9.769 1.00 0.00 C ATOM 1283 O ARG A 85 -6.140 5.953 9.080 1.00 0.00 O ATOM 1284 CB ARG A 85 -4.817 6.849 11.882 1.00 0.00 C ATOM 1285 CG ARG A 85 -4.760 6.689 13.400 1.00 0.00 C ATOM 1286 CD ARG A 85 -4.103 7.904 14.049 1.00 0.00 C ATOM 1287 NE ARG A 85 -4.077 7.689 15.503 1.00 0.00 N ATOM 1288 CZ ARG A 85 -3.763 8.595 16.434 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -3.419 9.838 16.124 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -3.804 8.257 17.712 1.00 0.00 N ATOM 0 H ARG A 85 -6.426 4.808 11.383 1.00 0.00 H new ATOM 0 HA ARG A 85 -6.755 7.768 11.682 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -4.275 6.023 11.423 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.294 7.765 11.607 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -5.768 6.561 13.795 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -4.201 5.788 13.654 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -3.091 8.039 13.666 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -4.658 8.811 13.808 1.00 0.00 H new ATOM 0 HE ARG A 85 -4.323 6.756 15.834 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -3.388 10.130 15.147 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -3.186 10.502 16.862 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.074 7.311 17.981 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -3.566 8.943 18.429 1.00 0.00 H new ATOM 1304 N LYS A 86 -6.214 8.199 9.268 1.00 0.00 N ATOM 1305 CA LYS A 86 -6.240 8.479 7.820 1.00 0.00 C ATOM 1306 C LYS A 86 -5.134 9.489 7.502 1.00 0.00 C ATOM 1307 O LYS A 86 -4.995 10.489 8.206 1.00 0.00 O ATOM 1308 CB LYS A 86 -7.614 9.057 7.461 1.00 0.00 C ATOM 1309 CG LYS A 86 -8.740 8.036 7.665 1.00 0.00 C ATOM 1310 CD LYS A 86 -10.095 8.715 7.871 1.00 0.00 C ATOM 1311 CE LYS A 86 -10.559 8.572 9.322 1.00 0.00 C ATOM 1312 NZ LYS A 86 -11.800 9.324 9.562 1.00 0.00 N ATOM 0 H LYS A 86 -6.242 9.038 9.848 1.00 0.00 H new ATOM 0 HA LYS A 86 -6.072 7.571 7.241 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.808 9.937 8.074 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.608 9.387 6.422 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -8.793 7.376 6.799 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.512 7.412 8.529 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -10.021 9.771 7.610 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -10.834 8.273 7.203 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.719 7.519 9.553 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.778 8.931 9.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -12.090 9.208 10.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.639 10.332 9.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -12.550 8.964 8.938 1.00 0.00 H new ATOM 1326 N TRP A 87 -4.373 9.210 6.447 1.00 0.00 N ATOM 1327 CA TRP A 87 -3.261 10.084 6.029 1.00 0.00 C ATOM 1328 C TRP A 87 -3.821 11.450 5.620 1.00 0.00 C ATOM 1329 O TRP A 87 -4.726 11.568 4.789 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.475 9.452 4.877 1.00 0.00 C ATOM 1331 CG TRP A 87 -1.270 10.298 4.436 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -1.308 11.311 3.566 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.037 10.164 4.855 1.00 0.00 C ATOM 1334 NE1 TRP A 87 -0.084 11.815 3.428 1.00 0.00 N ATOM 1335 CE2 TRP A 87 0.767 11.150 4.189 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.680 9.287 5.720 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.138 11.256 4.388 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 2.040 9.430 5.950 1.00 0.00 C ATOM 1339 CH2 TRP A 87 2.771 10.410 5.285 1.00 0.00 C ATOM 0 H TRP A 87 -4.500 8.386 5.860 1.00 0.00 H new ATOM 0 HA TRP A 87 -2.573 10.213 6.864 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -2.127 8.465 5.181 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -3.141 9.307 4.026 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -2.192 11.665 3.056 1.00 0.00 H new ATOM 0 HE1 TRP A 87 0.161 12.599 2.824 1.00 0.00 H new ATOM 0 HE3 TRP A 87 0.125 8.500 6.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 2.709 11.995 3.845 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.536 8.775 6.651 1.00 0.00 H new ATOM 0 HH2 TRP A 87 3.831 10.511 5.468 1.00 0.00 H new ATOM 1350 N THR A 88 -3.290 12.461 6.290 1.00 0.00 N ATOM 1351 CA THR A 88 -3.711 13.856 6.075 1.00 0.00 C ATOM 1352 C THR A 88 -2.806 14.475 5.004 1.00 0.00 C ATOM 1353 O THR A 88 -1.867 15.223 5.276 1.00 0.00 O ATOM 1354 CB THR A 88 -3.710 14.652 7.395 1.00 0.00 C ATOM 1355 OG1 THR A 88 -2.407 14.666 7.983 1.00 0.00 O ATOM 1356 CG2 THR A 88 -4.716 14.077 8.399 1.00 0.00 C ATOM 0 H THR A 88 -2.561 12.350 6.994 1.00 0.00 H new ATOM 0 HA THR A 88 -4.741 13.888 5.719 1.00 0.00 H new ATOM 0 HB THR A 88 -4.005 15.673 7.152 1.00 0.00 H new ATOM 0 HG1 THR A 88 -1.754 14.981 7.324 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.688 14.663 9.318 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.719 14.117 7.973 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.457 13.042 8.621 1.00 0.00 H new ATOM 1364 N LYS A 89 -3.083 14.090 3.756 1.00 0.00 N ATOM 1365 CA LYS A 89 -2.368 14.618 2.570 1.00 0.00 C ATOM 1366 C LYS A 89 -2.283 16.155 2.643 1.00 0.00 C ATOM 1367 O LYS A 89 -3.174 16.786 3.207 1.00 0.00 O ATOM 1368 CB LYS A 89 -3.072 14.195 1.270 1.00 0.00 C ATOM 1369 CG LYS A 89 -4.499 14.749 1.159 1.00 0.00 C ATOM 1370 CD LYS A 89 -5.019 14.782 -0.278 1.00 0.00 C ATOM 1371 CE LYS A 89 -5.912 13.584 -0.593 1.00 0.00 C ATOM 1372 NZ LYS A 89 -6.594 13.807 -1.874 1.00 0.00 N ATOM 0 H LYS A 89 -3.805 13.406 3.529 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.361 14.201 2.568 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -2.487 14.538 0.417 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -3.104 13.107 1.217 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -5.167 14.139 1.767 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.524 15.758 1.571 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -5.579 15.703 -0.440 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -4.175 14.796 -0.968 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -5.314 12.674 -0.640 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -6.645 13.444 0.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -7.203 12.992 -2.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -7.176 14.667 -1.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -5.887 13.921 -2.628 1.00 0.00 H new ATOM 1386 N THR A 90 -1.130 16.704 2.256 1.00 0.00 N ATOM 1387 CA THR A 90 -0.826 18.158 2.334 1.00 0.00 C ATOM 1388 C THR A 90 -1.067 18.778 3.734 1.00 0.00 C ATOM 1389 O THR A 90 -1.366 19.961 3.887 1.00 0.00 O ATOM 1390 CB THR A 90 -1.499 18.925 1.165 1.00 0.00 C ATOM 1391 OG1 THR A 90 -0.907 20.214 1.018 1.00 0.00 O ATOM 1392 CG2 THR A 90 -3.022 19.086 1.245 1.00 0.00 C ATOM 0 H THR A 90 -0.362 16.154 1.872 1.00 0.00 H new ATOM 0 HA THR A 90 0.250 18.271 2.202 1.00 0.00 H new ATOM 0 HB THR A 90 -1.321 18.290 0.298 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.884 20.665 1.888 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.376 19.637 0.374 1.00 0.00 H new ATOM 0 HG22 THR A 90 -3.491 18.102 1.267 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.283 19.633 2.151 1.00 0.00 H new ATOM 1400 N ASP A 91 -0.955 17.930 4.764 1.00 0.00 N ATOM 1401 CA ASP A 91 -1.179 18.249 6.192 1.00 0.00 C ATOM 1402 C ASP A 91 -2.516 18.986 6.411 1.00 0.00 C ATOM 1403 O ASP A 91 -2.567 20.151 6.807 1.00 0.00 O ATOM 1404 CB ASP A 91 0.017 19.013 6.786 1.00 0.00 C ATOM 1405 CG ASP A 91 1.377 18.326 6.596 1.00 0.00 C ATOM 1406 OD1 ASP A 91 1.408 17.075 6.515 1.00 0.00 O ATOM 1407 OD2 ASP A 91 2.373 19.077 6.532 1.00 0.00 O ATOM 0 H ASP A 91 -0.693 16.954 4.625 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.256 17.307 6.734 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.059 20.003 6.333 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.156 19.158 7.852 1.00 0.00 H new ATOM 1412 N GLY A 92 -3.595 18.265 6.082 1.00 0.00 N ATOM 1413 CA GLY A 92 -4.964 18.811 6.145 1.00 0.00 C ATOM 1414 C GLY A 92 -5.698 18.546 4.826 1.00 0.00 C ATOM 1415 O GLY A 92 -5.611 17.437 4.301 1.00 0.00 O ATOM 0 H GLY A 92 -3.549 17.296 5.767 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.508 18.354 6.971 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.928 19.883 6.341 1.00 0.00 H new ATOM 1419 N SER A 93 -6.471 19.541 4.382 1.00 0.00 N ATOM 1420 CA SER A 93 -7.347 19.500 3.178 1.00 0.00 C ATOM 1421 C SER A 93 -8.522 18.521 3.311 1.00 0.00 C ATOM 1422 O SER A 93 -9.663 18.937 3.498 1.00 0.00 O ATOM 1423 CB SER A 93 -6.598 19.184 1.873 1.00 0.00 C ATOM 1424 OG SER A 93 -6.424 20.354 1.072 1.00 0.00 O ATOM 0 H SER A 93 -6.515 20.440 4.862 1.00 0.00 H new ATOM 0 HA SER A 93 -7.734 20.518 3.120 1.00 0.00 H new ATOM 0 HB2 SER A 93 -5.624 18.754 2.106 1.00 0.00 H new ATOM 0 HB3 SER A 93 -7.151 18.434 1.308 1.00 0.00 H new ATOM 0 HG SER A 93 -5.943 20.120 0.251 1.00 0.00 H new ATOM 1430 N GLY A 94 -8.167 17.233 3.379 1.00 0.00 N ATOM 1431 CA GLY A 94 -9.107 16.105 3.461 1.00 0.00 C ATOM 1432 C GLY A 94 -8.363 14.839 3.926 1.00 0.00 C ATOM 1433 O GLY A 94 -7.267 14.570 3.427 1.00 0.00 O ATOM 0 H GLY A 94 -7.191 16.936 3.379 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.912 16.341 4.157 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -9.567 15.931 2.488 1.00 0.00 H new ATOM 1437 N PRO A 95 -8.900 14.121 4.924 1.00 0.00 N ATOM 1438 CA PRO A 95 -8.321 12.844 5.377 1.00 0.00 C ATOM 1439 C PRO A 95 -8.557 11.746 4.334 1.00 0.00 C ATOM 1440 O PRO A 95 -9.685 11.462 3.928 1.00 0.00 O ATOM 1441 CB PRO A 95 -9.001 12.557 6.717 1.00 0.00 C ATOM 1442 CG PRO A 95 -10.364 13.235 6.585 1.00 0.00 C ATOM 1443 CD PRO A 95 -10.061 14.490 5.763 1.00 0.00 C ATOM 0 HA PRO A 95 -7.239 12.885 5.499 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -9.102 11.486 6.893 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.430 12.965 7.551 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -11.086 12.591 6.083 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.784 13.485 7.559 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.916 14.778 5.151 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.830 15.338 6.407 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.450 11.152 3.912 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.447 10.101 2.884 1.00 0.00 C ATOM 1453 C ALA A 96 -7.021 8.771 3.510 1.00 0.00 C ATOM 1454 O ALA A 96 -5.915 8.636 4.035 1.00 0.00 O ATOM 1455 CB ALA A 96 -6.501 10.502 1.751 1.00 0.00 C ATOM 0 H ALA A 96 -6.522 11.380 4.269 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.449 9.980 2.472 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.497 9.724 0.988 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.838 11.441 1.311 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.493 10.628 2.146 1.00 0.00 H new ATOM 1461 N LYS A 97 -8.019 7.899 3.663 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.844 6.517 4.160 1.00 0.00 C ATOM 1463 C LYS A 97 -6.533 5.889 3.669 1.00 0.00 C ATOM 1464 O LYS A 97 -6.260 5.830 2.468 1.00 0.00 O ATOM 1465 CB LYS A 97 -9.011 5.633 3.705 1.00 0.00 C ATOM 1466 CG LYS A 97 -10.261 5.738 4.586 1.00 0.00 C ATOM 1467 CD LYS A 97 -10.109 4.927 5.875 1.00 0.00 C ATOM 1468 CE LYS A 97 -11.343 5.074 6.767 1.00 0.00 C ATOM 1469 NZ LYS A 97 -11.087 4.499 8.095 1.00 0.00 N ATOM 0 H LYS A 97 -8.989 8.128 3.444 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.815 6.576 5.248 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.278 5.901 2.683 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.680 4.595 3.687 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -10.447 6.783 4.833 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -11.129 5.382 4.031 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.956 3.876 5.631 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.224 5.261 6.416 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -11.606 6.127 6.864 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -12.195 4.574 6.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.934 4.606 8.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.858 3.489 7.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.288 4.994 8.539 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.737 5.475 4.645 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.414 4.903 4.364 1.00 0.00 C ATOM 1485 C LEU A 98 -4.373 3.382 4.516 1.00 0.00 C ATOM 1486 O LEU A 98 -5.034 2.784 5.368 1.00 0.00 O ATOM 1487 CB LEU A 98 -3.291 5.593 5.154 1.00 0.00 C ATOM 1488 CG LEU A 98 -3.501 5.909 6.636 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -3.873 4.701 7.486 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -2.166 6.424 7.148 1.00 0.00 C ATOM 0 H LEU A 98 -5.976 5.521 5.635 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.226 5.107 3.310 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.403 4.966 5.076 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.064 6.532 4.648 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.327 6.616 6.715 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.004 5.012 8.523 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.803 4.269 7.117 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.079 3.957 7.428 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.252 6.668 8.207 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.404 5.656 7.013 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.883 7.317 6.591 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.595 2.787 3.630 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.463 1.325 3.560 1.00 0.00 C ATOM 1504 C PHE A 99 -2.001 0.913 3.360 1.00 0.00 C ATOM 1505 O PHE A 99 -1.222 1.625 2.724 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.397 0.778 2.469 1.00 0.00 C ATOM 1507 CG PHE A 99 -3.852 0.853 1.049 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -3.981 1.996 0.263 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -3.209 -0.275 0.536 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -3.477 1.998 -1.024 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -2.695 -0.263 -0.738 1.00 0.00 C ATOM 1512 CZ PHE A 99 -2.822 0.879 -1.532 1.00 0.00 C ATOM 0 H PHE A 99 -3.037 3.290 2.940 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.770 0.883 4.508 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.626 -0.263 2.698 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.337 1.328 2.509 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.471 2.874 0.656 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.115 -1.162 1.144 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -3.592 2.876 -1.642 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.193 -1.137 -1.126 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.415 0.894 -2.532 1.00 0.00 H new ATOM 1522 N GLY A 100 -1.682 -0.227 3.975 1.00 0.00 N ATOM 1523 CA GLY A 100 -0.327 -0.792 3.940 1.00 0.00 C ATOM 1524 C GLY A 100 -0.317 -2.303 3.709 1.00 0.00 C ATOM 1525 O GLY A 100 -1.234 -3.031 4.092 1.00 0.00 O ATOM 0 H GLY A 100 -2.349 -0.784 4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.244 -0.305 3.149 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.178 -0.570 4.880 1.00 0.00 H new ATOM 1529 N PHE A 101 0.762 -2.754 3.093 1.00 0.00 N ATOM 1530 CA PHE A 101 0.993 -4.194 2.899 1.00 0.00 C ATOM 1531 C PHE A 101 2.373 -4.651 3.377 1.00 0.00 C ATOM 1532 O PHE A 101 3.331 -3.880 3.363 1.00 0.00 O ATOM 1533 CB PHE A 101 0.774 -4.609 1.438 1.00 0.00 C ATOM 1534 CG PHE A 101 1.633 -3.883 0.419 1.00 0.00 C ATOM 1535 CD1 PHE A 101 2.996 -4.165 0.338 1.00 0.00 C ATOM 1536 CD2 PHE A 101 1.044 -3.028 -0.511 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.766 -3.583 -0.639 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.812 -2.463 -1.502 1.00 0.00 C ATOM 1539 CZ PHE A 101 3.183 -2.722 -1.570 1.00 0.00 C ATOM 0 H PHE A 101 1.496 -2.154 2.716 1.00 0.00 H new ATOM 0 HA PHE A 101 0.254 -4.697 3.523 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.962 -5.679 1.350 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.274 -4.448 1.185 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.448 -4.844 1.046 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.012 -2.810 -0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.825 -3.792 -0.687 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.352 -1.814 -2.233 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.787 -2.260 -2.337 1.00 0.00 H new ATOM 1549 N VAL A 102 2.442 -5.947 3.664 1.00 0.00 N ATOM 1550 CA VAL A 102 3.719 -6.631 3.953 1.00 0.00 C ATOM 1551 C VAL A 102 4.239 -7.461 2.786 1.00 0.00 C ATOM 1552 O VAL A 102 3.659 -8.466 2.366 1.00 0.00 O ATOM 1553 CB VAL A 102 3.795 -7.449 5.247 1.00 0.00 C ATOM 1554 CG1 VAL A 102 3.920 -6.482 6.407 1.00 0.00 C ATOM 1555 CG2 VAL A 102 2.624 -8.402 5.479 1.00 0.00 C ATOM 0 H VAL A 102 1.626 -6.558 3.705 1.00 0.00 H new ATOM 0 HA VAL A 102 4.376 -5.777 4.116 1.00 0.00 H new ATOM 0 HB VAL A 102 4.666 -8.099 5.160 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.976 -7.040 7.342 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.824 -5.884 6.287 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.051 -5.825 6.428 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.769 -8.935 6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 102 1.695 -7.833 5.524 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.571 -9.119 4.660 1.00 0.00 H new ATOM 1565 N ALA A 103 5.337 -6.921 2.285 1.00 0.00 N ATOM 1566 CA ALA A 103 6.118 -7.484 1.177 1.00 0.00 C ATOM 1567 C ALA A 103 7.088 -8.567 1.671 1.00 0.00 C ATOM 1568 O ALA A 103 8.103 -8.254 2.298 1.00 0.00 O ATOM 1569 CB ALA A 103 6.852 -6.326 0.492 1.00 0.00 C ATOM 0 H ALA A 103 5.729 -6.050 2.644 1.00 0.00 H new ATOM 0 HA ALA A 103 5.460 -7.977 0.461 1.00 0.00 H new ATOM 0 HB1 ALA A 103 7.444 -6.711 -0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 103 6.125 -5.606 0.117 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.510 -5.837 1.210 1.00 0.00 H new ATOM 1575 N ARG A 104 6.646 -9.819 1.553 1.00 0.00 N ATOM 1576 CA ARG A 104 7.439 -10.991 1.978 1.00 0.00 C ATOM 1577 C ARG A 104 8.277 -11.516 0.809 1.00 0.00 C ATOM 1578 O ARG A 104 7.826 -12.328 0.009 1.00 0.00 O ATOM 1579 CB ARG A 104 6.533 -12.096 2.536 1.00 0.00 C ATOM 1580 CG ARG A 104 7.316 -13.234 3.205 1.00 0.00 C ATOM 1581 CD ARG A 104 7.061 -14.572 2.505 1.00 0.00 C ATOM 1582 NE ARG A 104 6.754 -15.587 3.527 1.00 0.00 N ATOM 1583 CZ ARG A 104 6.547 -16.894 3.331 1.00 0.00 C ATOM 1584 NH1 ARG A 104 6.682 -17.471 2.145 1.00 0.00 N ATOM 1585 NH2 ARG A 104 6.256 -17.671 4.362 1.00 0.00 N ATOM 0 H ARG A 104 5.734 -10.057 1.163 1.00 0.00 H new ATOM 0 HA ARG A 104 8.112 -10.678 2.776 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.844 -11.662 3.260 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.928 -12.505 1.727 1.00 0.00 H new ATOM 0 HG2 ARG A 104 8.382 -13.007 3.183 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.028 -13.309 4.254 1.00 0.00 H new ATOM 0 HD2 ARG A 104 6.232 -14.480 1.803 1.00 0.00 H new ATOM 0 HD3 ARG A 104 7.936 -14.870 1.928 1.00 0.00 H new ATOM 0 HE ARG A 104 6.692 -15.257 4.490 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.954 -16.914 1.335 1.00 0.00 H new ATOM 0 HH12 ARG A 104 6.514 -18.472 2.043 1.00 0.00 H new ATOM 0 HH21 ARG A 104 6.191 -17.272 5.299 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.097 -18.668 4.220 1.00 0.00 H new ATOM 1599 N LYS A 105 9.517 -11.050 0.763 1.00 0.00 N ATOM 1600 CA LYS A 105 10.441 -11.457 -0.306 1.00 0.00 C ATOM 1601 C LYS A 105 11.132 -12.767 0.091 1.00 0.00 C ATOM 1602 O LYS A 105 11.947 -12.793 1.019 1.00 0.00 O ATOM 1603 CB LYS A 105 11.460 -10.347 -0.576 1.00 0.00 C ATOM 1604 CG LYS A 105 11.912 -10.407 -2.035 1.00 0.00 C ATOM 1605 CD LYS A 105 13.064 -9.440 -2.304 1.00 0.00 C ATOM 1606 CE LYS A 105 13.402 -9.425 -3.795 1.00 0.00 C ATOM 1607 NZ LYS A 105 14.688 -8.758 -4.034 1.00 0.00 N ATOM 0 H LYS A 105 9.911 -10.397 1.441 1.00 0.00 H new ATOM 0 HA LYS A 105 9.885 -11.625 -1.228 1.00 0.00 H new ATOM 0 HB2 LYS A 105 11.018 -9.374 -0.362 1.00 0.00 H new ATOM 0 HB3 LYS A 105 12.319 -10.459 0.086 1.00 0.00 H new ATOM 0 HG2 LYS A 105 12.223 -11.423 -2.279 1.00 0.00 H new ATOM 0 HG3 LYS A 105 11.073 -10.165 -2.687 1.00 0.00 H new ATOM 0 HD2 LYS A 105 12.791 -8.437 -1.975 1.00 0.00 H new ATOM 0 HD3 LYS A 105 13.940 -9.737 -1.728 1.00 0.00 H new ATOM 0 HE2 LYS A 105 13.442 -10.446 -4.173 1.00 0.00 H new ATOM 0 HE3 LYS A 105 12.614 -8.912 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 14.896 -8.760 -5.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 14.639 -7.777 -3.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 15.441 -9.264 -3.526 1.00 0.00 H new ATOM 1621 N GLN A 106 10.769 -13.837 -0.616 1.00 0.00 N ATOM 1622 CA GLN A 106 11.376 -15.176 -0.428 1.00 0.00 C ATOM 1623 C GLN A 106 12.914 -15.218 -0.443 1.00 0.00 C ATOM 1624 O GLN A 106 13.511 -16.045 0.243 1.00 0.00 O ATOM 1625 CB GLN A 106 10.838 -16.185 -1.441 1.00 0.00 C ATOM 1626 CG GLN A 106 10.090 -17.308 -0.722 1.00 0.00 C ATOM 1627 CD GLN A 106 8.608 -17.277 -1.094 1.00 0.00 C ATOM 1628 OE1 GLN A 106 7.780 -16.630 -0.470 1.00 0.00 O ATOM 1629 NE2 GLN A 106 8.264 -17.941 -2.173 1.00 0.00 N ATOM 0 H GLN A 106 10.048 -13.811 -1.337 1.00 0.00 H new ATOM 0 HA GLN A 106 11.075 -15.449 0.584 1.00 0.00 H new ATOM 0 HB2 GLN A 106 10.171 -15.685 -2.143 1.00 0.00 H new ATOM 0 HB3 GLN A 106 11.660 -16.601 -2.023 1.00 0.00 H new ATOM 0 HG2 GLN A 106 10.520 -18.272 -0.992 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.204 -17.199 0.356 1.00 0.00 H new ATOM 0 HE21 GLN A 106 8.963 -18.478 -2.686 1.00 0.00 H new ATOM 0 HE22 GLN A 106 7.297 -17.920 -2.498 1.00 0.00 H new ATOM 1638 N GLY A 107 13.522 -14.217 -1.101 1.00 0.00 N ATOM 1639 CA GLY A 107 14.982 -13.980 -1.063 1.00 0.00 C ATOM 1640 C GLY A 107 15.566 -13.960 0.365 1.00 0.00 C ATOM 1641 O GLY A 107 16.714 -14.343 0.566 1.00 0.00 O ATOM 0 H GLY A 107 13.016 -13.545 -1.678 1.00 0.00 H new ATOM 0 HA2 GLY A 107 15.483 -14.756 -1.641 1.00 0.00 H new ATOM 0 HA3 GLY A 107 15.200 -13.029 -1.550 1.00 0.00 H new ATOM 1645 N SER A 108 14.769 -13.478 1.321 1.00 0.00 N ATOM 1646 CA SER A 108 15.122 -13.491 2.759 1.00 0.00 C ATOM 1647 C SER A 108 14.131 -14.246 3.662 1.00 0.00 C ATOM 1648 O SER A 108 14.547 -14.860 4.640 1.00 0.00 O ATOM 1649 CB SER A 108 15.312 -12.070 3.297 1.00 0.00 C ATOM 1650 OG SER A 108 14.094 -11.309 3.298 1.00 0.00 O ATOM 0 H SER A 108 13.857 -13.065 1.129 1.00 0.00 H new ATOM 0 HA SER A 108 16.061 -14.043 2.800 1.00 0.00 H new ATOM 0 HB2 SER A 108 15.705 -12.120 4.313 1.00 0.00 H new ATOM 0 HB3 SER A 108 16.057 -11.554 2.692 1.00 0.00 H new ATOM 0 HG SER A 108 14.238 -10.461 3.768 1.00 0.00 H new ATOM 1656 N THR A 109 12.831 -14.056 3.412 1.00 0.00 N ATOM 1657 CA THR A 109 11.703 -14.690 4.148 1.00 0.00 C ATOM 1658 C THR A 109 11.776 -14.441 5.676 1.00 0.00 C ATOM 1659 O THR A 109 11.257 -15.205 6.486 1.00 0.00 O ATOM 1660 CB THR A 109 11.585 -16.192 3.803 1.00 0.00 C ATOM 1661 OG1 THR A 109 11.760 -16.375 2.397 1.00 0.00 O ATOM 1662 CG2 THR A 109 10.189 -16.744 4.113 1.00 0.00 C ATOM 0 H THR A 109 12.511 -13.437 2.667 1.00 0.00 H new ATOM 0 HA THR A 109 10.787 -14.205 3.811 1.00 0.00 H new ATOM 0 HB THR A 109 12.341 -16.706 4.397 1.00 0.00 H new ATOM 0 HG1 THR A 109 12.696 -16.207 2.159 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.151 -17.802 3.855 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.977 -16.621 5.175 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.445 -16.201 3.529 1.00 0.00 H new ATOM 1670 N THR A 110 12.189 -13.216 6.000 1.00 0.00 N ATOM 1671 CA THR A 110 12.450 -12.714 7.377 1.00 0.00 C ATOM 1672 C THR A 110 12.422 -11.177 7.472 1.00 0.00 C ATOM 1673 O THR A 110 12.012 -10.618 8.489 1.00 0.00 O ATOM 1674 CB THR A 110 13.755 -13.315 7.958 1.00 0.00 C ATOM 1675 OG1 THR A 110 13.479 -14.667 8.317 1.00 0.00 O ATOM 1676 CG2 THR A 110 14.351 -12.610 9.185 1.00 0.00 C ATOM 0 H THR A 110 12.363 -12.505 5.290 1.00 0.00 H new ATOM 0 HA THR A 110 11.625 -13.061 7.999 1.00 0.00 H new ATOM 0 HB THR A 110 14.505 -13.198 7.175 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.287 -15.079 8.688 1.00 0.00 H new ATOM 0 HG21 THR A 110 15.260 -13.125 9.495 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.588 -11.577 8.931 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.628 -12.627 10.001 1.00 0.00 H new ATOM 1684 N ASP A 111 12.817 -10.493 6.403 1.00 0.00 N ATOM 1685 CA ASP A 111 12.805 -9.019 6.388 1.00 0.00 C ATOM 1686 C ASP A 111 11.827 -8.477 5.343 1.00 0.00 C ATOM 1687 O ASP A 111 12.088 -8.520 4.143 1.00 0.00 O ATOM 1688 CB ASP A 111 14.201 -8.376 6.289 1.00 0.00 C ATOM 1689 CG ASP A 111 15.348 -9.335 5.955 1.00 0.00 C ATOM 1690 OD1 ASP A 111 15.796 -10.033 6.890 1.00 0.00 O ATOM 1691 OD2 ASP A 111 15.706 -9.383 4.759 1.00 0.00 O ATOM 0 H ASP A 111 13.148 -10.923 5.539 1.00 0.00 H new ATOM 0 HA ASP A 111 12.438 -8.715 7.369 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.169 -7.596 5.528 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.424 -7.887 7.237 1.00 0.00 H new ATOM 1696 N ASN A 112 10.635 -8.211 5.862 1.00 0.00 N ATOM 1697 CA ASN A 112 9.515 -7.639 5.094 1.00 0.00 C ATOM 1698 C ASN A 112 9.441 -6.120 5.236 1.00 0.00 C ATOM 1699 O ASN A 112 9.781 -5.533 6.268 1.00 0.00 O ATOM 1700 CB ASN A 112 8.178 -8.234 5.545 1.00 0.00 C ATOM 1701 CG ASN A 112 7.970 -9.677 5.086 1.00 0.00 C ATOM 1702 OD1 ASN A 112 8.884 -10.401 4.700 1.00 0.00 O ATOM 1703 ND2 ASN A 112 6.736 -10.116 5.113 1.00 0.00 N ATOM 0 H ASN A 112 10.407 -8.386 6.841 1.00 0.00 H new ATOM 0 HA ASN A 112 9.701 -7.889 4.049 1.00 0.00 H new ATOM 0 HB2 ASN A 112 8.120 -8.195 6.633 1.00 0.00 H new ATOM 0 HB3 ASN A 112 7.366 -7.617 5.160 1.00 0.00 H new ATOM 0 HD21 ASN A 112 6.527 -11.068 4.812 1.00 0.00 H new ATOM 0 HD22 ASN A 112 5.985 -9.506 5.435 1.00 0.00 H new ATOM 1710 N VAL A 113 8.913 -5.534 4.173 1.00 0.00 N ATOM 1711 CA VAL A 113 8.683 -4.085 4.124 1.00 0.00 C ATOM 1712 C VAL A 113 7.175 -3.809 4.108 1.00 0.00 C ATOM 1713 O VAL A 113 6.419 -4.461 3.382 1.00 0.00 O ATOM 1714 CB VAL A 113 9.512 -3.504 2.959 1.00 0.00 C ATOM 1715 CG1 VAL A 113 8.759 -3.111 1.679 1.00 0.00 C ATOM 1716 CG2 VAL A 113 10.367 -2.362 3.502 1.00 0.00 C ATOM 0 H VAL A 113 8.633 -6.033 3.329 1.00 0.00 H new ATOM 0 HA VAL A 113 9.035 -3.562 5.013 1.00 0.00 H new ATOM 0 HB VAL A 113 10.126 -4.328 2.595 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.465 -2.719 0.947 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.259 -3.988 1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.017 -2.347 1.913 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.962 -1.937 2.694 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.721 -1.591 3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 113 11.030 -2.742 4.279 1.00 0.00 H new ATOM 1726 N CYS A 114 6.764 -2.950 5.032 1.00 0.00 N ATOM 1727 CA CYS A 114 5.366 -2.508 5.068 1.00 0.00 C ATOM 1728 C CYS A 114 5.281 -1.107 4.458 1.00 0.00 C ATOM 1729 O CYS A 114 5.863 -0.149 4.964 1.00 0.00 O ATOM 1730 CB CYS A 114 4.774 -2.553 6.474 1.00 0.00 C ATOM 1731 SG CYS A 114 2.945 -2.513 6.403 1.00 0.00 S ATOM 0 H CYS A 114 7.361 -2.549 5.755 1.00 0.00 H new ATOM 0 HA CYS A 114 4.763 -3.199 4.479 1.00 0.00 H new ATOM 0 HB2 CYS A 114 5.104 -3.458 6.985 1.00 0.00 H new ATOM 0 HB3 CYS A 114 5.140 -1.707 7.056 1.00 0.00 H new ATOM 0 HG CYS A 114 2.461 -3.474 7.133 1.00 0.00 H new ATOM 1737 N HIS A 115 4.888 -1.151 3.193 1.00 0.00 N ATOM 1738 CA HIS A 115 4.676 0.059 2.381 1.00 0.00 C ATOM 1739 C HIS A 115 3.375 0.747 2.790 1.00 0.00 C ATOM 1740 O HIS A 115 2.396 0.069 3.097 1.00 0.00 O ATOM 1741 CB HIS A 115 4.580 -0.321 0.906 1.00 0.00 C ATOM 1742 CG HIS A 115 5.703 0.319 0.082 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.562 -0.357 -0.671 1.00 0.00 N ATOM 1744 CD2 HIS A 115 6.050 1.596 0.078 1.00 0.00 C ATOM 1745 CE1 HIS A 115 7.466 0.508 -1.134 1.00 0.00 C ATOM 1746 NE2 HIS A 115 7.161 1.703 -0.650 1.00 0.00 N ATOM 0 H HIS A 115 4.705 -2.021 2.693 1.00 0.00 H new ATOM 0 HA HIS A 115 5.516 0.735 2.542 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.627 -1.405 0.806 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.614 -0.006 0.511 1.00 0.00 H new ATOM 0 HD2 HIS A 115 5.529 2.402 0.573 1.00 0.00 H new ATOM 0 HE1 HIS A 115 8.296 0.276 -1.785 1.00 0.00 H new ATOM 0 HE2 HIS A 115 7.689 2.562 -0.808 1.00 0.00 H new ATOM 1754 N LEU A 116 3.417 2.073 2.820 1.00 0.00 N ATOM 1755 CA LEU A 116 2.219 2.864 3.136 1.00 0.00 C ATOM 1756 C LEU A 116 1.747 3.716 1.967 1.00 0.00 C ATOM 1757 O LEU A 116 2.524 4.204 1.145 1.00 0.00 O ATOM 1758 CB LEU A 116 2.377 3.745 4.384 1.00 0.00 C ATOM 1759 CG LEU A 116 2.570 2.998 5.712 1.00 0.00 C ATOM 1760 CD1 LEU A 116 1.536 1.891 5.933 1.00 0.00 C ATOM 1761 CD2 LEU A 116 4.001 2.482 5.836 1.00 0.00 C ATOM 0 H LEU A 116 4.254 2.625 2.633 1.00 0.00 H new ATOM 0 HA LEU A 116 1.456 2.116 3.350 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.231 4.405 4.233 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.495 4.380 4.471 1.00 0.00 H new ATOM 0 HG LEU A 116 2.399 3.718 6.512 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.726 1.401 6.888 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.536 2.324 5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.609 1.159 5.129 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.117 1.956 6.783 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.214 1.799 5.013 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.695 3.322 5.800 1.00 0.00 H new ATOM 1773 N PHE A 117 0.428 3.796 1.926 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.318 4.492 0.872 1.00 0.00 C ATOM 1775 C PHE A 117 -1.539 5.206 1.443 1.00 0.00 C ATOM 1776 O PHE A 117 -2.092 4.785 2.453 1.00 0.00 O ATOM 1777 CB PHE A 117 -0.804 3.467 -0.148 1.00 0.00 C ATOM 1778 CG PHE A 117 0.333 2.698 -0.785 1.00 0.00 C ATOM 1779 CD1 PHE A 117 1.013 3.273 -1.859 1.00 0.00 C ATOM 1780 CD2 PHE A 117 0.701 1.432 -0.327 1.00 0.00 C ATOM 1781 CE1 PHE A 117 2.012 2.585 -2.489 1.00 0.00 C ATOM 1782 CE2 PHE A 117 1.735 0.765 -0.935 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.402 1.326 -2.026 1.00 0.00 C ATOM 0 H PHE A 117 -0.173 3.374 2.634 1.00 0.00 H new ATOM 0 HA PHE A 117 0.343 5.227 0.413 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.483 2.768 0.340 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.375 3.975 -0.925 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.749 4.265 -2.194 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.175 0.980 0.501 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.502 3.017 -3.349 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.036 -0.204 -0.566 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.209 0.793 -2.506 1.00 0.00 H new ATOM 1793 N ALA A 118 -1.960 6.239 0.730 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.197 6.983 1.024 1.00 0.00 C ATOM 1795 C ALA A 118 -4.057 7.039 -0.237 1.00 0.00 C ATOM 1796 O ALA A 118 -3.557 7.273 -1.335 1.00 0.00 O ATOM 1797 CB ALA A 118 -2.860 8.406 1.464 1.00 0.00 C ATOM 0 H ALA A 118 -1.454 6.596 -0.080 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.738 6.479 1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.781 8.948 1.679 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.241 8.373 2.360 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.317 8.914 0.667 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.336 6.734 -0.087 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.260 6.774 -1.230 1.00 0.00 C ATOM 1805 C GLU A 119 -6.351 8.180 -1.850 1.00 0.00 C ATOM 1806 O GLU A 119 -6.535 9.166 -1.143 1.00 0.00 O ATOM 1807 CB GLU A 119 -7.632 6.282 -0.776 1.00 0.00 C ATOM 1808 CG GLU A 119 -8.449 5.856 -1.994 1.00 0.00 C ATOM 1809 CD GLU A 119 -7.752 4.776 -2.842 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -7.357 3.743 -2.258 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -7.571 5.046 -4.050 1.00 0.00 O ATOM 0 H GLU A 119 -5.762 6.459 0.798 1.00 0.00 H new ATOM 0 HA GLU A 119 -5.877 6.118 -2.012 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.520 5.444 -0.088 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.152 7.072 -0.234 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.416 5.480 -1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -8.643 6.729 -2.617 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.206 8.226 -3.172 1.00 0.00 N ATOM 1819 CA LEU A 120 -6.305 9.499 -3.915 1.00 0.00 C ATOM 1820 C LEU A 120 -7.637 9.604 -4.673 1.00 0.00 C ATOM 1821 O LEU A 120 -8.288 10.643 -4.625 1.00 0.00 O ATOM 1822 CB LEU A 120 -5.080 9.646 -4.833 1.00 0.00 C ATOM 1823 CG LEU A 120 -4.839 11.005 -5.526 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -5.794 11.291 -6.689 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -4.801 12.165 -4.528 1.00 0.00 C ATOM 0 H LEU A 120 -6.021 7.410 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.301 10.333 -3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.194 9.413 -4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.155 8.886 -5.611 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.849 10.920 -5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -5.559 12.263 -7.122 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.682 10.519 -7.450 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -6.821 11.295 -6.324 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.629 13.099 -5.062 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.752 12.220 -3.998 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.995 12.003 -3.812 1.00 0.00 H new ATOM 1837 N ASP A 121 -8.038 8.521 -5.342 1.00 0.00 N ATOM 1838 CA ASP A 121 -9.339 8.479 -6.039 1.00 0.00 C ATOM 1839 C ASP A 121 -10.532 8.491 -5.062 1.00 0.00 C ATOM 1840 O ASP A 121 -10.756 7.479 -4.395 1.00 0.00 O ATOM 1841 CB ASP A 121 -9.456 7.277 -6.985 1.00 0.00 C ATOM 1842 CG ASP A 121 -8.769 7.487 -8.338 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -8.746 8.644 -8.810 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -8.287 6.460 -8.864 1.00 0.00 O ATOM 0 H ASP A 121 -7.490 7.664 -5.420 1.00 0.00 H new ATOM 0 HA ASP A 121 -9.377 9.391 -6.635 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -9.024 6.402 -6.500 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -10.511 7.060 -7.153 1.00 0.00 H new ATOM 1849 N PRO A 122 -11.365 9.542 -5.107 1.00 0.00 N ATOM 1850 CA PRO A 122 -12.617 9.607 -4.323 1.00 0.00 C ATOM 1851 C PRO A 122 -13.680 8.579 -4.764 1.00 0.00 C ATOM 1852 O PRO A 122 -14.689 8.400 -4.091 1.00 0.00 O ATOM 1853 CB PRO A 122 -13.091 11.054 -4.475 1.00 0.00 C ATOM 1854 CG PRO A 122 -12.573 11.456 -5.855 1.00 0.00 C ATOM 1855 CD PRO A 122 -11.220 10.747 -5.951 1.00 0.00 C ATOM 0 HA PRO A 122 -12.444 9.339 -3.281 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -14.177 11.129 -4.416 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.685 11.694 -3.692 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -13.251 11.136 -6.647 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -12.467 12.537 -5.944 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -10.984 10.482 -6.982 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -10.412 11.386 -5.593 1.00 0.00 H new ATOM 1863 N ASP A 123 -13.418 7.903 -5.885 1.00 0.00 N ATOM 1864 CA ASP A 123 -14.256 6.813 -6.430 1.00 0.00 C ATOM 1865 C ASP A 123 -13.858 5.420 -5.921 1.00 0.00 C ATOM 1866 O ASP A 123 -14.724 4.627 -5.571 1.00 0.00 O ATOM 1867 CB ASP A 123 -14.202 6.812 -7.960 1.00 0.00 C ATOM 1868 CG ASP A 123 -15.059 7.925 -8.567 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -14.602 9.086 -8.492 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -16.132 7.582 -9.106 1.00 0.00 O ATOM 0 H ASP A 123 -12.598 8.098 -6.459 1.00 0.00 H new ATOM 0 HA ASP A 123 -15.268 7.014 -6.078 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -13.169 6.932 -8.286 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -14.544 5.847 -8.334 1.00 0.00 H new ATOM 1875 N GLN A 124 -12.554 5.214 -5.743 1.00 0.00 N ATOM 1876 CA GLN A 124 -12.014 3.916 -5.308 1.00 0.00 C ATOM 1877 C GLN A 124 -11.464 4.073 -3.887 1.00 0.00 C ATOM 1878 O GLN A 124 -10.353 4.576 -3.748 1.00 0.00 O ATOM 1879 CB GLN A 124 -10.917 3.430 -6.266 1.00 0.00 C ATOM 1880 CG GLN A 124 -11.421 2.311 -7.181 1.00 0.00 C ATOM 1881 CD GLN A 124 -12.456 2.790 -8.202 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -13.582 3.154 -7.897 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -12.085 2.821 -9.458 1.00 0.00 N ATOM 0 H GLN A 124 -11.844 5.931 -5.893 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.806 3.167 -5.317 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.566 4.266 -6.872 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.063 3.073 -5.690 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -10.574 1.873 -7.709 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -11.860 1.521 -6.571 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -11.147 2.519 -9.720 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -12.734 3.147 -10.174 1.00 0.00 H new ATOM 1892 N PRO A 125 -12.270 3.815 -2.850 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.806 3.918 -1.455 1.00 0.00 C ATOM 1894 C PRO A 125 -10.730 2.866 -1.172 1.00 0.00 C ATOM 1895 O PRO A 125 -10.753 1.771 -1.737 1.00 0.00 O ATOM 1896 CB PRO A 125 -13.066 3.721 -0.607 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.975 2.864 -1.486 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.667 3.342 -2.907 1.00 0.00 C ATOM 0 HA PRO A 125 -11.336 4.875 -1.230 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.838 3.224 0.336 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -13.533 4.674 -0.360 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.761 1.802 -1.366 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -15.026 3.008 -1.235 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.782 2.534 -3.630 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -14.343 4.141 -3.211 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.818 3.199 -0.263 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.712 2.290 0.110 1.00 0.00 C ATOM 1908 C ALA A 126 -9.205 0.915 0.592 1.00 0.00 C ATOM 1909 O ALA A 126 -8.655 -0.104 0.189 1.00 0.00 O ATOM 1910 CB ALA A 126 -7.791 2.955 1.135 1.00 0.00 C ATOM 0 H ALA A 126 -9.814 4.089 0.235 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.135 2.098 -0.795 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.984 2.271 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.371 3.866 0.709 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.362 3.202 2.030 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.357 0.909 1.269 1.00 0.00 N ATOM 1917 CA ALA A 127 -11.112 -0.319 1.599 1.00 0.00 C ATOM 1918 C ALA A 127 -11.427 -1.203 0.381 1.00 0.00 C ATOM 1919 O ALA A 127 -10.936 -2.321 0.329 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.390 0.041 2.363 1.00 0.00 C ATOM 0 H ALA A 127 -10.802 1.761 1.610 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.462 -0.922 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.940 -0.869 2.602 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -12.129 0.560 3.285 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -13.012 0.689 1.746 1.00 0.00 H new ATOM 1926 N ALA A 128 -11.997 -0.622 -0.677 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.240 -1.332 -1.954 1.00 0.00 C ATOM 1928 C ALA A 128 -10.943 -1.824 -2.623 1.00 0.00 C ATOM 1929 O ALA A 128 -10.883 -2.964 -3.080 1.00 0.00 O ATOM 1930 CB ALA A 128 -13.020 -0.446 -2.926 1.00 0.00 C ATOM 0 H ALA A 128 -12.305 0.350 -0.682 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.831 -2.213 -1.706 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.187 -0.987 -3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.980 -0.178 -2.484 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.449 0.460 -3.130 1.00 0.00 H new ATOM 1936 N ILE A 129 -9.874 -1.042 -2.472 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.516 -1.411 -2.929 1.00 0.00 C ATOM 1938 C ILE A 129 -7.964 -2.621 -2.154 1.00 0.00 C ATOM 1939 O ILE A 129 -7.560 -3.600 -2.772 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.635 -0.137 -2.946 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -7.811 0.611 -4.279 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.156 -0.306 -2.554 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.404 -0.182 -5.534 1.00 0.00 C ATOM 0 H ILE A 129 -9.917 -0.125 -2.027 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.528 -1.777 -3.956 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.014 0.472 -2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.856 0.905 -4.377 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.224 1.529 -4.242 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -5.653 0.659 -2.607 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -6.091 -0.694 -1.537 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -5.675 -1.004 -3.240 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -7.565 0.432 -6.420 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.350 -0.453 -5.467 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -8.008 -1.087 -5.604 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.164 -2.607 -0.842 1.00 0.00 N ATOM 1956 CA VAL A 130 -7.806 -3.687 0.096 1.00 0.00 C ATOM 1957 C VAL A 130 -8.688 -4.946 -0.034 1.00 0.00 C ATOM 1958 O VAL A 130 -8.199 -6.066 0.082 1.00 0.00 O ATOM 1959 CB VAL A 130 -7.710 -3.044 1.488 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -8.004 -3.970 2.674 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.297 -2.469 1.623 1.00 0.00 C ATOM 0 H VAL A 130 -8.598 -1.812 -0.373 1.00 0.00 H new ATOM 0 HA VAL A 130 -6.835 -4.119 -0.144 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.492 -2.287 1.540 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.907 -3.411 3.605 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.018 -4.360 2.589 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.296 -4.799 2.673 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.186 -2.001 2.601 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.566 -3.271 1.520 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.131 -1.725 0.844 1.00 0.00 H new ATOM 1971 N ASN A 131 -9.942 -4.729 -0.404 1.00 0.00 N ATOM 1972 CA ASN A 131 -10.928 -5.799 -0.634 1.00 0.00 C ATOM 1973 C ASN A 131 -10.641 -6.516 -1.959 1.00 0.00 C ATOM 1974 O ASN A 131 -10.725 -7.738 -2.034 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.337 -5.198 -0.611 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.381 -6.280 -0.336 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -13.475 -6.833 0.751 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.172 -6.620 -1.326 1.00 0.00 N ATOM 0 H ASN A 131 -10.318 -3.793 -0.558 1.00 0.00 H new ATOM 0 HA ASN A 131 -10.856 -6.544 0.159 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -12.396 -4.426 0.156 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.548 -4.716 -1.566 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.872 -7.350 -1.192 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.087 -6.154 -2.229 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.188 -5.750 -2.948 1.00 0.00 N ATOM 1986 CA PHE A 132 -9.730 -6.261 -4.249 1.00 0.00 C ATOM 1987 C PHE A 132 -8.326 -6.882 -4.195 1.00 0.00 C ATOM 1988 O PHE A 132 -8.159 -8.024 -4.613 1.00 0.00 O ATOM 1989 CB PHE A 132 -9.820 -5.110 -5.258 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.074 -5.331 -6.572 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.056 -6.553 -7.239 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.303 -4.271 -7.048 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -8.283 -6.713 -8.375 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -7.556 -4.424 -8.192 1.00 0.00 C ATOM 1995 CZ PHE A 132 -7.541 -5.646 -8.866 1.00 0.00 C ATOM 0 H PHE A 132 -10.125 -4.735 -2.872 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.375 -7.083 -4.559 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -10.871 -4.928 -5.483 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.433 -4.206 -4.788 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -9.647 -7.378 -6.869 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.293 -3.330 -6.518 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -8.256 -7.667 -8.880 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -6.978 -3.594 -8.571 1.00 0.00 H new ATOM 0 HZ PHE A 132 -6.955 -5.762 -9.766 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.361 -6.171 -3.615 1.00 0.00 N ATOM 2006 CA VAL A 133 -5.966 -6.643 -3.508 1.00 0.00 C ATOM 2007 C VAL A 133 -5.858 -7.964 -2.717 1.00 0.00 C ATOM 2008 O VAL A 133 -5.051 -8.815 -3.065 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.068 -5.509 -2.971 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.237 -5.253 -1.472 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -3.600 -5.710 -3.358 1.00 0.00 C ATOM 0 H VAL A 133 -7.516 -5.251 -3.203 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.597 -6.894 -4.502 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.414 -4.600 -3.464 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.575 -4.443 -1.164 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.271 -4.976 -1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.986 -6.157 -0.918 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.003 -4.889 -2.960 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.241 -6.653 -2.946 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.510 -5.731 -4.444 1.00 0.00 H new ATOM 2021 N SER A 134 -6.759 -8.141 -1.748 1.00 0.00 N ATOM 2022 CA SER A 134 -6.879 -9.384 -0.958 1.00 0.00 C ATOM 2023 C SER A 134 -7.757 -10.448 -1.648 1.00 0.00 C ATOM 2024 O SER A 134 -7.412 -11.630 -1.636 1.00 0.00 O ATOM 2025 CB SER A 134 -7.418 -9.032 0.431 1.00 0.00 C ATOM 2026 OG SER A 134 -7.117 -10.060 1.376 1.00 0.00 O ATOM 0 H SER A 134 -7.434 -7.424 -1.482 1.00 0.00 H new ATOM 0 HA SER A 134 -5.890 -9.833 -0.870 1.00 0.00 H new ATOM 0 HB2 SER A 134 -6.984 -8.089 0.764 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.497 -8.886 0.379 1.00 0.00 H new ATOM 0 HG SER A 134 -7.471 -9.810 2.255 1.00 0.00 H new ATOM 2032 N ARG A 135 -8.782 -10.008 -2.392 1.00 0.00 N ATOM 2033 CA ARG A 135 -9.643 -10.900 -3.203 1.00 0.00 C ATOM 2034 C ARG A 135 -8.847 -11.550 -4.348 1.00 0.00 C ATOM 2035 O ARG A 135 -8.776 -12.772 -4.438 1.00 0.00 O ATOM 2036 CB ARG A 135 -10.856 -10.148 -3.776 1.00 0.00 C ATOM 2037 CG ARG A 135 -11.785 -11.067 -4.578 1.00 0.00 C ATOM 2038 CD ARG A 135 -13.196 -11.132 -3.994 1.00 0.00 C ATOM 2039 NE ARG A 135 -14.068 -10.149 -4.659 1.00 0.00 N ATOM 2040 CZ ARG A 135 -15.405 -10.164 -4.649 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -16.086 -11.118 -4.027 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -16.089 -9.244 -5.309 1.00 0.00 N ATOM 0 H ARG A 135 -9.043 -9.024 -2.453 1.00 0.00 H new ATOM 0 HA ARG A 135 -10.006 -11.683 -2.537 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.416 -9.691 -2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -10.509 -9.338 -4.417 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -11.838 -10.714 -5.608 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -11.361 -12.071 -4.606 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -13.604 -12.135 -4.120 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -13.163 -10.934 -2.923 1.00 0.00 H new ATOM 0 HE ARG A 135 -13.614 -9.393 -5.171 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -15.590 -11.864 -3.540 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -17.106 -11.105 -4.035 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -15.597 -8.518 -5.829 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -17.109 -9.261 -5.298 1.00 0.00 H new ATOM 2056 N VAL A 136 -8.162 -10.711 -5.123 1.00 0.00 N ATOM 2057 CA VAL A 136 -7.336 -11.150 -6.264 1.00 0.00 C ATOM 2058 C VAL A 136 -6.131 -12.001 -5.813 1.00 0.00 C ATOM 2059 O VAL A 136 -5.627 -12.815 -6.584 1.00 0.00 O ATOM 2060 CB VAL A 136 -6.950 -9.937 -7.136 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -5.775 -9.112 -6.595 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -6.739 -10.359 -8.591 1.00 0.00 C ATOM 0 H VAL A 136 -8.159 -9.701 -4.983 1.00 0.00 H new ATOM 0 HA VAL A 136 -7.927 -11.817 -6.892 1.00 0.00 H new ATOM 0 HB VAL A 136 -7.800 -9.256 -7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -5.573 -8.281 -7.270 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -6.026 -8.725 -5.608 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -4.890 -9.744 -6.522 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.468 -9.488 -9.187 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -5.939 -11.098 -8.643 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -7.660 -10.793 -8.981 1.00 0.00 H new ATOM 2072 N MET A 137 -5.665 -11.745 -4.587 1.00 0.00 N ATOM 2073 CA MET A 137 -4.593 -12.536 -3.953 1.00 0.00 C ATOM 2074 C MET A 137 -4.977 -14.009 -3.777 1.00 0.00 C ATOM 2075 O MET A 137 -4.173 -14.892 -4.067 1.00 0.00 O ATOM 2076 CB MET A 137 -4.206 -11.969 -2.582 1.00 0.00 C ATOM 2077 CG MET A 137 -3.017 -11.018 -2.699 1.00 0.00 C ATOM 2078 SD MET A 137 -1.740 -11.298 -1.420 1.00 0.00 S ATOM 2079 CE MET A 137 -2.227 -10.048 -0.253 1.00 0.00 C ATOM 0 H MET A 137 -6.016 -10.986 -4.003 1.00 0.00 H new ATOM 0 HA MET A 137 -3.743 -12.471 -4.632 1.00 0.00 H new ATOM 0 HB2 MET A 137 -5.056 -11.442 -2.149 1.00 0.00 H new ATOM 0 HB3 MET A 137 -3.958 -12.785 -1.904 1.00 0.00 H new ATOM 0 HG2 MET A 137 -2.565 -11.131 -3.685 1.00 0.00 H new ATOM 0 HG3 MET A 137 -3.374 -9.990 -2.628 1.00 0.00 H new ATOM 0 HE1 MET A 137 -1.345 -9.668 0.263 1.00 0.00 H new ATOM 0 HE2 MET A 137 -2.719 -9.231 -0.780 1.00 0.00 H new ATOM 0 HE3 MET A 137 -2.916 -10.478 0.474 1.00 0.00 H new ATOM 2089 N LEU A 138 -6.233 -14.212 -3.371 1.00 0.00 N ATOM 2090 CA LEU A 138 -6.834 -15.513 -2.999 1.00 0.00 C ATOM 2091 C LEU A 138 -8.283 -15.378 -2.497 1.00 0.00 C ATOM 2092 O LEU A 138 -9.175 -16.019 -3.047 1.00 0.00 O ATOM 2093 CB LEU A 138 -5.978 -16.316 -1.997 1.00 0.00 C ATOM 2094 CG LEU A 138 -5.331 -15.478 -0.884 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -6.002 -15.721 0.468 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -3.828 -15.759 -0.815 1.00 0.00 C ATOM 0 H LEU A 138 -6.897 -13.443 -3.286 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.859 -16.085 -3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -6.604 -17.082 -1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -5.192 -16.834 -2.546 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.475 -14.425 -1.127 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.517 -15.111 1.230 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.056 -15.452 0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.912 -16.774 0.735 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.382 -15.159 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.665 -16.816 -0.605 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.366 -15.503 -1.768 1.00 0.00 H new ATOM 2108 N GLY A 139 -8.507 -14.389 -1.616 1.00 0.00 N ATOM 2109 CA GLY A 139 -9.822 -14.162 -0.980 1.00 0.00 C ATOM 2110 C GLY A 139 -10.184 -15.278 0.010 1.00 0.00 C ATOM 2111 O GLY A 139 -10.465 -16.413 -0.370 1.00 0.00 O ATOM 0 H GLY A 139 -7.789 -13.726 -1.324 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.812 -13.205 -0.459 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -10.591 -14.098 -1.750 1.00 0.00 H new ATOM 2115 N SER A 140 -10.201 -14.894 1.284 1.00 0.00 N ATOM 2116 CA SER A 140 -10.482 -15.803 2.415 1.00 0.00 C ATOM 2117 C SER A 140 -11.327 -15.112 3.489 1.00 0.00 C ATOM 2118 O SER A 140 -11.407 -13.882 3.529 1.00 0.00 O ATOM 2119 CB SER A 140 -9.180 -16.308 3.048 1.00 0.00 C ATOM 2120 OG SER A 140 -8.494 -17.141 2.114 1.00 0.00 O ATOM 0 H SER A 140 -10.019 -13.933 1.574 1.00 0.00 H new ATOM 0 HA SER A 140 -11.041 -16.649 2.015 1.00 0.00 H new ATOM 0 HB2 SER A 140 -8.550 -15.465 3.333 1.00 0.00 H new ATOM 0 HB3 SER A 140 -9.397 -16.866 3.959 1.00 0.00 H new ATOM 0 HG SER A 140 -7.660 -17.464 2.515 1.00 0.00 H new ATOM 2126 N GLY A 141 -12.031 -15.932 4.279 1.00 0.00 N ATOM 2127 CA GLY A 141 -12.892 -15.441 5.374 1.00 0.00 C ATOM 2128 C GLY A 141 -14.281 -15.022 4.874 1.00 0.00 C ATOM 2129 O GLY A 141 -15.272 -15.655 5.229 1.00 0.00 O ATOM 0 H GLY A 141 -12.024 -16.947 4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -12.999 -16.221 6.128 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -12.411 -14.592 5.860 1.00 0.00 H new ATOM 2133 N GLN A 142 -14.295 -14.012 3.999 1.00 0.00 N ATOM 2134 CA GLN A 142 -15.496 -13.340 3.440 1.00 0.00 C ATOM 2135 C GLN A 142 -16.314 -12.575 4.490 1.00 0.00 C ATOM 2136 O GLN A 142 -16.498 -11.364 4.389 1.00 0.00 O ATOM 2137 CB GLN A 142 -16.433 -14.299 2.691 1.00 0.00 C ATOM 2138 CG GLN A 142 -16.197 -14.315 1.180 1.00 0.00 C ATOM 2139 CD GLN A 142 -17.129 -15.303 0.472 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -18.276 -15.549 0.833 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -16.647 -15.877 -0.605 1.00 0.00 N ATOM 0 H GLN A 142 -13.430 -13.612 3.636 1.00 0.00 H new ATOM 0 HA GLN A 142 -15.082 -12.623 2.731 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -16.300 -15.307 3.084 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -17.467 -14.014 2.888 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -16.353 -13.314 0.777 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -15.160 -14.583 0.976 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -15.694 -15.675 -0.908 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -17.225 -16.525 -1.139 1.00 0.00 H new ATOM 2150 N LYS A 143 -16.738 -13.308 5.511 1.00 0.00 N ATOM 2151 CA LYS A 143 -17.563 -12.791 6.607 1.00 0.00 C ATOM 2152 C LYS A 143 -16.978 -13.232 7.956 1.00 0.00 C ATOM 2153 O LYS A 143 -16.976 -14.410 8.304 1.00 0.00 O ATOM 2154 CB LYS A 143 -18.995 -13.272 6.368 1.00 0.00 C ATOM 2155 CG LYS A 143 -19.992 -12.655 7.345 1.00 0.00 C ATOM 2156 CD LYS A 143 -21.379 -12.649 6.710 1.00 0.00 C ATOM 2157 CE LYS A 143 -22.450 -12.609 7.797 1.00 0.00 C ATOM 2158 NZ LYS A 143 -23.463 -11.587 7.506 1.00 0.00 N ATOM 0 H LYS A 143 -16.516 -14.299 5.607 1.00 0.00 H new ATOM 0 HA LYS A 143 -17.572 -11.701 6.636 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -19.292 -13.026 5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -19.029 -14.358 6.457 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -20.007 -13.223 8.275 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -19.690 -11.639 7.598 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -21.484 -11.786 6.053 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -21.509 -13.537 6.092 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -22.927 -13.586 7.877 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -21.986 -12.401 8.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -24.178 -11.582 8.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -23.009 -10.653 7.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -23.921 -11.801 6.597 1.00 0.00 H new ATOM 2172 N ARG A 144 -16.392 -12.237 8.621 1.00 0.00 N ATOM 2173 CA ARG A 144 -15.728 -12.346 9.944 1.00 0.00 C ATOM 2174 C ARG A 144 -14.499 -13.287 10.010 1.00 0.00 C ATOM 2175 O ARG A 144 -13.621 -12.995 10.852 1.00 0.00 O ATOM 2176 CB ARG A 144 -16.805 -12.669 10.994 1.00 0.00 C ATOM 2177 CG ARG A 144 -16.412 -12.294 12.425 1.00 0.00 C ATOM 2178 CD ARG A 144 -17.631 -12.311 13.358 1.00 0.00 C ATOM 2179 NE ARG A 144 -18.496 -11.125 13.182 1.00 0.00 N ATOM 2180 CZ ARG A 144 -18.264 -9.886 13.640 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -17.167 -9.584 14.322 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -19.144 -8.917 13.435 1.00 0.00 N ATOM 2183 OXT ARG A 144 -14.364 -14.166 9.129 1.00 99.99 O ATOM 0 H ARG A 144 -16.359 -11.288 8.247 1.00 0.00 H new ATOM 0 HA ARG A 144 -15.269 -11.381 10.160 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -17.723 -12.144 10.731 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -17.026 -13.736 10.957 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -15.659 -12.991 12.793 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -15.959 -11.303 12.433 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -18.214 -13.213 13.172 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -17.292 -12.359 14.393 1.00 0.00 H new ATOM 0 HE ARG A 144 -19.360 -11.264 12.657 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -16.470 -10.304 14.512 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -17.020 -8.632 14.657 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -20.006 -9.110 12.925 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -18.959 -7.978 13.787 1.00 0.00 H new TER 2197 ARG A 144