USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1058 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 78 MET CE :methyl -112:sc= -10.6! (180deg=-20.4!) USER MOD Set 1.2: A 86 MET CE :methyl -104:sc= -5.4 (180deg=-13.4!) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -2.54! K(o=-2.5!,f=-1.3) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -1.01 K(o=-1,f=-3.2!) USER MOD Single : A 11 ASN : amide:sc= -9.33! C(o=-9.3!,f=-7.6!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl 145:sc= -10.7! (180deg=-13.1!) USER MOD Single : A 18 GLN : amide:sc= -1.75! C(o=-1.7!,f=-2.7!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 43:sc= 0.574 USER MOD Single : A 28 SER OG : rot 180:sc= -0.456 USER MOD Single : A 34 TYR OH : rot 155:sc= 0.156 USER MOD Single : A 35 ASN : amide:sc= -3.42! C(o=-3.4!,f=-6.3!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot -179:sc= -3.98! USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc=-0.00827 K(o=-0.0083,f=-0.57) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -2.3! K(o=-2.3!,f=-0.63) USER MOD Single : A 69 HIS : no HD1:sc= -4.57! K(o=-4.6!,f=-2) USER MOD Single : A 70 HIS : no HD1:sc= -1.99 X(o=-2,f=-1.8) USER MOD Single : A 72 ASN : amide:sc= -0.775 K(o=-0.78,f=0.13) USER MOD Single : A 74 LYS NZ :NH3+ -157:sc= -0.0768 (180deg=-0.519) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= -1.25 K(o=-1.3,f=-5.2!) USER MOD Single : A 85 THR OG1 : rot 180:sc= -1.5! USER MOD Single : A 88 GLN : amide:sc= -2.7! K(o=-2.7!,f=0) USER MOD Single : A 89 GLN : amide:sc= -0.532 K(o=-0.53,f=-4.8!) USER MOD Single : A 95 HIS : no HD1:sc= -3.22! C(o=-3.2!,f=-2.8!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -3.28 K(o=-3.3,f=-6.7!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -115:sc= -0.188 (180deg=-1.05) USER MOD Single : A 110 LYS NZ :NH3+ 149:sc= -2.87 (180deg=-4.58!) USER MOD Single : A 111 THR OG1 : rot -150:sc= -1.26 USER MOD Single : A 116 MET CE :methyl 160:sc= -0.0156 (180deg=-0.32) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -5.4! X(o=-5.4!,f=-5) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 ASN : amide:sc= -0.825 K(o=-0.82,f=-3.5!) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 26 N GLU A 3 -6.573 -10.257 -10.283 1.00 0.00 N ATOM 27 CA GLU A 3 -7.058 -9.600 -9.081 1.00 0.00 C ATOM 28 C GLU A 3 -7.591 -8.205 -9.416 1.00 0.00 C ATOM 29 O GLU A 3 -8.434 -7.671 -8.699 1.00 0.00 O ATOM 30 CB GLU A 3 -5.960 -9.526 -8.017 1.00 0.00 C ATOM 31 CG GLU A 3 -5.691 -10.904 -7.410 1.00 0.00 C ATOM 32 CD GLU A 3 -4.713 -11.702 -8.275 1.00 0.00 C ATOM 33 OE1 GLU A 3 -3.738 -11.081 -8.750 1.00 0.00 O ATOM 34 OE2 GLU A 3 -4.963 -12.916 -8.442 1.00 0.00 O ATOM 0 HA GLU A 3 -7.877 -10.192 -8.672 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.044 -9.135 -8.461 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.256 -8.830 -7.232 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.284 -10.790 -6.405 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -6.628 -11.452 -7.314 1.00 0.00 H new ATOM 41 N ILE A 4 -7.076 -7.656 -10.508 1.00 0.00 N ATOM 42 CA ILE A 4 -7.489 -6.334 -10.947 1.00 0.00 C ATOM 43 C ILE A 4 -9.004 -6.324 -11.161 1.00 0.00 C ATOM 44 O ILE A 4 -9.672 -5.340 -10.850 1.00 0.00 O ATOM 45 CB ILE A 4 -6.690 -5.906 -12.179 1.00 0.00 C ATOM 46 CG1 ILE A 4 -5.221 -6.307 -12.047 1.00 0.00 C ATOM 47 CG2 ILE A 4 -6.855 -4.408 -12.444 1.00 0.00 C ATOM 48 CD1 ILE A 4 -4.687 -5.981 -10.650 1.00 0.00 C ATOM 0 H ILE A 4 -6.377 -8.103 -11.101 1.00 0.00 H new ATOM 0 HA ILE A 4 -7.270 -5.591 -10.180 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.089 -6.433 -13.046 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.113 -7.374 -12.242 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.629 -5.784 -12.798 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.277 -4.129 -13.325 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.908 -4.182 -12.614 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.498 -3.845 -11.582 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.640 -6.276 -10.583 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.774 -4.910 -10.468 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -5.266 -6.524 -9.903 1.00 0.00 H new ATOM 60 N MET A 5 -9.502 -7.432 -11.690 1.00 0.00 N ATOM 61 CA MET A 5 -10.927 -7.563 -11.949 1.00 0.00 C ATOM 62 C MET A 5 -11.687 -7.913 -10.669 1.00 0.00 C ATOM 63 O MET A 5 -12.912 -8.036 -10.683 1.00 0.00 O ATOM 64 CB MET A 5 -11.156 -8.655 -12.995 1.00 0.00 C ATOM 65 CG MET A 5 -11.973 -8.123 -14.175 1.00 0.00 C ATOM 66 SD MET A 5 -13.164 -9.345 -14.693 1.00 0.00 S ATOM 67 CE MET A 5 -13.930 -8.476 -16.052 1.00 0.00 C ATOM 0 H MET A 5 -8.945 -8.247 -11.946 1.00 0.00 H new ATOM 0 HA MET A 5 -11.300 -6.608 -12.320 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.196 -9.028 -13.352 1.00 0.00 H new ATOM 0 HB3 MET A 5 -11.676 -9.497 -12.539 1.00 0.00 H new ATOM 0 HG2 MET A 5 -12.484 -7.204 -13.889 1.00 0.00 H new ATOM 0 HG3 MET A 5 -11.310 -7.875 -15.004 1.00 0.00 H new ATOM 0 HE1 MET A 5 -14.705 -9.102 -16.494 1.00 0.00 H new ATOM 0 HE2 MET A 5 -14.376 -7.551 -15.687 1.00 0.00 H new ATOM 0 HE3 MET A 5 -13.178 -8.244 -16.806 1.00 0.00 H new ATOM 77 N LYS A 6 -10.930 -8.064 -9.592 1.00 0.00 N ATOM 78 CA LYS A 6 -11.518 -8.398 -8.305 1.00 0.00 C ATOM 79 C LYS A 6 -11.108 -7.346 -7.274 1.00 0.00 C ATOM 80 O LYS A 6 -9.960 -7.320 -6.830 1.00 0.00 O ATOM 81 CB LYS A 6 -11.152 -9.828 -7.904 1.00 0.00 C ATOM 82 CG LYS A 6 -12.258 -10.809 -8.298 1.00 0.00 C ATOM 83 CD LYS A 6 -11.848 -12.251 -7.991 1.00 0.00 C ATOM 84 CE LYS A 6 -12.850 -12.916 -7.044 1.00 0.00 C ATOM 85 NZ LYS A 6 -13.908 -13.608 -7.813 1.00 0.00 N ATOM 0 H LYS A 6 -9.915 -7.961 -9.584 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.606 -8.378 -8.366 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.217 -10.116 -8.385 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.985 -9.876 -6.828 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -13.174 -10.565 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -12.477 -10.708 -9.361 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.785 -12.820 -8.918 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.855 -12.263 -7.542 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.334 -13.629 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.297 -12.165 -6.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -14.580 -14.054 -7.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -14.411 -12.919 -8.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -13.478 -14.338 -8.416 1.00 0.00 H new ATOM 99 N ASN A 7 -12.066 -6.502 -6.923 1.00 0.00 N ATOM 100 CA ASN A 7 -11.819 -5.450 -5.951 1.00 0.00 C ATOM 101 C ASN A 7 -12.738 -5.650 -4.744 1.00 0.00 C ATOM 102 O ASN A 7 -13.906 -5.999 -4.899 1.00 0.00 O ATOM 103 CB ASN A 7 -12.114 -4.072 -6.545 1.00 0.00 C ATOM 104 CG ASN A 7 -13.621 -3.841 -6.677 1.00 0.00 C ATOM 105 OD1 ASN A 7 -14.251 -4.223 -7.650 1.00 0.00 O ATOM 106 ND2 ASN A 7 -14.162 -3.199 -5.647 1.00 0.00 N ATOM 0 H ASN A 7 -13.016 -6.525 -7.294 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.770 -5.501 -5.659 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -11.678 -3.299 -5.912 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -11.642 -3.986 -7.524 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -15.162 -2.998 -5.639 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -13.577 -2.907 -4.864 1.00 0.00 H new ATOM 113 N LEU A 8 -12.172 -5.422 -3.567 1.00 0.00 N ATOM 114 CA LEU A 8 -12.926 -5.573 -2.333 1.00 0.00 C ATOM 115 C LEU A 8 -14.076 -4.564 -2.317 1.00 0.00 C ATOM 116 O LEU A 8 -14.223 -3.769 -3.242 1.00 0.00 O ATOM 117 CB LEU A 8 -11.997 -5.467 -1.122 1.00 0.00 C ATOM 118 CG LEU A 8 -12.432 -6.237 0.126 1.00 0.00 C ATOM 119 CD1 LEU A 8 -13.144 -5.315 1.118 1.00 0.00 C ATOM 120 CD2 LEU A 8 -13.287 -7.448 -0.247 1.00 0.00 C ATOM 0 H LEU A 8 -11.201 -5.134 -3.442 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.372 -6.566 -2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.008 -5.819 -1.416 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -11.895 -4.414 -0.858 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.539 -6.616 0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -13.443 -5.887 1.996 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.469 -4.514 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.028 -4.886 0.646 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.583 -7.978 0.659 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.178 -7.114 -0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -12.711 -8.117 -0.887 1.00 0.00 H new ATOM 132 N SER A 9 -14.863 -4.632 -1.254 1.00 0.00 N ATOM 133 CA SER A 9 -15.997 -3.734 -1.104 1.00 0.00 C ATOM 134 C SER A 9 -15.564 -2.295 -1.382 1.00 0.00 C ATOM 135 O SER A 9 -15.498 -1.874 -2.537 1.00 0.00 O ATOM 136 CB SER A 9 -16.605 -3.845 0.296 1.00 0.00 C ATOM 137 OG SER A 9 -17.284 -5.083 0.487 1.00 0.00 O ATOM 0 H SER A 9 -14.739 -5.294 -0.488 1.00 0.00 H new ATOM 0 HA SER A 9 -16.761 -4.023 -1.826 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.817 -3.745 1.042 1.00 0.00 H new ATOM 0 HB3 SER A 9 -17.301 -3.021 0.455 1.00 0.00 H new ATOM 0 HG SER A 9 -17.656 -5.116 1.393 1.00 0.00 H new ATOM 143 N ASN A 10 -15.280 -1.577 -0.305 1.00 0.00 N ATOM 144 CA ASN A 10 -14.856 -0.191 -0.419 1.00 0.00 C ATOM 145 C ASN A 10 -13.482 -0.027 0.234 1.00 0.00 C ATOM 146 O ASN A 10 -12.632 0.703 -0.271 1.00 0.00 O ATOM 147 CB ASN A 10 -15.833 0.745 0.292 1.00 0.00 C ATOM 148 CG ASN A 10 -17.077 0.994 -0.564 1.00 0.00 C ATOM 149 OD1 ASN A 10 -17.040 0.957 -1.783 1.00 0.00 O ATOM 150 ND2 ASN A 10 -18.176 1.250 0.139 1.00 0.00 N ATOM 0 H ASN A 10 -15.335 -1.929 0.651 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.820 0.064 -1.478 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.126 0.312 1.248 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.341 1.693 0.509 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -19.058 1.431 -0.341 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -18.137 1.266 1.158 1.00 0.00 H new ATOM 157 N ASN A 11 -13.308 -0.719 1.352 1.00 0.00 N ATOM 158 CA ASN A 11 -12.052 -0.661 2.080 1.00 0.00 C ATOM 159 C ASN A 11 -10.901 -0.482 1.090 1.00 0.00 C ATOM 160 O ASN A 11 -9.941 0.235 1.370 1.00 0.00 O ATOM 161 CB ASN A 11 -11.808 -1.952 2.862 1.00 0.00 C ATOM 162 CG ASN A 11 -13.129 -2.572 3.326 1.00 0.00 C ATOM 163 OD1 ASN A 11 -13.284 -3.778 3.408 1.00 0.00 O ATOM 164 ND2 ASN A 11 -14.069 -1.680 3.623 1.00 0.00 N ATOM 0 H ASN A 11 -14.016 -1.322 1.770 1.00 0.00 H new ATOM 0 HA ASN A 11 -12.104 0.177 2.776 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.268 -2.663 2.237 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -11.177 -1.744 3.726 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -14.986 -1.993 3.942 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -13.873 -0.683 3.532 1.00 0.00 H new ATOM 171 N PHE A 12 -11.033 -1.145 -0.049 1.00 0.00 N ATOM 172 CA PHE A 12 -10.015 -1.069 -1.083 1.00 0.00 C ATOM 173 C PHE A 12 -10.563 -0.397 -2.343 1.00 0.00 C ATOM 174 O PHE A 12 -10.134 0.698 -2.704 1.00 0.00 O ATOM 175 CB PHE A 12 -9.611 -2.506 -1.419 1.00 0.00 C ATOM 176 CG PHE A 12 -8.469 -3.049 -0.559 1.00 0.00 C ATOM 177 CD1 PHE A 12 -8.712 -3.455 0.717 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.211 -3.126 -1.068 1.00 0.00 C ATOM 179 CE1 PHE A 12 -7.653 -3.960 1.516 1.00 0.00 C ATOM 180 CE2 PHE A 12 -6.151 -3.631 -0.269 1.00 0.00 C ATOM 181 CZ PHE A 12 -6.394 -4.037 1.006 1.00 0.00 C ATOM 0 H PHE A 12 -11.830 -1.738 -0.279 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.168 -0.481 -0.730 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -10.480 -3.154 -1.302 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -9.317 -2.554 -2.467 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -9.711 -3.393 1.122 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -7.017 -2.803 -2.080 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.847 -4.283 2.528 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -5.152 -3.693 -0.674 1.00 0.00 H new ATOM 0 HZ PHE A 12 -5.588 -4.420 1.614 1.00 0.00 H new ATOM 191 N GLY A 13 -11.502 -1.081 -2.980 1.00 0.00 N ATOM 192 CA GLY A 13 -12.113 -0.564 -4.193 1.00 0.00 C ATOM 193 C GLY A 13 -12.443 0.922 -4.050 1.00 0.00 C ATOM 194 O GLY A 13 -12.329 1.682 -5.010 1.00 0.00 O ATOM 0 H GLY A 13 -11.855 -1.989 -2.679 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.437 -0.711 -5.036 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.023 -1.123 -4.413 1.00 0.00 H new ATOM 198 N LYS A 14 -12.845 1.294 -2.843 1.00 0.00 N ATOM 199 CA LYS A 14 -13.190 2.676 -2.561 1.00 0.00 C ATOM 200 C LYS A 14 -11.912 3.477 -2.312 1.00 0.00 C ATOM 201 O LYS A 14 -11.783 4.610 -2.776 1.00 0.00 O ATOM 202 CB LYS A 14 -14.199 2.752 -1.413 1.00 0.00 C ATOM 203 CG LYS A 14 -14.841 4.140 -1.339 1.00 0.00 C ATOM 204 CD LYS A 14 -14.318 4.922 -0.133 1.00 0.00 C ATOM 205 CE LYS A 14 -14.858 4.338 1.175 1.00 0.00 C ATOM 206 NZ LYS A 14 -14.906 5.380 2.227 1.00 0.00 N ATOM 0 H LYS A 14 -12.939 0.661 -2.049 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.685 3.128 -3.420 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.972 1.997 -1.553 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.700 2.527 -0.470 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.629 4.692 -2.255 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.924 4.040 -1.270 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -13.228 4.898 -0.124 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -14.613 5.968 -0.218 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.856 3.930 1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.225 3.513 1.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.275 4.967 3.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.948 5.751 2.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.529 6.154 1.920 1.00 0.00 H new ATOM 220 N ALA A 15 -10.998 2.859 -1.578 1.00 0.00 N ATOM 221 CA ALA A 15 -9.732 3.500 -1.261 1.00 0.00 C ATOM 222 C ALA A 15 -9.021 3.884 -2.559 1.00 0.00 C ATOM 223 O ALA A 15 -8.558 5.014 -2.707 1.00 0.00 O ATOM 224 CB ALA A 15 -8.892 2.567 -0.389 1.00 0.00 C ATOM 0 H ALA A 15 -11.109 1.921 -1.193 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.897 4.416 -0.693 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.943 3.047 -0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.430 2.349 0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.704 1.638 -0.927 1.00 0.00 H new ATOM 230 N MET A 16 -8.957 2.922 -3.469 1.00 0.00 N ATOM 231 CA MET A 16 -8.309 3.146 -4.751 1.00 0.00 C ATOM 232 C MET A 16 -9.152 4.063 -5.639 1.00 0.00 C ATOM 233 O MET A 16 -8.613 4.894 -6.367 1.00 0.00 O ATOM 234 CB MET A 16 -8.097 1.805 -5.456 1.00 0.00 C ATOM 235 CG MET A 16 -9.371 0.957 -5.415 1.00 0.00 C ATOM 236 SD MET A 16 -8.985 -0.696 -4.864 1.00 0.00 S ATOM 237 CE MET A 16 -7.908 -0.323 -3.490 1.00 0.00 C ATOM 0 H MET A 16 -9.343 1.986 -3.344 1.00 0.00 H new ATOM 0 HA MET A 16 -7.348 3.629 -4.572 1.00 0.00 H new ATOM 0 HB2 MET A 16 -7.803 1.977 -6.492 1.00 0.00 H new ATOM 0 HB3 MET A 16 -7.280 1.264 -4.978 1.00 0.00 H new ATOM 0 HG2 MET A 16 -10.099 1.412 -4.744 1.00 0.00 H new ATOM 0 HG3 MET A 16 -9.827 0.922 -6.404 1.00 0.00 H new ATOM 0 HE1 MET A 16 -8.059 -1.058 -2.699 1.00 0.00 H new ATOM 0 HE2 MET A 16 -6.870 -0.355 -3.822 1.00 0.00 H new ATOM 0 HE3 MET A 16 -8.136 0.672 -3.108 1.00 0.00 H new ATOM 247 N ASP A 17 -10.462 3.882 -5.547 1.00 0.00 N ATOM 248 CA ASP A 17 -11.385 4.684 -6.333 1.00 0.00 C ATOM 249 C ASP A 17 -11.312 6.141 -5.869 1.00 0.00 C ATOM 250 O ASP A 17 -11.269 7.055 -6.690 1.00 0.00 O ATOM 251 CB ASP A 17 -12.825 4.202 -6.151 1.00 0.00 C ATOM 252 CG ASP A 17 -13.882 5.037 -6.875 1.00 0.00 C ATOM 253 OD1 ASP A 17 -14.335 6.032 -6.267 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.216 4.662 -8.020 1.00 0.00 O ATOM 0 H ASP A 17 -10.906 3.192 -4.941 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.103 4.592 -7.382 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.895 3.172 -6.501 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.057 4.193 -5.086 1.00 0.00 H new ATOM 259 N GLN A 18 -11.300 6.310 -4.555 1.00 0.00 N ATOM 260 CA GLN A 18 -11.233 7.639 -3.972 1.00 0.00 C ATOM 261 C GLN A 18 -9.844 8.243 -4.187 1.00 0.00 C ATOM 262 O GLN A 18 -9.710 9.453 -4.361 1.00 0.00 O ATOM 263 CB GLN A 18 -11.591 7.605 -2.486 1.00 0.00 C ATOM 264 CG GLN A 18 -13.079 7.895 -2.273 1.00 0.00 C ATOM 265 CD GLN A 18 -13.360 8.277 -0.817 1.00 0.00 C ATOM 266 OE1 GLN A 18 -12.467 8.590 -0.048 1.00 0.00 O ATOM 267 NE2 GLN A 18 -14.647 8.234 -0.488 1.00 0.00 N ATOM 0 H GLN A 18 -11.336 5.548 -3.877 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.965 8.272 -4.474 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -11.344 6.628 -2.071 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.993 8.340 -1.947 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -13.394 8.704 -2.932 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.667 7.017 -2.542 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -15.342 7.963 -1.183 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.939 8.472 0.460 1.00 0.00 H new ATOM 276 N CYS A 19 -8.846 7.373 -4.171 1.00 0.00 N ATOM 277 CA CYS A 19 -7.471 7.805 -4.361 1.00 0.00 C ATOM 278 C CYS A 19 -7.332 8.343 -5.787 1.00 0.00 C ATOM 279 O CYS A 19 -6.591 9.296 -6.024 1.00 0.00 O ATOM 280 CB CYS A 19 -6.479 6.677 -4.076 1.00 0.00 C ATOM 281 SG CYS A 19 -5.619 6.799 -2.466 1.00 0.00 S ATOM 0 H CYS A 19 -8.962 6.370 -4.029 1.00 0.00 H new ATOM 0 HA CYS A 19 -7.232 8.596 -3.650 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -7.010 5.726 -4.117 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.733 6.659 -4.870 1.00 0.00 H new ATOM 286 N LYS A 20 -8.054 7.708 -6.698 1.00 0.00 N ATOM 287 CA LYS A 20 -8.020 8.110 -8.093 1.00 0.00 C ATOM 288 C LYS A 20 -8.605 9.517 -8.229 1.00 0.00 C ATOM 289 O LYS A 20 -8.557 10.114 -9.305 1.00 0.00 O ATOM 290 CB LYS A 20 -8.715 7.066 -8.970 1.00 0.00 C ATOM 291 CG LYS A 20 -7.884 6.753 -10.216 1.00 0.00 C ATOM 292 CD LYS A 20 -8.711 5.990 -11.250 1.00 0.00 C ATOM 293 CE LYS A 20 -9.234 6.931 -12.338 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.258 6.253 -13.161 1.00 0.00 N ATOM 0 H LYS A 20 -8.666 6.917 -6.497 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.991 8.157 -8.450 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.875 6.153 -8.397 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.698 7.432 -9.267 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.515 7.681 -10.653 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.011 6.163 -9.936 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.101 5.208 -11.703 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.549 5.496 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.660 7.824 -11.881 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.409 7.259 -12.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.602 6.906 -13.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.841 5.414 -13.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.052 5.962 -12.556 1.00 0.00 H new ATOM 308 N ASP A 21 -9.147 10.006 -7.124 1.00 0.00 N ATOM 309 CA ASP A 21 -9.743 11.332 -7.105 1.00 0.00 C ATOM 310 C ASP A 21 -8.903 12.252 -6.215 1.00 0.00 C ATOM 311 O ASP A 21 -8.258 13.175 -6.706 1.00 0.00 O ATOM 312 CB ASP A 21 -11.163 11.290 -6.536 1.00 0.00 C ATOM 313 CG ASP A 21 -11.872 12.644 -6.469 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.197 13.620 -6.079 1.00 0.00 O ATOM 315 OD2 ASP A 21 -13.075 12.671 -6.809 1.00 0.00 O ATOM 0 H ASP A 21 -9.186 9.508 -6.235 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.776 11.701 -8.130 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -11.762 10.613 -7.144 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -11.124 10.867 -5.532 1.00 0.00 H new ATOM 320 N GLU A 22 -8.940 11.965 -4.923 1.00 0.00 N ATOM 321 CA GLU A 22 -8.191 12.755 -3.960 1.00 0.00 C ATOM 322 C GLU A 22 -6.737 12.903 -4.412 1.00 0.00 C ATOM 323 O GLU A 22 -6.172 13.992 -4.347 1.00 0.00 O ATOM 324 CB GLU A 22 -8.272 12.136 -2.563 1.00 0.00 C ATOM 325 CG GLU A 22 -7.866 10.661 -2.593 1.00 0.00 C ATOM 326 CD GLU A 22 -8.789 9.821 -1.707 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.960 10.231 -1.559 1.00 0.00 O ATOM 328 OE2 GLU A 22 -8.302 8.788 -1.198 1.00 0.00 O ATOM 0 H GLU A 22 -9.476 11.197 -4.520 1.00 0.00 H new ATOM 0 HA GLU A 22 -8.637 13.748 -3.907 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -7.621 12.682 -1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -9.287 12.230 -2.178 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.903 10.291 -3.617 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.836 10.557 -2.253 1.00 0.00 H new ATOM 335 N LEU A 23 -6.174 11.790 -4.858 1.00 0.00 N ATOM 336 CA LEU A 23 -4.796 11.782 -5.320 1.00 0.00 C ATOM 337 C LEU A 23 -4.774 11.884 -6.847 1.00 0.00 C ATOM 338 O LEU A 23 -3.717 12.081 -7.444 1.00 0.00 O ATOM 339 CB LEU A 23 -4.056 10.558 -4.776 1.00 0.00 C ATOM 340 CG LEU A 23 -3.898 10.492 -3.255 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.480 9.090 -2.809 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.927 11.564 -2.758 1.00 0.00 C ATOM 0 H LEU A 23 -6.647 10.888 -4.909 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.260 12.649 -4.934 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.583 9.663 -5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.064 10.528 -5.226 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.867 10.700 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.374 9.070 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.240 8.370 -3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.528 8.830 -3.271 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.833 11.495 -1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.950 11.412 -3.218 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.305 12.550 -3.027 1.00 0.00 H new ATOM 354 N SER A 24 -5.955 11.749 -7.434 1.00 0.00 N ATOM 355 CA SER A 24 -6.084 11.825 -8.879 1.00 0.00 C ATOM 356 C SER A 24 -5.045 10.921 -9.546 1.00 0.00 C ATOM 357 O SER A 24 -4.742 11.084 -10.727 1.00 0.00 O ATOM 358 CB SER A 24 -5.928 13.266 -9.371 1.00 0.00 C ATOM 359 OG SER A 24 -7.158 13.981 -9.324 1.00 0.00 O ATOM 0 H SER A 24 -6.830 11.588 -6.935 1.00 0.00 H new ATOM 0 HA SER A 24 -7.082 11.483 -9.151 1.00 0.00 H new ATOM 0 HB2 SER A 24 -5.186 13.780 -8.759 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.550 13.261 -10.393 1.00 0.00 H new ATOM 0 HG SER A 24 -7.619 13.784 -8.482 1.00 0.00 H new ATOM 365 N LEU A 25 -4.527 9.988 -8.759 1.00 0.00 N ATOM 366 CA LEU A 25 -3.528 9.058 -9.259 1.00 0.00 C ATOM 367 C LEU A 25 -4.226 7.921 -10.007 1.00 0.00 C ATOM 368 O LEU A 25 -5.446 7.783 -9.938 1.00 0.00 O ATOM 369 CB LEU A 25 -2.624 8.581 -8.121 1.00 0.00 C ATOM 370 CG LEU A 25 -3.152 7.410 -7.292 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.669 7.501 -7.116 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.724 6.072 -7.897 1.00 0.00 C ATOM 0 H LEU A 25 -4.780 9.857 -7.780 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.869 9.553 -9.973 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.661 8.296 -8.544 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.442 9.422 -7.451 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.709 7.470 -6.298 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.018 6.656 -6.523 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.921 8.431 -6.606 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.151 7.481 -8.094 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.113 5.256 -7.288 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.118 5.988 -8.910 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.636 6.017 -7.925 1.00 0.00 H new ATOM 384 N PRO A 26 -3.400 7.115 -10.727 1.00 0.00 N ATOM 385 CA PRO A 26 -3.924 5.994 -11.489 1.00 0.00 C ATOM 386 C PRO A 26 -4.308 4.836 -10.565 1.00 0.00 C ATOM 387 O PRO A 26 -3.462 4.303 -9.849 1.00 0.00 O ATOM 388 CB PRO A 26 -2.820 5.633 -12.469 1.00 0.00 C ATOM 389 CG PRO A 26 -1.549 6.254 -11.911 1.00 0.00 C ATOM 390 CD PRO A 26 -1.950 7.249 -10.835 1.00 0.00 C ATOM 0 HA PRO A 26 -4.844 6.239 -12.020 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.718 4.552 -12.562 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.039 6.019 -13.464 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.899 5.484 -11.496 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -0.989 6.752 -12.702 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.460 7.026 -9.887 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.666 8.265 -11.109 1.00 0.00 H new ATOM 398 N ASP A 27 -5.583 4.481 -10.613 1.00 0.00 N ATOM 399 CA ASP A 27 -6.090 3.396 -9.789 1.00 0.00 C ATOM 400 C ASP A 27 -5.487 2.075 -10.269 1.00 0.00 C ATOM 401 O ASP A 27 -5.762 1.019 -9.701 1.00 0.00 O ATOM 402 CB ASP A 27 -7.612 3.288 -9.895 1.00 0.00 C ATOM 403 CG ASP A 27 -8.135 2.859 -11.268 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.287 2.676 -12.168 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.373 2.721 -11.386 1.00 0.00 O ATOM 0 H ASP A 27 -6.281 4.925 -11.210 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.815 3.601 -8.754 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.964 2.575 -9.150 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -8.048 4.254 -9.642 1.00 0.00 H new ATOM 410 N SER A 28 -4.676 2.175 -11.312 1.00 0.00 N ATOM 411 CA SER A 28 -4.032 1.000 -11.875 1.00 0.00 C ATOM 412 C SER A 28 -2.789 0.643 -11.058 1.00 0.00 C ATOM 413 O SER A 28 -2.507 -0.533 -10.830 1.00 0.00 O ATOM 414 CB SER A 28 -3.656 1.227 -13.341 1.00 0.00 C ATOM 415 OG SER A 28 -2.892 2.415 -13.519 1.00 0.00 O ATOM 0 H SER A 28 -4.450 3.052 -11.782 1.00 0.00 H new ATOM 0 HA SER A 28 -4.738 0.170 -11.833 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.087 0.372 -13.706 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.563 1.286 -13.943 1.00 0.00 H new ATOM 0 HG SER A 28 -2.671 2.523 -14.468 1.00 0.00 H new ATOM 421 N VAL A 29 -2.075 1.679 -10.640 1.00 0.00 N ATOM 422 CA VAL A 29 -0.868 1.489 -9.855 1.00 0.00 C ATOM 423 C VAL A 29 -1.225 0.787 -8.542 1.00 0.00 C ATOM 424 O VAL A 29 -0.461 -0.042 -8.051 1.00 0.00 O ATOM 425 CB VAL A 29 -0.165 2.832 -9.643 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.254 3.447 -10.979 1.00 0.00 C ATOM 427 CG2 VAL A 29 -1.051 3.795 -8.850 1.00 0.00 C ATOM 0 H VAL A 29 -2.310 2.653 -10.831 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.163 0.849 -10.386 1.00 0.00 H new ATOM 0 HB VAL A 29 0.738 2.650 -9.060 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.751 4.400 -10.801 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.938 2.771 -11.492 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.629 3.608 -11.598 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.528 4.742 -8.713 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.979 3.968 -9.395 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.278 3.362 -7.876 1.00 0.00 H new ATOM 437 N VAL A 30 -2.385 1.147 -8.013 1.00 0.00 N ATOM 438 CA VAL A 30 -2.852 0.562 -6.767 1.00 0.00 C ATOM 439 C VAL A 30 -3.405 -0.838 -7.041 1.00 0.00 C ATOM 440 O VAL A 30 -3.325 -1.719 -6.187 1.00 0.00 O ATOM 441 CB VAL A 30 -3.873 1.489 -6.104 1.00 0.00 C ATOM 442 CG1 VAL A 30 -5.146 1.595 -6.947 1.00 0.00 C ATOM 443 CG2 VAL A 30 -4.195 1.024 -4.683 1.00 0.00 C ATOM 0 H VAL A 30 -3.015 1.836 -8.424 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.027 0.453 -6.063 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.430 2.483 -6.039 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.855 2.260 -6.453 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.899 1.994 -7.931 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.592 0.607 -7.058 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.923 1.700 -4.235 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.608 0.016 -4.715 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.284 1.024 -4.085 1.00 0.00 H new ATOM 453 N ALA A 31 -3.952 -0.999 -8.237 1.00 0.00 N ATOM 454 CA ALA A 31 -4.518 -2.278 -8.636 1.00 0.00 C ATOM 455 C ALA A 31 -3.393 -3.303 -8.788 1.00 0.00 C ATOM 456 O ALA A 31 -3.643 -4.508 -8.801 1.00 0.00 O ATOM 457 CB ALA A 31 -5.325 -2.101 -9.923 1.00 0.00 C ATOM 0 H ALA A 31 -4.016 -0.266 -8.943 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.202 -2.650 -7.873 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.749 -3.060 -10.221 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.130 -1.386 -9.752 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.672 -1.731 -10.714 1.00 0.00 H new ATOM 463 N ASP A 32 -2.178 -2.788 -8.899 1.00 0.00 N ATOM 464 CA ASP A 32 -1.013 -3.644 -9.049 1.00 0.00 C ATOM 465 C ASP A 32 -0.621 -4.211 -7.684 1.00 0.00 C ATOM 466 O ASP A 32 0.083 -5.217 -7.603 1.00 0.00 O ATOM 467 CB ASP A 32 0.182 -2.858 -9.595 1.00 0.00 C ATOM 468 CG ASP A 32 1.237 -3.702 -10.312 1.00 0.00 C ATOM 469 OD1 ASP A 32 1.086 -4.941 -10.288 1.00 0.00 O ATOM 470 OD2 ASP A 32 2.172 -3.087 -10.871 1.00 0.00 O ATOM 0 H ASP A 32 -1.974 -1.789 -8.888 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.270 -4.442 -9.746 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.186 -2.100 -10.286 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.660 -2.331 -8.769 1.00 0.00 H new ATOM 475 N LEU A 33 -1.095 -3.541 -6.642 1.00 0.00 N ATOM 476 CA LEU A 33 -0.803 -3.966 -5.284 1.00 0.00 C ATOM 477 C LEU A 33 -1.262 -5.413 -5.096 1.00 0.00 C ATOM 478 O LEU A 33 -0.488 -6.263 -4.658 1.00 0.00 O ATOM 479 CB LEU A 33 -1.414 -2.991 -4.276 1.00 0.00 C ATOM 480 CG LEU A 33 -1.282 -3.382 -2.802 1.00 0.00 C ATOM 481 CD1 LEU A 33 -2.656 -3.622 -2.174 1.00 0.00 C ATOM 482 CD2 LEU A 33 -0.356 -4.588 -2.634 1.00 0.00 C ATOM 0 H LEU A 33 -1.679 -2.708 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 33 0.271 -3.947 -5.101 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.949 -2.015 -4.416 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.473 -2.875 -4.508 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.824 -2.549 -2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.534 -3.898 -1.127 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.251 -2.711 -2.242 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.163 -4.427 -2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.280 -4.844 -1.577 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.761 -5.437 -3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.634 -4.343 -3.020 1.00 0.00 H new ATOM 494 N TYR A 34 -2.520 -5.650 -5.439 1.00 0.00 N ATOM 495 CA TYR A 34 -3.093 -6.979 -5.314 1.00 0.00 C ATOM 496 C TYR A 34 -2.364 -7.977 -6.217 1.00 0.00 C ATOM 497 O TYR A 34 -2.382 -9.179 -5.960 1.00 0.00 O ATOM 498 CB TYR A 34 -4.545 -6.859 -5.778 1.00 0.00 C ATOM 499 CG TYR A 34 -5.556 -6.748 -4.633 1.00 0.00 C ATOM 500 CD1 TYR A 34 -5.879 -7.863 -3.887 1.00 0.00 C ATOM 501 CD2 TYR A 34 -6.146 -5.533 -4.348 1.00 0.00 C ATOM 502 CE1 TYR A 34 -6.829 -7.760 -2.811 1.00 0.00 C ATOM 503 CE2 TYR A 34 -7.096 -5.429 -3.272 1.00 0.00 C ATOM 504 CZ TYR A 34 -7.391 -6.547 -2.556 1.00 0.00 C ATOM 505 OH TYR A 34 -8.290 -6.450 -1.539 1.00 0.00 O ATOM 0 H TYR A 34 -3.159 -4.943 -5.804 1.00 0.00 H new ATOM 0 HA TYR A 34 -3.010 -7.337 -4.288 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.640 -5.983 -6.419 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.794 -7.728 -6.387 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -5.418 -8.814 -4.111 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -5.895 -4.660 -4.933 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -7.090 -8.625 -2.220 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.564 -4.484 -3.038 1.00 0.00 H new ATOM 0 HH TYR A 34 -8.310 -5.528 -1.207 1.00 0.00 H new ATOM 515 N ASN A 35 -1.740 -7.439 -7.255 1.00 0.00 N ATOM 516 CA ASN A 35 -1.006 -8.268 -8.198 1.00 0.00 C ATOM 517 C ASN A 35 0.342 -8.654 -7.587 1.00 0.00 C ATOM 518 O ASN A 35 0.525 -9.785 -7.142 1.00 0.00 O ATOM 519 CB ASN A 35 -0.738 -7.514 -9.501 1.00 0.00 C ATOM 520 CG ASN A 35 -1.522 -8.130 -10.662 1.00 0.00 C ATOM 521 OD1 ASN A 35 -2.334 -7.487 -11.307 1.00 0.00 O ATOM 522 ND2 ASN A 35 -1.234 -9.407 -10.891 1.00 0.00 N ATOM 0 H ASN A 35 -1.727 -6.441 -7.464 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.608 -9.152 -8.411 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.018 -6.467 -9.384 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.328 -7.536 -9.725 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.703 -9.908 -11.645 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.543 -9.886 -10.313 1.00 0.00 H new ATOM 529 N PHE A 36 1.253 -7.692 -7.588 1.00 0.00 N ATOM 530 CA PHE A 36 2.580 -7.917 -7.041 1.00 0.00 C ATOM 531 C PHE A 36 3.489 -6.711 -7.294 1.00 0.00 C ATOM 532 O PHE A 36 4.464 -6.809 -8.036 1.00 0.00 O ATOM 533 CB PHE A 36 3.160 -9.136 -7.760 1.00 0.00 C ATOM 534 CG PHE A 36 3.271 -8.969 -9.277 1.00 0.00 C ATOM 535 CD1 PHE A 36 2.186 -9.187 -10.065 1.00 0.00 C ATOM 536 CD2 PHE A 36 4.457 -8.605 -9.836 1.00 0.00 C ATOM 537 CE1 PHE A 36 2.290 -9.033 -11.474 1.00 0.00 C ATOM 538 CE2 PHE A 36 4.560 -8.451 -11.243 1.00 0.00 C ATOM 539 CZ PHE A 36 3.473 -8.667 -12.033 1.00 0.00 C ATOM 0 H PHE A 36 1.098 -6.755 -7.959 1.00 0.00 H new ATOM 0 HA PHE A 36 2.517 -8.072 -5.964 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.150 -9.347 -7.355 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.536 -10.003 -7.545 1.00 0.00 H new ATOM 0 HD1 PHE A 36 1.245 -9.477 -9.621 1.00 0.00 H new ATOM 0 HD2 PHE A 36 5.320 -8.433 -9.209 1.00 0.00 H new ATOM 0 HE1 PHE A 36 1.428 -9.207 -12.101 1.00 0.00 H new ATOM 0 HE2 PHE A 36 5.501 -8.162 -11.687 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.551 -8.548 -13.104 1.00 0.00 H new ATOM 549 N TRP A 37 3.137 -5.602 -6.661 1.00 0.00 N ATOM 550 CA TRP A 37 3.907 -4.378 -6.806 1.00 0.00 C ATOM 551 C TRP A 37 4.975 -4.360 -5.711 1.00 0.00 C ATOM 552 O TRP A 37 5.661 -3.355 -5.525 1.00 0.00 O ATOM 553 CB TRP A 37 2.996 -3.149 -6.775 1.00 0.00 C ATOM 554 CG TRP A 37 2.442 -2.822 -5.387 1.00 0.00 C ATOM 555 CD1 TRP A 37 2.630 -3.495 -4.244 1.00 0.00 C ATOM 556 CD2 TRP A 37 1.596 -1.705 -5.042 1.00 0.00 C ATOM 557 NE1 TRP A 37 1.969 -2.896 -3.189 1.00 0.00 N ATOM 558 CE2 TRP A 37 1.320 -1.772 -3.691 1.00 0.00 C ATOM 559 CE3 TRP A 37 1.080 -0.673 -5.844 1.00 0.00 C ATOM 560 CZ2 TRP A 37 0.521 -0.837 -3.024 1.00 0.00 C ATOM 561 CZ3 TRP A 37 0.284 0.255 -5.161 1.00 0.00 C ATOM 562 CH2 TRP A 37 -0.004 0.201 -3.802 1.00 0.00 C ATOM 0 H TRP A 37 2.327 -5.525 -6.045 1.00 0.00 H new ATOM 0 HA TRP A 37 4.403 -4.346 -7.776 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.552 -2.288 -7.146 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.163 -3.309 -7.459 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.224 -4.393 -4.158 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.959 -3.218 -2.221 1.00 0.00 H new ATOM 0 HE3 TRP A 37 1.281 -0.601 -6.903 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 0.320 -0.912 -1.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -0.136 1.071 -5.731 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -0.630 0.956 -3.349 1.00 0.00 H new ATOM 573 N LYS A 38 5.085 -5.484 -5.017 1.00 0.00 N ATOM 574 CA LYS A 38 6.059 -5.608 -3.946 1.00 0.00 C ATOM 575 C LYS A 38 7.396 -5.026 -4.408 1.00 0.00 C ATOM 576 O LYS A 38 7.923 -4.103 -3.787 1.00 0.00 O ATOM 577 CB LYS A 38 6.152 -7.060 -3.472 1.00 0.00 C ATOM 578 CG LYS A 38 5.449 -7.244 -2.126 1.00 0.00 C ATOM 579 CD LYS A 38 4.007 -7.715 -2.319 1.00 0.00 C ATOM 580 CE LYS A 38 3.616 -8.737 -1.249 1.00 0.00 C ATOM 581 NZ LYS A 38 2.790 -9.814 -1.839 1.00 0.00 N ATOM 0 H LYS A 38 4.516 -6.316 -5.176 1.00 0.00 H new ATOM 0 HA LYS A 38 5.744 -5.032 -3.076 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.701 -7.718 -4.215 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.199 -7.351 -3.382 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.995 -7.970 -1.523 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.457 -6.303 -1.576 1.00 0.00 H new ATOM 0 HD2 LYS A 38 3.332 -6.860 -2.274 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.895 -8.158 -3.309 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.513 -9.163 -0.800 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.063 -8.243 -0.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.533 -10.499 -1.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.925 -9.404 -2.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.330 -10.296 -2.585 1.00 0.00 H new ATOM 595 N ASP A 39 7.908 -5.588 -5.492 1.00 0.00 N ATOM 596 CA ASP A 39 9.174 -5.136 -6.044 1.00 0.00 C ATOM 597 C ASP A 39 9.001 -3.728 -6.616 1.00 0.00 C ATOM 598 O ASP A 39 9.921 -2.914 -6.559 1.00 0.00 O ATOM 599 CB ASP A 39 9.639 -6.054 -7.176 1.00 0.00 C ATOM 600 CG ASP A 39 8.704 -6.115 -8.385 1.00 0.00 C ATOM 601 OD1 ASP A 39 7.475 -6.120 -8.152 1.00 0.00 O ATOM 602 OD2 ASP A 39 9.238 -6.155 -9.515 1.00 0.00 O ATOM 0 H ASP A 39 7.469 -6.353 -6.004 1.00 0.00 H new ATOM 0 HA ASP A 39 9.915 -5.146 -5.245 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.621 -5.722 -7.512 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.761 -7.062 -6.779 1.00 0.00 H new ATOM 607 N ASP A 40 7.817 -3.484 -7.157 1.00 0.00 N ATOM 608 CA ASP A 40 7.512 -2.188 -7.739 1.00 0.00 C ATOM 609 C ASP A 40 7.219 -1.187 -6.620 1.00 0.00 C ATOM 610 O ASP A 40 6.087 -1.089 -6.150 1.00 0.00 O ATOM 611 CB ASP A 40 6.277 -2.265 -8.638 1.00 0.00 C ATOM 612 CG ASP A 40 5.771 -0.918 -9.159 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.634 -0.064 -9.455 1.00 0.00 O ATOM 614 OD2 ASP A 40 4.531 -0.774 -9.249 1.00 0.00 O ATOM 0 H ASP A 40 7.057 -4.162 -7.205 1.00 0.00 H new ATOM 0 HA ASP A 40 8.371 -1.874 -8.332 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.506 -2.904 -9.491 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.472 -2.749 -8.084 1.00 0.00 H new ATOM 619 N TYR A 41 8.261 -0.468 -6.226 1.00 0.00 N ATOM 620 CA TYR A 41 8.130 0.522 -5.171 1.00 0.00 C ATOM 621 C TYR A 41 8.058 1.936 -5.750 1.00 0.00 C ATOM 622 O TYR A 41 8.228 2.126 -6.955 1.00 0.00 O ATOM 623 CB TYR A 41 9.394 0.398 -4.316 1.00 0.00 C ATOM 624 CG TYR A 41 9.561 1.516 -3.285 1.00 0.00 C ATOM 625 CD1 TYR A 41 8.694 1.601 -2.215 1.00 0.00 C ATOM 626 CD2 TYR A 41 10.578 2.437 -3.425 1.00 0.00 C ATOM 627 CE1 TYR A 41 8.851 2.652 -1.244 1.00 0.00 C ATOM 628 CE2 TYR A 41 10.735 3.489 -2.454 1.00 0.00 C ATOM 629 CZ TYR A 41 9.863 3.545 -1.410 1.00 0.00 C ATOM 630 OH TYR A 41 10.012 4.539 -0.495 1.00 0.00 O ATOM 0 H TYR A 41 9.199 -0.552 -6.619 1.00 0.00 H new ATOM 0 HA TYR A 41 7.219 0.352 -4.598 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.377 -0.561 -3.797 1.00 0.00 H new ATOM 0 HB3 TYR A 41 10.264 0.390 -4.972 1.00 0.00 H new ATOM 0 HD1 TYR A 41 7.898 0.879 -2.106 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.256 2.369 -4.263 1.00 0.00 H new ATOM 0 HE1 TYR A 41 8.179 2.730 -0.402 1.00 0.00 H new ATOM 0 HE2 TYR A 41 11.527 4.217 -2.552 1.00 0.00 H new ATOM 0 HH TYR A 41 10.767 5.109 -0.751 1.00 0.00 H new ATOM 640 N VAL A 42 7.808 2.890 -4.868 1.00 0.00 N ATOM 641 CA VAL A 42 7.711 4.282 -5.278 1.00 0.00 C ATOM 642 C VAL A 42 8.777 4.571 -6.336 1.00 0.00 C ATOM 643 O VAL A 42 8.588 5.433 -7.194 1.00 0.00 O ATOM 644 CB VAL A 42 7.818 5.196 -4.056 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.006 6.656 -4.477 1.00 0.00 C ATOM 646 CG2 VAL A 42 6.597 5.041 -3.147 1.00 0.00 C ATOM 0 H VAL A 42 7.669 2.728 -3.870 1.00 0.00 H new ATOM 0 HA VAL A 42 6.740 4.481 -5.731 1.00 0.00 H new ATOM 0 HB VAL A 42 8.699 4.895 -3.489 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.079 7.284 -3.589 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.919 6.751 -5.065 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.154 6.974 -5.077 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.698 5.702 -2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.695 5.303 -3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.526 4.008 -2.806 1.00 0.00 H new ATOM 656 N MET A 43 9.876 3.837 -6.241 1.00 0.00 N ATOM 657 CA MET A 43 10.973 4.005 -7.180 1.00 0.00 C ATOM 658 C MET A 43 10.449 4.257 -8.595 1.00 0.00 C ATOM 659 O MET A 43 11.111 4.910 -9.399 1.00 0.00 O ATOM 660 CB MET A 43 11.846 2.749 -7.174 1.00 0.00 C ATOM 661 CG MET A 43 13.280 3.077 -7.595 1.00 0.00 C ATOM 662 SD MET A 43 14.144 3.875 -6.252 1.00 0.00 S ATOM 663 CE MET A 43 15.454 2.693 -5.978 1.00 0.00 C ATOM 0 H MET A 43 10.031 3.124 -5.528 1.00 0.00 H new ATOM 0 HA MET A 43 11.562 4.869 -6.872 1.00 0.00 H new ATOM 0 HB2 MET A 43 11.848 2.307 -6.177 1.00 0.00 H new ATOM 0 HB3 MET A 43 11.425 2.006 -7.851 1.00 0.00 H new ATOM 0 HG2 MET A 43 13.801 2.164 -7.882 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.271 3.727 -8.470 1.00 0.00 H new ATOM 0 HE1 MET A 43 16.092 3.039 -5.165 1.00 0.00 H new ATOM 0 HE2 MET A 43 15.023 1.727 -5.715 1.00 0.00 H new ATOM 0 HE3 MET A 43 16.047 2.590 -6.887 1.00 0.00 H new ATOM 673 N THR A 44 9.264 3.724 -8.856 1.00 0.00 N ATOM 674 CA THR A 44 8.644 3.884 -10.161 1.00 0.00 C ATOM 675 C THR A 44 7.492 4.888 -10.084 1.00 0.00 C ATOM 676 O THR A 44 7.486 5.886 -10.804 1.00 0.00 O ATOM 677 CB THR A 44 8.212 2.500 -10.650 1.00 0.00 C ATOM 678 OG1 THR A 44 9.376 1.978 -11.286 1.00 0.00 O ATOM 679 CG2 THR A 44 7.176 2.573 -11.774 1.00 0.00 C ATOM 0 H THR A 44 8.717 3.182 -8.187 1.00 0.00 H new ATOM 0 HA THR A 44 9.346 4.297 -10.886 1.00 0.00 H new ATOM 0 HB THR A 44 7.803 1.932 -9.815 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.186 1.081 -11.631 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.904 1.564 -12.084 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.288 3.095 -11.417 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.597 3.112 -12.623 1.00 0.00 H new ATOM 687 N ASP A 45 6.545 4.589 -9.208 1.00 0.00 N ATOM 688 CA ASP A 45 5.391 5.453 -9.028 1.00 0.00 C ATOM 689 C ASP A 45 5.069 5.564 -7.537 1.00 0.00 C ATOM 690 O ASP A 45 4.547 4.624 -6.939 1.00 0.00 O ATOM 691 CB ASP A 45 4.161 4.882 -9.737 1.00 0.00 C ATOM 692 CG ASP A 45 3.406 5.876 -10.624 1.00 0.00 C ATOM 693 OD1 ASP A 45 4.086 6.544 -11.432 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.167 5.944 -10.471 1.00 0.00 O ATOM 0 H ASP A 45 6.553 3.760 -8.614 1.00 0.00 H new ATOM 0 HA ASP A 45 5.631 6.429 -9.451 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.473 4.036 -10.349 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.474 4.495 -8.985 1.00 0.00 H new ATOM 699 N ARG A 46 5.394 6.721 -6.978 1.00 0.00 N ATOM 700 CA ARG A 46 5.145 6.966 -5.568 1.00 0.00 C ATOM 701 C ARG A 46 3.652 6.837 -5.261 1.00 0.00 C ATOM 702 O ARG A 46 3.273 6.395 -4.179 1.00 0.00 O ATOM 703 CB ARG A 46 5.623 8.361 -5.159 1.00 0.00 C ATOM 704 CG ARG A 46 4.668 9.441 -5.672 1.00 0.00 C ATOM 705 CD ARG A 46 3.610 9.779 -4.620 1.00 0.00 C ATOM 706 NE ARG A 46 4.157 10.744 -3.641 1.00 0.00 N ATOM 707 CZ ARG A 46 4.319 12.051 -3.885 1.00 0.00 C ATOM 708 NH1 ARG A 46 3.978 12.558 -5.076 1.00 0.00 N ATOM 709 NH2 ARG A 46 4.825 12.852 -2.936 1.00 0.00 N ATOM 0 H ARG A 46 5.827 7.498 -7.476 1.00 0.00 H new ATOM 0 HA ARG A 46 5.702 6.221 -4.999 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.695 8.421 -4.073 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.623 8.537 -5.555 1.00 0.00 H new ATOM 0 HG2 ARG A 46 5.231 10.338 -5.928 1.00 0.00 H new ATOM 0 HG3 ARG A 46 4.182 9.098 -6.585 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.727 10.199 -5.102 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.292 8.871 -4.108 1.00 0.00 H new ATOM 0 HE ARG A 46 4.428 10.392 -2.723 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.594 11.949 -5.799 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.102 13.553 -5.261 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.086 12.466 -2.029 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.949 13.847 -3.121 1.00 0.00 H new ATOM 723 N LEU A 47 2.844 7.231 -6.235 1.00 0.00 N ATOM 724 CA LEU A 47 1.401 7.164 -6.084 1.00 0.00 C ATOM 725 C LEU A 47 1.014 5.795 -5.520 1.00 0.00 C ATOM 726 O LEU A 47 0.181 5.704 -4.620 1.00 0.00 O ATOM 727 CB LEU A 47 0.707 7.504 -7.405 1.00 0.00 C ATOM 728 CG LEU A 47 1.212 8.755 -8.125 1.00 0.00 C ATOM 729 CD1 LEU A 47 1.509 9.878 -7.130 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.423 8.432 -9.002 1.00 0.00 C ATOM 0 H LEU A 47 3.162 7.598 -7.132 1.00 0.00 H new ATOM 0 HA LEU A 47 1.058 7.912 -5.369 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.814 6.653 -8.078 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.359 7.625 -7.212 1.00 0.00 H new ATOM 0 HG LEU A 47 0.422 9.111 -8.786 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.867 10.756 -7.668 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.599 10.132 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.273 9.548 -6.426 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.762 9.339 -9.503 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.227 8.038 -8.381 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.144 7.688 -9.748 1.00 0.00 H new ATOM 742 N ALA A 48 1.638 4.766 -6.072 1.00 0.00 N ATOM 743 CA ALA A 48 1.370 3.406 -5.635 1.00 0.00 C ATOM 744 C ALA A 48 1.612 3.302 -4.128 1.00 0.00 C ATOM 745 O ALA A 48 0.936 2.540 -3.437 1.00 0.00 O ATOM 746 CB ALA A 48 2.238 2.432 -6.434 1.00 0.00 C ATOM 0 H ALA A 48 2.329 4.846 -6.818 1.00 0.00 H new ATOM 0 HA ALA A 48 0.329 3.142 -5.820 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.037 1.412 -6.106 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.006 2.524 -7.495 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.290 2.665 -6.271 1.00 0.00 H new ATOM 752 N GLY A 49 2.578 4.080 -3.661 1.00 0.00 N ATOM 753 CA GLY A 49 2.917 4.084 -2.248 1.00 0.00 C ATOM 754 C GLY A 49 1.956 4.973 -1.457 1.00 0.00 C ATOM 755 O GLY A 49 1.688 4.712 -0.284 1.00 0.00 O ATOM 0 H GLY A 49 3.136 4.711 -4.236 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.881 3.067 -1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.939 4.440 -2.116 1.00 0.00 H new ATOM 759 N CYS A 50 1.465 6.004 -2.129 1.00 0.00 N ATOM 760 CA CYS A 50 0.539 6.933 -1.502 1.00 0.00 C ATOM 761 C CYS A 50 -0.849 6.289 -1.485 1.00 0.00 C ATOM 762 O CYS A 50 -1.560 6.364 -0.484 1.00 0.00 O ATOM 763 CB CYS A 50 0.531 8.288 -2.210 1.00 0.00 C ATOM 764 SG CYS A 50 1.516 9.591 -1.386 1.00 0.00 S ATOM 0 H CYS A 50 1.691 6.217 -3.101 1.00 0.00 H new ATOM 0 HA CYS A 50 0.858 7.134 -0.479 1.00 0.00 H new ATOM 0 HB2 CYS A 50 0.908 8.154 -3.224 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.500 8.631 -2.296 1.00 0.00 H new ATOM 769 N ALA A 51 -1.194 5.672 -2.606 1.00 0.00 N ATOM 770 CA ALA A 51 -2.484 5.017 -2.733 1.00 0.00 C ATOM 771 C ALA A 51 -2.653 4.008 -1.595 1.00 0.00 C ATOM 772 O ALA A 51 -3.698 3.967 -0.947 1.00 0.00 O ATOM 773 CB ALA A 51 -2.593 4.364 -4.112 1.00 0.00 C ATOM 0 H ALA A 51 -0.602 5.612 -3.434 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.292 5.744 -2.652 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.561 3.873 -4.206 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.496 5.127 -4.884 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.799 3.626 -4.229 1.00 0.00 H new ATOM 779 N ILE A 52 -1.609 3.219 -1.388 1.00 0.00 N ATOM 780 CA ILE A 52 -1.628 2.213 -0.340 1.00 0.00 C ATOM 781 C ILE A 52 -1.839 2.895 1.013 1.00 0.00 C ATOM 782 O ILE A 52 -2.601 2.408 1.847 1.00 0.00 O ATOM 783 CB ILE A 52 -0.367 1.348 -0.404 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.450 0.186 0.586 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.889 2.195 -0.191 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.869 -0.381 0.652 1.00 0.00 C ATOM 0 H ILE A 52 -0.745 3.256 -1.928 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.463 1.528 -0.485 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.298 0.916 -1.402 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.245 -0.599 0.289 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.144 0.525 1.576 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.771 1.557 -0.241 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.949 2.958 -0.967 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.843 2.674 0.787 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.898 -1.206 1.364 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.558 0.400 0.973 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.163 -0.742 -0.334 1.00 0.00 H new ATOM 798 N ASN A 53 -1.149 4.012 1.190 1.00 0.00 N ATOM 799 CA ASN A 53 -1.250 4.767 2.428 1.00 0.00 C ATOM 800 C ASN A 53 -2.705 5.185 2.647 1.00 0.00 C ATOM 801 O ASN A 53 -3.221 5.088 3.759 1.00 0.00 O ATOM 802 CB ASN A 53 -0.397 6.037 2.369 1.00 0.00 C ATOM 803 CG ASN A 53 0.698 6.010 3.437 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.855 5.728 3.171 1.00 0.00 O ATOM 805 ND2 ASN A 53 0.271 6.317 4.660 1.00 0.00 N ATOM 0 H ASN A 53 -0.517 4.413 0.497 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.897 4.132 3.241 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.055 6.131 1.382 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -1.030 6.912 2.514 1.00 0.00 H new ATOM 0 HD21 ASN A 53 0.926 6.326 5.442 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.711 6.544 4.815 1.00 0.00 H new ATOM 812 N CYS A 54 -3.325 5.643 1.569 1.00 0.00 N ATOM 813 CA CYS A 54 -4.711 6.075 1.630 1.00 0.00 C ATOM 814 C CYS A 54 -5.587 4.847 1.884 1.00 0.00 C ATOM 815 O CYS A 54 -6.659 4.956 2.477 1.00 0.00 O ATOM 816 CB CYS A 54 -5.128 6.821 0.361 1.00 0.00 C ATOM 817 SG CYS A 54 -5.970 5.789 -0.895 1.00 0.00 S ATOM 0 H CYS A 54 -2.893 5.724 0.649 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.837 6.785 2.448 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.790 7.641 0.640 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.241 7.266 -0.090 1.00 0.00 H new ATOM 822 N LEU A 55 -5.100 3.705 1.421 1.00 0.00 N ATOM 823 CA LEU A 55 -5.825 2.458 1.590 1.00 0.00 C ATOM 824 C LEU A 55 -6.174 2.271 3.068 1.00 0.00 C ATOM 825 O LEU A 55 -7.232 1.739 3.396 1.00 0.00 O ATOM 826 CB LEU A 55 -5.033 1.293 0.994 1.00 0.00 C ATOM 827 CG LEU A 55 -5.858 0.096 0.515 1.00 0.00 C ATOM 828 CD1 LEU A 55 -5.773 -0.054 -1.006 1.00 0.00 C ATOM 829 CD2 LEU A 55 -5.441 -1.184 1.242 1.00 0.00 C ATOM 0 H LEU A 55 -4.211 3.618 0.928 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.766 2.488 1.041 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.451 1.668 0.152 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.322 0.943 1.742 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.903 0.280 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.368 -0.912 -1.321 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.157 0.848 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.734 -0.206 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.043 -2.019 0.883 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.388 -1.386 1.048 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.595 -1.060 2.314 1.00 0.00 H new ATOM 841 N ALA A 56 -5.264 2.724 3.918 1.00 0.00 N ATOM 842 CA ALA A 56 -5.463 2.613 5.354 1.00 0.00 C ATOM 843 C ALA A 56 -6.539 3.608 5.794 1.00 0.00 C ATOM 844 O ALA A 56 -7.041 3.531 6.913 1.00 0.00 O ATOM 845 CB ALA A 56 -4.131 2.840 6.073 1.00 0.00 C ATOM 0 H ALA A 56 -4.388 3.168 3.641 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.810 1.614 5.617 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.280 2.757 7.150 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.409 2.091 5.748 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.754 3.834 5.835 1.00 0.00 H new ATOM 851 N THR A 57 -6.862 4.520 4.888 1.00 0.00 N ATOM 852 CA THR A 57 -7.869 5.529 5.168 1.00 0.00 C ATOM 853 C THR A 57 -8.744 5.096 6.346 1.00 0.00 C ATOM 854 O THR A 57 -8.819 5.794 7.357 1.00 0.00 O ATOM 855 CB THR A 57 -8.660 5.777 3.882 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.879 6.361 4.332 1.00 0.00 O ATOM 857 CG2 THR A 57 -9.097 4.479 3.203 1.00 0.00 C ATOM 0 H THR A 57 -6.444 4.581 3.960 1.00 0.00 H new ATOM 0 HA THR A 57 -7.412 6.471 5.472 1.00 0.00 H new ATOM 0 HB THR A 57 -8.053 6.361 3.190 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.452 6.556 3.562 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.654 4.713 2.296 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.217 3.888 2.947 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.731 3.909 3.882 1.00 0.00 H new ATOM 865 N LYS A 58 -9.383 3.950 6.176 1.00 0.00 N ATOM 866 CA LYS A 58 -10.251 3.415 7.213 1.00 0.00 C ATOM 867 C LYS A 58 -9.619 2.151 7.799 1.00 0.00 C ATOM 868 O LYS A 58 -9.685 1.081 7.194 1.00 0.00 O ATOM 869 CB LYS A 58 -11.665 3.200 6.670 1.00 0.00 C ATOM 870 CG LYS A 58 -12.406 4.532 6.530 1.00 0.00 C ATOM 871 CD LYS A 58 -13.323 4.778 7.730 1.00 0.00 C ATOM 872 CE LYS A 58 -14.579 5.547 7.313 1.00 0.00 C ATOM 873 NZ LYS A 58 -15.010 6.460 8.395 1.00 0.00 N ATOM 0 H LYS A 58 -9.318 3.375 5.336 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.353 4.129 8.030 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.615 2.704 5.701 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.219 2.540 7.338 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.686 5.346 6.445 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.994 4.530 5.612 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -13.607 3.825 8.176 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.785 5.340 8.494 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -14.379 6.117 6.406 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -15.381 4.847 7.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.863 6.974 8.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.220 5.909 9.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -14.250 7.140 8.599 1.00 0.00 H new ATOM 887 N LEU A 59 -9.022 2.315 8.970 1.00 0.00 N ATOM 888 CA LEU A 59 -8.379 1.201 9.645 1.00 0.00 C ATOM 889 C LEU A 59 -9.450 0.250 10.184 1.00 0.00 C ATOM 890 O LEU A 59 -9.167 -0.912 10.468 1.00 0.00 O ATOM 891 CB LEU A 59 -7.411 1.709 10.716 1.00 0.00 C ATOM 892 CG LEU A 59 -5.922 1.554 10.403 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.620 1.963 8.960 1.00 0.00 C ATOM 894 CD2 LEU A 59 -5.066 2.329 11.407 1.00 0.00 C ATOM 0 H LEU A 59 -8.970 3.203 9.469 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.770 0.631 8.944 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.617 2.765 10.892 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.623 1.184 11.647 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.661 0.500 10.502 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.555 1.843 8.763 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -6.188 1.332 8.276 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.902 3.005 8.811 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.012 2.202 11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.323 3.387 11.364 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.252 1.951 12.412 1.00 0.00 H new ATOM 906 N ASP A 60 -10.657 0.781 10.310 1.00 0.00 N ATOM 907 CA ASP A 60 -11.772 -0.006 10.810 1.00 0.00 C ATOM 908 C ASP A 60 -12.079 -1.133 9.822 1.00 0.00 C ATOM 909 O ASP A 60 -12.463 -2.230 10.226 1.00 0.00 O ATOM 910 CB ASP A 60 -13.030 0.852 10.956 1.00 0.00 C ATOM 911 CG ASP A 60 -13.594 0.938 12.375 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.784 1.189 13.293 1.00 0.00 O ATOM 913 OD2 ASP A 60 -14.823 0.749 12.510 1.00 0.00 O ATOM 0 H ASP A 60 -10.888 1.746 10.075 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.493 -0.405 11.785 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.806 1.861 10.609 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.802 0.453 10.298 1.00 0.00 H new ATOM 918 N VAL A 61 -11.898 -0.824 8.547 1.00 0.00 N ATOM 919 CA VAL A 61 -12.152 -1.797 7.498 1.00 0.00 C ATOM 920 C VAL A 61 -10.916 -2.682 7.319 1.00 0.00 C ATOM 921 O VAL A 61 -11.037 -3.881 7.080 1.00 0.00 O ATOM 922 CB VAL A 61 -12.568 -1.083 6.210 1.00 0.00 C ATOM 923 CG1 VAL A 61 -13.893 -0.340 6.398 1.00 0.00 C ATOM 924 CG2 VAL A 61 -11.469 -0.131 5.732 1.00 0.00 C ATOM 0 H VAL A 61 -11.578 0.086 8.216 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.981 -2.448 7.774 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.715 -1.840 5.440 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -14.166 0.159 5.468 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.673 -1.051 6.671 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.785 0.402 7.189 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -11.790 0.364 4.815 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.277 0.618 6.500 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -10.557 -0.696 5.540 1.00 0.00 H new ATOM 934 N VAL A 62 -9.756 -2.053 7.441 1.00 0.00 N ATOM 935 CA VAL A 62 -8.499 -2.766 7.295 1.00 0.00 C ATOM 936 C VAL A 62 -8.308 -3.703 8.490 1.00 0.00 C ATOM 937 O VAL A 62 -7.899 -4.852 8.326 1.00 0.00 O ATOM 938 CB VAL A 62 -7.349 -1.772 7.125 1.00 0.00 C ATOM 939 CG1 VAL A 62 -6.103 -2.239 7.881 1.00 0.00 C ATOM 940 CG2 VAL A 62 -7.037 -1.543 5.644 1.00 0.00 C ATOM 0 H VAL A 62 -9.661 -1.057 7.639 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.512 -3.383 6.396 1.00 0.00 H new ATOM 0 HB VAL A 62 -7.663 -0.820 7.553 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.301 -1.514 7.743 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.333 -2.328 8.943 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.786 -3.208 7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -6.216 -0.832 5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -6.753 -2.488 5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.920 -1.145 5.144 1.00 0.00 H new ATOM 950 N ASP A 63 -8.614 -3.178 9.667 1.00 0.00 N ATOM 951 CA ASP A 63 -8.480 -3.952 10.890 1.00 0.00 C ATOM 952 C ASP A 63 -9.766 -3.823 11.712 1.00 0.00 C ATOM 953 O ASP A 63 -10.019 -2.781 12.314 1.00 0.00 O ATOM 954 CB ASP A 63 -7.320 -3.439 11.744 1.00 0.00 C ATOM 955 CG ASP A 63 -7.232 -1.916 11.867 1.00 0.00 C ATOM 956 OD1 ASP A 63 -6.835 -1.288 10.862 1.00 0.00 O ATOM 957 OD2 ASP A 63 -7.563 -1.415 12.963 1.00 0.00 O ATOM 0 H ASP A 63 -8.954 -2.226 9.800 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.291 -4.989 10.614 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.408 -3.865 12.744 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.386 -3.809 11.321 1.00 0.00 H new ATOM 962 N PRO A 64 -10.561 -4.925 11.710 1.00 0.00 N ATOM 963 CA PRO A 64 -11.813 -4.946 12.448 1.00 0.00 C ATOM 964 C PRO A 64 -11.561 -5.087 13.950 1.00 0.00 C ATOM 965 O PRO A 64 -12.210 -4.424 14.757 1.00 0.00 O ATOM 966 CB PRO A 64 -12.595 -6.111 11.864 1.00 0.00 C ATOM 967 CG PRO A 64 -11.574 -6.981 11.149 1.00 0.00 C ATOM 968 CD PRO A 64 -10.292 -6.176 11.007 1.00 0.00 C ATOM 0 HA PRO A 64 -12.376 -4.018 12.349 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -13.105 -6.671 12.648 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.361 -5.760 11.173 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -11.390 -7.895 11.713 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.947 -7.280 10.170 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -9.444 -6.702 11.445 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -10.050 -5.998 9.959 1.00 0.00 H new ATOM 976 N ASP A 65 -10.618 -5.959 14.280 1.00 0.00 N ATOM 977 CA ASP A 65 -10.273 -6.196 15.672 1.00 0.00 C ATOM 978 C ASP A 65 -8.876 -5.638 15.948 1.00 0.00 C ATOM 979 O ASP A 65 -8.349 -5.791 17.049 1.00 0.00 O ATOM 980 CB ASP A 65 -10.254 -7.693 15.986 1.00 0.00 C ATOM 981 CG ASP A 65 -11.364 -8.171 16.926 1.00 0.00 C ATOM 982 OD1 ASP A 65 -11.943 -7.299 17.608 1.00 0.00 O ATOM 983 OD2 ASP A 65 -11.607 -9.396 16.940 1.00 0.00 O ATOM 0 H ASP A 65 -10.083 -6.509 13.608 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.022 -5.706 16.294 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.328 -8.246 15.050 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.290 -7.944 16.429 1.00 0.00 H new ATOM 988 N GLY A 66 -8.315 -5.002 14.930 1.00 0.00 N ATOM 989 CA GLY A 66 -6.988 -4.420 15.050 1.00 0.00 C ATOM 990 C GLY A 66 -5.930 -5.338 14.434 1.00 0.00 C ATOM 991 O GLY A 66 -4.868 -5.546 15.020 1.00 0.00 O ATOM 0 H GLY A 66 -8.755 -4.877 14.018 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.966 -3.450 14.554 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.757 -4.246 16.101 1.00 0.00 H new ATOM 995 N ASN A 67 -6.256 -5.861 13.262 1.00 0.00 N ATOM 996 CA ASN A 67 -5.346 -6.751 12.560 1.00 0.00 C ATOM 997 C ASN A 67 -3.965 -6.098 12.478 1.00 0.00 C ATOM 998 O ASN A 67 -2.946 -6.777 12.588 1.00 0.00 O ATOM 999 CB ASN A 67 -5.829 -7.020 11.135 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.852 -7.931 10.387 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -5.078 -9.117 10.214 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -3.757 -7.313 9.958 1.00 0.00 N ATOM 0 H ASN A 67 -7.138 -5.686 12.780 1.00 0.00 H new ATOM 0 HA ASN A 67 -5.303 -7.692 13.108 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.815 -7.484 11.163 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.935 -6.077 10.599 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -3.043 -7.835 9.450 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -3.630 -6.317 10.137 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.976 -4.787 12.281 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.736 -4.035 12.181 1.00 0.00 C ATOM 1011 C LEU A 68 -3.057 -2.544 12.070 1.00 0.00 C ATOM 1012 O LEU A 68 -4.216 -2.145 12.177 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.878 -4.566 11.031 1.00 0.00 C ATOM 1014 CG LEU A 68 -2.151 -3.957 9.654 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.489 -3.216 9.638 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.992 -3.059 9.213 1.00 0.00 C ATOM 0 H LEU A 68 -4.823 -4.227 12.188 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.137 -4.167 13.082 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.830 -4.399 11.279 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.022 -5.644 10.964 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.224 -4.768 8.929 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.659 -2.793 8.648 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.293 -3.912 9.878 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.470 -2.415 10.377 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.211 -2.638 8.231 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.863 -2.251 9.933 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.076 -3.647 9.160 1.00 0.00 H new ATOM 1028 N HIS A 69 -2.011 -1.760 11.856 1.00 0.00 N ATOM 1029 CA HIS A 69 -2.168 -0.320 11.730 1.00 0.00 C ATOM 1030 C HIS A 69 -1.139 0.222 10.735 1.00 0.00 C ATOM 1031 O HIS A 69 0.065 0.135 10.972 1.00 0.00 O ATOM 1032 CB HIS A 69 -2.082 0.358 13.098 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.280 0.108 13.983 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.197 0.063 15.365 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -4.589 -0.110 13.671 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.407 -0.172 15.849 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -5.268 -0.279 14.799 1.00 0.00 N ATOM 0 H HIS A 69 -1.051 -2.094 11.767 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.159 -0.092 11.338 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -1.186 0.008 13.610 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -1.968 1.432 12.953 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -5.004 -0.140 12.674 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -4.666 -0.263 16.894 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -6.270 -0.459 14.868 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.652 0.769 9.643 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.794 1.325 8.611 1.00 0.00 C ATOM 1048 C HIS A 70 0.356 2.097 9.261 1.00 0.00 C ATOM 1049 O HIS A 70 0.157 2.792 10.256 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.604 2.179 7.632 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.834 3.596 8.101 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.766 4.687 7.250 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -2.135 4.089 9.337 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -2.014 5.781 7.955 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -2.241 5.409 9.247 1.00 0.00 N ATOM 0 H HIS A 70 -2.651 0.839 9.450 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.357 0.518 8.023 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -1.087 2.204 6.673 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.569 1.702 7.462 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -2.265 3.505 10.236 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -2.033 6.791 7.573 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -2.457 6.041 10.018 1.00 0.00 H new ATOM 1064 N GLY A 71 1.534 1.949 8.671 1.00 0.00 N ATOM 1065 CA GLY A 71 2.715 2.623 9.180 1.00 0.00 C ATOM 1066 C GLY A 71 3.313 1.864 10.366 1.00 0.00 C ATOM 1067 O GLY A 71 4.523 1.665 10.435 1.00 0.00 O ATOM 0 H GLY A 71 1.695 1.372 7.845 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.458 2.710 8.387 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.456 3.637 9.486 1.00 0.00 H new ATOM 1071 N ASN A 72 2.433 1.460 11.272 1.00 0.00 N ATOM 1072 CA ASN A 72 2.859 0.726 12.452 1.00 0.00 C ATOM 1073 C ASN A 72 2.040 -0.562 12.568 1.00 0.00 C ATOM 1074 O ASN A 72 1.072 -0.620 13.325 1.00 0.00 O ATOM 1075 CB ASN A 72 2.631 1.548 13.723 1.00 0.00 C ATOM 1076 CG ASN A 72 3.027 0.752 14.968 1.00 0.00 C ATOM 1077 OD1 ASN A 72 2.291 -0.089 15.458 1.00 0.00 O ATOM 1078 ND2 ASN A 72 4.227 1.061 15.450 1.00 0.00 N ATOM 0 H ASN A 72 1.429 1.627 11.212 1.00 0.00 H new ATOM 0 HA ASN A 72 3.922 0.508 12.349 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.213 2.468 13.675 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.582 1.837 13.790 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.582 0.584 16.279 1.00 0.00 H new ATOM 0 HD22 ASN A 72 4.792 1.775 14.991 1.00 0.00 H new ATOM 1085 N ALA A 73 2.459 -1.562 11.808 1.00 0.00 N ATOM 1086 CA ALA A 73 1.778 -2.845 11.818 1.00 0.00 C ATOM 1087 C ALA A 73 1.934 -3.492 13.195 1.00 0.00 C ATOM 1088 O ALA A 73 3.048 -3.622 13.701 1.00 0.00 O ATOM 1089 CB ALA A 73 2.330 -3.725 10.694 1.00 0.00 C ATOM 0 H ALA A 73 3.262 -1.510 11.181 1.00 0.00 H new ATOM 0 HA ALA A 73 0.711 -2.714 11.636 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.819 -4.688 10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.166 -3.235 9.734 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.398 -3.880 10.845 1.00 0.00 H new ATOM 1095 N LYS A 74 0.802 -3.880 13.763 1.00 0.00 N ATOM 1096 CA LYS A 74 0.799 -4.510 15.072 1.00 0.00 C ATOM 1097 C LYS A 74 1.617 -5.803 15.014 1.00 0.00 C ATOM 1098 O LYS A 74 2.036 -6.227 13.938 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.634 -4.712 15.567 1.00 0.00 C ATOM 1100 CG LYS A 74 -1.129 -3.482 16.330 1.00 0.00 C ATOM 1101 CD LYS A 74 -1.688 -3.872 17.700 1.00 0.00 C ATOM 1102 CE LYS A 74 -1.982 -2.632 18.546 1.00 0.00 C ATOM 1103 NZ LYS A 74 -0.734 -1.890 18.829 1.00 0.00 N ATOM 0 H LYS A 74 -0.120 -3.770 13.340 1.00 0.00 H new ATOM 0 HA LYS A 74 1.277 -3.862 15.806 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -1.291 -4.907 14.720 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.679 -5.588 16.214 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -0.310 -2.774 16.456 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -1.901 -2.976 15.749 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -2.601 -4.454 17.572 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.973 -4.510 18.220 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.686 -1.985 18.022 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -2.457 -2.927 19.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.861 -1.310 19.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.044 -2.564 18.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.506 -1.274 18.023 1.00 0.00 H new ATOM 1117 N ASP A 75 1.819 -6.391 16.184 1.00 0.00 N ATOM 1118 CA ASP A 75 2.580 -7.625 16.279 1.00 0.00 C ATOM 1119 C ASP A 75 1.766 -8.767 15.669 1.00 0.00 C ATOM 1120 O ASP A 75 2.206 -9.916 15.669 1.00 0.00 O ATOM 1121 CB ASP A 75 2.874 -7.980 17.738 1.00 0.00 C ATOM 1122 CG ASP A 75 4.008 -7.181 18.383 1.00 0.00 C ATOM 1123 OD1 ASP A 75 4.553 -6.302 17.680 1.00 0.00 O ATOM 1124 OD2 ASP A 75 4.305 -7.467 19.563 1.00 0.00 O ATOM 0 H ASP A 75 1.469 -6.036 17.074 1.00 0.00 H new ATOM 0 HA ASP A 75 3.520 -7.484 15.746 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.966 -7.830 18.322 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.119 -9.041 17.796 1.00 0.00 H new ATOM 1129 N PHE A 76 0.594 -8.413 15.164 1.00 0.00 N ATOM 1130 CA PHE A 76 -0.285 -9.395 14.552 1.00 0.00 C ATOM 1131 C PHE A 76 0.024 -9.554 13.061 1.00 0.00 C ATOM 1132 O PHE A 76 0.110 -10.673 12.558 1.00 0.00 O ATOM 1133 CB PHE A 76 -1.715 -8.876 14.711 1.00 0.00 C ATOM 1134 CG PHE A 76 -2.283 -9.040 16.122 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -1.749 -8.337 17.156 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -3.322 -9.890 16.341 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -2.278 -8.491 18.465 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -3.851 -10.044 17.650 1.00 0.00 C ATOM 1139 CZ PHE A 76 -3.317 -9.340 18.686 1.00 0.00 C ATOM 0 H PHE A 76 0.232 -7.459 15.166 1.00 0.00 H new ATOM 0 HA PHE A 76 -0.149 -10.365 15.030 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.740 -7.820 14.441 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.361 -9.400 14.007 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.924 -7.662 16.982 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.745 -10.448 15.519 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.854 -7.933 19.287 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.676 -10.719 17.824 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.718 -9.456 19.682 1.00 0.00 H new ATOM 1149 N ALA A 77 0.181 -8.418 12.397 1.00 0.00 N ATOM 1150 CA ALA A 77 0.479 -8.417 10.976 1.00 0.00 C ATOM 1151 C ALA A 77 1.847 -9.063 10.745 1.00 0.00 C ATOM 1152 O ALA A 77 1.956 -10.055 10.026 1.00 0.00 O ATOM 1153 CB ALA A 77 0.412 -6.986 10.441 1.00 0.00 C ATOM 0 H ALA A 77 0.107 -7.492 12.818 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.259 -9.004 10.429 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.636 -6.986 9.374 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.588 -6.584 10.602 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.141 -6.367 10.965 1.00 0.00 H new ATOM 1159 N MET A 78 2.857 -8.472 11.367 1.00 0.00 N ATOM 1160 CA MET A 78 4.213 -8.978 11.239 1.00 0.00 C ATOM 1161 C MET A 78 4.422 -10.215 12.112 1.00 0.00 C ATOM 1162 O MET A 78 5.463 -10.359 12.753 1.00 0.00 O ATOM 1163 CB MET A 78 5.205 -7.888 11.650 1.00 0.00 C ATOM 1164 CG MET A 78 4.915 -7.391 13.069 1.00 0.00 C ATOM 1165 SD MET A 78 6.069 -8.121 14.219 1.00 0.00 S ATOM 1166 CE MET A 78 4.967 -9.199 15.119 1.00 0.00 C ATOM 0 H MET A 78 2.763 -7.648 11.961 1.00 0.00 H new ATOM 0 HA MET A 78 4.379 -9.260 10.199 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.222 -8.278 11.598 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.147 -7.055 10.950 1.00 0.00 H new ATOM 0 HG2 MET A 78 4.991 -6.304 13.105 1.00 0.00 H new ATOM 0 HG3 MET A 78 3.894 -7.649 13.352 1.00 0.00 H new ATOM 0 HE1 MET A 78 4.860 -8.838 16.142 1.00 0.00 H new ATOM 0 HE2 MET A 78 3.991 -9.209 14.634 1.00 0.00 H new ATOM 0 HE3 MET A 78 5.376 -10.209 15.132 1.00 0.00 H new ATOM 1176 N LYS A 79 3.417 -11.079 12.110 1.00 0.00 N ATOM 1177 CA LYS A 79 3.477 -12.299 12.896 1.00 0.00 C ATOM 1178 C LYS A 79 2.601 -13.368 12.237 1.00 0.00 C ATOM 1179 O LYS A 79 3.056 -14.486 11.997 1.00 0.00 O ATOM 1180 CB LYS A 79 3.114 -12.018 14.354 1.00 0.00 C ATOM 1181 CG LYS A 79 3.342 -13.256 15.225 1.00 0.00 C ATOM 1182 CD LYS A 79 3.332 -12.889 16.711 1.00 0.00 C ATOM 1183 CE LYS A 79 4.559 -13.459 17.424 1.00 0.00 C ATOM 1184 NZ LYS A 79 4.473 -13.211 18.882 1.00 0.00 N ATOM 0 H LYS A 79 2.556 -10.958 11.576 1.00 0.00 H new ATOM 0 HA LYS A 79 4.495 -12.688 12.917 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.715 -11.190 14.729 1.00 0.00 H new ATOM 0 HB3 LYS A 79 2.070 -11.710 14.420 1.00 0.00 H new ATOM 0 HG2 LYS A 79 2.566 -13.995 15.024 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.296 -13.717 14.967 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.314 -11.805 16.821 1.00 0.00 H new ATOM 0 HD3 LYS A 79 2.425 -13.272 17.178 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.632 -14.530 17.235 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.464 -13.002 17.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.314 -13.604 19.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.426 -12.187 19.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.619 -13.667 19.262 1.00 0.00 H new ATOM 1198 N HIS A 80 1.363 -12.987 11.965 1.00 0.00 N ATOM 1199 CA HIS A 80 0.419 -13.897 11.341 1.00 0.00 C ATOM 1200 C HIS A 80 0.854 -14.179 9.902 1.00 0.00 C ATOM 1201 O HIS A 80 0.260 -15.015 9.222 1.00 0.00 O ATOM 1202 CB HIS A 80 -1.007 -13.350 11.433 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.365 -12.380 10.332 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.475 -11.440 9.842 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.523 -12.215 9.631 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.081 -10.745 8.890 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.351 -11.228 8.761 1.00 0.00 N ATOM 0 H HIS A 80 0.991 -12.059 12.166 1.00 0.00 H new ATOM 0 HA HIS A 80 0.416 -14.846 11.876 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.708 -14.185 11.410 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.134 -12.854 12.395 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.485 -11.305 10.160 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.427 -12.791 9.762 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -0.647 -9.939 8.317 1.00 0.00 H new ATOM 1216 N GLY A 81 1.888 -13.465 9.479 1.00 0.00 N ATOM 1217 CA GLY A 81 2.408 -13.628 8.132 1.00 0.00 C ATOM 1218 C GLY A 81 3.895 -13.271 8.074 1.00 0.00 C ATOM 1219 O GLY A 81 4.412 -12.921 7.014 1.00 0.00 O ATOM 0 H GLY A 81 2.379 -12.773 10.045 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.264 -14.658 7.804 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.850 -12.993 7.443 1.00 0.00 H new ATOM 1223 N ALA A 82 4.541 -13.372 9.227 1.00 0.00 N ATOM 1224 CA ALA A 82 5.959 -13.065 9.320 1.00 0.00 C ATOM 1225 C ALA A 82 6.674 -14.196 10.061 1.00 0.00 C ATOM 1226 O ALA A 82 6.201 -14.661 11.097 1.00 0.00 O ATOM 1227 CB ALA A 82 6.143 -11.710 10.006 1.00 0.00 C ATOM 0 H ALA A 82 4.109 -13.662 10.104 1.00 0.00 H new ATOM 0 HA ALA A 82 6.402 -12.991 8.327 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.206 -11.479 10.076 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.641 -10.937 9.424 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.713 -11.748 11.007 1.00 0.00 H new ATOM 1233 N ASP A 83 7.803 -14.605 9.501 1.00 0.00 N ATOM 1234 CA ASP A 83 8.588 -15.674 10.097 1.00 0.00 C ATOM 1235 C ASP A 83 9.399 -15.114 11.268 1.00 0.00 C ATOM 1236 O ASP A 83 9.809 -13.955 11.245 1.00 0.00 O ATOM 1237 CB ASP A 83 9.570 -16.267 9.084 1.00 0.00 C ATOM 1238 CG ASP A 83 9.073 -17.519 8.359 1.00 0.00 C ATOM 1239 OD1 ASP A 83 8.144 -18.156 8.899 1.00 0.00 O ATOM 1240 OD2 ASP A 83 9.636 -17.810 7.281 1.00 0.00 O ATOM 0 H ASP A 83 8.193 -14.216 8.642 1.00 0.00 H new ATOM 0 HA ASP A 83 7.900 -16.451 10.431 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.807 -15.505 8.341 1.00 0.00 H new ATOM 0 HB3 ASP A 83 10.499 -16.509 9.600 1.00 0.00 H new ATOM 1245 N GLU A 84 9.603 -15.963 12.263 1.00 0.00 N ATOM 1246 CA GLU A 84 10.357 -15.567 13.441 1.00 0.00 C ATOM 1247 C GLU A 84 11.580 -14.743 13.037 1.00 0.00 C ATOM 1248 O GLU A 84 12.013 -13.863 13.779 1.00 0.00 O ATOM 1249 CB GLU A 84 10.766 -16.789 14.266 1.00 0.00 C ATOM 1250 CG GLU A 84 10.348 -16.629 15.730 1.00 0.00 C ATOM 1251 CD GLU A 84 10.044 -17.986 16.365 1.00 0.00 C ATOM 1252 OE1 GLU A 84 9.363 -18.789 15.691 1.00 0.00 O ATOM 1253 OE2 GLU A 84 10.500 -18.191 17.511 1.00 0.00 O ATOM 0 H GLU A 84 9.260 -16.923 12.279 1.00 0.00 H new ATOM 0 HA GLU A 84 9.716 -14.945 14.066 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.305 -17.684 13.849 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.845 -16.928 14.206 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.143 -16.133 16.287 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.468 -15.989 15.793 1.00 0.00 H new ATOM 1260 N THR A 85 12.102 -15.057 11.861 1.00 0.00 N ATOM 1261 CA THR A 85 13.268 -14.357 11.348 1.00 0.00 C ATOM 1262 C THR A 85 12.938 -12.883 11.100 1.00 0.00 C ATOM 1263 O THR A 85 13.768 -12.008 11.342 1.00 0.00 O ATOM 1264 CB THR A 85 13.748 -15.092 10.095 1.00 0.00 C ATOM 1265 OG1 THR A 85 15.139 -14.793 10.030 1.00 0.00 O ATOM 1266 CG2 THR A 85 13.177 -14.490 8.809 1.00 0.00 C ATOM 0 H THR A 85 11.739 -15.787 11.248 1.00 0.00 H new ATOM 0 HA THR A 85 14.081 -14.358 12.074 1.00 0.00 H new ATOM 0 HB THR A 85 13.467 -16.143 10.160 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.532 -15.232 9.247 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.549 -15.048 7.950 1.00 0.00 H new ATOM 0 HG22 THR A 85 12.089 -14.544 8.834 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.486 -13.448 8.726 1.00 0.00 H new ATOM 1274 N MET A 86 11.725 -12.654 10.621 1.00 0.00 N ATOM 1275 CA MET A 86 11.274 -11.302 10.338 1.00 0.00 C ATOM 1276 C MET A 86 11.467 -10.393 11.554 1.00 0.00 C ATOM 1277 O MET A 86 11.670 -9.189 11.408 1.00 0.00 O ATOM 1278 CB MET A 86 9.795 -11.326 9.949 1.00 0.00 C ATOM 1279 CG MET A 86 8.911 -11.583 11.171 1.00 0.00 C ATOM 1280 SD MET A 86 8.084 -10.076 11.654 1.00 0.00 S ATOM 1281 CE MET A 86 8.264 -10.178 13.427 1.00 0.00 C ATOM 0 H MET A 86 11.040 -13.382 10.421 1.00 0.00 H new ATOM 0 HA MET A 86 11.869 -10.907 9.514 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.520 -10.376 9.490 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.624 -12.102 9.202 1.00 0.00 H new ATOM 0 HG2 MET A 86 8.175 -12.354 10.942 1.00 0.00 H new ATOM 0 HG3 MET A 86 9.517 -11.956 11.997 1.00 0.00 H new ATOM 0 HE1 MET A 86 7.315 -10.477 13.872 1.00 0.00 H new ATOM 0 HE2 MET A 86 9.028 -10.915 13.673 1.00 0.00 H new ATOM 0 HE3 MET A 86 8.559 -9.205 13.819 1.00 0.00 H new ATOM 1291 N ALA A 87 11.400 -11.006 12.726 1.00 0.00 N ATOM 1292 CA ALA A 87 11.565 -10.268 13.968 1.00 0.00 C ATOM 1293 C ALA A 87 12.869 -9.469 13.910 1.00 0.00 C ATOM 1294 O ALA A 87 12.876 -8.266 14.162 1.00 0.00 O ATOM 1295 CB ALA A 87 11.527 -11.240 15.148 1.00 0.00 C ATOM 0 H ALA A 87 11.234 -12.006 12.843 1.00 0.00 H new ATOM 0 HA ALA A 87 10.749 -9.558 14.106 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.651 -10.687 16.079 1.00 0.00 H new ATOM 0 HB2 ALA A 87 10.570 -11.761 15.160 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.334 -11.966 15.047 1.00 0.00 H new ATOM 1301 N GLN A 88 13.942 -10.173 13.578 1.00 0.00 N ATOM 1302 CA GLN A 88 15.250 -9.544 13.486 1.00 0.00 C ATOM 1303 C GLN A 88 15.531 -9.115 12.044 1.00 0.00 C ATOM 1304 O GLN A 88 15.993 -8.002 11.804 1.00 0.00 O ATOM 1305 CB GLN A 88 16.344 -10.479 14.003 1.00 0.00 C ATOM 1306 CG GLN A 88 17.734 -9.921 13.691 1.00 0.00 C ATOM 1307 CD GLN A 88 18.521 -10.879 12.793 1.00 0.00 C ATOM 1308 OE1 GLN A 88 19.423 -11.576 13.226 1.00 0.00 O ATOM 1309 NE2 GLN A 88 18.129 -10.873 11.523 1.00 0.00 N ATOM 0 H GLN A 88 13.933 -11.171 13.370 1.00 0.00 H new ATOM 0 HA GLN A 88 15.250 -8.654 14.116 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.235 -10.612 15.079 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.232 -11.463 13.547 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.639 -8.952 13.200 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.280 -9.756 14.620 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.366 -10.264 11.228 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.591 -11.477 10.844 1.00 0.00 H new ATOM 1318 N GLN A 89 15.239 -10.022 11.124 1.00 0.00 N ATOM 1319 CA GLN A 89 15.455 -9.752 9.712 1.00 0.00 C ATOM 1320 C GLN A 89 14.951 -8.352 9.357 1.00 0.00 C ATOM 1321 O GLN A 89 15.731 -7.488 8.960 1.00 0.00 O ATOM 1322 CB GLN A 89 14.784 -10.815 8.841 1.00 0.00 C ATOM 1323 CG GLN A 89 15.728 -11.992 8.588 1.00 0.00 C ATOM 1324 CD GLN A 89 15.631 -12.471 7.138 1.00 0.00 C ATOM 1325 OE1 GLN A 89 14.624 -13.005 6.699 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.728 -12.249 6.420 1.00 0.00 N ATOM 0 H GLN A 89 14.855 -10.945 11.328 1.00 0.00 H new ATOM 0 HA GLN A 89 16.526 -9.792 9.514 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.876 -11.170 9.329 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.483 -10.375 7.890 1.00 0.00 H new ATOM 0 HG2 GLN A 89 16.753 -11.694 8.809 1.00 0.00 H new ATOM 0 HG3 GLN A 89 15.482 -12.812 9.263 1.00 0.00 H new ATOM 0 HE21 GLN A 89 17.536 -11.797 6.849 1.00 0.00 H new ATOM 0 HE22 GLN A 89 16.762 -12.530 5.440 1.00 0.00 H new ATOM 1335 N LEU A 90 13.647 -8.171 9.512 1.00 0.00 N ATOM 1336 CA LEU A 90 13.028 -6.891 9.212 1.00 0.00 C ATOM 1337 C LEU A 90 13.831 -5.774 9.880 1.00 0.00 C ATOM 1338 O LEU A 90 14.101 -4.745 9.263 1.00 0.00 O ATOM 1339 CB LEU A 90 11.550 -6.906 9.605 1.00 0.00 C ATOM 1340 CG LEU A 90 10.678 -7.941 8.894 1.00 0.00 C ATOM 1341 CD1 LEU A 90 9.194 -7.696 9.175 1.00 0.00 C ATOM 1342 CD2 LEU A 90 10.978 -7.975 7.394 1.00 0.00 C ATOM 0 H LEU A 90 13.002 -8.890 9.841 1.00 0.00 H new ATOM 0 HA LEU A 90 13.046 -6.700 8.139 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.482 -7.079 10.679 1.00 0.00 H new ATOM 0 HB3 LEU A 90 11.134 -5.917 9.414 1.00 0.00 H new ATOM 0 HG LEU A 90 10.924 -8.925 9.294 1.00 0.00 H new ATOM 0 HD11 LEU A 90 8.597 -8.447 8.657 1.00 0.00 H new ATOM 0 HD12 LEU A 90 9.011 -7.763 10.247 1.00 0.00 H new ATOM 0 HD13 LEU A 90 8.916 -6.703 8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.344 -8.720 6.913 1.00 0.00 H new ATOM 0 HD22 LEU A 90 10.779 -6.995 6.961 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.025 -8.235 7.238 1.00 0.00 H new ATOM 1354 N VAL A 91 14.188 -6.012 11.133 1.00 0.00 N ATOM 1355 CA VAL A 91 14.954 -5.038 11.892 1.00 0.00 C ATOM 1356 C VAL A 91 16.231 -4.690 11.126 1.00 0.00 C ATOM 1357 O VAL A 91 16.845 -3.653 11.369 1.00 0.00 O ATOM 1358 CB VAL A 91 15.228 -5.569 13.300 1.00 0.00 C ATOM 1359 CG1 VAL A 91 16.703 -5.406 13.670 1.00 0.00 C ATOM 1360 CG2 VAL A 91 14.325 -4.883 14.330 1.00 0.00 C ATOM 0 H VAL A 91 13.961 -6.866 11.642 1.00 0.00 H new ATOM 0 HA VAL A 91 14.385 -4.116 12.012 1.00 0.00 H new ATOM 0 HB VAL A 91 14.997 -6.634 13.307 1.00 0.00 H new ATOM 0 HG11 VAL A 91 16.871 -5.791 14.676 1.00 0.00 H new ATOM 0 HG12 VAL A 91 17.319 -5.960 12.962 1.00 0.00 H new ATOM 0 HG13 VAL A 91 16.972 -4.350 13.637 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.540 -5.278 15.323 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.511 -3.809 14.319 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.281 -5.073 14.082 1.00 0.00 H new ATOM 1370 N ASP A 92 16.596 -5.581 10.215 1.00 0.00 N ATOM 1371 CA ASP A 92 17.791 -5.382 9.410 1.00 0.00 C ATOM 1372 C ASP A 92 17.541 -4.259 8.402 1.00 0.00 C ATOM 1373 O ASP A 92 18.118 -3.178 8.515 1.00 0.00 O ATOM 1374 CB ASP A 92 18.145 -6.648 8.628 1.00 0.00 C ATOM 1375 CG ASP A 92 18.240 -7.923 9.470 1.00 0.00 C ATOM 1376 OD1 ASP A 92 18.115 -7.796 10.707 1.00 0.00 O ATOM 1377 OD2 ASP A 92 18.435 -8.994 8.856 1.00 0.00 O ATOM 0 H ASP A 92 16.086 -6.442 10.016 1.00 0.00 H new ATOM 0 HA ASP A 92 18.612 -5.131 10.082 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.395 -6.799 7.851 1.00 0.00 H new ATOM 0 HB3 ASP A 92 19.099 -6.491 8.124 1.00 0.00 H new ATOM 1382 N ILE A 93 16.681 -4.552 7.438 1.00 0.00 N ATOM 1383 CA ILE A 93 16.346 -3.581 6.411 1.00 0.00 C ATOM 1384 C ILE A 93 15.639 -2.385 7.055 1.00 0.00 C ATOM 1385 O ILE A 93 15.974 -1.236 6.773 1.00 0.00 O ATOM 1386 CB ILE A 93 15.542 -4.241 5.290 1.00 0.00 C ATOM 1387 CG1 ILE A 93 14.037 -4.117 5.548 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.971 -5.696 5.090 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.572 -5.151 6.575 1.00 0.00 C ATOM 0 H ILE A 93 16.205 -5.450 7.347 1.00 0.00 H new ATOM 0 HA ILE A 93 17.251 -3.199 5.939 1.00 0.00 H new ATOM 0 HB ILE A 93 15.755 -3.712 4.361 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.807 -3.114 5.906 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.491 -4.255 4.615 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.384 -6.141 4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 93 17.029 -5.731 4.828 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.807 -6.254 6.012 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.500 -5.042 6.741 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.782 -6.154 6.202 1.00 0.00 H new ATOM 0 HD13 ILE A 93 14.102 -4.995 7.514 1.00 0.00 H new ATOM 1401 N ILE A 94 14.674 -2.700 7.907 1.00 0.00 N ATOM 1402 CA ILE A 94 13.917 -1.667 8.593 1.00 0.00 C ATOM 1403 C ILE A 94 14.884 -0.715 9.299 1.00 0.00 C ATOM 1404 O ILE A 94 14.559 0.448 9.529 1.00 0.00 O ATOM 1405 CB ILE A 94 12.880 -2.294 9.527 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.874 -3.139 8.742 1.00 0.00 C ATOM 1407 CG2 ILE A 94 12.191 -1.225 10.377 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.437 -2.737 9.081 1.00 0.00 C ATOM 0 H ILE A 94 14.399 -3.655 8.137 1.00 0.00 H new ATOM 0 HA ILE A 94 13.350 -1.072 7.877 1.00 0.00 H new ATOM 0 HB ILE A 94 13.399 -2.965 10.212 1.00 0.00 H new ATOM 0 HG12 ILE A 94 12.047 -3.017 7.673 1.00 0.00 H new ATOM 0 HG13 ILE A 94 12.024 -4.194 8.970 1.00 0.00 H new ATOM 0 HG21 ILE A 94 11.459 -1.697 11.032 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.935 -0.704 10.980 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.688 -0.511 9.725 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.742 -3.353 8.510 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.260 -2.884 10.146 1.00 0.00 H new ATOM 0 HD13 ILE A 94 10.284 -1.688 8.829 1.00 0.00 H new ATOM 1420 N HIS A 95 16.054 -1.246 9.623 1.00 0.00 N ATOM 1421 CA HIS A 95 17.072 -0.458 10.298 1.00 0.00 C ATOM 1422 C HIS A 95 17.742 0.484 9.296 1.00 0.00 C ATOM 1423 O HIS A 95 18.173 1.577 9.658 1.00 0.00 O ATOM 1424 CB HIS A 95 18.072 -1.365 11.019 1.00 0.00 C ATOM 1425 CG HIS A 95 17.793 -1.537 12.493 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.797 -1.605 13.443 1.00 0.00 N ATOM 1427 CD2 HIS A 95 16.614 -1.655 13.169 1.00 0.00 C ATOM 1428 CE1 HIS A 95 18.236 -1.757 14.634 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.883 -1.789 14.462 1.00 0.00 N ATOM 0 H HIS A 95 16.320 -2.212 9.431 1.00 0.00 H new ATOM 0 HA HIS A 95 16.608 0.158 11.068 1.00 0.00 H new ATOM 0 HB2 HIS A 95 18.067 -2.345 10.542 1.00 0.00 H new ATOM 0 HB3 HIS A 95 19.074 -0.955 10.895 1.00 0.00 H new ATOM 0 HD2 HIS A 95 15.629 -1.642 12.727 1.00 0.00 H new ATOM 0 HE1 HIS A 95 18.758 -1.841 15.576 1.00 0.00 H new ATOM 0 HE2 HIS A 95 16.192 -1.898 15.204 1.00 0.00 H new ATOM 1438 N GLY A 96 17.806 0.026 8.055 1.00 0.00 N ATOM 1439 CA GLY A 96 18.416 0.814 6.997 1.00 0.00 C ATOM 1440 C GLY A 96 17.389 1.742 6.343 1.00 0.00 C ATOM 1441 O GLY A 96 17.752 2.761 5.759 1.00 0.00 O ATOM 0 H GLY A 96 17.446 -0.881 7.758 1.00 0.00 H new ATOM 0 HA2 GLY A 96 19.237 1.404 7.405 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.843 0.151 6.245 1.00 0.00 H new ATOM 1445 N CYS A 97 16.127 1.355 6.463 1.00 0.00 N ATOM 1446 CA CYS A 97 15.047 2.139 5.893 1.00 0.00 C ATOM 1447 C CYS A 97 14.586 3.155 6.939 1.00 0.00 C ATOM 1448 O CYS A 97 14.685 4.362 6.722 1.00 0.00 O ATOM 1449 CB CYS A 97 13.896 1.250 5.414 1.00 0.00 C ATOM 1450 SG CYS A 97 13.822 0.999 3.603 1.00 0.00 S ATOM 0 H CYS A 97 15.830 0.508 6.947 1.00 0.00 H new ATOM 0 HA CYS A 97 15.404 2.667 5.009 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.981 0.277 5.898 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.955 1.689 5.744 1.00 0.00 H new ATOM 1455 N GLU A 98 14.093 2.631 8.051 1.00 0.00 N ATOM 1456 CA GLU A 98 13.617 3.479 9.131 1.00 0.00 C ATOM 1457 C GLU A 98 14.613 4.609 9.396 1.00 0.00 C ATOM 1458 O GLU A 98 14.216 5.727 9.721 1.00 0.00 O ATOM 1459 CB GLU A 98 13.365 2.661 10.399 1.00 0.00 C ATOM 1460 CG GLU A 98 12.473 3.427 11.378 1.00 0.00 C ATOM 1461 CD GLU A 98 13.132 3.528 12.755 1.00 0.00 C ATOM 1462 OE1 GLU A 98 14.316 3.928 12.791 1.00 0.00 O ATOM 1463 OE2 GLU A 98 12.436 3.203 13.742 1.00 0.00 O ATOM 0 H GLU A 98 14.013 1.630 8.228 1.00 0.00 H new ATOM 0 HA GLU A 98 12.668 3.921 8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.894 1.714 10.137 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.315 2.423 10.877 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.276 4.427 10.991 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.510 2.925 11.468 1.00 0.00 H new ATOM 1470 N LYS A 99 15.888 4.280 9.247 1.00 0.00 N ATOM 1471 CA LYS A 99 16.943 5.253 9.468 1.00 0.00 C ATOM 1472 C LYS A 99 16.948 6.262 8.317 1.00 0.00 C ATOM 1473 O LYS A 99 17.305 7.424 8.507 1.00 0.00 O ATOM 1474 CB LYS A 99 18.286 4.551 9.675 1.00 0.00 C ATOM 1475 CG LYS A 99 18.895 4.125 8.337 1.00 0.00 C ATOM 1476 CD LYS A 99 20.193 4.886 8.059 1.00 0.00 C ATOM 1477 CE LYS A 99 20.263 5.334 6.598 1.00 0.00 C ATOM 1478 NZ LYS A 99 21.225 6.448 6.444 1.00 0.00 N ATOM 0 H LYS A 99 16.214 3.352 8.976 1.00 0.00 H new ATOM 0 HA LYS A 99 16.758 5.813 10.385 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.973 5.219 10.195 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.149 3.676 10.311 1.00 0.00 H new ATOM 0 HG2 LYS A 99 19.093 3.053 8.348 1.00 0.00 H new ATOM 0 HG3 LYS A 99 18.182 4.309 7.534 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.256 5.756 8.713 1.00 0.00 H new ATOM 0 HD3 LYS A 99 21.048 4.251 8.290 1.00 0.00 H new ATOM 0 HE2 LYS A 99 20.563 4.496 5.968 1.00 0.00 H new ATOM 0 HE3 LYS A 99 19.276 5.649 6.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 21.261 6.740 5.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 20.922 7.252 7.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.169 6.135 6.747 1.00 0.00 H new ATOM 1492 N SER A 100 16.547 5.781 7.150 1.00 0.00 N ATOM 1493 CA SER A 100 16.502 6.627 5.968 1.00 0.00 C ATOM 1494 C SER A 100 15.088 7.180 5.776 1.00 0.00 C ATOM 1495 O SER A 100 14.860 8.022 4.909 1.00 0.00 O ATOM 1496 CB SER A 100 16.945 5.856 4.723 1.00 0.00 C ATOM 1497 OG SER A 100 18.045 6.486 4.070 1.00 0.00 O ATOM 0 H SER A 100 16.250 4.817 6.997 1.00 0.00 H new ATOM 0 HA SER A 100 17.194 7.457 6.113 1.00 0.00 H new ATOM 0 HB2 SER A 100 17.224 4.841 5.005 1.00 0.00 H new ATOM 0 HB3 SER A 100 16.108 5.776 4.029 1.00 0.00 H new ATOM 0 HG SER A 100 18.300 5.963 3.281 1.00 0.00 H new ATOM 1503 N ALA A 101 14.175 6.683 6.598 1.00 0.00 N ATOM 1504 CA ALA A 101 12.790 7.117 6.529 1.00 0.00 C ATOM 1505 C ALA A 101 12.420 7.832 7.829 1.00 0.00 C ATOM 1506 O ALA A 101 11.859 7.225 8.739 1.00 0.00 O ATOM 1507 CB ALA A 101 11.891 5.911 6.250 1.00 0.00 C ATOM 0 H ALA A 101 14.368 5.984 7.315 1.00 0.00 H new ATOM 0 HA ALA A 101 12.649 7.825 5.712 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.852 6.236 6.198 1.00 0.00 H new ATOM 0 HB2 ALA A 101 12.177 5.456 5.302 1.00 0.00 H new ATOM 0 HB3 ALA A 101 12.003 5.181 7.051 1.00 0.00 H new ATOM 1513 N PRO A 102 12.754 9.150 7.875 1.00 0.00 N ATOM 1514 CA PRO A 102 12.462 9.956 9.049 1.00 0.00 C ATOM 1515 C PRO A 102 10.972 10.297 9.123 1.00 0.00 C ATOM 1516 O PRO A 102 10.209 9.957 8.220 1.00 0.00 O ATOM 1517 CB PRO A 102 13.347 11.185 8.913 1.00 0.00 C ATOM 1518 CG PRO A 102 13.754 11.245 7.449 1.00 0.00 C ATOM 1519 CD PRO A 102 13.419 9.904 6.816 1.00 0.00 C ATOM 0 HA PRO A 102 12.672 9.432 9.982 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.810 12.087 9.207 1.00 0.00 H new ATOM 0 HB3 PRO A 102 14.222 11.110 9.559 1.00 0.00 H new ATOM 0 HG2 PRO A 102 13.226 12.050 6.939 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.820 11.455 7.357 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.769 10.026 5.949 1.00 0.00 H new ATOM 0 HD3 PRO A 102 14.318 9.393 6.471 1.00 0.00 H new ATOM 1527 N PRO A 103 10.594 10.984 10.234 1.00 0.00 N ATOM 1528 CA PRO A 103 9.211 11.374 10.438 1.00 0.00 C ATOM 1529 C PRO A 103 8.836 12.555 9.540 1.00 0.00 C ATOM 1530 O PRO A 103 8.238 13.526 10.002 1.00 0.00 O ATOM 1531 CB PRO A 103 9.106 11.698 11.919 1.00 0.00 C ATOM 1532 CG PRO A 103 10.532 11.926 12.396 1.00 0.00 C ATOM 1533 CD PRO A 103 11.472 11.403 11.323 1.00 0.00 C ATOM 0 HA PRO A 103 8.508 10.586 10.166 1.00 0.00 H new ATOM 0 HB2 PRO A 103 8.493 12.584 12.083 1.00 0.00 H new ATOM 0 HB3 PRO A 103 8.637 10.880 12.466 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.710 12.986 12.575 1.00 0.00 H new ATOM 0 HG3 PRO A 103 10.706 11.410 13.340 1.00 0.00 H new ATOM 0 HD2 PRO A 103 12.168 12.175 10.996 1.00 0.00 H new ATOM 0 HD3 PRO A 103 12.070 10.570 11.692 1.00 0.00 H new ATOM 1541 N ASN A 104 9.203 12.433 8.272 1.00 0.00 N ATOM 1542 CA ASN A 104 8.915 13.479 7.306 1.00 0.00 C ATOM 1543 C ASN A 104 7.399 13.622 7.153 1.00 0.00 C ATOM 1544 O ASN A 104 6.675 12.628 7.164 1.00 0.00 O ATOM 1545 CB ASN A 104 9.496 13.136 5.934 1.00 0.00 C ATOM 1546 CG ASN A 104 11.011 12.936 6.015 1.00 0.00 C ATOM 1547 OD1 ASN A 104 11.558 11.946 5.556 1.00 0.00 O ATOM 1548 ND2 ASN A 104 11.657 13.928 6.622 1.00 0.00 N ATOM 0 H ASN A 104 9.697 11.626 7.892 1.00 0.00 H new ATOM 0 HA ASN A 104 9.363 14.404 7.667 1.00 0.00 H new ATOM 0 HB2 ASN A 104 9.026 12.230 5.552 1.00 0.00 H new ATOM 0 HB3 ASN A 104 9.268 13.935 5.228 1.00 0.00 H new ATOM 0 HD21 ASN A 104 12.671 13.888 6.726 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.138 14.728 6.984 1.00 0.00 H new ATOM 1555 N ASP A 105 6.964 14.866 7.018 1.00 0.00 N ATOM 1556 CA ASP A 105 5.548 15.152 6.863 1.00 0.00 C ATOM 1557 C ASP A 105 5.004 14.378 5.662 1.00 0.00 C ATOM 1558 O ASP A 105 3.794 14.191 5.535 1.00 0.00 O ATOM 1559 CB ASP A 105 5.311 16.642 6.614 1.00 0.00 C ATOM 1560 CG ASP A 105 5.574 17.550 7.817 1.00 0.00 C ATOM 1561 OD1 ASP A 105 6.348 17.115 8.697 1.00 0.00 O ATOM 1562 OD2 ASP A 105 4.996 18.658 7.828 1.00 0.00 O ATOM 0 H ASP A 105 7.568 15.688 7.013 1.00 0.00 H new ATOM 0 HA ASP A 105 5.042 14.856 7.782 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.948 16.963 5.790 1.00 0.00 H new ATOM 0 HB3 ASP A 105 4.279 16.781 6.292 1.00 0.00 H new ATOM 1567 N ASP A 106 5.923 13.948 4.809 1.00 0.00 N ATOM 1568 CA ASP A 106 5.549 13.200 3.621 1.00 0.00 C ATOM 1569 C ASP A 106 5.321 11.735 3.998 1.00 0.00 C ATOM 1570 O ASP A 106 5.573 10.836 3.197 1.00 0.00 O ATOM 1571 CB ASP A 106 6.658 13.249 2.569 1.00 0.00 C ATOM 1572 CG ASP A 106 6.260 13.895 1.239 1.00 0.00 C ATOM 1573 OD1 ASP A 106 5.038 14.037 1.022 1.00 0.00 O ATOM 1574 OD2 ASP A 106 7.187 14.233 0.473 1.00 0.00 O ATOM 0 H ASP A 106 6.925 14.104 4.917 1.00 0.00 H new ATOM 0 HA ASP A 106 4.643 13.647 3.212 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.506 13.796 2.982 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.999 12.232 2.374 1.00 0.00 H new ATOM 1579 N LYS A 107 4.846 11.538 5.220 1.00 0.00 N ATOM 1580 CA LYS A 107 4.581 10.198 5.713 1.00 0.00 C ATOM 1581 C LYS A 107 3.930 9.370 4.604 1.00 0.00 C ATOM 1582 O LYS A 107 4.030 8.144 4.600 1.00 0.00 O ATOM 1583 CB LYS A 107 3.757 10.255 7.002 1.00 0.00 C ATOM 1584 CG LYS A 107 2.318 10.685 6.713 1.00 0.00 C ATOM 1585 CD LYS A 107 1.452 10.583 7.972 1.00 0.00 C ATOM 1586 CE LYS A 107 0.014 10.198 7.617 1.00 0.00 C ATOM 1587 NZ LYS A 107 -0.821 10.139 8.838 1.00 0.00 N ATOM 0 H LYS A 107 4.638 12.285 5.883 1.00 0.00 H new ATOM 0 HA LYS A 107 5.513 9.699 5.978 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.759 9.277 7.483 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.216 10.954 7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.308 11.710 6.343 1.00 0.00 H new ATOM 0 HG3 LYS A 107 1.898 10.058 5.927 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.874 9.841 8.650 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.457 11.537 8.500 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.402 10.925 6.919 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.003 9.231 7.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.794 9.877 8.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.432 9.429 9.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.825 11.070 9.301 1.00 0.00 H new ATOM 1601 N CYS A 108 3.279 10.073 3.690 1.00 0.00 N ATOM 1602 CA CYS A 108 2.612 9.417 2.577 1.00 0.00 C ATOM 1603 C CYS A 108 3.661 8.644 1.777 1.00 0.00 C ATOM 1604 O CYS A 108 3.487 7.457 1.503 1.00 0.00 O ATOM 1605 CB CYS A 108 1.853 10.419 1.704 1.00 0.00 C ATOM 1606 SG CYS A 108 0.741 9.665 0.461 1.00 0.00 S ATOM 0 H CYS A 108 3.199 11.090 3.696 1.00 0.00 H new ATOM 0 HA CYS A 108 1.862 8.723 2.956 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.264 11.070 2.350 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.576 11.051 1.188 1.00 0.00 H new ATOM 1611 N MET A 109 4.727 9.348 1.423 1.00 0.00 N ATOM 1612 CA MET A 109 5.804 8.741 0.660 1.00 0.00 C ATOM 1613 C MET A 109 7.006 8.434 1.555 1.00 0.00 C ATOM 1614 O MET A 109 7.984 7.837 1.106 1.00 0.00 O ATOM 1615 CB MET A 109 6.233 9.690 -0.462 1.00 0.00 C ATOM 1616 CG MET A 109 6.890 10.948 0.106 1.00 0.00 C ATOM 1617 SD MET A 109 8.199 11.495 -0.977 1.00 0.00 S ATOM 1618 CE MET A 109 9.376 12.083 0.232 1.00 0.00 C ATOM 0 H MET A 109 4.867 10.332 1.651 1.00 0.00 H new ATOM 0 HA MET A 109 5.441 7.804 0.238 1.00 0.00 H new ATOM 0 HB2 MET A 109 6.930 9.180 -1.128 1.00 0.00 H new ATOM 0 HB3 MET A 109 5.365 9.967 -1.060 1.00 0.00 H new ATOM 0 HG2 MET A 109 6.147 11.737 0.219 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.290 10.743 1.099 1.00 0.00 H new ATOM 0 HE1 MET A 109 9.504 13.160 0.122 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.009 11.862 1.234 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.334 11.586 0.079 1.00 0.00 H new ATOM 1628 N LYS A 110 6.894 8.855 2.807 1.00 0.00 N ATOM 1629 CA LYS A 110 7.959 8.634 3.769 1.00 0.00 C ATOM 1630 C LYS A 110 7.753 7.278 4.448 1.00 0.00 C ATOM 1631 O LYS A 110 8.508 6.337 4.208 1.00 0.00 O ATOM 1632 CB LYS A 110 8.049 9.806 4.749 1.00 0.00 C ATOM 1633 CG LYS A 110 8.895 9.436 5.969 1.00 0.00 C ATOM 1634 CD LYS A 110 8.013 9.178 7.192 1.00 0.00 C ATOM 1635 CE LYS A 110 8.579 8.043 8.048 1.00 0.00 C ATOM 1636 NZ LYS A 110 8.447 8.364 9.486 1.00 0.00 N ATOM 0 H LYS A 110 6.081 9.348 3.177 1.00 0.00 H new ATOM 0 HA LYS A 110 8.925 8.596 3.266 1.00 0.00 H new ATOM 0 HB2 LYS A 110 8.485 10.671 4.248 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.048 10.094 5.070 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.487 8.547 5.749 1.00 0.00 H new ATOM 0 HG3 LYS A 110 9.597 10.241 6.186 1.00 0.00 H new ATOM 0 HD2 LYS A 110 7.939 10.087 7.790 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.003 8.926 6.869 1.00 0.00 H new ATOM 0 HE2 LYS A 110 8.052 7.115 7.827 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.628 7.881 7.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.322 7.485 10.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 9.305 8.853 9.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.621 8.980 9.630 1.00 0.00 H new ATOM 1650 N THR A 111 6.726 7.221 5.283 1.00 0.00 N ATOM 1651 CA THR A 111 6.409 5.997 5.998 1.00 0.00 C ATOM 1652 C THR A 111 6.303 4.821 5.024 1.00 0.00 C ATOM 1653 O THR A 111 6.808 3.734 5.299 1.00 0.00 O ATOM 1654 CB THR A 111 5.131 6.236 6.804 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.327 7.518 7.393 1.00 0.00 O ATOM 1656 CG2 THR A 111 5.007 5.290 7.999 1.00 0.00 C ATOM 0 H THR A 111 6.102 8.004 5.480 1.00 0.00 H new ATOM 0 HA THR A 111 7.204 5.730 6.695 1.00 0.00 H new ATOM 0 HB THR A 111 4.264 6.114 6.155 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.849 7.562 8.247 1.00 0.00 H new ATOM 0 HG21 THR A 111 4.083 5.502 8.537 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.993 4.259 7.647 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.856 5.434 8.667 1.00 0.00 H new ATOM 1664 N ILE A 112 5.643 5.080 3.905 1.00 0.00 N ATOM 1665 CA ILE A 112 5.464 4.058 2.887 1.00 0.00 C ATOM 1666 C ILE A 112 6.804 3.374 2.617 1.00 0.00 C ATOM 1667 O ILE A 112 6.869 2.152 2.499 1.00 0.00 O ATOM 1668 CB ILE A 112 4.814 4.655 1.638 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.095 3.575 0.824 1.00 0.00 C ATOM 1670 CG2 ILE A 112 5.840 5.418 0.796 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.044 2.426 0.480 1.00 0.00 C ATOM 0 H ILE A 112 5.225 5.983 3.680 1.00 0.00 H new ATOM 0 HA ILE A 112 4.778 3.287 3.237 1.00 0.00 H new ATOM 0 HB ILE A 112 4.060 5.375 1.957 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.246 3.193 1.390 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.697 4.010 -0.093 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.351 5.832 -0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.267 6.228 1.388 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.633 4.738 0.485 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.509 1.673 -0.098 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.880 2.808 -0.107 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.421 1.978 1.399 1.00 0.00 H new ATOM 1683 N ASP A 113 7.843 4.191 2.525 1.00 0.00 N ATOM 1684 CA ASP A 113 9.178 3.681 2.272 1.00 0.00 C ATOM 1685 C ASP A 113 9.441 2.477 3.179 1.00 0.00 C ATOM 1686 O ASP A 113 9.802 1.403 2.701 1.00 0.00 O ATOM 1687 CB ASP A 113 10.241 4.740 2.572 1.00 0.00 C ATOM 1688 CG ASP A 113 11.454 4.722 1.641 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.841 3.605 1.233 1.00 0.00 O ATOM 1690 OD2 ASP A 113 11.968 5.826 1.356 1.00 0.00 O ATOM 0 H ASP A 113 7.786 5.205 2.622 1.00 0.00 H new ATOM 0 HA ASP A 113 9.236 3.401 1.220 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.776 5.724 2.519 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.587 4.605 3.597 1.00 0.00 H new ATOM 1695 N VAL A 114 9.248 2.697 4.471 1.00 0.00 N ATOM 1696 CA VAL A 114 9.460 1.644 5.450 1.00 0.00 C ATOM 1697 C VAL A 114 8.340 0.609 5.327 1.00 0.00 C ATOM 1698 O VAL A 114 8.606 -0.589 5.239 1.00 0.00 O ATOM 1699 CB VAL A 114 9.566 2.246 6.853 1.00 0.00 C ATOM 1700 CG1 VAL A 114 10.536 1.444 7.721 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.978 3.719 6.787 1.00 0.00 C ATOM 0 H VAL A 114 8.947 3.589 4.863 1.00 0.00 H new ATOM 0 HA VAL A 114 10.402 1.130 5.260 1.00 0.00 H new ATOM 0 HB VAL A 114 8.581 2.194 7.316 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.593 1.893 8.713 1.00 0.00 H new ATOM 0 HG12 VAL A 114 10.183 0.417 7.807 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.525 1.450 7.263 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.046 4.123 7.797 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.947 3.804 6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.234 4.280 6.221 1.00 0.00 H new ATOM 1711 N ALA A 115 7.113 1.108 5.324 1.00 0.00 N ATOM 1712 CA ALA A 115 5.953 0.241 5.214 1.00 0.00 C ATOM 1713 C ALA A 115 6.134 -0.697 4.018 1.00 0.00 C ATOM 1714 O ALA A 115 5.492 -1.744 3.943 1.00 0.00 O ATOM 1715 CB ALA A 115 4.687 1.093 5.100 1.00 0.00 C ATOM 0 H ALA A 115 6.897 2.102 5.396 1.00 0.00 H new ATOM 0 HA ALA A 115 5.851 -0.377 6.106 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.817 0.442 5.017 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.589 1.719 5.987 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.752 1.725 4.215 1.00 0.00 H new ATOM 1721 N MET A 116 7.011 -0.287 3.114 1.00 0.00 N ATOM 1722 CA MET A 116 7.284 -1.079 1.925 1.00 0.00 C ATOM 1723 C MET A 116 8.619 -1.817 2.053 1.00 0.00 C ATOM 1724 O MET A 116 8.755 -2.945 1.584 1.00 0.00 O ATOM 1725 CB MET A 116 7.324 -0.162 0.700 1.00 0.00 C ATOM 1726 CG MET A 116 7.073 -0.955 -0.584 1.00 0.00 C ATOM 1727 SD MET A 116 5.658 -0.289 -1.446 1.00 0.00 S ATOM 1728 CE MET A 116 4.588 -1.717 -1.431 1.00 0.00 C ATOM 0 H MET A 116 7.541 0.582 3.180 1.00 0.00 H new ATOM 0 HA MET A 116 6.490 -1.818 1.812 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.572 0.620 0.802 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.293 0.333 0.643 1.00 0.00 H new ATOM 0 HG2 MET A 116 7.953 -0.912 -1.226 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.903 -2.005 -0.345 1.00 0.00 H new ATOM 0 HE1 MET A 116 3.558 -1.402 -1.597 1.00 0.00 H new ATOM 0 HE2 MET A 116 4.888 -2.405 -2.221 1.00 0.00 H new ATOM 0 HE3 MET A 116 4.663 -2.218 -0.466 1.00 0.00 H new ATOM 1738 N CYS A 117 9.570 -1.149 2.692 1.00 0.00 N ATOM 1739 CA CYS A 117 10.888 -1.728 2.886 1.00 0.00 C ATOM 1740 C CYS A 117 10.715 -3.199 3.271 1.00 0.00 C ATOM 1741 O CYS A 117 11.343 -4.076 2.682 1.00 0.00 O ATOM 1742 CB CYS A 117 11.696 -0.954 3.931 1.00 0.00 C ATOM 1743 SG CYS A 117 13.512 -1.088 3.749 1.00 0.00 S ATOM 0 H CYS A 117 9.453 -0.213 3.081 1.00 0.00 H new ATOM 0 HA CYS A 117 11.458 -1.662 1.959 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.416 0.098 3.880 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.417 -1.310 4.923 1.00 0.00 H new ATOM 1748 N PHE A 118 9.859 -3.423 4.257 1.00 0.00 N ATOM 1749 CA PHE A 118 9.595 -4.770 4.728 1.00 0.00 C ATOM 1750 C PHE A 118 8.906 -5.605 3.645 1.00 0.00 C ATOM 1751 O PHE A 118 9.292 -6.746 3.396 1.00 0.00 O ATOM 1752 CB PHE A 118 8.660 -4.650 5.932 1.00 0.00 C ATOM 1753 CG PHE A 118 7.799 -5.890 6.180 1.00 0.00 C ATOM 1754 CD1 PHE A 118 8.309 -7.129 5.948 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.522 -5.754 6.629 1.00 0.00 C ATOM 1756 CE1 PHE A 118 7.509 -8.280 6.176 1.00 0.00 C ATOM 1757 CE2 PHE A 118 5.722 -6.905 6.859 1.00 0.00 C ATOM 1758 CZ PHE A 118 6.234 -8.145 6.628 1.00 0.00 C ATOM 0 H PHE A 118 9.339 -2.692 4.743 1.00 0.00 H new ATOM 0 HA PHE A 118 10.532 -5.262 4.988 1.00 0.00 H new ATOM 0 HB2 PHE A 118 9.256 -4.450 6.823 1.00 0.00 H new ATOM 0 HB3 PHE A 118 8.006 -3.790 5.787 1.00 0.00 H new ATOM 0 HD1 PHE A 118 9.322 -7.238 5.590 1.00 0.00 H new ATOM 0 HD2 PHE A 118 6.116 -4.770 6.811 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.914 -9.264 5.990 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.709 -6.796 7.217 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.628 -9.021 6.804 1.00 0.00 H new ATOM 1768 N LYS A 119 7.900 -5.003 3.029 1.00 0.00 N ATOM 1769 CA LYS A 119 7.156 -5.675 1.979 1.00 0.00 C ATOM 1770 C LYS A 119 8.107 -6.041 0.839 1.00 0.00 C ATOM 1771 O LYS A 119 7.895 -7.032 0.142 1.00 0.00 O ATOM 1772 CB LYS A 119 5.965 -4.822 1.536 1.00 0.00 C ATOM 1773 CG LYS A 119 4.761 -5.043 2.453 1.00 0.00 C ATOM 1774 CD LYS A 119 3.994 -6.306 2.058 1.00 0.00 C ATOM 1775 CE LYS A 119 3.112 -6.797 3.209 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.848 -7.361 2.688 1.00 0.00 N ATOM 0 H LYS A 119 7.583 -4.056 3.237 1.00 0.00 H new ATOM 0 HA LYS A 119 6.731 -6.607 2.351 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.245 -3.768 1.545 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.696 -5.072 0.510 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.097 -5.126 3.487 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.098 -4.180 2.402 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.376 -6.102 1.184 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.697 -7.089 1.775 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.644 -7.553 3.786 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.897 -5.972 3.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 1.261 -7.689 3.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.334 -6.629 2.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 2.059 -8.162 2.059 1.00 0.00 H new ATOM 1790 N LYS A 120 9.135 -5.221 0.683 1.00 0.00 N ATOM 1791 CA LYS A 120 10.122 -5.447 -0.360 1.00 0.00 C ATOM 1792 C LYS A 120 10.808 -6.794 -0.126 1.00 0.00 C ATOM 1793 O LYS A 120 11.256 -7.439 -1.073 1.00 0.00 O ATOM 1794 CB LYS A 120 11.093 -4.269 -0.444 1.00 0.00 C ATOM 1795 CG LYS A 120 10.814 -3.413 -1.680 1.00 0.00 C ATOM 1796 CD LYS A 120 12.118 -2.930 -2.319 1.00 0.00 C ATOM 1797 CE LYS A 120 12.076 -1.422 -2.576 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.160 -1.025 -3.503 1.00 0.00 N ATOM 0 H LYS A 120 9.307 -4.399 1.261 1.00 0.00 H new ATOM 0 HA LYS A 120 9.638 -5.501 -1.335 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.005 -3.657 0.454 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.117 -4.640 -0.478 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.242 -3.991 -2.405 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.202 -2.555 -1.402 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.957 -3.168 -1.666 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.285 -3.458 -3.258 1.00 0.00 H new ATOM 0 HE2 LYS A 120 11.109 -1.145 -2.997 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.179 -0.883 -1.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 13.118 0.001 -3.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.081 -1.271 -3.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.044 -1.525 -4.407 1.00 0.00 H new ATOM 1812 N GLU A 121 10.867 -7.180 1.140 1.00 0.00 N ATOM 1813 CA GLU A 121 11.491 -8.439 1.511 1.00 0.00 C ATOM 1814 C GLU A 121 10.800 -9.603 0.797 1.00 0.00 C ATOM 1815 O GLU A 121 11.424 -10.629 0.531 1.00 0.00 O ATOM 1816 CB GLU A 121 11.469 -8.636 3.029 1.00 0.00 C ATOM 1817 CG GLU A 121 12.129 -7.455 3.744 1.00 0.00 C ATOM 1818 CD GLU A 121 13.648 -7.482 3.563 1.00 0.00 C ATOM 1819 OE1 GLU A 121 14.306 -8.153 4.387 1.00 0.00 O ATOM 1820 OE2 GLU A 121 14.116 -6.834 2.602 1.00 0.00 O ATOM 0 H GLU A 121 10.493 -6.643 1.922 1.00 0.00 H new ATOM 0 HA GLU A 121 12.534 -8.412 1.197 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.440 -8.743 3.371 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.989 -9.559 3.287 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.729 -6.519 3.353 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.885 -7.486 4.806 1.00 0.00 H new ATOM 1827 N ILE A 122 9.523 -9.404 0.508 1.00 0.00 N ATOM 1828 CA ILE A 122 8.742 -10.425 -0.171 1.00 0.00 C ATOM 1829 C ILE A 122 9.089 -10.421 -1.660 1.00 0.00 C ATOM 1830 O ILE A 122 9.153 -11.476 -2.289 1.00 0.00 O ATOM 1831 CB ILE A 122 7.251 -10.236 0.116 1.00 0.00 C ATOM 1832 CG1 ILE A 122 7.028 -9.687 1.526 1.00 0.00 C ATOM 1833 CG2 ILE A 122 6.479 -11.535 -0.124 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.918 -10.407 2.540 1.00 0.00 C ATOM 0 H ILE A 122 9.009 -8.552 0.731 1.00 0.00 H new ATOM 0 HA ILE A 122 8.993 -11.415 0.210 1.00 0.00 H new ATOM 0 HB ILE A 122 6.860 -9.495 -0.581 1.00 0.00 H new ATOM 0 HG12 ILE A 122 7.242 -8.618 1.542 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.981 -9.807 1.806 1.00 0.00 H new ATOM 0 HG21 ILE A 122 5.422 -11.374 0.087 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.599 -11.843 -1.163 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.865 -12.315 0.533 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.741 -9.998 3.535 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.684 -11.472 2.538 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.965 -10.265 2.271 1.00 0.00 H new ATOM 1846 N HIS A 123 9.302 -9.222 -2.181 1.00 0.00 N ATOM 1847 CA HIS A 123 9.641 -9.065 -3.586 1.00 0.00 C ATOM 1848 C HIS A 123 10.740 -10.060 -3.964 1.00 0.00 C ATOM 1849 O HIS A 123 10.919 -10.379 -5.137 1.00 0.00 O ATOM 1850 CB HIS A 123 10.022 -7.617 -3.896 1.00 0.00 C ATOM 1851 CG HIS A 123 11.506 -7.392 -4.057 1.00 0.00 C ATOM 1852 ND1 HIS A 123 12.041 -6.593 -5.052 1.00 0.00 N ATOM 1853 CD2 HIS A 123 12.562 -7.870 -3.337 1.00 0.00 C ATOM 1854 CE1 HIS A 123 13.360 -6.598 -4.930 1.00 0.00 C ATOM 1855 NE2 HIS A 123 13.681 -7.390 -3.866 1.00 0.00 N ATOM 0 H HIS A 123 9.247 -8.349 -1.656 1.00 0.00 H new ATOM 0 HA HIS A 123 8.769 -9.289 -4.200 1.00 0.00 H new ATOM 0 HB2 HIS A 123 9.517 -7.307 -4.811 1.00 0.00 H new ATOM 0 HB3 HIS A 123 9.653 -6.976 -3.096 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.498 -8.527 -2.482 1.00 0.00 H new ATOM 0 HE1 HIS A 123 14.058 -6.069 -5.561 1.00 0.00 H new ATOM 0 HE2 HIS A 123 14.626 -7.582 -3.532 1.00 0.00 H new ATOM 1864 N LYS A 124 11.449 -10.525 -2.944 1.00 0.00 N ATOM 1865 CA LYS A 124 12.525 -11.477 -3.153 1.00 0.00 C ATOM 1866 C LYS A 124 12.009 -12.892 -2.882 1.00 0.00 C ATOM 1867 O LYS A 124 12.774 -13.771 -2.490 1.00 0.00 O ATOM 1868 CB LYS A 124 13.747 -11.098 -2.314 1.00 0.00 C ATOM 1869 CG LYS A 124 13.720 -11.803 -0.956 1.00 0.00 C ATOM 1870 CD LYS A 124 14.509 -11.010 0.089 1.00 0.00 C ATOM 1871 CE LYS A 124 15.807 -11.731 0.457 1.00 0.00 C ATOM 1872 NZ LYS A 124 16.820 -11.551 -0.607 1.00 0.00 N ATOM 0 H LYS A 124 11.298 -10.259 -1.971 1.00 0.00 H new ATOM 0 HA LYS A 124 12.859 -11.452 -4.190 1.00 0.00 H new ATOM 0 HB2 LYS A 124 14.658 -11.367 -2.849 1.00 0.00 H new ATOM 0 HB3 LYS A 124 13.771 -10.018 -2.167 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.688 -11.922 -0.625 1.00 0.00 H new ATOM 0 HG3 LYS A 124 14.141 -12.804 -1.053 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.737 -10.017 -0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 124 13.900 -10.871 0.982 1.00 0.00 H new ATOM 0 HE2 LYS A 124 16.190 -11.344 1.401 1.00 0.00 H new ATOM 0 HE3 LYS A 124 15.611 -12.793 0.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 17.695 -12.047 -0.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 16.458 -11.942 -1.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 17.020 -10.538 -0.728 1.00 0.00 H new ATOM 1886 N LEU A 125 10.715 -13.067 -3.102 1.00 0.00 N ATOM 1887 CA LEU A 125 10.087 -14.360 -2.887 1.00 0.00 C ATOM 1888 C LEU A 125 10.961 -15.454 -3.502 1.00 0.00 C ATOM 1889 O LEU A 125 11.984 -15.830 -2.933 1.00 0.00 O ATOM 1890 CB LEU A 125 8.650 -14.352 -3.412 1.00 0.00 C ATOM 1891 CG LEU A 125 8.340 -13.325 -4.504 1.00 0.00 C ATOM 1892 CD1 LEU A 125 9.477 -13.250 -5.524 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.992 -13.619 -5.167 1.00 0.00 C ATOM 0 H LEU A 125 10.083 -12.335 -3.427 1.00 0.00 H new ATOM 0 HA LEU A 125 10.010 -14.574 -1.821 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.420 -15.345 -3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.978 -14.174 -2.572 1.00 0.00 H new ATOM 0 HG LEU A 125 8.261 -12.343 -4.037 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.232 -12.513 -6.289 1.00 0.00 H new ATOM 0 HD12 LEU A 125 10.399 -12.958 -5.021 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.612 -14.226 -5.990 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.796 -12.875 -5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 125 7.017 -14.611 -5.618 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.202 -13.581 -4.417 1.00 0.00 H new ATOM 1905 N ASN A 126 10.524 -15.936 -4.657 1.00 0.00 N ATOM 1906 CA ASN A 126 11.253 -16.981 -5.355 1.00 0.00 C ATOM 1907 C ASN A 126 12.059 -16.358 -6.498 1.00 0.00 C ATOM 1908 O ASN A 126 13.123 -16.860 -6.857 1.00 0.00 O ATOM 1909 CB ASN A 126 10.297 -18.011 -5.958 1.00 0.00 C ATOM 1910 CG ASN A 126 9.395 -18.620 -4.882 1.00 0.00 C ATOM 1911 OD1 ASN A 126 9.747 -19.574 -4.209 1.00 0.00 O ATOM 1912 ND2 ASN A 126 8.218 -18.015 -4.759 1.00 0.00 N ATOM 0 H ASN A 126 9.675 -15.622 -5.126 1.00 0.00 H new ATOM 0 HA ASN A 126 11.907 -17.474 -4.636 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.685 -17.538 -6.726 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.868 -18.800 -6.447 1.00 0.00 H new ATOM 0 HD21 ASN A 126 7.545 -18.345 -4.068 1.00 0.00 H new ATOM 0 HD22 ASN A 126 7.988 -17.220 -5.356 1.00 0.00 H new ATOM 1919 N TRP A 127 11.521 -15.274 -7.036 1.00 0.00 N ATOM 1920 CA TRP A 127 12.176 -14.578 -8.131 1.00 0.00 C ATOM 1921 C TRP A 127 12.742 -13.266 -7.583 1.00 0.00 C ATOM 1922 O TRP A 127 12.096 -12.594 -6.780 1.00 0.00 O ATOM 1923 CB TRP A 127 11.215 -14.371 -9.302 1.00 0.00 C ATOM 1924 CG TRP A 127 9.788 -14.013 -8.883 1.00 0.00 C ATOM 1925 CD1 TRP A 127 8.800 -14.843 -8.524 1.00 0.00 C ATOM 1926 CD2 TRP A 127 9.226 -12.686 -8.790 1.00 0.00 C ATOM 1927 NE1 TRP A 127 7.647 -14.152 -8.210 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.915 -12.799 -8.377 1.00 0.00 C ATOM 1929 CE3 TRP A 127 9.808 -11.432 -9.049 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 7.073 -11.697 -8.185 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 8.954 -10.340 -8.853 1.00 0.00 C ATOM 1932 CH2 TRP A 127 7.631 -10.437 -8.437 1.00 0.00 C ATOM 0 H TRP A 127 10.639 -14.860 -6.734 1.00 0.00 H new ATOM 0 HA TRP A 127 12.997 -15.173 -8.531 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.604 -13.579 -9.942 1.00 0.00 H new ATOM 0 HB3 TRP A 127 11.189 -15.281 -9.902 1.00 0.00 H new ATOM 0 HD1 TRP A 127 8.894 -15.918 -8.485 1.00 0.00 H new ATOM 0 HE1 TRP A 127 6.761 -14.560 -7.910 1.00 0.00 H new ATOM 0 HE3 TRP A 127 10.832 -11.320 -9.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 6.049 -11.812 -7.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 9.351 -9.353 -9.038 1.00 0.00 H new ATOM 0 HH2 TRP A 127 7.036 -9.545 -8.309 1.00 0.00 H new ATOM 1943 N VAL A 128 13.941 -12.941 -8.041 1.00 0.00 N ATOM 1944 CA VAL A 128 14.602 -11.720 -7.607 1.00 0.00 C ATOM 1945 C VAL A 128 14.776 -10.786 -8.805 1.00 0.00 C ATOM 1946 O VAL A 128 15.527 -11.090 -9.731 1.00 0.00 O ATOM 1947 CB VAL A 128 15.926 -12.058 -6.916 1.00 0.00 C ATOM 1948 CG1 VAL A 128 15.685 -12.589 -5.501 1.00 0.00 C ATOM 1949 CG2 VAL A 128 16.737 -13.056 -7.745 1.00 0.00 C ATOM 0 H VAL A 128 14.473 -13.500 -8.708 1.00 0.00 H new ATOM 0 HA VAL A 128 13.991 -11.196 -6.872 1.00 0.00 H new ATOM 0 HB VAL A 128 16.507 -11.139 -6.835 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.641 -12.822 -5.032 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.166 -11.833 -4.912 1.00 0.00 H new ATOM 0 HG13 VAL A 128 15.076 -13.492 -5.550 1.00 0.00 H new ATOM 0 HG21 VAL A 128 17.673 -13.279 -7.232 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.164 -13.975 -7.871 1.00 0.00 H new ATOM 0 HG23 VAL A 128 16.953 -12.626 -8.723 1.00 0.00 H new ATOM 1959 N PRO A 129 14.049 -9.637 -8.749 1.00 0.00 N ATOM 1960 CA PRO A 129 14.115 -8.658 -9.819 1.00 0.00 C ATOM 1961 C PRO A 129 15.427 -7.871 -9.762 1.00 0.00 C ATOM 1962 O PRO A 129 15.419 -6.641 -9.806 1.00 0.00 O ATOM 1963 CB PRO A 129 12.888 -7.780 -9.626 1.00 0.00 C ATOM 1964 CG PRO A 129 12.435 -8.008 -8.192 1.00 0.00 C ATOM 1965 CD PRO A 129 13.149 -9.244 -7.669 1.00 0.00 C ATOM 0 HA PRO A 129 14.110 -9.116 -10.808 1.00 0.00 H new ATOM 0 HB2 PRO A 129 13.127 -6.731 -9.798 1.00 0.00 H new ATOM 0 HB3 PRO A 129 12.101 -8.047 -10.332 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.671 -7.141 -7.575 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.354 -8.145 -8.150 1.00 0.00 H new ATOM 0 HD2 PRO A 129 13.700 -9.026 -6.754 1.00 0.00 H new ATOM 0 HD3 PRO A 129 12.442 -10.040 -7.433 1.00 0.00 H new ATOM 1973 N ASN A 130 16.520 -8.612 -9.666 1.00 0.00 N ATOM 1974 CA ASN A 130 17.836 -8.000 -9.603 1.00 0.00 C ATOM 1975 C ASN A 130 17.899 -6.832 -10.589 1.00 0.00 C ATOM 1976 O ASN A 130 18.583 -5.840 -10.340 1.00 0.00 O ATOM 1977 CB ASN A 130 18.928 -9.001 -9.985 1.00 0.00 C ATOM 1978 CG ASN A 130 18.528 -9.801 -11.225 1.00 0.00 C ATOM 1979 OD1 ASN A 130 17.472 -10.409 -11.290 1.00 0.00 O ATOM 1980 ND2 ASN A 130 19.429 -9.769 -12.204 1.00 0.00 N ATOM 0 H ASN A 130 16.522 -9.631 -9.630 1.00 0.00 H new ATOM 0 HA ASN A 130 18.001 -7.660 -8.581 1.00 0.00 H new ATOM 0 HB2 ASN A 130 19.862 -8.471 -10.175 1.00 0.00 H new ATOM 0 HB3 ASN A 130 19.111 -9.681 -9.153 1.00 0.00 H new ATOM 0 HD21 ASN A 130 19.255 -10.273 -13.074 1.00 0.00 H new ATOM 0 HD22 ASN A 130 20.293 -9.240 -12.085 1.00 0.00 H new ATOM 1987 N MET A 131 17.175 -6.988 -11.688 1.00 0.00 N ATOM 1988 CA MET A 131 17.140 -5.958 -12.712 1.00 0.00 C ATOM 1989 C MET A 131 15.752 -5.321 -12.802 1.00 0.00 C ATOM 1990 O MET A 131 14.814 -5.937 -13.304 1.00 0.00 O ATOM 1991 CB MET A 131 17.508 -6.573 -14.066 1.00 0.00 C ATOM 1992 CG MET A 131 18.967 -6.279 -14.421 1.00 0.00 C ATOM 1993 SD MET A 131 19.787 -7.783 -14.921 1.00 0.00 S ATOM 1994 CE MET A 131 21.484 -7.230 -14.915 1.00 0.00 C ATOM 0 H MET A 131 16.609 -7.812 -11.891 1.00 0.00 H new ATOM 0 HA MET A 131 17.858 -5.183 -12.446 1.00 0.00 H new ATOM 0 HB2 MET A 131 17.347 -7.651 -14.036 1.00 0.00 H new ATOM 0 HB3 MET A 131 16.854 -6.174 -14.841 1.00 0.00 H new ATOM 0 HG2 MET A 131 19.014 -5.545 -15.225 1.00 0.00 H new ATOM 0 HG3 MET A 131 19.479 -5.844 -13.562 1.00 0.00 H new ATOM 0 HE1 MET A 131 22.136 -8.053 -15.207 1.00 0.00 H new ATOM 0 HE2 MET A 131 21.601 -6.407 -15.620 1.00 0.00 H new ATOM 0 HE3 MET A 131 21.753 -6.891 -13.914 1.00 0.00 H new ATOM 2004 N ASP A 132 15.667 -4.095 -12.307 1.00 0.00 N ATOM 2005 CA ASP A 132 14.409 -3.367 -12.325 1.00 0.00 C ATOM 2006 C ASP A 132 14.538 -2.157 -13.254 1.00 0.00 C ATOM 2007 O ASP A 132 15.428 -1.328 -13.079 1.00 0.00 O ATOM 2008 CB ASP A 132 14.049 -2.855 -10.929 1.00 0.00 C ATOM 2009 CG ASP A 132 12.587 -3.051 -10.525 1.00 0.00 C ATOM 2010 OD1 ASP A 132 11.719 -2.587 -11.296 1.00 0.00 O ATOM 2011 OD2 ASP A 132 12.370 -3.660 -9.456 1.00 0.00 O ATOM 0 H ASP A 132 16.448 -3.587 -11.891 1.00 0.00 H new ATOM 0 HA ASP A 132 13.631 -4.047 -12.671 1.00 0.00 H new ATOM 0 HB2 ASP A 132 14.683 -3.359 -10.199 1.00 0.00 H new ATOM 0 HB3 ASP A 132 14.285 -1.792 -10.876 1.00 0.00 H new ATOM 2016 N LEU A 133 13.635 -2.096 -14.221 1.00 0.00 N ATOM 2017 CA LEU A 133 13.636 -1.001 -15.177 1.00 0.00 C ATOM 2018 C LEU A 133 13.934 0.309 -14.446 1.00 0.00 C ATOM 2019 O LEU A 133 13.260 0.649 -13.474 1.00 0.00 O ATOM 2020 CB LEU A 133 12.326 -0.981 -15.969 1.00 0.00 C ATOM 2021 CG LEU A 133 11.208 -0.112 -15.391 1.00 0.00 C ATOM 2022 CD1 LEU A 133 10.920 -0.486 -13.935 1.00 0.00 C ATOM 2023 CD2 LEU A 133 11.531 1.376 -15.547 1.00 0.00 C ATOM 0 H LEU A 133 12.898 -2.786 -14.364 1.00 0.00 H new ATOM 0 HA LEU A 133 14.426 -1.140 -15.915 1.00 0.00 H new ATOM 0 HB2 LEU A 133 12.541 -0.637 -16.981 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.959 -2.004 -16.052 1.00 0.00 H new ATOM 0 HG LEU A 133 10.298 -0.305 -15.960 1.00 0.00 H new ATOM 0 HD11 LEU A 133 10.121 0.147 -13.548 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.614 -1.531 -13.881 1.00 0.00 H new ATOM 0 HD13 LEU A 133 11.820 -0.341 -13.337 1.00 0.00 H new ATOM 0 HD21 LEU A 133 10.719 1.970 -15.128 1.00 0.00 H new ATOM 0 HD22 LEU A 133 12.458 1.604 -15.020 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.646 1.614 -16.604 1.00 0.00 H new ATOM 2035 N VAL A 134 14.945 1.009 -14.940 1.00 0.00 N ATOM 2036 CA VAL A 134 15.339 2.274 -14.347 1.00 0.00 C ATOM 2037 C VAL A 134 15.064 3.408 -15.337 1.00 0.00 C ATOM 2038 O VAL A 134 14.413 4.392 -14.995 1.00 0.00 O ATOM 2039 CB VAL A 134 16.802 2.210 -13.904 1.00 0.00 C ATOM 2040 CG1 VAL A 134 17.318 3.596 -13.508 1.00 0.00 C ATOM 2041 CG2 VAL A 134 16.987 1.210 -12.762 1.00 0.00 C ATOM 0 H VAL A 134 15.503 0.723 -15.745 1.00 0.00 H new ATOM 0 HA VAL A 134 14.749 2.475 -13.453 1.00 0.00 H new ATOM 0 HB VAL A 134 17.392 1.863 -14.752 1.00 0.00 H new ATOM 0 HG11 VAL A 134 18.360 3.521 -13.197 1.00 0.00 H new ATOM 0 HG12 VAL A 134 17.241 4.270 -14.361 1.00 0.00 H new ATOM 0 HG13 VAL A 134 16.721 3.985 -12.683 1.00 0.00 H new ATOM 0 HG21 VAL A 134 18.036 1.185 -12.467 1.00 0.00 H new ATOM 0 HG22 VAL A 134 16.378 1.513 -11.911 1.00 0.00 H new ATOM 0 HG23 VAL A 134 16.679 0.218 -13.093 1.00 0.00 H new ATOM 2051 N ILE A 135 15.573 3.229 -16.548 1.00 0.00 N ATOM 2052 CA ILE A 135 15.390 4.222 -17.591 1.00 0.00 C ATOM 2053 C ILE A 135 14.349 3.719 -18.593 1.00 0.00 C ATOM 2054 O ILE A 135 13.827 4.494 -19.394 1.00 0.00 O ATOM 2055 CB ILE A 135 16.733 4.583 -18.230 1.00 0.00 C ATOM 2056 CG1 ILE A 135 17.610 3.341 -18.396 1.00 0.00 C ATOM 2057 CG2 ILE A 135 17.440 5.684 -17.436 1.00 0.00 C ATOM 2058 CD1 ILE A 135 18.428 3.075 -17.130 1.00 0.00 C ATOM 0 H ILE A 135 16.112 2.410 -16.829 1.00 0.00 H new ATOM 0 HA ILE A 135 15.004 5.150 -17.168 1.00 0.00 H new ATOM 0 HB ILE A 135 16.543 4.979 -19.228 1.00 0.00 H new ATOM 0 HG12 ILE A 135 16.984 2.476 -18.618 1.00 0.00 H new ATOM 0 HG13 ILE A 135 18.280 3.475 -19.245 1.00 0.00 H new ATOM 0 HG21 ILE A 135 18.392 5.922 -17.911 1.00 0.00 H new ATOM 0 HG22 ILE A 135 16.813 6.576 -17.413 1.00 0.00 H new ATOM 0 HG23 ILE A 135 17.619 5.340 -16.417 1.00 0.00 H new ATOM 0 HD11 ILE A 135 19.043 2.187 -17.274 1.00 0.00 H new ATOM 0 HD12 ILE A 135 19.070 3.932 -16.925 1.00 0.00 H new ATOM 0 HD13 ILE A 135 17.754 2.917 -16.288 1.00 0.00 H new ATOM 2070 N GLY A 136 14.075 2.425 -18.514 1.00 0.00 N ATOM 2071 CA GLY A 136 13.105 1.809 -19.402 1.00 0.00 C ATOM 2072 C GLY A 136 13.754 1.410 -20.730 1.00 0.00 C ATOM 2073 O GLY A 136 13.110 1.453 -21.778 1.00 0.00 O ATOM 0 H GLY A 136 14.509 1.786 -17.848 1.00 0.00 H new ATOM 0 HA2 GLY A 136 12.676 0.929 -18.924 1.00 0.00 H new ATOM 0 HA3 GLY A 136 12.285 2.502 -19.588 1.00 0.00 H new ATOM 2077 N GLU A 137 15.020 1.031 -20.643 1.00 0.00 N ATOM 2078 CA GLU A 137 15.763 0.625 -21.824 1.00 0.00 C ATOM 2079 C GLU A 137 15.846 -0.901 -21.899 1.00 0.00 C ATOM 2080 O GLU A 137 15.620 -1.589 -20.906 1.00 0.00 O ATOM 2081 CB GLU A 137 17.158 1.251 -21.836 1.00 0.00 C ATOM 2082 CG GLU A 137 18.026 0.682 -20.714 1.00 0.00 C ATOM 2083 CD GLU A 137 19.348 0.141 -21.262 1.00 0.00 C ATOM 2084 OE1 GLU A 137 19.281 -0.822 -22.057 1.00 0.00 O ATOM 2085 OE2 GLU A 137 20.395 0.701 -20.874 1.00 0.00 O ATOM 0 H GLU A 137 15.551 0.996 -19.773 1.00 0.00 H new ATOM 0 HA GLU A 137 15.232 0.985 -22.705 1.00 0.00 H new ATOM 0 HB2 GLU A 137 17.635 1.066 -22.798 1.00 0.00 H new ATOM 0 HB3 GLU A 137 17.076 2.332 -21.724 1.00 0.00 H new ATOM 0 HG2 GLU A 137 18.225 1.458 -19.975 1.00 0.00 H new ATOM 0 HG3 GLU A 137 17.487 -0.115 -20.202 1.00 0.00 H new ATOM 2092 N VAL A 138 16.171 -1.386 -23.089 1.00 0.00 N ATOM 2093 CA VAL A 138 16.289 -2.817 -23.308 1.00 0.00 C ATOM 2094 C VAL A 138 17.460 -3.361 -22.488 1.00 0.00 C ATOM 2095 O VAL A 138 18.616 -3.218 -22.882 1.00 0.00 O ATOM 2096 CB VAL A 138 16.419 -3.110 -24.805 1.00 0.00 C ATOM 2097 CG1 VAL A 138 15.261 -2.487 -25.587 1.00 0.00 C ATOM 2098 CG2 VAL A 138 17.767 -2.626 -25.341 1.00 0.00 C ATOM 0 H VAL A 138 16.356 -0.812 -23.912 1.00 0.00 H new ATOM 0 HA VAL A 138 15.389 -3.330 -22.968 1.00 0.00 H new ATOM 0 HB VAL A 138 16.372 -4.190 -24.942 1.00 0.00 H new ATOM 0 HG11 VAL A 138 15.377 -2.710 -26.648 1.00 0.00 H new ATOM 0 HG12 VAL A 138 14.317 -2.900 -25.230 1.00 0.00 H new ATOM 0 HG13 VAL A 138 15.263 -1.407 -25.441 1.00 0.00 H new ATOM 0 HG21 VAL A 138 17.835 -2.846 -26.406 1.00 0.00 H new ATOM 0 HG22 VAL A 138 17.855 -1.551 -25.186 1.00 0.00 H new ATOM 0 HG23 VAL A 138 18.573 -3.136 -24.813 1.00 0.00 H new ATOM 2108 N LEU A 139 17.121 -3.972 -21.363 1.00 0.00 N ATOM 2109 CA LEU A 139 18.131 -4.537 -20.484 1.00 0.00 C ATOM 2110 C LEU A 139 17.449 -5.160 -19.265 1.00 0.00 C ATOM 2111 O LEU A 139 17.771 -6.281 -18.873 1.00 0.00 O ATOM 2112 CB LEU A 139 19.183 -3.485 -20.130 1.00 0.00 C ATOM 2113 CG LEU A 139 20.002 -3.752 -18.864 1.00 0.00 C ATOM 2114 CD1 LEU A 139 21.451 -3.298 -19.043 1.00 0.00 C ATOM 2115 CD2 LEU A 139 19.345 -3.109 -17.642 1.00 0.00 C ATOM 0 H LEU A 139 16.161 -4.088 -21.039 1.00 0.00 H new ATOM 0 HA LEU A 139 18.672 -5.337 -20.990 1.00 0.00 H new ATOM 0 HB2 LEU A 139 19.871 -3.391 -20.970 1.00 0.00 H new ATOM 0 HB3 LEU A 139 18.683 -2.523 -20.019 1.00 0.00 H new ATOM 0 HG LEU A 139 20.022 -4.828 -18.689 1.00 0.00 H new ATOM 0 HD11 LEU A 139 22.011 -3.499 -18.130 1.00 0.00 H new ATOM 0 HD12 LEU A 139 21.903 -3.842 -19.873 1.00 0.00 H new ATOM 0 HD13 LEU A 139 21.474 -2.229 -19.255 1.00 0.00 H new ATOM 0 HD21 LEU A 139 19.946 -3.313 -16.756 1.00 0.00 H new ATOM 0 HD22 LEU A 139 19.274 -2.032 -17.792 1.00 0.00 H new ATOM 0 HD23 LEU A 139 18.346 -3.523 -17.506 1.00 0.00 H new ATOM 2127 N ALA A 140 16.520 -4.405 -18.697 1.00 0.00 N ATOM 2128 CA ALA A 140 15.790 -4.869 -17.530 1.00 0.00 C ATOM 2129 C ALA A 140 14.452 -5.464 -17.973 1.00 0.00 C ATOM 2130 O ALA A 140 14.020 -5.254 -19.106 1.00 0.00 O ATOM 2131 CB ALA A 140 15.614 -3.712 -16.544 1.00 0.00 C ATOM 0 H ALA A 140 16.256 -3.475 -19.023 1.00 0.00 H new ATOM 0 HA ALA A 140 16.347 -5.654 -17.017 1.00 0.00 H new ATOM 0 HB1 ALA A 140 15.066 -4.060 -15.668 1.00 0.00 H new ATOM 0 HB2 ALA A 140 16.593 -3.344 -16.237 1.00 0.00 H new ATOM 0 HB3 ALA A 140 15.057 -2.907 -17.024 1.00 0.00 H new ATOM 2137 N GLU A 141 13.834 -6.197 -17.058 1.00 0.00 N ATOM 2138 CA GLU A 141 12.554 -6.824 -17.340 1.00 0.00 C ATOM 2139 C GLU A 141 11.442 -5.776 -17.361 1.00 0.00 C ATOM 2140 O GLU A 141 10.790 -5.537 -16.345 1.00 0.00 O ATOM 2141 CB GLU A 141 12.250 -7.929 -16.326 1.00 0.00 C ATOM 2142 CG GLU A 141 12.405 -7.416 -14.893 1.00 0.00 C ATOM 2143 CD GLU A 141 11.153 -7.714 -14.066 1.00 0.00 C ATOM 2144 OE1 GLU A 141 10.055 -7.364 -14.551 1.00 0.00 O ATOM 2145 OE2 GLU A 141 11.323 -8.284 -12.967 1.00 0.00 O ATOM 0 H GLU A 141 14.196 -6.371 -16.120 1.00 0.00 H new ATOM 0 HA GLU A 141 12.607 -7.286 -18.326 1.00 0.00 H new ATOM 0 HB2 GLU A 141 11.235 -8.297 -16.477 1.00 0.00 H new ATOM 0 HB3 GLU A 141 12.922 -8.772 -16.489 1.00 0.00 H new ATOM 0 HG2 GLU A 141 13.273 -7.883 -14.427 1.00 0.00 H new ATOM 0 HG3 GLU A 141 12.590 -6.342 -14.905 1.00 0.00 H new ATOM 2152 N VAL A 142 11.256 -5.177 -18.527 1.00 0.00 N ATOM 2153 CA VAL A 142 10.232 -4.159 -18.694 1.00 0.00 C ATOM 2154 C VAL A 142 8.923 -4.823 -19.122 1.00 0.00 C ATOM 2155 O VAL A 142 7.887 -4.627 -18.489 1.00 0.00 O ATOM 2156 CB VAL A 142 10.712 -3.091 -19.679 1.00 0.00 C ATOM 2157 CG1 VAL A 142 10.873 -3.674 -21.084 1.00 0.00 C ATOM 2158 CG2 VAL A 142 9.764 -1.889 -19.688 1.00 0.00 C ATOM 0 H VAL A 142 11.798 -5.377 -19.368 1.00 0.00 H new ATOM 0 HA VAL A 142 10.043 -3.649 -17.749 1.00 0.00 H new ATOM 0 HB VAL A 142 11.690 -2.744 -19.347 1.00 0.00 H new ATOM 0 HG11 VAL A 142 11.215 -2.894 -21.764 1.00 0.00 H new ATOM 0 HG12 VAL A 142 11.604 -4.482 -21.061 1.00 0.00 H new ATOM 0 HG13 VAL A 142 9.915 -4.062 -21.429 1.00 0.00 H new ATOM 0 HG21 VAL A 142 10.127 -1.144 -20.396 1.00 0.00 H new ATOM 0 HG22 VAL A 142 8.767 -2.214 -19.984 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.722 -1.451 -18.691 1.00 0.00 H new