USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1316 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 158 GLN : amide:sc= -0.145 K(o=-0.1,f=-0.77) USER MOD Set 1.2: A 159 SER OG : rot -22:sc= 0.0446 USER MOD Set 2.1: A 124 TYR OH : rot 180:sc= 0.00229 USER MOD Set 2.2: A 149 GLN : amide:sc= 0.00294 X(o=0.0052,f=-0.39) USER MOD Set 3.1: A 114 LYS NZ :NH3+ 156:sc= 1.01 (180deg=0) USER MOD Set 3.2: A 171 HIS : no HD1:sc= 0.395 K(o=1.4,f=-1.5) USER MOD Set 4.1: A 105 HIS : no HD1:sc= -0.0682 K(o=-0.068,f=-0.92) USER MOD Set 4.2: A 118 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 33 HIS : no HD1:sc= -0.221 K(o=-1.2,f=-5.5) USER MOD Set 5.2: A 43 MET CE :methyl -169:sc= -0.988 (180deg=-1.69) USER MOD Set 6.1: A 10 SER OG : rot 180:sc= 0.543 USER MOD Set 6.2: A 34 ASN : amide:sc= 1.21 K(o=1.8,f=-6.4!) USER MOD Set 7.1: A 1 MET CE :methyl 151:sc= -0.394 (180deg=-0.27) USER MOD Set 7.2: A 3 MET CE :methyl -176:sc= -1.42 (180deg=-1.57) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.635 K(o=0.64,f=-6.6!) USER MOD Single : A 7 TYR OH : rot 167:sc= 1.22 USER MOD Single : A 9 SER OG : rot -63:sc= 1.25 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0983 USER MOD Single : A 12 CYS SG : rot 84:sc= 0.124 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -90:sc= -0.28 USER MOD Single : A 16 MET CE :methyl -168:sc= -0.0653 (180deg=-0.308) USER MOD Single : A 20 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.15) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -171:sc= 1.13 (180deg=0.991) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= 0.281 X(o=0.28,f=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.234 USER MOD Single : A 62 GLN : amide:sc= 0.0383 X(o=0.038,f=-0.043) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0.981 K(o=0.98,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -153:sc= 2.19 (180deg=0.859) USER MOD Single : A 85 TYR OH : rot 30:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 1.83 K(o=1.8,f=-4.3!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -168:sc= -0.885 (180deg=-1.02) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0466 USER MOD Single : A 111 LYS NZ :NH3+ 177:sc= 1.34 (180deg=1.14) USER MOD Single : A 121 THR OG1 : rot 130:sc= -0.0195 USER MOD Single : A 127 THR OG1 : rot -30:sc= 0.00905 USER MOD Single : A 128 SER OG : rot -79:sc= 0.0998 USER MOD Single : A 130 LYS NZ :NH3+ 169:sc= 1.2 (180deg=0.931) USER MOD Single : A 137 GLN : amide:sc= -0.0715 X(o=-0.072,f=-0.35) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -1.16! X(o=-1.2!,f=-0.67) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -120:sc= -0.274 USER MOD Single : A 161 CYS SG : rot 80:sc= -1.07 USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 ASN : amide:sc= 0.818 K(o=0.82,f=-0.00011) USER MOD Single : A 168 MET CE :methyl -155:sc= -0.65 (180deg=-2.3!) USER MOD Single : A 172 TYR OH : rot -172:sc= 0.923 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.225 1.338 0.013 1.00 0.00 N ATOM 2 CA MET A 1 2.692 -0.035 -0.238 1.00 0.00 C ATOM 3 C MET A 1 1.232 0.037 -0.721 1.00 0.00 C ATOM 4 O MET A 1 0.433 0.788 -0.164 1.00 0.00 O ATOM 5 CB MET A 1 2.851 -0.956 1.000 1.00 0.00 C ATOM 6 CG MET A 1 2.545 -2.442 0.731 1.00 0.00 C ATOM 7 SD MET A 1 2.217 -3.444 2.209 1.00 0.00 S ATOM 8 CE MET A 1 0.606 -2.773 2.695 1.00 0.00 C ATOM 0 H1 MET A 1 4.211 1.274 0.338 1.00 0.00 H new ATOM 0 H2 MET A 1 3.186 1.892 -0.867 1.00 0.00 H new ATOM 0 H3 MET A 1 2.650 1.806 0.742 1.00 0.00 H new ATOM 0 HA MET A 1 3.287 -0.487 -1.031 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.871 -0.870 1.373 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.191 -0.599 1.791 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.680 -2.504 0.070 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.388 -2.879 0.195 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.032 -3.543 3.211 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.752 -1.922 3.360 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.063 -2.450 1.807 1.00 0.00 H new ATOM 20 N ASN A 2 0.873 -0.758 -1.736 1.00 0.00 N ATOM 21 CA ASN A 2 -0.467 -0.879 -2.321 1.00 0.00 C ATOM 22 C ASN A 2 -0.683 -2.335 -2.733 1.00 0.00 C ATOM 23 O ASN A 2 0.285 -3.092 -2.793 1.00 0.00 O ATOM 24 CB ASN A 2 -0.606 0.034 -3.557 1.00 0.00 C ATOM 25 CG ASN A 2 0.228 -0.406 -4.761 1.00 0.00 C ATOM 26 OD1 ASN A 2 1.302 -0.988 -4.643 1.00 0.00 O ATOM 27 ND2 ASN A 2 -0.263 -0.166 -5.959 1.00 0.00 N ATOM 0 H ASN A 2 1.548 -1.368 -2.197 1.00 0.00 H new ATOM 0 HA ASN A 2 -1.213 -0.575 -1.586 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -1.655 0.071 -3.851 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.316 1.048 -3.280 1.00 0.00 H new ATOM 0 HD21 ASN A 2 0.249 -0.464 -6.789 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -1.156 0.318 -6.057 1.00 0.00 H new ATOM 34 N MET A 3 -1.921 -2.736 -3.038 1.00 0.00 N ATOM 35 CA MET A 3 -2.228 -4.110 -3.439 1.00 0.00 C ATOM 36 C MET A 3 -3.034 -4.137 -4.731 1.00 0.00 C ATOM 37 O MET A 3 -4.111 -3.548 -4.786 1.00 0.00 O ATOM 38 CB MET A 3 -2.990 -4.880 -2.341 1.00 0.00 C ATOM 39 CG MET A 3 -2.494 -4.697 -0.904 1.00 0.00 C ATOM 40 SD MET A 3 -3.153 -3.251 -0.041 1.00 0.00 S ATOM 41 CE MET A 3 -2.752 -3.814 1.625 1.00 0.00 C ATOM 0 H MET A 3 -2.734 -2.120 -3.014 1.00 0.00 H new ATOM 0 HA MET A 3 -1.271 -4.606 -3.601 1.00 0.00 H new ATOM 0 HB2 MET A 3 -4.038 -4.581 -2.380 1.00 0.00 H new ATOM 0 HB3 MET A 3 -2.952 -5.942 -2.582 1.00 0.00 H new ATOM 0 HG2 MET A 3 -2.749 -5.589 -0.332 1.00 0.00 H new ATOM 0 HG3 MET A 3 -1.406 -4.628 -0.918 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.136 -3.099 2.353 1.00 0.00 H new ATOM 0 HE2 MET A 3 -3.207 -4.789 1.799 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.670 -3.894 1.731 1.00 0.00 H new ATOM 51 N GLY A 4 -2.547 -4.849 -5.746 1.00 0.00 N ATOM 52 CA GLY A 4 -3.333 -5.170 -6.937 1.00 0.00 C ATOM 53 C GLY A 4 -4.031 -6.500 -6.670 1.00 0.00 C ATOM 54 O GLY A 4 -3.433 -7.365 -6.031 1.00 0.00 O ATOM 0 H GLY A 4 -1.597 -5.220 -5.766 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.063 -4.386 -7.139 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.690 -5.242 -7.815 1.00 0.00 H new ATOM 58 N LEU A 5 -5.274 -6.697 -7.106 1.00 0.00 N ATOM 59 CA LEU A 5 -6.093 -7.850 -6.713 1.00 0.00 C ATOM 60 C LEU A 5 -6.687 -8.419 -7.992 1.00 0.00 C ATOM 61 O LEU A 5 -7.676 -7.874 -8.486 1.00 0.00 O ATOM 62 CB LEU A 5 -7.152 -7.350 -5.709 1.00 0.00 C ATOM 63 CG LEU A 5 -7.983 -8.415 -4.970 1.00 0.00 C ATOM 64 CD1 LEU A 5 -9.067 -7.671 -4.201 1.00 0.00 C ATOM 65 CD2 LEU A 5 -8.641 -9.469 -5.858 1.00 0.00 C ATOM 0 H LEU A 5 -5.747 -6.059 -7.746 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.533 -8.644 -6.219 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -6.646 -6.739 -4.962 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.841 -6.696 -6.243 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.295 -8.974 -4.335 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -9.685 -8.387 -3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.604 -6.982 -3.494 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -9.689 -7.111 -4.899 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.201 -10.169 -5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.319 -8.982 -6.559 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -7.873 -10.009 -6.412 1.00 0.00 H new ATOM 77 N PHE A 6 -6.073 -9.461 -8.551 1.00 0.00 N ATOM 78 CA PHE A 6 -6.428 -9.956 -9.874 1.00 0.00 C ATOM 79 C PHE A 6 -7.227 -11.250 -9.807 1.00 0.00 C ATOM 80 O PHE A 6 -7.013 -12.098 -8.938 1.00 0.00 O ATOM 81 CB PHE A 6 -5.217 -10.011 -10.813 1.00 0.00 C ATOM 82 CG PHE A 6 -4.458 -11.317 -10.915 1.00 0.00 C ATOM 83 CD1 PHE A 6 -4.977 -12.356 -11.709 1.00 0.00 C ATOM 84 CD2 PHE A 6 -3.172 -11.442 -10.358 1.00 0.00 C ATOM 85 CE1 PHE A 6 -4.215 -13.509 -11.939 1.00 0.00 C ATOM 86 CE2 PHE A 6 -2.402 -12.590 -10.619 1.00 0.00 C ATOM 87 CZ PHE A 6 -2.931 -13.632 -11.396 1.00 0.00 C ATOM 0 H PHE A 6 -5.320 -9.981 -8.100 1.00 0.00 H new ATOM 0 HA PHE A 6 -7.104 -9.230 -10.326 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.557 -9.743 -11.813 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.514 -9.240 -10.498 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -5.963 -12.265 -12.141 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -2.776 -10.657 -9.730 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -4.622 -14.309 -12.540 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.401 -12.670 -10.220 1.00 0.00 H new ATOM 0 HZ PHE A 6 -2.350 -14.525 -11.574 1.00 0.00 H new ATOM 97 N TYR A 7 -8.163 -11.373 -10.742 1.00 0.00 N ATOM 98 CA TYR A 7 -9.064 -12.498 -10.926 1.00 0.00 C ATOM 99 C TYR A 7 -9.593 -12.436 -12.364 1.00 0.00 C ATOM 100 O TYR A 7 -9.250 -11.522 -13.118 1.00 0.00 O ATOM 101 CB TYR A 7 -10.192 -12.449 -9.878 1.00 0.00 C ATOM 102 CG TYR A 7 -10.988 -11.158 -9.859 1.00 0.00 C ATOM 103 CD1 TYR A 7 -10.494 -10.046 -9.154 1.00 0.00 C ATOM 104 CD2 TYR A 7 -12.208 -11.059 -10.552 1.00 0.00 C ATOM 105 CE1 TYR A 7 -11.199 -8.833 -9.153 1.00 0.00 C ATOM 106 CE2 TYR A 7 -12.930 -9.854 -10.537 1.00 0.00 C ATOM 107 CZ TYR A 7 -12.432 -8.734 -9.831 1.00 0.00 C ATOM 108 OH TYR A 7 -13.110 -7.554 -9.801 1.00 0.00 O ATOM 0 H TYR A 7 -8.320 -10.641 -11.434 1.00 0.00 H new ATOM 0 HA TYR A 7 -8.551 -13.448 -10.779 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -10.876 -13.278 -10.062 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -9.758 -12.606 -8.890 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.565 -10.126 -8.609 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -12.590 -11.910 -11.096 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.798 -7.975 -8.633 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -13.869 -9.783 -11.066 1.00 0.00 H new ATOM 0 HH TYR A 7 -13.824 -7.570 -10.472 1.00 0.00 H new ATOM 118 N GLY A 8 -10.386 -13.437 -12.758 1.00 0.00 N ATOM 119 CA GLY A 8 -10.833 -13.639 -14.135 1.00 0.00 C ATOM 120 C GLY A 8 -12.075 -12.816 -14.465 1.00 0.00 C ATOM 121 O GLY A 8 -12.201 -11.667 -14.045 1.00 0.00 O ATOM 0 H GLY A 8 -10.741 -14.143 -12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.029 -13.370 -14.819 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.047 -14.696 -14.294 1.00 0.00 H new ATOM 125 N SER A 9 -12.981 -13.425 -15.234 1.00 0.00 N ATOM 126 CA SER A 9 -14.177 -12.792 -15.775 1.00 0.00 C ATOM 127 C SER A 9 -15.070 -12.233 -14.664 1.00 0.00 C ATOM 128 O SER A 9 -15.178 -12.827 -13.590 1.00 0.00 O ATOM 129 CB SER A 9 -14.938 -13.840 -16.604 1.00 0.00 C ATOM 130 OG SER A 9 -14.046 -14.598 -17.403 1.00 0.00 O ATOM 0 H SER A 9 -12.895 -14.405 -15.504 1.00 0.00 H new ATOM 0 HA SER A 9 -13.888 -11.948 -16.402 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.491 -14.504 -15.939 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.671 -13.344 -17.241 1.00 0.00 H new ATOM 0 HG SER A 9 -13.601 -14.008 -18.046 1.00 0.00 H new ATOM 136 N SER A 10 -15.776 -11.138 -14.945 1.00 0.00 N ATOM 137 CA SER A 10 -16.677 -10.467 -14.006 1.00 0.00 C ATOM 138 C SER A 10 -17.809 -11.383 -13.510 1.00 0.00 C ATOM 139 O SER A 10 -18.375 -11.156 -12.441 1.00 0.00 O ATOM 140 CB SER A 10 -17.263 -9.239 -14.717 1.00 0.00 C ATOM 141 OG SER A 10 -16.267 -8.598 -15.510 1.00 0.00 O ATOM 0 H SER A 10 -15.737 -10.680 -15.856 1.00 0.00 H new ATOM 0 HA SER A 10 -16.109 -10.180 -13.121 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.099 -9.541 -15.348 1.00 0.00 H new ATOM 0 HB3 SER A 10 -17.656 -8.538 -13.980 1.00 0.00 H new ATOM 0 HG SER A 10 -16.657 -7.818 -15.958 1.00 0.00 H new ATOM 147 N THR A 11 -18.137 -12.429 -14.274 1.00 0.00 N ATOM 148 CA THR A 11 -19.140 -13.434 -13.947 1.00 0.00 C ATOM 149 C THR A 11 -18.694 -14.366 -12.805 1.00 0.00 C ATOM 150 O THR A 11 -19.538 -15.056 -12.226 1.00 0.00 O ATOM 151 CB THR A 11 -19.450 -14.218 -15.240 1.00 0.00 C ATOM 152 OG1 THR A 11 -18.246 -14.472 -15.956 1.00 0.00 O ATOM 153 CG2 THR A 11 -20.378 -13.414 -16.162 1.00 0.00 C ATOM 0 H THR A 11 -17.689 -12.601 -15.174 1.00 0.00 H new ATOM 0 HA THR A 11 -20.040 -12.944 -13.576 1.00 0.00 H new ATOM 0 HB THR A 11 -19.933 -15.151 -14.949 1.00 0.00 H new ATOM 0 HG1 THR A 11 -18.451 -14.971 -16.774 1.00 0.00 H new ATOM 0 HG21 THR A 11 -20.581 -13.989 -17.066 1.00 0.00 H new ATOM 0 HG22 THR A 11 -21.315 -13.208 -15.645 1.00 0.00 H new ATOM 0 HG23 THR A 11 -19.898 -12.473 -16.431 1.00 0.00 H new ATOM 161 N CYS A 12 -17.398 -14.401 -12.455 1.00 0.00 N ATOM 162 CA CYS A 12 -16.910 -15.206 -11.342 1.00 0.00 C ATOM 163 C CYS A 12 -17.429 -14.605 -10.031 1.00 0.00 C ATOM 164 O CYS A 12 -17.293 -13.399 -9.811 1.00 0.00 O ATOM 165 CB CYS A 12 -15.371 -15.262 -11.324 1.00 0.00 C ATOM 166 SG CYS A 12 -14.710 -15.915 -12.884 1.00 0.00 S ATOM 0 H CYS A 12 -16.670 -13.873 -12.937 1.00 0.00 H new ATOM 0 HA CYS A 12 -17.276 -16.226 -11.458 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -14.972 -14.263 -11.148 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -15.038 -15.888 -10.496 1.00 0.00 H new ATOM 0 HG CYS A 12 -14.621 -14.953 -13.754 1.00 0.00 H new ATOM 172 N TYR A 13 -17.905 -15.449 -9.106 1.00 0.00 N ATOM 173 CA TYR A 13 -18.293 -15.014 -7.759 1.00 0.00 C ATOM 174 C TYR A 13 -17.109 -14.394 -7.003 1.00 0.00 C ATOM 175 O TYR A 13 -17.301 -13.594 -6.090 1.00 0.00 O ATOM 176 CB TYR A 13 -18.905 -16.187 -6.978 1.00 0.00 C ATOM 177 CG TYR A 13 -20.197 -16.713 -7.582 1.00 0.00 C ATOM 178 CD1 TYR A 13 -21.382 -15.964 -7.449 1.00 0.00 C ATOM 179 CD2 TYR A 13 -20.219 -17.932 -8.288 1.00 0.00 C ATOM 180 CE1 TYR A 13 -22.577 -16.414 -8.035 1.00 0.00 C ATOM 181 CE2 TYR A 13 -21.413 -18.396 -8.870 1.00 0.00 C ATOM 182 CZ TYR A 13 -22.601 -17.635 -8.752 1.00 0.00 C ATOM 183 OH TYR A 13 -23.769 -18.064 -9.313 1.00 0.00 O ATOM 0 H TYR A 13 -18.031 -16.448 -9.270 1.00 0.00 H new ATOM 0 HA TYR A 13 -19.049 -14.235 -7.857 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -18.179 -16.999 -6.930 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -19.096 -15.870 -5.953 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -21.372 -15.038 -6.893 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -19.314 -18.514 -8.383 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -23.479 -15.828 -7.938 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -21.423 -19.333 -9.407 1.00 0.00 H new ATOM 0 HH TYR A 13 -23.618 -18.917 -9.771 1.00 0.00 H new ATOM 193 N THR A 14 -15.885 -14.691 -7.445 1.00 0.00 N ATOM 194 CA THR A 14 -14.633 -14.074 -7.027 1.00 0.00 C ATOM 195 C THR A 14 -14.693 -12.540 -7.049 1.00 0.00 C ATOM 196 O THR A 14 -14.012 -11.924 -6.235 1.00 0.00 O ATOM 197 CB THR A 14 -13.547 -14.591 -7.982 1.00 0.00 C ATOM 198 OG1 THR A 14 -13.763 -15.971 -8.201 1.00 0.00 O ATOM 199 CG2 THR A 14 -12.119 -14.395 -7.487 1.00 0.00 C ATOM 0 H THR A 14 -15.737 -15.415 -8.148 1.00 0.00 H new ATOM 0 HA THR A 14 -14.419 -14.342 -5.992 1.00 0.00 H new ATOM 0 HB THR A 14 -13.636 -14.002 -8.895 1.00 0.00 H new ATOM 0 HG1 THR A 14 -13.271 -16.490 -7.530 1.00 0.00 H new ATOM 0 HG21 THR A 14 -11.421 -14.790 -8.225 1.00 0.00 H new ATOM 0 HG22 THR A 14 -11.928 -13.332 -7.339 1.00 0.00 H new ATOM 0 HG23 THR A 14 -11.986 -14.923 -6.543 1.00 0.00 H new ATOM 207 N GLU A 15 -15.508 -11.906 -7.899 1.00 0.00 N ATOM 208 CA GLU A 15 -15.599 -10.449 -7.914 1.00 0.00 C ATOM 209 C GLU A 15 -16.199 -9.929 -6.597 1.00 0.00 C ATOM 210 O GLU A 15 -15.754 -8.893 -6.100 1.00 0.00 O ATOM 211 CB GLU A 15 -16.376 -9.975 -9.151 1.00 0.00 C ATOM 212 CG GLU A 15 -16.409 -8.441 -9.234 1.00 0.00 C ATOM 213 CD GLU A 15 -16.426 -7.930 -10.685 1.00 0.00 C ATOM 214 OE1 GLU A 15 -17.525 -7.747 -11.259 1.00 0.00 O ATOM 215 OE2 GLU A 15 -15.322 -7.678 -11.234 1.00 0.00 O ATOM 0 H GLU A 15 -16.107 -12.376 -8.578 1.00 0.00 H new ATOM 0 HA GLU A 15 -14.597 -10.027 -7.988 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -15.914 -10.380 -10.051 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.394 -10.362 -9.114 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.291 -8.071 -8.711 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -15.539 -8.034 -8.719 1.00 0.00 H new ATOM 222 N MET A 16 -17.127 -10.666 -5.972 1.00 0.00 N ATOM 223 CA MET A 16 -17.685 -10.271 -4.679 1.00 0.00 C ATOM 224 C MET A 16 -16.629 -10.423 -3.584 1.00 0.00 C ATOM 225 O MET A 16 -16.500 -9.530 -2.748 1.00 0.00 O ATOM 226 CB MET A 16 -18.987 -11.025 -4.348 1.00 0.00 C ATOM 227 CG MET A 16 -20.203 -10.399 -5.048 1.00 0.00 C ATOM 228 SD MET A 16 -20.276 -10.544 -6.858 1.00 0.00 S ATOM 229 CE MET A 16 -20.833 -12.261 -6.992 1.00 0.00 C ATOM 0 H MET A 16 -17.505 -11.538 -6.343 1.00 0.00 H new ATOM 0 HA MET A 16 -17.963 -9.219 -4.737 1.00 0.00 H new ATOM 0 HB2 MET A 16 -18.890 -12.068 -4.651 1.00 0.00 H new ATOM 0 HB3 MET A 16 -19.146 -11.020 -3.270 1.00 0.00 H new ATOM 0 HG2 MET A 16 -21.103 -10.854 -4.635 1.00 0.00 H new ATOM 0 HG3 MET A 16 -20.234 -9.340 -4.791 1.00 0.00 H new ATOM 0 HE1 MET A 16 -20.732 -12.597 -8.024 1.00 0.00 H new ATOM 0 HE2 MET A 16 -20.225 -12.892 -6.344 1.00 0.00 H new ATOM 0 HE3 MET A 16 -21.878 -12.329 -6.689 1.00 0.00 H new ATOM 239 N ALA A 17 -15.812 -11.489 -3.616 1.00 0.00 N ATOM 240 CA ALA A 17 -14.658 -11.599 -2.719 1.00 0.00 C ATOM 241 C ALA A 17 -13.712 -10.418 -2.949 1.00 0.00 C ATOM 242 O ALA A 17 -13.246 -9.818 -1.989 1.00 0.00 O ATOM 243 CB ALA A 17 -13.929 -12.936 -2.928 1.00 0.00 C ATOM 0 H ALA A 17 -15.931 -12.279 -4.250 1.00 0.00 H new ATOM 0 HA ALA A 17 -15.008 -11.572 -1.687 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -13.076 -12.995 -2.252 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -14.613 -13.759 -2.722 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.580 -13.003 -3.958 1.00 0.00 H new ATOM 249 N ALA A 18 -13.460 -10.049 -4.207 1.00 0.00 N ATOM 250 CA ALA A 18 -12.514 -9.006 -4.569 1.00 0.00 C ATOM 251 C ALA A 18 -12.939 -7.652 -4.011 1.00 0.00 C ATOM 252 O ALA A 18 -12.134 -6.970 -3.373 1.00 0.00 O ATOM 253 CB ALA A 18 -12.352 -8.960 -6.092 1.00 0.00 C ATOM 0 H ALA A 18 -13.918 -10.477 -5.011 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.547 -9.241 -4.124 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.642 -8.177 -6.359 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -11.982 -9.922 -6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.316 -8.749 -6.554 1.00 0.00 H new ATOM 259 N GLU A 19 -14.203 -7.263 -4.191 1.00 0.00 N ATOM 260 CA GLU A 19 -14.665 -5.987 -3.657 1.00 0.00 C ATOM 261 C GLU A 19 -14.679 -6.022 -2.122 1.00 0.00 C ATOM 262 O GLU A 19 -14.286 -5.043 -1.492 1.00 0.00 O ATOM 263 CB GLU A 19 -15.981 -5.519 -4.298 1.00 0.00 C ATOM 264 CG GLU A 19 -17.196 -6.402 -4.011 1.00 0.00 C ATOM 265 CD GLU A 19 -18.488 -5.762 -4.550 1.00 0.00 C ATOM 266 OE1 GLU A 19 -18.851 -5.999 -5.727 1.00 0.00 O ATOM 267 OE2 GLU A 19 -19.157 -5.015 -3.794 1.00 0.00 O ATOM 0 H GLU A 19 -14.909 -7.802 -4.692 1.00 0.00 H new ATOM 0 HA GLU A 19 -13.950 -5.214 -3.939 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.196 -4.509 -3.951 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.840 -5.462 -5.377 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.054 -7.381 -4.468 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.287 -6.562 -2.937 1.00 0.00 H new ATOM 274 N LYS A 20 -15.012 -7.160 -1.501 1.00 0.00 N ATOM 275 CA LYS A 20 -14.995 -7.278 -0.041 1.00 0.00 C ATOM 276 C LYS A 20 -13.570 -7.194 0.503 1.00 0.00 C ATOM 277 O LYS A 20 -13.365 -6.541 1.520 1.00 0.00 O ATOM 278 CB LYS A 20 -15.726 -8.555 0.407 1.00 0.00 C ATOM 279 CG LYS A 20 -17.247 -8.416 0.190 1.00 0.00 C ATOM 280 CD LYS A 20 -18.019 -9.734 0.387 1.00 0.00 C ATOM 281 CE LYS A 20 -18.035 -10.258 1.836 1.00 0.00 C ATOM 282 NZ LYS A 20 -18.860 -9.424 2.759 1.00 0.00 N ATOM 0 H LYS A 20 -15.296 -8.010 -1.988 1.00 0.00 H new ATOM 0 HA LYS A 20 -15.537 -6.433 0.384 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.350 -9.411 -0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.520 -8.748 1.460 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -17.638 -7.669 0.881 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -17.430 -8.044 -0.818 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -19.047 -9.590 0.055 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.580 -10.497 -0.256 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.417 -11.279 1.841 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.012 -10.299 2.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -19.011 -9.938 3.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -18.366 -8.530 2.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.779 -9.222 2.316 1.00 0.00 H new ATOM 296 N ILE A 21 -12.574 -7.765 -0.181 1.00 0.00 N ATOM 297 CA ILE A 21 -11.172 -7.652 0.199 1.00 0.00 C ATOM 298 C ILE A 21 -10.808 -6.166 0.268 1.00 0.00 C ATOM 299 O ILE A 21 -10.323 -5.715 1.306 1.00 0.00 O ATOM 300 CB ILE A 21 -10.294 -8.444 -0.801 1.00 0.00 C ATOM 301 CG1 ILE A 21 -10.363 -9.978 -0.626 1.00 0.00 C ATOM 302 CG2 ILE A 21 -8.823 -8.017 -0.700 1.00 0.00 C ATOM 303 CD1 ILE A 21 -9.970 -10.755 -1.890 1.00 0.00 C ATOM 0 H ILE A 21 -12.725 -8.323 -1.021 1.00 0.00 H new ATOM 0 HA ILE A 21 -10.992 -8.087 1.182 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.706 -8.203 -1.781 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.705 -10.273 0.192 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -11.376 -10.258 -0.337 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.228 -8.589 -1.413 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.736 -6.954 -0.925 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -8.458 -8.205 0.310 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.041 -11.825 -1.696 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.643 -10.489 -2.705 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.946 -10.504 -2.168 1.00 0.00 H new ATOM 315 N ARG A 22 -11.039 -5.390 -0.805 1.00 0.00 N ATOM 316 CA ARG A 22 -10.662 -3.970 -0.783 1.00 0.00 C ATOM 317 C ARG A 22 -11.448 -3.224 0.281 1.00 0.00 C ATOM 318 O ARG A 22 -10.889 -2.353 0.927 1.00 0.00 O ATOM 319 CB ARG A 22 -10.769 -3.277 -2.162 1.00 0.00 C ATOM 320 CG ARG A 22 -12.183 -3.079 -2.707 1.00 0.00 C ATOM 321 CD ARG A 22 -12.282 -2.025 -3.816 1.00 0.00 C ATOM 322 NE ARG A 22 -13.700 -1.695 -4.081 1.00 0.00 N ATOM 323 CZ ARG A 22 -14.176 -0.953 -5.094 1.00 0.00 C ATOM 324 NH1 ARG A 22 -13.349 -0.405 -5.983 1.00 0.00 N ATOM 325 NH2 ARG A 22 -15.486 -0.762 -5.214 1.00 0.00 N ATOM 0 H ARG A 22 -11.471 -5.710 -1.672 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.604 -3.936 -0.525 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.288 -2.301 -2.094 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -10.201 -3.863 -2.885 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.550 -4.031 -3.091 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.841 -2.791 -1.887 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -11.740 -1.126 -3.523 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.812 -2.398 -4.726 1.00 0.00 H new ATOM 0 HE ARG A 22 -14.387 -2.070 -3.427 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -12.342 -0.547 -5.898 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.722 0.157 -6.748 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.126 -1.178 -4.538 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -15.851 -0.199 -5.982 1.00 0.00 H new ATOM 339 N ASP A 23 -12.718 -3.562 0.465 1.00 0.00 N ATOM 340 CA ASP A 23 -13.592 -2.836 1.379 1.00 0.00 C ATOM 341 C ASP A 23 -13.087 -2.991 2.814 1.00 0.00 C ATOM 342 O ASP A 23 -13.100 -2.039 3.597 1.00 0.00 O ATOM 343 CB ASP A 23 -15.031 -3.343 1.270 1.00 0.00 C ATOM 344 CG ASP A 23 -15.932 -2.618 2.283 1.00 0.00 C ATOM 345 OD1 ASP A 23 -16.263 -1.431 2.052 1.00 0.00 O ATOM 346 OD2 ASP A 23 -16.333 -3.240 3.296 1.00 0.00 O ATOM 0 H ASP A 23 -13.170 -4.342 -0.012 1.00 0.00 H new ATOM 0 HA ASP A 23 -13.579 -1.781 1.106 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.405 -3.180 0.259 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -15.060 -4.417 1.452 1.00 0.00 H new ATOM 351 N ILE A 24 -12.591 -4.189 3.133 1.00 0.00 N ATOM 352 CA ILE A 24 -12.156 -4.577 4.458 1.00 0.00 C ATOM 353 C ILE A 24 -10.756 -4.026 4.736 1.00 0.00 C ATOM 354 O ILE A 24 -10.557 -3.333 5.736 1.00 0.00 O ATOM 355 CB ILE A 24 -12.309 -6.110 4.584 1.00 0.00 C ATOM 356 CG1 ILE A 24 -13.813 -6.471 4.657 1.00 0.00 C ATOM 357 CG2 ILE A 24 -11.542 -6.669 5.789 1.00 0.00 C ATOM 358 CD1 ILE A 24 -14.109 -7.966 4.501 1.00 0.00 C ATOM 0 H ILE A 24 -12.481 -4.934 2.445 1.00 0.00 H new ATOM 0 HA ILE A 24 -12.775 -4.140 5.241 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.871 -6.574 3.700 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -14.211 -6.131 5.613 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -14.345 -5.924 3.878 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.678 -7.749 5.838 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.481 -6.441 5.683 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -11.921 -6.214 6.704 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -15.184 -8.133 4.564 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.745 -8.310 3.533 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.609 -8.521 5.295 1.00 0.00 H new ATOM 370 N ILE A 25 -9.794 -4.322 3.858 1.00 0.00 N ATOM 371 CA ILE A 25 -8.415 -3.855 4.008 1.00 0.00 C ATOM 372 C ILE A 25 -8.367 -2.324 3.957 1.00 0.00 C ATOM 373 O ILE A 25 -7.735 -1.687 4.801 1.00 0.00 O ATOM 374 CB ILE A 25 -7.532 -4.485 2.910 1.00 0.00 C ATOM 375 CG1 ILE A 25 -7.461 -6.014 3.101 1.00 0.00 C ATOM 376 CG2 ILE A 25 -6.124 -3.862 2.855 1.00 0.00 C ATOM 377 CD1 ILE A 25 -6.669 -6.750 2.018 1.00 0.00 C ATOM 0 H ILE A 25 -9.949 -4.891 3.026 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.027 -4.166 4.978 1.00 0.00 H new ATOM 0 HB ILE A 25 -7.998 -4.270 1.949 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.011 -6.226 4.071 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.475 -6.412 3.126 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.545 -4.341 2.066 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.206 -2.795 2.648 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.624 -4.008 3.812 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.670 -7.819 2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.130 -6.572 1.046 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.643 -6.383 2.005 1.00 0.00 H new ATOM 389 N GLY A 26 -9.030 -1.751 2.956 1.00 0.00 N ATOM 390 CA GLY A 26 -9.101 -0.320 2.708 1.00 0.00 C ATOM 391 C GLY A 26 -9.057 -0.035 1.205 1.00 0.00 C ATOM 392 O GLY A 26 -8.060 -0.349 0.549 1.00 0.00 O ATOM 0 H GLY A 26 -9.552 -2.296 2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.019 0.084 3.134 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.271 0.183 3.204 1.00 0.00 H new ATOM 396 N PRO A 27 -10.100 0.592 0.634 1.00 0.00 N ATOM 397 CA PRO A 27 -10.239 0.741 -0.811 1.00 0.00 C ATOM 398 C PRO A 27 -9.337 1.837 -1.404 1.00 0.00 C ATOM 399 O PRO A 27 -9.301 1.994 -2.623 1.00 0.00 O ATOM 400 CB PRO A 27 -11.733 1.007 -1.033 1.00 0.00 C ATOM 401 CG PRO A 27 -12.148 1.734 0.245 1.00 0.00 C ATOM 402 CD PRO A 27 -11.320 1.024 1.306 1.00 0.00 C ATOM 0 HA PRO A 27 -9.905 -0.154 -1.336 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -11.907 1.618 -1.919 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -12.292 0.081 -1.170 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.922 2.799 0.198 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -13.217 1.643 0.436 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.093 1.692 2.137 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -11.861 0.173 1.720 1.00 0.00 H new ATOM 410 N GLU A 28 -8.603 2.592 -0.574 1.00 0.00 N ATOM 411 CA GLU A 28 -7.673 3.614 -1.035 1.00 0.00 C ATOM 412 C GLU A 28 -6.324 2.997 -1.433 1.00 0.00 C ATOM 413 O GLU A 28 -5.582 3.596 -2.213 1.00 0.00 O ATOM 414 CB GLU A 28 -7.536 4.742 0.006 1.00 0.00 C ATOM 415 CG GLU A 28 -6.883 4.314 1.330 1.00 0.00 C ATOM 416 CD GLU A 28 -6.745 5.506 2.296 1.00 0.00 C ATOM 417 OE1 GLU A 28 -5.704 6.205 2.259 1.00 0.00 O ATOM 418 OE2 GLU A 28 -7.672 5.744 3.111 1.00 0.00 O1- ATOM 0 H GLU A 28 -8.644 2.504 0.441 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.078 4.071 -1.938 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.949 5.551 -0.429 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.526 5.145 0.218 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.481 3.532 1.797 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -5.900 3.888 1.132 1.00 0.00 H new ATOM 425 N LEU A 29 -6.006 1.807 -0.902 1.00 0.00 N ATOM 426 CA LEU A 29 -4.722 1.135 -1.071 1.00 0.00 C ATOM 427 C LEU A 29 -4.838 -0.221 -1.775 1.00 0.00 C ATOM 428 O LEU A 29 -3.850 -0.683 -2.345 1.00 0.00 O ATOM 429 CB LEU A 29 -3.991 1.062 0.283 1.00 0.00 C ATOM 430 CG LEU A 29 -4.659 0.245 1.413 1.00 0.00 C ATOM 431 CD1 LEU A 29 -3.578 -0.321 2.344 1.00 0.00 C ATOM 432 CD2 LEU A 29 -5.597 1.082 2.287 1.00 0.00 C ATOM 0 H LEU A 29 -6.659 1.275 -0.327 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.113 1.733 -1.749 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.999 0.645 0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -3.849 2.081 0.644 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.238 -0.536 0.919 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.049 -0.897 3.141 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.910 -0.968 1.775 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.006 0.499 2.778 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.034 0.450 3.061 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.035 1.891 2.753 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.392 1.502 1.670 1.00 0.00 H new ATOM 444 N VAL A 30 -6.015 -0.855 -1.776 1.00 0.00 N ATOM 445 CA VAL A 30 -6.280 -2.023 -2.618 1.00 0.00 C ATOM 446 C VAL A 30 -6.872 -1.516 -3.944 1.00 0.00 C ATOM 447 O VAL A 30 -7.627 -0.543 -3.954 1.00 0.00 O ATOM 448 CB VAL A 30 -7.222 -3.004 -1.903 1.00 0.00 C ATOM 449 CG1 VAL A 30 -7.523 -4.267 -2.732 1.00 0.00 C ATOM 450 CG2 VAL A 30 -6.683 -3.468 -0.549 1.00 0.00 C ATOM 0 H VAL A 30 -6.806 -0.574 -1.196 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.361 -2.573 -2.819 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.137 -2.428 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.193 -4.919 -2.172 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -7.996 -3.981 -3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.593 -4.796 -2.940 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.392 -4.159 -0.093 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.726 -3.971 -0.691 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.546 -2.605 0.103 1.00 0.00 H new ATOM 460 N THR A 31 -6.582 -2.211 -5.042 1.00 0.00 N ATOM 461 CA THR A 31 -7.073 -1.908 -6.385 1.00 0.00 C ATOM 462 C THR A 31 -7.599 -3.210 -6.997 1.00 0.00 C ATOM 463 O THR A 31 -6.927 -4.240 -6.899 1.00 0.00 O ATOM 464 CB THR A 31 -5.925 -1.293 -7.219 1.00 0.00 C ATOM 465 OG1 THR A 31 -5.265 -0.253 -6.512 1.00 0.00 O ATOM 466 CG2 THR A 31 -6.406 -0.716 -8.556 1.00 0.00 C ATOM 0 H THR A 31 -5.976 -3.031 -5.020 1.00 0.00 H new ATOM 0 HA THR A 31 -7.884 -1.180 -6.363 1.00 0.00 H new ATOM 0 HB THR A 31 -5.239 -2.118 -7.411 1.00 0.00 H new ATOM 0 HG1 THR A 31 -4.544 0.113 -7.066 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.558 -0.298 -9.098 1.00 0.00 H new ATOM 0 HG22 THR A 31 -6.863 -1.507 -9.151 1.00 0.00 H new ATOM 0 HG23 THR A 31 -7.140 0.068 -8.371 1.00 0.00 H new ATOM 474 N LEU A 32 -8.784 -3.185 -7.620 1.00 0.00 N ATOM 475 CA LEU A 32 -9.311 -4.360 -8.320 1.00 0.00 C ATOM 476 C LEU A 32 -8.629 -4.458 -9.682 1.00 0.00 C ATOM 477 O LEU A 32 -8.412 -3.445 -10.344 1.00 0.00 O ATOM 478 CB LEU A 32 -10.849 -4.317 -8.475 1.00 0.00 C ATOM 479 CG LEU A 32 -11.663 -4.141 -7.178 1.00 0.00 C ATOM 480 CD1 LEU A 32 -13.146 -4.434 -7.425 1.00 0.00 C ATOM 481 CD2 LEU A 32 -11.166 -5.049 -6.051 1.00 0.00 C ATOM 0 H LEU A 32 -9.393 -2.367 -7.653 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.093 -5.246 -7.724 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.102 -3.500 -9.151 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.170 -5.240 -8.957 1.00 0.00 H new ATOM 0 HG LEU A 32 -11.530 -3.104 -6.871 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.702 -4.304 -6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -13.532 -3.747 -8.179 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -13.261 -5.460 -7.776 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.772 -4.887 -5.159 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.247 -6.091 -6.361 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.124 -4.817 -5.829 1.00 0.00 H new ATOM 493 N HIS A 33 -8.313 -5.681 -10.104 1.00 0.00 N ATOM 494 CA HIS A 33 -7.600 -5.975 -11.341 1.00 0.00 C ATOM 495 C HIS A 33 -8.312 -7.140 -12.041 1.00 0.00 C ATOM 496 O HIS A 33 -7.734 -8.185 -12.329 1.00 0.00 O ATOM 497 CB HIS A 33 -6.114 -6.199 -11.014 1.00 0.00 C ATOM 498 CG HIS A 33 -5.233 -6.275 -12.225 1.00 0.00 C ATOM 499 ND1 HIS A 33 -4.455 -7.368 -12.609 1.00 0.00 N ATOM 500 CD2 HIS A 33 -5.047 -5.253 -13.101 1.00 0.00 C ATOM 501 CE1 HIS A 33 -3.856 -6.991 -13.747 1.00 0.00 C ATOM 502 NE2 HIS A 33 -4.207 -5.739 -14.079 1.00 0.00 N ATOM 0 H HIS A 33 -8.555 -6.520 -9.576 1.00 0.00 H new ATOM 0 HA HIS A 33 -7.615 -5.149 -12.052 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -5.766 -5.388 -10.373 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -6.012 -7.122 -10.444 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -5.471 -4.262 -13.043 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -3.182 -7.611 -14.319 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -3.904 -5.234 -14.912 1.00 0.00 H new ATOM 510 N ASN A 34 -9.622 -6.972 -12.258 1.00 0.00 N ATOM 511 CA ASN A 34 -10.419 -7.884 -13.077 1.00 0.00 C ATOM 512 C ASN A 34 -9.744 -7.974 -14.449 1.00 0.00 C ATOM 513 O ASN A 34 -9.526 -6.940 -15.088 1.00 0.00 O ATOM 514 CB ASN A 34 -11.848 -7.322 -13.198 1.00 0.00 C ATOM 515 CG ASN A 34 -12.786 -8.171 -14.056 1.00 0.00 C ATOM 516 OD1 ASN A 34 -12.407 -8.689 -15.098 1.00 0.00 O ATOM 517 ND2 ASN A 34 -14.051 -8.270 -13.686 1.00 0.00 N ATOM 0 H ASN A 34 -10.158 -6.197 -11.868 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.481 -8.878 -12.634 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.274 -7.227 -12.199 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.797 -6.318 -13.620 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -14.715 -8.779 -14.270 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -14.364 -7.837 -12.817 1.00 0.00 H new ATOM 524 N LEU A 35 -9.396 -9.177 -14.907 1.00 0.00 N ATOM 525 CA LEU A 35 -8.570 -9.324 -16.104 1.00 0.00 C ATOM 526 C LEU A 35 -9.323 -8.995 -17.399 1.00 0.00 C ATOM 527 O LEU A 35 -8.677 -8.743 -18.419 1.00 0.00 O ATOM 528 CB LEU A 35 -7.926 -10.715 -16.144 1.00 0.00 C ATOM 529 CG LEU A 35 -6.693 -10.809 -15.221 1.00 0.00 C ATOM 530 CD1 LEU A 35 -6.319 -12.284 -15.045 1.00 0.00 C ATOM 531 CD2 LEU A 35 -5.492 -10.032 -15.793 1.00 0.00 C ATOM 0 H LEU A 35 -9.671 -10.057 -14.471 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.774 -8.583 -16.039 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -8.660 -11.463 -15.845 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -7.631 -10.949 -17.167 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.946 -10.362 -14.260 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.448 -12.363 -14.394 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.156 -12.821 -14.598 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.086 -12.719 -16.017 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.644 -10.122 -15.115 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.223 -10.442 -16.766 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.758 -8.981 -15.903 1.00 0.00 H new ATOM 543 N LYS A 36 -10.663 -8.955 -17.388 1.00 0.00 N ATOM 544 CA LYS A 36 -11.426 -8.405 -18.503 1.00 0.00 C ATOM 545 C LYS A 36 -11.169 -6.893 -18.604 1.00 0.00 C ATOM 546 O LYS A 36 -11.210 -6.342 -19.706 1.00 0.00 O ATOM 547 CB LYS A 36 -12.932 -8.698 -18.310 1.00 0.00 C ATOM 548 CG LYS A 36 -13.847 -8.271 -19.477 1.00 0.00 C ATOM 549 CD LYS A 36 -13.648 -9.081 -20.769 1.00 0.00 C ATOM 550 CE LYS A 36 -14.342 -10.449 -20.669 1.00 0.00 C ATOM 551 NZ LYS A 36 -13.774 -11.439 -21.619 1.00 0.00 N ATOM 0 H LYS A 36 -11.235 -9.298 -16.617 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.106 -8.876 -19.432 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.058 -9.768 -18.145 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.269 -8.194 -17.404 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -14.886 -8.364 -19.161 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -13.672 -7.217 -19.693 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -14.049 -8.526 -21.617 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -12.583 -9.221 -20.955 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.247 -10.829 -19.652 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.407 -10.329 -20.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -14.367 -12.293 -21.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.748 -11.028 -22.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.809 -11.690 -21.323 1.00 0.00 H new ATOM 565 N ASP A 37 -10.913 -6.223 -17.477 1.00 0.00 N ATOM 566 CA ASP A 37 -10.879 -4.765 -17.384 1.00 0.00 C ATOM 567 C ASP A 37 -9.485 -4.173 -17.589 1.00 0.00 C ATOM 568 O ASP A 37 -9.369 -3.117 -18.219 1.00 0.00 O ATOM 569 CB ASP A 37 -11.460 -4.294 -16.050 1.00 0.00 C ATOM 570 CG ASP A 37 -11.516 -2.758 -16.001 1.00 0.00 C ATOM 571 OD1 ASP A 37 -12.366 -2.161 -16.708 1.00 0.00 O ATOM 572 OD2 ASP A 37 -10.748 -2.145 -15.222 1.00 0.00 O ATOM 0 H ASP A 37 -10.721 -6.688 -16.590 1.00 0.00 H new ATOM 0 HA ASP A 37 -11.497 -4.398 -18.203 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -12.461 -4.705 -15.917 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -10.850 -4.668 -15.228 1.00 0.00 H new ATOM 577 N ASP A 38 -8.423 -4.836 -17.114 1.00 0.00 N ATOM 578 CA ASP A 38 -7.045 -4.359 -17.302 1.00 0.00 C ATOM 579 C ASP A 38 -6.067 -5.498 -17.599 1.00 0.00 C ATOM 580 O ASP A 38 -6.318 -6.662 -17.270 1.00 0.00 O ATOM 581 CB ASP A 38 -6.544 -3.503 -16.120 1.00 0.00 C ATOM 582 CG ASP A 38 -5.750 -2.273 -16.609 1.00 0.00 C ATOM 583 OD1 ASP A 38 -5.086 -2.337 -17.671 1.00 0.00 O ATOM 584 OD2 ASP A 38 -5.792 -1.228 -15.914 1.00 0.00 O1- ATOM 0 H ASP A 38 -8.492 -5.710 -16.593 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.078 -3.714 -18.180 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -7.394 -3.174 -15.521 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.913 -4.110 -15.471 1.00 0.00 H new ATOM 589 N SER A 39 -4.952 -5.145 -18.235 1.00 0.00 N ATOM 590 CA SER A 39 -3.962 -6.051 -18.807 1.00 0.00 C ATOM 591 C SER A 39 -3.015 -6.602 -17.723 1.00 0.00 C ATOM 592 O SER A 39 -2.885 -5.993 -16.658 1.00 0.00 O ATOM 593 CB SER A 39 -3.226 -5.291 -19.931 1.00 0.00 C ATOM 594 OG SER A 39 -4.159 -4.738 -20.856 1.00 0.00 O ATOM 0 H SER A 39 -4.703 -4.165 -18.372 1.00 0.00 H new ATOM 0 HA SER A 39 -4.442 -6.931 -19.235 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.617 -4.496 -19.501 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.547 -5.967 -20.451 1.00 0.00 H new ATOM 0 HG SER A 39 -3.676 -4.258 -21.561 1.00 0.00 H new ATOM 600 N PRO A 40 -2.308 -7.731 -17.950 1.00 0.00 N ATOM 601 CA PRO A 40 -1.537 -8.401 -16.897 1.00 0.00 C ATOM 602 C PRO A 40 -0.226 -7.694 -16.562 1.00 0.00 C ATOM 603 O PRO A 40 0.259 -7.820 -15.448 1.00 0.00 O ATOM 604 CB PRO A 40 -1.276 -9.814 -17.425 1.00 0.00 C ATOM 605 CG PRO A 40 -1.202 -9.591 -18.934 1.00 0.00 C ATOM 606 CD PRO A 40 -2.285 -8.535 -19.169 1.00 0.00 C ATOM 0 HA PRO A 40 -2.096 -8.397 -15.961 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -0.350 -10.231 -17.030 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -2.076 -10.503 -17.155 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -0.218 -9.239 -19.244 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.402 -10.507 -19.489 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -2.055 -7.922 -20.040 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.254 -8.999 -19.353 1.00 0.00 H new ATOM 614 N LYS A 41 0.360 -6.919 -17.478 1.00 0.00 N ATOM 615 CA LYS A 41 1.676 -6.298 -17.257 1.00 0.00 C ATOM 616 C LYS A 41 1.599 -5.235 -16.142 1.00 0.00 C ATOM 617 O LYS A 41 2.601 -4.921 -15.506 1.00 0.00 O ATOM 618 CB LYS A 41 2.222 -5.761 -18.602 1.00 0.00 C ATOM 619 CG LYS A 41 2.378 -6.860 -19.684 1.00 0.00 C ATOM 620 CD LYS A 41 3.749 -7.558 -19.719 1.00 0.00 C ATOM 621 CE LYS A 41 4.827 -6.798 -20.520 1.00 0.00 C ATOM 622 NZ LYS A 41 4.622 -6.852 -21.994 1.00 0.00 N1+ ATOM 0 H LYS A 41 -0.055 -6.704 -18.384 1.00 0.00 H new ATOM 0 HA LYS A 41 2.390 -7.040 -16.899 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.552 -4.987 -18.975 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.190 -5.290 -18.431 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.608 -7.615 -19.525 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.191 -6.414 -20.661 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.101 -7.694 -18.696 1.00 0.00 H new ATOM 0 HD3 LYS A 41 3.627 -8.552 -20.149 1.00 0.00 H new ATOM 0 HE2 LYS A 41 4.838 -5.756 -20.201 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.806 -7.214 -20.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.380 -6.322 -22.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.640 -7.842 -22.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 3.702 -6.429 -22.232 1.00 0.00 H new ATOM 636 N LEU A 42 0.385 -4.775 -15.818 1.00 0.00 N ATOM 637 CA LEU A 42 0.048 -3.909 -14.685 1.00 0.00 C ATOM 638 C LEU A 42 0.432 -4.574 -13.372 1.00 0.00 C ATOM 639 O LEU A 42 0.782 -3.868 -12.431 1.00 0.00 O ATOM 640 CB LEU A 42 -1.478 -3.653 -14.653 1.00 0.00 C ATOM 641 CG LEU A 42 -2.136 -2.689 -15.671 1.00 0.00 C ATOM 642 CD1 LEU A 42 -1.954 -1.232 -15.237 1.00 0.00 C ATOM 643 CD2 LEU A 42 -1.606 -2.821 -17.104 1.00 0.00 C ATOM 0 H LEU A 42 -0.437 -5.012 -16.374 1.00 0.00 H new ATOM 0 HA LEU A 42 0.594 -2.973 -14.805 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.969 -4.620 -14.763 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.721 -3.283 -13.657 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.187 -2.976 -15.678 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.424 -0.573 -15.967 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.417 -1.082 -14.262 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.891 -1.002 -15.173 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.121 -2.110 -17.749 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.536 -2.614 -17.117 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.784 -3.834 -17.466 1.00 0.00 H new ATOM 655 N MET A 43 0.389 -5.908 -13.288 1.00 0.00 N ATOM 656 CA MET A 43 0.710 -6.647 -12.067 1.00 0.00 C ATOM 657 C MET A 43 2.138 -6.357 -11.606 1.00 0.00 C ATOM 658 O MET A 43 2.431 -6.494 -10.421 1.00 0.00 O ATOM 659 CB MET A 43 0.585 -8.157 -12.289 1.00 0.00 C ATOM 660 CG MET A 43 -0.838 -8.621 -12.590 1.00 0.00 C ATOM 661 SD MET A 43 -0.918 -10.418 -12.700 1.00 0.00 S ATOM 662 CE MET A 43 -2.514 -10.602 -13.528 1.00 0.00 C ATOM 0 H MET A 43 0.129 -6.507 -14.071 1.00 0.00 H new ATOM 0 HA MET A 43 0.000 -6.321 -11.307 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.234 -8.448 -13.115 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.946 -8.676 -11.401 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.512 -8.270 -11.809 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.178 -8.180 -13.527 1.00 0.00 H new ATOM 0 HE1 MET A 43 -2.818 -11.648 -13.504 1.00 0.00 H new ATOM 0 HE2 MET A 43 -3.261 -9.995 -13.017 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.427 -10.274 -14.564 1.00 0.00 H new ATOM 672 N GLU A 44 3.031 -5.947 -12.515 1.00 0.00 N ATOM 673 CA GLU A 44 4.418 -5.672 -12.175 1.00 0.00 C ATOM 674 C GLU A 44 4.506 -4.482 -11.211 1.00 0.00 C ATOM 675 O GLU A 44 5.368 -4.480 -10.331 1.00 0.00 O ATOM 676 CB GLU A 44 5.264 -5.442 -13.441 1.00 0.00 C ATOM 677 CG GLU A 44 5.353 -6.685 -14.345 1.00 0.00 C ATOM 678 CD GLU A 44 6.306 -6.488 -15.543 1.00 0.00 C ATOM 679 OE1 GLU A 44 6.216 -5.458 -16.254 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 7.140 -7.391 -15.797 1.00 0.00 O ATOM 0 H GLU A 44 2.807 -5.800 -13.499 1.00 0.00 H new ATOM 0 HA GLU A 44 4.829 -6.545 -11.668 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.837 -4.616 -14.010 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.270 -5.141 -13.148 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.692 -7.535 -13.753 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.358 -6.931 -14.715 1.00 0.00 H new ATOM 687 N GLN A 45 3.583 -3.515 -11.315 1.00 0.00 N ATOM 688 CA GLN A 45 3.683 -2.228 -10.620 1.00 0.00 C ATOM 689 C GLN A 45 3.498 -2.321 -9.101 1.00 0.00 C ATOM 690 O GLN A 45 4.145 -1.594 -8.345 1.00 0.00 O ATOM 691 CB GLN A 45 2.577 -1.285 -11.116 1.00 0.00 C ATOM 692 CG GLN A 45 2.453 -1.084 -12.635 1.00 0.00 C ATOM 693 CD GLN A 45 1.135 -0.375 -12.949 1.00 0.00 C ATOM 694 OE1 GLN A 45 1.110 0.743 -13.456 1.00 0.00 O ATOM 695 NE2 GLN A 45 0.010 -1.006 -12.624 1.00 0.00 N ATOM 0 H GLN A 45 2.743 -3.606 -11.887 1.00 0.00 H new ATOM 0 HA GLN A 45 4.689 -1.869 -10.835 1.00 0.00 H new ATOM 0 HB2 GLN A 45 1.623 -1.660 -10.746 1.00 0.00 H new ATOM 0 HB3 GLN A 45 2.735 -0.309 -10.658 1.00 0.00 H new ATOM 0 HG2 GLN A 45 3.292 -0.495 -13.004 1.00 0.00 H new ATOM 0 HG3 GLN A 45 2.491 -2.047 -13.144 1.00 0.00 H new ATOM 0 HE21 GLN A 45 0.049 -1.935 -12.204 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.892 -0.561 -12.795 1.00 0.00 H new ATOM 704 N TYR A 46 2.560 -3.168 -8.669 1.00 0.00 N ATOM 705 CA TYR A 46 2.051 -3.163 -7.300 1.00 0.00 C ATOM 706 C TYR A 46 3.085 -3.714 -6.319 1.00 0.00 C ATOM 707 O TYR A 46 3.768 -4.692 -6.623 1.00 0.00 O ATOM 708 CB TYR A 46 0.720 -3.929 -7.206 1.00 0.00 C ATOM 709 CG TYR A 46 -0.383 -3.489 -8.156 1.00 0.00 C ATOM 710 CD1 TYR A 46 -0.441 -4.007 -9.463 1.00 0.00 C ATOM 711 CD2 TYR A 46 -1.385 -2.598 -7.726 1.00 0.00 C ATOM 712 CE1 TYR A 46 -1.479 -3.628 -10.334 1.00 0.00 C ATOM 713 CE2 TYR A 46 -2.395 -2.176 -8.611 1.00 0.00 C ATOM 714 CZ TYR A 46 -2.445 -2.687 -9.927 1.00 0.00 C ATOM 715 OH TYR A 46 -3.409 -2.298 -10.812 1.00 0.00 O ATOM 0 H TYR A 46 2.132 -3.878 -9.263 1.00 0.00 H new ATOM 0 HA TYR A 46 1.859 -2.128 -7.019 1.00 0.00 H new ATOM 0 HB2 TYR A 46 0.921 -4.986 -7.382 1.00 0.00 H new ATOM 0 HB3 TYR A 46 0.347 -3.841 -6.186 1.00 0.00 H new ATOM 0 HD1 TYR A 46 0.316 -4.700 -9.800 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -1.379 -2.235 -6.709 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -1.536 -4.062 -11.322 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -3.134 -1.460 -8.283 1.00 0.00 H new ATOM 0 HH TYR A 46 -4.002 -1.646 -10.384 1.00 0.00 H new ATOM 725 N ASP A 47 3.174 -3.120 -5.126 1.00 0.00 N ATOM 726 CA ASP A 47 4.065 -3.579 -4.053 1.00 0.00 C ATOM 727 C ASP A 47 3.572 -4.910 -3.489 1.00 0.00 C ATOM 728 O ASP A 47 4.370 -5.738 -3.042 1.00 0.00 O ATOM 729 CB ASP A 47 4.133 -2.546 -2.915 1.00 0.00 C ATOM 730 CG ASP A 47 4.972 -1.300 -3.238 1.00 0.00 C ATOM 731 OD1 ASP A 47 6.046 -1.408 -3.878 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 4.562 -0.196 -2.803 1.00 0.00 O ATOM 0 H ASP A 47 2.625 -2.298 -4.874 1.00 0.00 H new ATOM 0 HA ASP A 47 5.061 -3.706 -4.478 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.120 -2.232 -2.665 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.546 -3.027 -2.028 1.00 0.00 H new ATOM 737 N VAL A 48 2.259 -5.131 -3.524 1.00 0.00 N ATOM 738 CA VAL A 48 1.620 -6.384 -3.173 1.00 0.00 C ATOM 739 C VAL A 48 0.749 -6.782 -4.350 1.00 0.00 C ATOM 740 O VAL A 48 0.132 -5.933 -4.994 1.00 0.00 O ATOM 741 CB VAL A 48 0.748 -6.243 -1.911 1.00 0.00 C ATOM 742 CG1 VAL A 48 0.271 -7.624 -1.437 1.00 0.00 C ATOM 743 CG2 VAL A 48 1.417 -5.451 -0.777 1.00 0.00 C ATOM 0 H VAL A 48 1.593 -4.413 -3.809 1.00 0.00 H new ATOM 0 HA VAL A 48 2.379 -7.136 -2.958 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.119 -5.647 -2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.344 -7.510 -0.544 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.316 -8.096 -2.225 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.135 -8.247 -1.205 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.741 -5.395 0.076 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.338 -5.951 -0.478 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.647 -4.444 -1.124 1.00 0.00 H new ATOM 753 N LEU A 49 0.613 -8.077 -4.582 1.00 0.00 N ATOM 754 CA LEU A 49 -0.342 -8.626 -5.523 1.00 0.00 C ATOM 755 C LEU A 49 -1.202 -9.638 -4.777 1.00 0.00 C ATOM 756 O LEU A 49 -0.732 -10.261 -3.832 1.00 0.00 O ATOM 757 CB LEU A 49 0.485 -9.258 -6.640 1.00 0.00 C ATOM 758 CG LEU A 49 -0.287 -9.643 -7.914 1.00 0.00 C ATOM 759 CD1 LEU A 49 -0.878 -8.416 -8.615 1.00 0.00 C ATOM 760 CD2 LEU A 49 0.670 -10.348 -8.881 1.00 0.00 C ATOM 0 H LEU A 49 1.175 -8.787 -4.112 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.016 -7.886 -5.955 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.278 -8.563 -6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 49 0.967 -10.153 -6.247 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.108 -10.299 -7.625 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.415 -8.731 -9.510 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.566 -7.907 -7.940 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.074 -7.735 -8.895 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.132 -10.625 -9.788 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.490 -9.676 -9.136 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.070 -11.245 -8.408 1.00 0.00 H new ATOM 772 N ILE A 50 -2.448 -9.822 -5.176 1.00 0.00 N ATOM 773 CA ILE A 50 -3.380 -10.765 -4.597 1.00 0.00 C ATOM 774 C ILE A 50 -3.926 -11.559 -5.799 1.00 0.00 C ATOM 775 O ILE A 50 -4.365 -10.946 -6.773 1.00 0.00 O ATOM 776 CB ILE A 50 -4.433 -9.974 -3.779 1.00 0.00 C ATOM 777 CG1 ILE A 50 -3.904 -9.353 -2.461 1.00 0.00 C ATOM 778 CG2 ILE A 50 -5.647 -10.862 -3.511 1.00 0.00 C ATOM 779 CD1 ILE A 50 -4.767 -8.173 -1.989 1.00 0.00 C ATOM 0 H ILE A 50 -2.853 -9.292 -5.948 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.955 -11.471 -3.884 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.712 -9.119 -4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.881 -10.118 -1.685 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.878 -9.015 -2.606 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.386 -10.304 -2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.085 -11.175 -4.459 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.337 -11.742 -2.947 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.358 -7.771 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.769 -7.395 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.788 -8.515 -1.816 1.00 0.00 H new ATOM 791 N LEU A 51 -3.874 -12.894 -5.748 1.00 0.00 N ATOM 792 CA LEU A 51 -4.310 -13.816 -6.811 1.00 0.00 C ATOM 793 C LEU A 51 -5.602 -14.464 -6.329 1.00 0.00 C ATOM 794 O LEU A 51 -5.605 -14.945 -5.195 1.00 0.00 O ATOM 795 CB LEU A 51 -3.241 -14.919 -7.033 1.00 0.00 C ATOM 796 CG LEU A 51 -1.988 -14.540 -7.837 1.00 0.00 C ATOM 797 CD1 LEU A 51 -1.417 -13.156 -7.520 1.00 0.00 C ATOM 798 CD2 LEU A 51 -0.882 -15.546 -7.547 1.00 0.00 C ATOM 0 H LEU A 51 -3.512 -13.386 -4.931 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.453 -13.281 -7.750 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.918 -15.276 -6.055 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.722 -15.758 -7.536 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.309 -14.537 -8.879 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.535 -12.977 -8.135 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.168 -12.395 -7.732 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.140 -13.109 -6.467 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.009 -15.281 -8.116 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.650 -15.535 -6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.213 -16.544 -7.835 1.00 0.00 H new ATOM 810 N GLY A 52 -6.657 -14.534 -7.152 1.00 0.00 N ATOM 811 CA GLY A 52 -7.932 -15.099 -6.734 1.00 0.00 C ATOM 812 C GLY A 52 -8.497 -15.939 -7.860 1.00 0.00 C ATOM 813 O GLY A 52 -8.558 -15.463 -8.994 1.00 0.00 O ATOM 0 H GLY A 52 -6.644 -14.202 -8.116 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.798 -15.709 -5.841 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.629 -14.302 -6.474 1.00 0.00 H new ATOM 817 N ILE A 53 -8.885 -17.187 -7.589 1.00 0.00 N ATOM 818 CA ILE A 53 -9.425 -18.077 -8.617 1.00 0.00 C ATOM 819 C ILE A 53 -10.396 -19.106 -8.023 1.00 0.00 C ATOM 820 O ILE A 53 -10.068 -19.722 -7.011 1.00 0.00 O ATOM 821 CB ILE A 53 -8.254 -18.745 -9.379 1.00 0.00 C ATOM 822 CG1 ILE A 53 -8.792 -19.709 -10.454 1.00 0.00 C ATOM 823 CG2 ILE A 53 -7.217 -19.458 -8.485 1.00 0.00 C ATOM 824 CD1 ILE A 53 -7.913 -19.770 -11.679 1.00 0.00 C ATOM 0 H ILE A 53 -8.834 -17.605 -6.660 1.00 0.00 H new ATOM 0 HA ILE A 53 -10.009 -17.491 -9.326 1.00 0.00 H new ATOM 0 HB ILE A 53 -7.711 -17.924 -9.847 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -8.882 -20.708 -10.027 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.794 -19.396 -10.747 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -6.437 -19.894 -9.109 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -6.772 -18.738 -7.798 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -7.709 -20.246 -7.915 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -8.342 -20.465 -12.401 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -7.843 -18.779 -12.127 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -6.917 -20.111 -11.396 1.00 0.00 H new ATOM 836 N PRO A 54 -11.570 -19.347 -8.627 1.00 0.00 N ATOM 837 CA PRO A 54 -12.404 -20.479 -8.258 1.00 0.00 C ATOM 838 C PRO A 54 -11.938 -21.715 -9.043 1.00 0.00 C ATOM 839 O PRO A 54 -11.684 -21.637 -10.246 1.00 0.00 O ATOM 840 CB PRO A 54 -13.825 -20.043 -8.608 1.00 0.00 C ATOM 841 CG PRO A 54 -13.625 -19.160 -9.839 1.00 0.00 C ATOM 842 CD PRO A 54 -12.245 -18.531 -9.633 1.00 0.00 C ATOM 0 HA PRO A 54 -12.347 -20.754 -7.205 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.467 -20.897 -8.825 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.291 -19.494 -7.790 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.662 -19.745 -10.758 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.402 -18.399 -9.913 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.681 -18.517 -10.565 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -12.335 -17.497 -9.299 1.00 0.00 H new ATOM 850 N THR A 55 -11.833 -22.861 -8.375 1.00 0.00 N ATOM 851 CA THR A 55 -11.632 -24.151 -9.023 1.00 0.00 C ATOM 852 C THR A 55 -12.989 -24.871 -9.014 1.00 0.00 C ATOM 853 O THR A 55 -13.609 -25.017 -7.958 1.00 0.00 O ATOM 854 CB THR A 55 -10.525 -24.952 -8.322 1.00 0.00 C ATOM 855 OG1 THR A 55 -9.350 -24.175 -8.155 1.00 0.00 O ATOM 856 CG2 THR A 55 -10.114 -26.156 -9.161 1.00 0.00 C ATOM 0 H THR A 55 -11.886 -22.919 -7.358 1.00 0.00 H new ATOM 0 HA THR A 55 -11.291 -24.032 -10.051 1.00 0.00 H new ATOM 0 HB THR A 55 -10.934 -25.255 -7.358 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.456 -23.584 -7.381 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.329 -26.708 -8.645 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.976 -26.806 -9.311 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.743 -25.816 -10.128 1.00 0.00 H new ATOM 864 N TRP A 56 -13.433 -25.328 -10.187 1.00 0.00 N ATOM 865 CA TRP A 56 -14.611 -26.166 -10.386 1.00 0.00 C ATOM 866 C TRP A 56 -14.280 -27.140 -11.517 1.00 0.00 C ATOM 867 O TRP A 56 -13.476 -26.803 -12.388 1.00 0.00 O ATOM 868 CB TRP A 56 -15.825 -25.320 -10.806 1.00 0.00 C ATOM 869 CG TRP A 56 -16.321 -24.279 -9.849 1.00 0.00 C ATOM 870 CD1 TRP A 56 -16.803 -24.513 -8.608 1.00 0.00 C ATOM 871 CD2 TRP A 56 -16.470 -22.840 -10.066 1.00 0.00 C ATOM 872 NE1 TRP A 56 -17.241 -23.332 -8.046 1.00 0.00 N ATOM 873 CE2 TRP A 56 -17.076 -22.267 -8.907 1.00 0.00 C ATOM 874 CE3 TRP A 56 -16.181 -21.964 -11.136 1.00 0.00 C ATOM 875 CZ2 TRP A 56 -17.383 -20.899 -8.818 1.00 0.00 C ATOM 876 CZ3 TRP A 56 -16.485 -20.590 -11.059 1.00 0.00 C ATOM 877 CH2 TRP A 56 -17.086 -20.058 -9.905 1.00 0.00 C ATOM 0 H TRP A 56 -12.957 -25.112 -11.063 1.00 0.00 H new ATOM 0 HA TRP A 56 -14.859 -26.682 -9.458 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -15.577 -24.821 -11.743 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -16.650 -26.001 -11.016 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -16.840 -25.480 -8.128 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -17.638 -23.256 -7.109 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -15.718 -22.355 -12.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -17.841 -20.498 -7.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -16.255 -19.942 -11.892 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -17.319 -19.005 -9.853 1.00 0.00 H new ATOM 888 N ASP A 57 -14.930 -28.303 -11.545 1.00 0.00 N ATOM 889 CA ASP A 57 -14.856 -29.200 -12.699 1.00 0.00 C ATOM 890 C ASP A 57 -15.474 -28.514 -13.921 1.00 0.00 C ATOM 891 O ASP A 57 -16.470 -27.799 -13.779 1.00 0.00 O ATOM 892 CB ASP A 57 -15.587 -30.511 -12.407 1.00 0.00 C ATOM 893 CG ASP A 57 -15.666 -31.397 -13.662 1.00 0.00 C ATOM 894 OD1 ASP A 57 -14.600 -31.810 -14.178 1.00 0.00 O ATOM 895 OD2 ASP A 57 -16.792 -31.677 -14.138 1.00 0.00 O ATOM 0 H ASP A 57 -15.514 -28.647 -10.782 1.00 0.00 H new ATOM 0 HA ASP A 57 -13.810 -29.428 -12.903 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -15.071 -31.048 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -16.593 -30.297 -12.046 1.00 0.00 H new ATOM 900 N PHE A 58 -14.881 -28.729 -15.103 1.00 0.00 N ATOM 901 CA PHE A 58 -15.198 -28.125 -16.403 1.00 0.00 C ATOM 902 C PHE A 58 -14.983 -26.600 -16.468 1.00 0.00 C ATOM 903 O PHE A 58 -14.411 -26.122 -17.450 1.00 0.00 O ATOM 904 CB PHE A 58 -16.596 -28.552 -16.880 1.00 0.00 C ATOM 905 CG PHE A 58 -16.929 -28.123 -18.296 1.00 0.00 C ATOM 906 CD1 PHE A 58 -16.448 -28.870 -19.389 1.00 0.00 C ATOM 907 CD2 PHE A 58 -17.709 -26.970 -18.526 1.00 0.00 C ATOM 908 CE1 PHE A 58 -16.744 -28.469 -20.705 1.00 0.00 C ATOM 909 CE2 PHE A 58 -18.006 -26.571 -19.842 1.00 0.00 C ATOM 910 CZ PHE A 58 -17.522 -27.319 -20.931 1.00 0.00 C ATOM 0 H PHE A 58 -14.103 -29.384 -15.180 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.467 -28.522 -17.107 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -16.674 -29.637 -16.813 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.341 -28.136 -16.202 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -15.850 -29.753 -19.217 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.078 -26.393 -17.691 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -16.374 -29.044 -21.541 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.606 -25.690 -20.016 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.748 -27.010 -21.941 1.00 0.00 H new ATOM 920 N GLY A 59 -15.393 -25.845 -15.446 1.00 0.00 N ATOM 921 CA GLY A 59 -15.217 -24.400 -15.378 1.00 0.00 C ATOM 922 C GLY A 59 -13.729 -24.058 -15.299 1.00 0.00 C ATOM 923 O GLY A 59 -13.189 -23.428 -16.214 1.00 0.00 O ATOM 0 H GLY A 59 -15.865 -26.232 -14.629 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.661 -23.930 -16.255 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.737 -24.003 -14.506 1.00 0.00 H new ATOM 927 N GLU A 60 -13.064 -24.554 -14.245 1.00 0.00 N ATOM 928 CA GLU A 60 -11.630 -24.378 -14.007 1.00 0.00 C ATOM 929 C GLU A 60 -11.226 -22.894 -14.132 1.00 0.00 C ATOM 930 O GLU A 60 -11.987 -21.983 -13.794 1.00 0.00 O ATOM 931 CB GLU A 60 -10.862 -25.369 -14.913 1.00 0.00 C ATOM 932 CG GLU A 60 -9.532 -25.827 -14.296 1.00 0.00 C ATOM 933 CD GLU A 60 -8.784 -26.781 -15.241 1.00 0.00 C ATOM 934 OE1 GLU A 60 -8.030 -26.289 -16.115 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 -8.938 -28.020 -15.112 1.00 0.00 O ATOM 0 H GLU A 60 -13.524 -25.102 -13.518 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.357 -24.626 -12.981 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -11.488 -26.240 -15.104 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.668 -24.898 -15.877 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.909 -24.959 -14.082 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.721 -26.326 -13.345 1.00 0.00 H new ATOM 942 N ILE A 61 -9.989 -22.660 -14.550 1.00 0.00 N ATOM 943 CA ILE A 61 -9.439 -21.380 -14.959 1.00 0.00 C ATOM 944 C ILE A 61 -10.294 -20.857 -16.133 1.00 0.00 C ATOM 945 O ILE A 61 -10.471 -21.555 -17.136 1.00 0.00 O ATOM 946 CB ILE A 61 -7.954 -21.617 -15.339 1.00 0.00 C ATOM 947 CG1 ILE A 61 -7.124 -22.157 -14.151 1.00 0.00 C ATOM 948 CG2 ILE A 61 -7.292 -20.334 -15.870 1.00 0.00 C ATOM 949 CD1 ILE A 61 -5.769 -22.762 -14.482 1.00 0.00 C ATOM 0 H ILE A 61 -9.301 -23.410 -14.616 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.466 -20.625 -14.173 1.00 0.00 H new ATOM 0 HB ILE A 61 -7.965 -22.370 -16.127 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.969 -21.340 -13.446 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.718 -22.913 -13.637 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.253 -20.540 -16.126 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.823 -19.991 -16.758 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -7.331 -19.560 -15.103 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.289 -23.102 -13.565 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.903 -23.607 -15.157 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.142 -22.010 -14.962 1.00 0.00 H new ATOM 961 N GLN A 62 -10.803 -19.622 -16.008 1.00 0.00 N ATOM 962 CA GLN A 62 -11.605 -18.964 -17.043 1.00 0.00 C ATOM 963 C GLN A 62 -10.682 -18.465 -18.145 1.00 0.00 C ATOM 964 O GLN A 62 -9.501 -18.217 -17.904 1.00 0.00 O ATOM 965 CB GLN A 62 -12.431 -17.795 -16.454 1.00 0.00 C ATOM 966 CG GLN A 62 -13.822 -18.193 -15.923 1.00 0.00 C ATOM 967 CD GLN A 62 -13.796 -19.381 -14.963 1.00 0.00 C ATOM 968 OE1 GLN A 62 -14.449 -20.396 -15.197 1.00 0.00 O ATOM 969 NE2 GLN A 62 -13.023 -19.291 -13.889 1.00 0.00 N ATOM 0 H GLN A 62 -10.666 -19.049 -15.176 1.00 0.00 H new ATOM 0 HA GLN A 62 -12.310 -19.685 -17.455 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.864 -17.340 -15.642 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -12.555 -17.032 -17.223 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -14.266 -17.337 -15.415 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -14.468 -18.433 -16.767 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -12.490 -18.439 -13.714 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -12.962 -20.074 -13.238 1.00 0.00 H new ATOM 978 N GLU A 63 -11.240 -18.223 -19.333 1.00 0.00 N ATOM 979 CA GLU A 63 -10.496 -17.742 -20.493 1.00 0.00 C ATOM 980 C GLU A 63 -9.747 -16.450 -20.156 1.00 0.00 C ATOM 981 O GLU A 63 -8.574 -16.328 -20.486 1.00 0.00 O ATOM 982 CB GLU A 63 -11.477 -17.543 -21.659 1.00 0.00 C ATOM 983 CG GLU A 63 -10.792 -17.006 -22.923 1.00 0.00 C ATOM 984 CD GLU A 63 -11.770 -16.960 -24.112 1.00 0.00 C ATOM 985 OE1 GLU A 63 -12.462 -15.927 -24.297 1.00 0.00 O ATOM 986 OE2 GLU A 63 -11.847 -17.948 -24.883 1.00 0.00 O ATOM 0 H GLU A 63 -12.234 -18.358 -19.516 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.745 -18.476 -20.785 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -11.960 -18.493 -21.888 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.262 -16.851 -21.354 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.402 -16.006 -22.731 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.940 -17.638 -23.174 1.00 0.00 H new ATOM 993 N ASP A 64 -10.377 -15.523 -19.426 1.00 0.00 N ATOM 994 CA ASP A 64 -9.774 -14.224 -19.080 1.00 0.00 C ATOM 995 C ASP A 64 -8.523 -14.385 -18.212 1.00 0.00 C ATOM 996 O ASP A 64 -7.643 -13.526 -18.220 1.00 0.00 O ATOM 997 CB ASP A 64 -10.788 -13.344 -18.328 1.00 0.00 C ATOM 998 CG ASP A 64 -11.803 -12.711 -19.285 1.00 0.00 C ATOM 999 OD1 ASP A 64 -11.407 -11.998 -20.237 1.00 0.00 O ATOM 1000 OD2 ASP A 64 -13.018 -12.938 -19.090 1.00 0.00 O ATOM 0 H ASP A 64 -11.319 -15.649 -19.057 1.00 0.00 H new ATOM 0 HA ASP A 64 -9.487 -13.750 -20.018 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.313 -13.945 -17.586 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -10.259 -12.560 -17.787 1.00 0.00 H new ATOM 1005 N TRP A 65 -8.446 -15.486 -17.462 1.00 0.00 N ATOM 1006 CA TRP A 65 -7.383 -15.791 -16.518 1.00 0.00 C ATOM 1007 C TRP A 65 -6.321 -16.617 -17.268 1.00 0.00 C ATOM 1008 O TRP A 65 -5.137 -16.286 -17.241 1.00 0.00 O ATOM 1009 CB TRP A 65 -8.043 -16.493 -15.310 1.00 0.00 C ATOM 1010 CG TRP A 65 -7.561 -16.227 -13.901 1.00 0.00 C ATOM 1011 CD1 TRP A 65 -8.362 -15.981 -12.831 1.00 0.00 C ATOM 1012 CD2 TRP A 65 -6.223 -16.343 -13.326 1.00 0.00 C ATOM 1013 NE1 TRP A 65 -7.630 -15.961 -11.670 1.00 0.00 N ATOM 1014 CE2 TRP A 65 -6.339 -16.340 -11.905 1.00 0.00 C ATOM 1015 CE3 TRP A 65 -4.929 -16.533 -13.841 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 -5.296 -16.706 -11.054 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 -3.855 -16.867 -12.999 1.00 0.00 C ATOM 1018 CH2 TRP A 65 -4.063 -17.043 -11.621 1.00 0.00 C ATOM 0 H TRP A 65 -9.156 -16.217 -17.502 1.00 0.00 H new ATOM 0 HA TRP A 65 -6.860 -14.920 -16.123 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -9.104 -16.247 -15.337 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -7.961 -17.567 -15.479 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -9.429 -15.823 -12.887 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -8.000 -15.699 -10.756 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.758 -16.420 -14.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -5.437 -16.729 -9.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.865 -16.989 -13.413 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -3.272 -17.438 -11.001 1.00 0.00 H new ATOM 1029 N GLU A 66 -6.714 -17.638 -18.037 1.00 0.00 N ATOM 1030 CA GLU A 66 -5.821 -18.480 -18.800 1.00 0.00 C ATOM 1031 C GLU A 66 -5.091 -17.655 -19.866 1.00 0.00 C ATOM 1032 O GLU A 66 -3.906 -17.885 -20.116 1.00 0.00 O ATOM 1033 CB GLU A 66 -6.671 -19.613 -19.398 1.00 0.00 C ATOM 1034 CG GLU A 66 -5.966 -20.222 -20.598 1.00 0.00 C ATOM 1035 CD GLU A 66 -6.645 -21.512 -21.083 1.00 0.00 C ATOM 1036 OE1 GLU A 66 -7.599 -21.430 -21.895 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 -6.215 -22.617 -20.673 1.00 0.00 O ATOM 0 H GLU A 66 -7.695 -17.899 -18.141 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.040 -18.912 -18.174 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.849 -20.380 -18.644 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.646 -19.227 -19.697 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.947 -19.497 -21.411 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -4.930 -20.436 -20.337 1.00 0.00 H new ATOM 1044 N ALA A 67 -5.778 -16.677 -20.464 1.00 0.00 N ATOM 1045 CA ALA A 67 -5.257 -15.874 -21.567 1.00 0.00 C ATOM 1046 C ALA A 67 -3.973 -15.148 -21.169 1.00 0.00 C ATOM 1047 O ALA A 67 -3.148 -14.835 -22.031 1.00 0.00 O ATOM 1048 CB ALA A 67 -6.298 -14.836 -21.994 1.00 0.00 C ATOM 0 H ALA A 67 -6.726 -16.419 -20.189 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.037 -16.550 -22.393 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -5.902 -14.241 -22.817 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.207 -15.344 -22.318 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.527 -14.183 -21.152 1.00 0.00 H new ATOM 1054 N VAL A 68 -3.805 -14.884 -19.871 1.00 0.00 N ATOM 1055 CA VAL A 68 -2.612 -14.245 -19.337 1.00 0.00 C ATOM 1056 C VAL A 68 -1.706 -15.220 -18.615 1.00 0.00 C ATOM 1057 O VAL A 68 -0.539 -14.890 -18.461 1.00 0.00 O ATOM 1058 CB VAL A 68 -2.967 -13.033 -18.465 1.00 0.00 C ATOM 1059 CG1 VAL A 68 -3.697 -11.995 -19.327 1.00 0.00 C ATOM 1060 CG2 VAL A 68 -3.810 -13.376 -17.237 1.00 0.00 C ATOM 0 H VAL A 68 -4.501 -15.111 -19.161 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.042 -13.876 -20.190 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.028 -12.635 -18.080 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.953 -11.130 -18.716 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.049 -11.682 -20.146 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.608 -12.435 -19.733 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.018 -12.467 -16.673 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.749 -13.829 -17.555 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.265 -14.077 -16.606 1.00 0.00 H new ATOM 1070 N TRP A 69 -2.173 -16.403 -18.206 1.00 0.00 N ATOM 1071 CA TRP A 69 -1.399 -17.377 -17.428 1.00 0.00 C ATOM 1072 C TRP A 69 -0.056 -17.679 -18.101 1.00 0.00 C ATOM 1073 O TRP A 69 0.968 -17.817 -17.435 1.00 0.00 O ATOM 1074 CB TRP A 69 -2.257 -18.642 -17.265 1.00 0.00 C ATOM 1075 CG TRP A 69 -1.961 -19.524 -16.091 1.00 0.00 C ATOM 1076 CD1 TRP A 69 -0.819 -20.205 -15.856 1.00 0.00 C ATOM 1077 CD2 TRP A 69 -2.831 -19.836 -14.966 1.00 0.00 C ATOM 1078 NE1 TRP A 69 -0.927 -20.914 -14.675 1.00 0.00 N ATOM 1079 CE2 TRP A 69 -2.128 -20.671 -14.058 1.00 0.00 C ATOM 1080 CE3 TRP A 69 -4.133 -19.462 -14.603 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 -2.663 -21.063 -12.827 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 -4.665 -19.809 -13.349 1.00 0.00 C ATOM 1083 CH2 TRP A 69 -3.937 -20.610 -12.454 1.00 0.00 C ATOM 0 H TRP A 69 -3.121 -16.718 -18.411 1.00 0.00 H new ATOM 0 HA TRP A 69 -1.161 -16.971 -16.445 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -3.301 -18.336 -17.203 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -2.153 -19.239 -18.171 1.00 0.00 H new ATOM 0 HD1 TRP A 69 0.050 -20.197 -16.497 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.207 -21.537 -14.309 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -4.737 -18.898 -15.298 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 -2.100 -21.709 -12.169 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -5.646 -19.455 -13.070 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -4.352 -20.873 -11.492 1.00 0.00 H new ATOM 1094 N ASP A 70 -0.051 -17.686 -19.433 1.00 0.00 N ATOM 1095 CA ASP A 70 1.115 -17.887 -20.285 1.00 0.00 C ATOM 1096 C ASP A 70 2.129 -16.726 -20.218 1.00 0.00 C ATOM 1097 O ASP A 70 3.326 -16.939 -20.398 1.00 0.00 O ATOM 1098 CB ASP A 70 0.597 -18.086 -21.712 1.00 0.00 C ATOM 1099 CG ASP A 70 1.752 -18.320 -22.699 1.00 0.00 C ATOM 1100 OD1 ASP A 70 2.348 -19.424 -22.688 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 2.051 -17.410 -23.510 1.00 0.00 O ATOM 0 H ASP A 70 -0.905 -17.544 -19.973 1.00 0.00 H new ATOM 0 HA ASP A 70 1.667 -18.760 -19.936 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.084 -18.936 -21.738 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.026 -17.210 -22.019 1.00 0.00 H new ATOM 1106 N GLN A 71 1.667 -15.506 -19.907 1.00 0.00 N ATOM 1107 CA GLN A 71 2.467 -14.293 -19.759 1.00 0.00 C ATOM 1108 C GLN A 71 2.905 -14.062 -18.316 1.00 0.00 C ATOM 1109 O GLN A 71 3.891 -13.374 -18.079 1.00 0.00 O ATOM 1110 CB GLN A 71 1.689 -13.059 -20.261 1.00 0.00 C ATOM 1111 CG GLN A 71 1.361 -13.166 -21.760 1.00 0.00 C ATOM 1112 CD GLN A 71 1.150 -11.787 -22.381 1.00 0.00 C ATOM 1113 OE1 GLN A 71 1.983 -11.286 -23.132 1.00 0.00 O ATOM 1114 NE2 GLN A 71 0.047 -11.133 -22.051 1.00 0.00 N ATOM 0 H GLN A 71 0.674 -15.336 -19.745 1.00 0.00 H new ATOM 0 HA GLN A 71 3.361 -14.434 -20.366 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.765 -12.955 -19.693 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.277 -12.159 -20.080 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.172 -13.680 -22.276 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.464 -13.770 -21.896 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.634 -11.564 -21.426 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.122 -10.198 -22.422 1.00 0.00 H new ATOM 1123 N LEU A 72 2.194 -14.623 -17.336 1.00 0.00 N ATOM 1124 CA LEU A 72 2.465 -14.359 -15.921 1.00 0.00 C ATOM 1125 C LEU A 72 3.841 -14.872 -15.500 1.00 0.00 C ATOM 1126 O LEU A 72 4.427 -14.320 -14.574 1.00 0.00 O ATOM 1127 CB LEU A 72 1.353 -14.932 -15.023 1.00 0.00 C ATOM 1128 CG LEU A 72 -0.027 -14.283 -15.228 1.00 0.00 C ATOM 1129 CD1 LEU A 72 -1.023 -14.874 -14.235 1.00 0.00 C ATOM 1130 CD2 LEU A 72 -0.011 -12.761 -15.094 1.00 0.00 C ATOM 0 H LEU A 72 1.420 -15.268 -17.498 1.00 0.00 H new ATOM 0 HA LEU A 72 2.473 -13.277 -15.790 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.269 -16.003 -15.208 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.647 -14.811 -13.980 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.326 -14.503 -16.253 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.000 -14.413 -14.382 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.101 -15.949 -14.395 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.680 -14.682 -13.218 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.017 -12.371 -15.251 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.333 -12.487 -14.097 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.662 -12.337 -15.839 1.00 0.00 H new ATOM 1142 N ASP A 73 4.375 -15.893 -16.183 1.00 0.00 N ATOM 1143 CA ASP A 73 5.745 -16.353 -15.942 1.00 0.00 C ATOM 1144 C ASP A 73 6.775 -15.413 -16.586 1.00 0.00 C ATOM 1145 O ASP A 73 7.910 -15.343 -16.117 1.00 0.00 O ATOM 1146 CB ASP A 73 5.934 -17.817 -16.371 1.00 0.00 C ATOM 1147 CG ASP A 73 7.421 -18.210 -16.488 1.00 0.00 C ATOM 1148 OD1 ASP A 73 8.041 -18.512 -15.442 1.00 0.00 O ATOM 1149 OD2 ASP A 73 7.947 -18.277 -17.626 1.00 0.00 O1- ATOM 0 H ASP A 73 3.878 -16.414 -16.905 1.00 0.00 H new ATOM 0 HA ASP A 73 5.921 -16.320 -14.867 1.00 0.00 H new ATOM 0 HB2 ASP A 73 5.444 -18.470 -15.649 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.442 -17.978 -17.330 1.00 0.00 H new ATOM 1154 N ASP A 74 6.401 -14.630 -17.606 1.00 0.00 N ATOM 1155 CA ASP A 74 7.314 -13.700 -18.275 1.00 0.00 C ATOM 1156 C ASP A 74 7.512 -12.407 -17.473 1.00 0.00 C ATOM 1157 O ASP A 74 8.574 -11.785 -17.549 1.00 0.00 O ATOM 1158 CB ASP A 74 6.814 -13.380 -19.690 1.00 0.00 C ATOM 1159 CG ASP A 74 7.801 -12.454 -20.422 1.00 0.00 C ATOM 1160 OD1 ASP A 74 8.906 -12.923 -20.793 1.00 0.00 O1- ATOM 1161 OD2 ASP A 74 7.462 -11.271 -20.660 1.00 0.00 O ATOM 0 H ASP A 74 5.456 -14.625 -17.989 1.00 0.00 H new ATOM 0 HA ASP A 74 8.284 -14.193 -18.343 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.689 -14.304 -20.254 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.835 -12.905 -19.636 1.00 0.00 H new ATOM 1166 N LEU A 75 6.507 -12.018 -16.675 1.00 0.00 N ATOM 1167 CA LEU A 75 6.529 -10.817 -15.846 1.00 0.00 C ATOM 1168 C LEU A 75 7.707 -10.855 -14.875 1.00 0.00 C ATOM 1169 O LEU A 75 8.041 -11.908 -14.325 1.00 0.00 O ATOM 1170 CB LEU A 75 5.229 -10.667 -15.031 1.00 0.00 C ATOM 1171 CG LEU A 75 3.914 -10.602 -15.822 1.00 0.00 C ATOM 1172 CD1 LEU A 75 2.766 -10.236 -14.878 1.00 0.00 C ATOM 1173 CD2 LEU A 75 3.954 -9.590 -16.964 1.00 0.00 C ATOM 0 H LEU A 75 5.639 -12.546 -16.590 1.00 0.00 H new ATOM 0 HA LEU A 75 6.627 -9.967 -16.521 1.00 0.00 H new ATOM 0 HB2 LEU A 75 5.166 -11.505 -14.337 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.308 -9.761 -14.430 1.00 0.00 H new ATOM 0 HG LEU A 75 3.762 -11.588 -16.262 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.833 -10.190 -15.440 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.682 -10.992 -14.097 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.964 -9.265 -14.424 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.996 -9.591 -17.485 1.00 0.00 H new ATOM 0 HD22 LEU A 75 4.148 -8.595 -16.562 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.747 -9.860 -17.662 1.00 0.00 H new ATOM 1185 N ASN A 76 8.293 -9.695 -14.596 1.00 0.00 N ATOM 1186 CA ASN A 76 9.279 -9.532 -13.537 1.00 0.00 C ATOM 1187 C ASN A 76 8.537 -9.222 -12.240 1.00 0.00 C ATOM 1188 O ASN A 76 7.914 -8.168 -12.124 1.00 0.00 O ATOM 1189 CB ASN A 76 10.301 -8.434 -13.871 1.00 0.00 C ATOM 1190 CG ASN A 76 11.396 -8.457 -12.808 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.357 -7.716 -11.831 1.00 0.00 O ATOM 1192 ND2 ASN A 76 12.337 -9.376 -12.943 1.00 0.00 N ATOM 0 H ASN A 76 8.094 -8.834 -15.105 1.00 0.00 H new ATOM 0 HA ASN A 76 9.850 -10.454 -13.429 1.00 0.00 H new ATOM 0 HB2 ASN A 76 10.728 -8.601 -14.860 1.00 0.00 H new ATOM 0 HB3 ASN A 76 9.816 -7.458 -13.895 1.00 0.00 H new ATOM 0 HD21 ASN A 76 13.053 -9.482 -12.225 1.00 0.00 H new ATOM 0 HD22 ASN A 76 12.346 -9.979 -13.765 1.00 0.00 H new ATOM 1199 N LEU A 77 8.569 -10.154 -11.279 1.00 0.00 N ATOM 1200 CA LEU A 77 7.774 -10.075 -10.041 1.00 0.00 C ATOM 1201 C LEU A 77 8.661 -10.085 -8.790 1.00 0.00 C ATOM 1202 O LEU A 77 8.149 -10.193 -7.680 1.00 0.00 O ATOM 1203 CB LEU A 77 6.756 -11.240 -10.002 1.00 0.00 C ATOM 1204 CG LEU A 77 5.831 -11.379 -11.227 1.00 0.00 C ATOM 1205 CD1 LEU A 77 4.869 -12.552 -11.071 1.00 0.00 C ATOM 1206 CD2 LEU A 77 4.974 -10.122 -11.442 1.00 0.00 C ATOM 0 H LEU A 77 9.150 -10.990 -11.336 1.00 0.00 H new ATOM 0 HA LEU A 77 7.237 -9.126 -10.042 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.307 -12.173 -9.882 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.134 -11.121 -9.115 1.00 0.00 H new ATOM 0 HG LEU A 77 6.493 -11.536 -12.079 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.232 -12.620 -11.953 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.437 -13.476 -10.961 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.250 -12.400 -10.187 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.337 -10.261 -12.315 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.353 -9.950 -10.563 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.624 -9.261 -11.601 1.00 0.00 H new ATOM 1218 N GLU A 78 9.980 -10.018 -8.965 1.00 0.00 N ATOM 1219 CA GLU A 78 10.973 -10.247 -7.919 1.00 0.00 C ATOM 1220 C GLU A 78 10.702 -9.422 -6.664 1.00 0.00 C ATOM 1221 O GLU A 78 10.455 -8.213 -6.716 1.00 0.00 O ATOM 1222 CB GLU A 78 12.383 -9.959 -8.447 1.00 0.00 C ATOM 1223 CG GLU A 78 12.901 -11.150 -9.254 1.00 0.00 C ATOM 1224 CD GLU A 78 14.249 -10.820 -9.920 1.00 0.00 C ATOM 1225 OE1 GLU A 78 14.248 -10.169 -10.994 1.00 0.00 O ATOM 1226 OE2 GLU A 78 15.311 -11.215 -9.378 1.00 0.00 O1- ATOM 0 H GLU A 78 10.399 -9.796 -9.868 1.00 0.00 H new ATOM 0 HA GLU A 78 10.899 -11.297 -7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.369 -9.066 -9.072 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.056 -9.755 -7.614 1.00 0.00 H new ATOM 0 HG2 GLU A 78 13.016 -12.014 -8.600 1.00 0.00 H new ATOM 0 HG3 GLU A 78 12.171 -11.422 -10.017 1.00 0.00 H new ATOM 1233 N GLY A 79 10.785 -10.114 -5.530 1.00 0.00 N ATOM 1234 CA GLY A 79 10.713 -9.552 -4.189 1.00 0.00 C ATOM 1235 C GLY A 79 9.330 -9.063 -3.750 1.00 0.00 C ATOM 1236 O GLY A 79 9.194 -8.686 -2.583 1.00 0.00 O ATOM 0 H GLY A 79 10.910 -11.126 -5.524 1.00 0.00 H new ATOM 0 HA2 GLY A 79 11.054 -10.306 -3.480 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.411 -8.717 -4.126 1.00 0.00 H new ATOM 1240 N LYS A 80 8.299 -9.047 -4.615 1.00 0.00 N ATOM 1241 CA LYS A 80 7.010 -8.473 -4.243 1.00 0.00 C ATOM 1242 C LYS A 80 6.268 -9.419 -3.314 1.00 0.00 C ATOM 1243 O LYS A 80 6.500 -10.630 -3.321 1.00 0.00 O ATOM 1244 CB LYS A 80 6.209 -7.983 -5.468 1.00 0.00 C ATOM 1245 CG LYS A 80 5.270 -8.991 -6.147 1.00 0.00 C ATOM 1246 CD LYS A 80 4.269 -8.335 -7.118 1.00 0.00 C ATOM 1247 CE LYS A 80 4.858 -7.639 -8.371 1.00 0.00 C ATOM 1248 NZ LYS A 80 5.465 -6.294 -8.115 1.00 0.00 N1+ ATOM 0 H LYS A 80 8.340 -9.422 -5.563 1.00 0.00 H new ATOM 0 HA LYS A 80 7.172 -7.559 -3.671 1.00 0.00 H new ATOM 0 HB2 LYS A 80 5.614 -7.123 -5.160 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.919 -7.628 -6.215 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.867 -9.723 -6.691 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.718 -9.536 -5.381 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.570 -9.101 -7.453 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.691 -7.598 -6.561 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.618 -8.288 -8.806 1.00 0.00 H new ATOM 0 HE3 LYS A 80 4.068 -7.530 -9.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.414 -5.720 -8.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.943 -5.817 -7.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.460 -6.410 -7.834 1.00 0.00 H new ATOM 1262 N ILE A 81 5.333 -8.872 -2.551 1.00 0.00 N ATOM 1263 CA ILE A 81 4.495 -9.667 -1.669 1.00 0.00 C ATOM 1264 C ILE A 81 3.340 -10.191 -2.510 1.00 0.00 C ATOM 1265 O ILE A 81 2.788 -9.459 -3.329 1.00 0.00 O ATOM 1266 CB ILE A 81 4.036 -8.858 -0.436 1.00 0.00 C ATOM 1267 CG1 ILE A 81 5.211 -8.104 0.224 1.00 0.00 C ATOM 1268 CG2 ILE A 81 3.361 -9.825 0.556 1.00 0.00 C ATOM 1269 CD1 ILE A 81 4.876 -7.499 1.588 1.00 0.00 C ATOM 0 H ILE A 81 5.136 -7.872 -2.526 1.00 0.00 H new ATOM 0 HA ILE A 81 5.050 -10.507 -1.251 1.00 0.00 H new ATOM 0 HB ILE A 81 3.323 -8.096 -0.750 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.050 -8.790 0.339 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.539 -7.308 -0.444 1.00 0.00 H new ATOM 0 HG21 ILE A 81 3.029 -9.272 1.435 1.00 0.00 H new ATOM 0 HG22 ILE A 81 2.502 -10.296 0.078 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.074 -10.593 0.858 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.753 -6.987 1.984 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.058 -6.787 1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 81 4.578 -8.292 2.274 1.00 0.00 H new ATOM 1281 N VAL A 82 2.960 -11.444 -2.300 1.00 0.00 N ATOM 1282 CA VAL A 82 1.846 -12.067 -2.999 1.00 0.00 C ATOM 1283 C VAL A 82 0.906 -12.761 -2.015 1.00 0.00 C ATOM 1284 O VAL A 82 1.344 -13.605 -1.238 1.00 0.00 O ATOM 1285 CB VAL A 82 2.367 -13.037 -4.077 1.00 0.00 C ATOM 1286 CG1 VAL A 82 1.187 -13.751 -4.744 1.00 0.00 C ATOM 1287 CG2 VAL A 82 3.178 -12.306 -5.160 1.00 0.00 C ATOM 0 H VAL A 82 3.422 -12.062 -1.633 1.00 0.00 H new ATOM 0 HA VAL A 82 1.268 -11.291 -3.502 1.00 0.00 H new ATOM 0 HB VAL A 82 3.020 -13.755 -3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.560 -14.436 -5.506 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.629 -14.311 -3.994 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.531 -13.014 -5.208 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.527 -13.025 -5.901 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.548 -11.561 -5.646 1.00 0.00 H new ATOM 0 HG23 VAL A 82 4.035 -11.812 -4.702 1.00 0.00 H new ATOM 1297 N ALA A 83 -0.388 -12.442 -2.078 1.00 0.00 N ATOM 1298 CA ALA A 83 -1.434 -13.223 -1.428 1.00 0.00 C ATOM 1299 C ALA A 83 -1.956 -14.201 -2.474 1.00 0.00 C ATOM 1300 O ALA A 83 -2.065 -13.846 -3.650 1.00 0.00 O ATOM 1301 CB ALA A 83 -2.586 -12.349 -0.920 1.00 0.00 C ATOM 0 H ALA A 83 -0.738 -11.629 -2.585 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.023 -13.729 -0.555 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -3.338 -12.979 -0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.205 -11.629 -0.196 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.036 -11.817 -1.758 1.00 0.00 H new ATOM 1307 N LEU A 84 -2.350 -15.393 -2.049 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.025 -16.367 -2.892 1.00 0.00 C ATOM 1309 C LEU A 84 -4.329 -16.699 -2.201 1.00 0.00 C ATOM 1310 O LEU A 84 -4.349 -16.848 -0.979 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.161 -17.632 -3.017 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.101 -17.546 -4.130 1.00 0.00 C ATOM 1313 CD1 LEU A 84 0.186 -18.249 -3.706 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -1.613 -18.190 -5.426 1.00 0.00 C ATOM 0 H LEU A 84 -2.207 -15.715 -1.092 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.197 -15.976 -3.895 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.663 -17.817 -2.065 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.809 -18.487 -3.209 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.899 -16.490 -4.307 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.921 -18.176 -4.507 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.580 -17.775 -2.807 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.024 -19.299 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.846 -18.116 -6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.845 -19.239 -5.244 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.513 -17.672 -5.759 1.00 0.00 H new ATOM 1326 N TYR A 85 -5.413 -16.838 -2.948 1.00 0.00 N ATOM 1327 CA TYR A 85 -6.642 -17.398 -2.435 1.00 0.00 C ATOM 1328 C TYR A 85 -7.377 -18.037 -3.589 1.00 0.00 C ATOM 1329 O TYR A 85 -7.056 -17.830 -4.763 1.00 0.00 O ATOM 1330 CB TYR A 85 -7.500 -16.350 -1.717 1.00 0.00 C ATOM 1331 CG TYR A 85 -8.224 -15.344 -2.579 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -9.538 -15.605 -3.020 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -7.612 -14.116 -2.874 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -10.231 -14.645 -3.780 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -8.302 -13.156 -3.630 1.00 0.00 C ATOM 1336 CZ TYR A 85 -9.612 -13.412 -4.091 1.00 0.00 C ATOM 1337 OH TYR A 85 -10.260 -12.466 -4.825 1.00 0.00 O ATOM 0 H TYR A 85 -5.460 -16.563 -3.929 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.415 -18.150 -1.680 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -8.242 -16.875 -1.115 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -6.858 -15.803 -1.026 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.013 -16.543 -2.774 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.613 -13.910 -2.520 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -11.234 -14.849 -4.125 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.827 -12.214 -3.861 1.00 0.00 H new ATOM 0 HH TYR A 85 -11.225 -12.535 -4.669 1.00 0.00 H new ATOM 1347 N GLY A 86 -8.388 -18.818 -3.255 1.00 0.00 N ATOM 1348 CA GLY A 86 -9.295 -19.327 -4.241 1.00 0.00 C ATOM 1349 C GLY A 86 -10.538 -19.842 -3.567 1.00 0.00 C ATOM 1350 O GLY A 86 -10.666 -19.815 -2.342 1.00 0.00 O ATOM 0 H GLY A 86 -8.594 -19.109 -2.299 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -9.553 -18.542 -4.952 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -8.819 -20.127 -4.809 1.00 0.00 H new ATOM 1354 N LEU A 87 -11.454 -20.319 -4.393 1.00 0.00 N ATOM 1355 CA LEU A 87 -12.651 -20.992 -3.960 1.00 0.00 C ATOM 1356 C LEU A 87 -12.570 -22.417 -4.460 1.00 0.00 C ATOM 1357 O LEU A 87 -12.047 -22.668 -5.546 1.00 0.00 O ATOM 1358 CB LEU A 87 -13.855 -20.172 -4.435 1.00 0.00 C ATOM 1359 CG LEU A 87 -15.220 -20.846 -4.230 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -16.279 -19.767 -3.978 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -15.580 -21.644 -5.486 1.00 0.00 C ATOM 0 H LEU A 87 -11.377 -20.243 -5.407 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.765 -21.061 -2.878 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.855 -19.217 -3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.731 -19.952 -5.495 1.00 0.00 H new ATOM 0 HG LEU A 87 -15.179 -21.520 -3.374 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -17.251 -20.238 -3.832 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.014 -19.198 -3.087 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -16.327 -19.096 -4.836 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -16.548 -22.125 -5.346 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -15.629 -20.972 -6.343 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -14.820 -22.404 -5.664 1.00 0.00 H new ATOM 1373 N GLY A 88 -13.071 -23.340 -3.658 1.00 0.00 N ATOM 1374 CA GLY A 88 -13.136 -24.756 -3.956 1.00 0.00 C ATOM 1375 C GLY A 88 -14.484 -25.302 -3.500 1.00 0.00 C ATOM 1376 O GLY A 88 -15.353 -24.545 -3.060 1.00 0.00 O ATOM 0 H GLY A 88 -13.460 -23.111 -2.743 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.006 -24.921 -5.026 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.327 -25.284 -3.451 1.00 0.00 H new ATOM 1380 N ASP A 89 -14.654 -26.617 -3.605 1.00 0.00 N ATOM 1381 CA ASP A 89 -15.882 -27.308 -3.237 1.00 0.00 C ATOM 1382 C ASP A 89 -15.533 -28.682 -2.673 1.00 0.00 C ATOM 1383 O ASP A 89 -14.683 -29.379 -3.235 1.00 0.00 O ATOM 1384 CB ASP A 89 -16.771 -27.462 -4.474 1.00 0.00 C ATOM 1385 CG ASP A 89 -17.844 -28.518 -4.211 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -18.557 -28.385 -3.194 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -17.901 -29.516 -4.959 1.00 0.00 O ATOM 0 H ASP A 89 -13.928 -27.242 -3.955 1.00 0.00 H new ATOM 0 HA ASP A 89 -16.419 -26.733 -2.482 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -17.238 -26.508 -4.718 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -16.167 -27.750 -5.334 1.00 0.00 H new ATOM 1392 N GLN A 90 -16.177 -29.072 -1.577 1.00 0.00 N ATOM 1393 CA GLN A 90 -16.017 -30.369 -0.936 1.00 0.00 C ATOM 1394 C GLN A 90 -17.179 -31.321 -1.264 1.00 0.00 C ATOM 1395 O GLN A 90 -17.099 -32.497 -0.906 1.00 0.00 O ATOM 1396 CB GLN A 90 -15.885 -30.184 0.582 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.615 -29.430 0.991 1.00 0.00 C ATOM 1398 CD GLN A 90 -14.662 -29.100 2.481 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -14.125 -29.818 3.320 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -15.337 -28.017 2.833 1.00 0.00 N ATOM 0 H GLN A 90 -16.847 -28.472 -1.096 1.00 0.00 H new ATOM 0 HA GLN A 90 -15.108 -30.826 -1.327 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -16.756 -29.643 0.953 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -15.889 -31.162 1.062 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -13.736 -30.036 0.772 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.523 -28.513 0.409 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -15.775 -27.435 2.119 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -15.419 -27.765 3.818 1.00 0.00 H new ATOM 1409 N LEU A 91 -18.237 -30.869 -1.950 1.00 0.00 N ATOM 1410 CA LEU A 91 -19.325 -31.742 -2.396 1.00 0.00 C ATOM 1411 C LEU A 91 -18.776 -32.727 -3.434 1.00 0.00 C ATOM 1412 O LEU A 91 -19.052 -33.924 -3.349 1.00 0.00 O ATOM 1413 CB LEU A 91 -20.543 -30.952 -2.936 1.00 0.00 C ATOM 1414 CG LEU A 91 -21.313 -30.107 -1.904 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -22.559 -29.509 -2.566 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -21.768 -30.877 -0.655 1.00 0.00 C ATOM 0 H LEU A 91 -18.360 -29.890 -2.210 1.00 0.00 H new ATOM 0 HA LEU A 91 -19.701 -32.295 -1.535 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -20.198 -30.292 -3.732 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -21.238 -31.660 -3.388 1.00 0.00 H new ATOM 0 HG LEU A 91 -20.609 -29.345 -1.570 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -23.106 -28.910 -1.838 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -22.259 -28.878 -3.403 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -23.199 -30.313 -2.929 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -22.301 -30.202 0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -22.429 -31.692 -0.951 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -20.897 -31.284 -0.141 1.00 0.00 H new ATOM 1428 N GLY A 92 -17.920 -32.254 -4.340 1.00 0.00 N ATOM 1429 CA GLY A 92 -17.111 -33.060 -5.251 1.00 0.00 C ATOM 1430 C GLY A 92 -15.897 -33.669 -4.540 1.00 0.00 C ATOM 1431 O GLY A 92 -14.795 -33.666 -5.092 1.00 0.00 O ATOM 0 H GLY A 92 -17.766 -31.253 -4.463 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -17.723 -33.857 -5.674 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -16.774 -32.442 -6.083 1.00 0.00 H new ATOM 1435 N TYR A 93 -16.068 -34.095 -3.284 1.00 0.00 N ATOM 1436 CA TYR A 93 -15.079 -34.705 -2.395 1.00 0.00 C ATOM 1437 C TYR A 93 -13.784 -33.889 -2.180 1.00 0.00 C ATOM 1438 O TYR A 93 -12.860 -34.375 -1.524 1.00 0.00 O ATOM 1439 CB TYR A 93 -14.844 -36.165 -2.829 1.00 0.00 C ATOM 1440 CG TYR A 93 -14.145 -37.050 -1.808 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -14.806 -37.409 -0.616 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -12.835 -37.518 -2.045 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -14.165 -38.223 0.336 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -12.185 -38.326 -1.096 1.00 0.00 C ATOM 1445 CZ TYR A 93 -12.848 -38.681 0.101 1.00 0.00 C ATOM 1446 OH TYR A 93 -12.206 -39.475 1.010 1.00 0.00 O ATOM 0 H TYR A 93 -16.977 -34.014 -2.828 1.00 0.00 H new ATOM 0 HA TYR A 93 -15.500 -34.702 -1.390 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -15.808 -36.613 -3.072 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -14.254 -36.162 -3.745 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -15.810 -37.057 -0.432 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -12.328 -37.254 -2.961 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -14.678 -38.498 1.246 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -11.180 -38.675 -1.281 1.00 0.00 H new ATOM 0 HH TYR A 93 -11.310 -39.693 0.679 1.00 0.00 H new ATOM 1456 N GLY A 94 -13.676 -32.651 -2.690 1.00 0.00 N ATOM 1457 CA GLY A 94 -12.426 -31.924 -2.644 1.00 0.00 C ATOM 1458 C GLY A 94 -11.396 -32.554 -3.581 1.00 0.00 C ATOM 1459 O GLY A 94 -10.201 -32.434 -3.325 1.00 0.00 O ATOM 0 H GLY A 94 -14.443 -32.147 -3.134 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.594 -30.885 -2.927 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.041 -31.918 -1.624 1.00 0.00 H new ATOM 1463 N GLU A 95 -11.846 -33.239 -4.640 1.00 0.00 N ATOM 1464 CA GLU A 95 -11.002 -33.637 -5.770 1.00 0.00 C ATOM 1465 C GLU A 95 -10.724 -32.400 -6.644 1.00 0.00 C ATOM 1466 O GLU A 95 -9.795 -32.401 -7.452 1.00 0.00 O ATOM 1467 CB GLU A 95 -11.706 -34.722 -6.607 1.00 0.00 C ATOM 1468 CG GLU A 95 -11.798 -36.072 -5.888 1.00 0.00 C ATOM 1469 CD GLU A 95 -12.490 -37.131 -6.768 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -11.807 -37.759 -7.616 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -13.714 -37.366 -6.608 1.00 0.00 O ATOM 0 H GLU A 95 -12.817 -33.535 -4.736 1.00 0.00 H new ATOM 0 HA GLU A 95 -10.063 -34.045 -5.396 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -12.711 -34.383 -6.859 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -11.169 -34.853 -7.546 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.797 -36.414 -5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -12.351 -35.953 -4.956 1.00 0.00 H new ATOM 1478 N TRP A 96 -11.523 -31.339 -6.457 1.00 0.00 N ATOM 1479 CA TRP A 96 -11.458 -30.071 -7.169 1.00 0.00 C ATOM 1480 C TRP A 96 -11.025 -28.929 -6.236 1.00 0.00 C ATOM 1481 O TRP A 96 -11.122 -27.766 -6.626 1.00 0.00 O ATOM 1482 CB TRP A 96 -12.848 -29.795 -7.775 1.00 0.00 C ATOM 1483 CG TRP A 96 -13.514 -30.924 -8.515 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -12.899 -31.887 -9.243 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -14.942 -31.228 -8.596 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -13.833 -32.784 -9.719 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -15.109 -32.428 -9.348 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -16.117 -30.613 -8.112 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -16.366 -32.992 -9.604 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -17.388 -31.163 -8.372 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -17.516 -32.351 -9.114 1.00 0.00 C ATOM 0 H TRP A 96 -12.271 -31.352 -5.764 1.00 0.00 H new ATOM 0 HA TRP A 96 -10.710 -30.128 -7.960 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -13.512 -29.482 -6.969 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -12.757 -28.951 -8.459 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -11.836 -31.944 -9.424 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -13.606 -33.608 -10.276 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -16.040 -29.705 -7.532 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -16.450 -33.908 -10.171 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -18.272 -30.668 -7.998 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -18.493 -32.768 -9.306 1.00 0.00 H new ATOM 1502 N PHE A 97 -10.629 -29.205 -4.986 1.00 0.00 N ATOM 1503 CA PHE A 97 -10.375 -28.140 -4.022 1.00 0.00 C ATOM 1504 C PHE A 97 -9.140 -27.336 -4.424 1.00 0.00 C ATOM 1505 O PHE A 97 -8.033 -27.865 -4.404 1.00 0.00 O ATOM 1506 CB PHE A 97 -10.216 -28.683 -2.591 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.710 -27.711 -1.539 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -12.091 -27.487 -1.395 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -9.800 -26.996 -0.738 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -12.561 -26.513 -0.499 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -10.273 -26.035 0.171 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.648 -25.777 0.277 1.00 0.00 C ATOM 0 H PHE A 97 -10.480 -30.148 -4.627 1.00 0.00 H new ATOM 0 HA PHE A 97 -11.245 -27.484 -4.029 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.764 -29.621 -2.500 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.166 -28.909 -2.407 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -12.793 -28.067 -1.976 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.740 -27.186 -0.822 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -13.621 -26.330 -0.406 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.575 -25.492 0.791 1.00 0.00 H new ATOM 0 HZ PHE A 97 -12.005 -25.014 0.953 1.00 0.00 H new ATOM 1522 N LEU A 98 -9.323 -26.050 -4.745 1.00 0.00 N ATOM 1523 CA LEU A 98 -8.247 -25.063 -4.914 1.00 0.00 C ATOM 1524 C LEU A 98 -7.160 -25.464 -5.920 1.00 0.00 C ATOM 1525 O LEU A 98 -6.076 -24.892 -5.880 1.00 0.00 O ATOM 1526 CB LEU A 98 -7.654 -24.709 -3.524 1.00 0.00 C ATOM 1527 CG LEU A 98 -8.647 -24.103 -2.519 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -7.954 -23.875 -1.177 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -9.283 -22.800 -2.994 1.00 0.00 C ATOM 0 H LEU A 98 -10.250 -25.654 -4.899 1.00 0.00 H new ATOM 0 HA LEU A 98 -8.698 -24.177 -5.360 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.228 -25.613 -3.088 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.833 -24.007 -3.666 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.457 -24.825 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.663 -23.445 -0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.587 -24.826 -0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.116 -23.191 -1.312 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.971 -22.433 -2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.504 -22.057 -3.168 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.828 -22.978 -3.921 1.00 0.00 H new ATOM 1541 N ASP A 99 -7.392 -26.411 -6.830 1.00 0.00 N ATOM 1542 CA ASP A 99 -6.313 -26.961 -7.659 1.00 0.00 C ATOM 1543 C ASP A 99 -5.651 -25.875 -8.515 1.00 0.00 C ATOM 1544 O ASP A 99 -4.431 -25.861 -8.679 1.00 0.00 O ATOM 1545 CB ASP A 99 -6.840 -28.107 -8.528 1.00 0.00 C ATOM 1546 CG ASP A 99 -5.682 -28.884 -9.166 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -4.994 -29.631 -8.436 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -5.480 -28.794 -10.400 1.00 0.00 O ATOM 0 H ASP A 99 -8.311 -26.813 -7.013 1.00 0.00 H new ATOM 0 HA ASP A 99 -5.546 -27.358 -6.994 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.445 -28.781 -7.921 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.490 -27.709 -9.307 1.00 0.00 H new ATOM 1553 N ALA A 100 -6.435 -24.885 -8.962 1.00 0.00 N ATOM 1554 CA ALA A 100 -5.929 -23.751 -9.717 1.00 0.00 C ATOM 1555 C ALA A 100 -5.114 -22.779 -8.852 1.00 0.00 C ATOM 1556 O ALA A 100 -4.163 -22.189 -9.356 1.00 0.00 O ATOM 1557 CB ALA A 100 -7.099 -23.073 -10.438 1.00 0.00 C ATOM 0 H ALA A 100 -7.442 -24.856 -8.805 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.221 -24.111 -10.464 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.730 -22.220 -11.008 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.571 -23.785 -11.115 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.829 -22.731 -9.705 1.00 0.00 H new ATOM 1563 N LEU A 101 -5.412 -22.658 -7.549 1.00 0.00 N ATOM 1564 CA LEU A 101 -4.603 -21.868 -6.608 1.00 0.00 C ATOM 1565 C LEU A 101 -3.182 -22.438 -6.606 1.00 0.00 C ATOM 1566 O LEU A 101 -2.210 -21.686 -6.698 1.00 0.00 O ATOM 1567 CB LEU A 101 -5.257 -21.931 -5.206 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.741 -20.968 -4.120 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -5.648 -21.035 -2.888 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -3.346 -21.323 -3.611 1.00 0.00 C ATOM 0 H LEU A 101 -6.221 -23.105 -7.118 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.554 -20.820 -6.903 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.325 -21.754 -5.328 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -5.144 -22.948 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.726 -19.986 -4.592 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.276 -20.351 -2.125 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.662 -20.750 -3.167 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.652 -22.051 -2.494 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.043 -20.605 -2.849 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.359 -22.325 -3.181 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -2.638 -21.293 -4.439 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.055 -23.769 -6.571 1.00 0.00 N ATOM 1583 CA GLY A 102 -1.756 -24.417 -6.483 1.00 0.00 C ATOM 1584 C GLY A 102 -0.927 -24.207 -7.740 1.00 0.00 C ATOM 1585 O GLY A 102 0.291 -24.072 -7.650 1.00 0.00 O ATOM 0 H GLY A 102 -3.844 -24.415 -6.603 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.214 -24.026 -5.622 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -1.895 -25.485 -6.315 1.00 0.00 H new ATOM 1589 N MET A 103 -1.567 -24.123 -8.909 1.00 0.00 N ATOM 1590 CA MET A 103 -0.843 -23.959 -10.162 1.00 0.00 C ATOM 1591 C MET A 103 -0.183 -22.575 -10.236 1.00 0.00 C ATOM 1592 O MET A 103 0.980 -22.506 -10.634 1.00 0.00 O ATOM 1593 CB MET A 103 -1.752 -24.305 -11.356 1.00 0.00 C ATOM 1594 CG MET A 103 -1.968 -25.811 -11.445 1.00 0.00 C ATOM 1595 SD MET A 103 -2.930 -26.414 -12.860 1.00 0.00 S ATOM 1596 CE MET A 103 -4.592 -25.884 -12.371 1.00 0.00 C ATOM 0 H MET A 103 -2.581 -24.166 -9.009 1.00 0.00 H new ATOM 0 HA MET A 103 -0.017 -24.668 -10.208 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.712 -23.800 -11.248 1.00 0.00 H new ATOM 0 HB3 MET A 103 -1.303 -23.941 -12.280 1.00 0.00 H new ATOM 0 HG2 MET A 103 -0.991 -26.294 -11.467 1.00 0.00 H new ATOM 0 HG3 MET A 103 -2.465 -26.138 -10.532 1.00 0.00 H new ATOM 0 HE1 MET A 103 -5.330 -26.357 -13.019 1.00 0.00 H new ATOM 0 HE2 MET A 103 -4.777 -26.175 -11.337 1.00 0.00 H new ATOM 0 HE3 MET A 103 -4.670 -24.801 -12.463 1.00 0.00 H new ATOM 1606 N LEU A 104 -0.840 -21.480 -9.806 1.00 0.00 N ATOM 1607 CA LEU A 104 -0.158 -20.186 -9.805 1.00 0.00 C ATOM 1608 C LEU A 104 0.884 -20.126 -8.690 1.00 0.00 C ATOM 1609 O LEU A 104 1.976 -19.610 -8.914 1.00 0.00 O ATOM 1610 CB LEU A 104 -1.151 -19.007 -9.760 1.00 0.00 C ATOM 1611 CG LEU A 104 -0.665 -17.773 -10.548 1.00 0.00 C ATOM 1612 CD1 LEU A 104 0.689 -17.216 -10.121 1.00 0.00 C ATOM 1613 CD2 LEU A 104 -0.602 -18.041 -12.054 1.00 0.00 C ATOM 0 H LEU A 104 -1.803 -21.468 -9.469 1.00 0.00 H new ATOM 0 HA LEU A 104 0.375 -20.085 -10.750 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.110 -19.333 -10.163 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.321 -18.723 -8.721 1.00 0.00 H new ATOM 0 HG LEU A 104 -1.420 -17.023 -10.311 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.937 -16.351 -10.737 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.645 -16.915 -9.074 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.454 -17.983 -10.247 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.255 -17.145 -12.569 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.088 -18.862 -12.249 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.594 -18.307 -12.418 1.00 0.00 H new ATOM 1625 N HIS A 105 0.594 -20.700 -7.518 1.00 0.00 N ATOM 1626 CA HIS A 105 1.581 -20.811 -6.444 1.00 0.00 C ATOM 1627 C HIS A 105 2.886 -21.416 -6.974 1.00 0.00 C ATOM 1628 O HIS A 105 3.955 -20.831 -6.802 1.00 0.00 O ATOM 1629 CB HIS A 105 1.017 -21.647 -5.291 1.00 0.00 C ATOM 1630 CG HIS A 105 2.006 -21.813 -4.165 1.00 0.00 C ATOM 1631 ND1 HIS A 105 2.330 -20.831 -3.230 1.00 0.00 N ATOM 1632 CD2 HIS A 105 2.758 -22.929 -3.924 1.00 0.00 C ATOM 1633 CE1 HIS A 105 3.280 -21.373 -2.451 1.00 0.00 C ATOM 1634 NE2 HIS A 105 3.551 -22.631 -2.839 1.00 0.00 N ATOM 0 H HIS A 105 -0.319 -21.095 -7.291 1.00 0.00 H new ATOM 0 HA HIS A 105 1.802 -19.813 -6.066 1.00 0.00 H new ATOM 0 HB2 HIS A 105 0.113 -21.172 -4.910 1.00 0.00 H new ATOM 0 HB3 HIS A 105 0.728 -22.629 -5.665 1.00 0.00 H new ATOM 0 HD2 HIS A 105 2.735 -23.858 -4.474 1.00 0.00 H new ATOM 0 HE1 HIS A 105 3.760 -20.868 -1.626 1.00 0.00 H new ATOM 0 HE2 HIS A 105 4.228 -23.258 -2.404 1.00 0.00 H new ATOM 1642 N ASP A 106 2.782 -22.529 -7.702 1.00 0.00 N ATOM 1643 CA ASP A 106 3.933 -23.253 -8.239 1.00 0.00 C ATOM 1644 C ASP A 106 4.706 -22.446 -9.286 1.00 0.00 C ATOM 1645 O ASP A 106 5.940 -22.407 -9.246 1.00 0.00 O ATOM 1646 CB ASP A 106 3.487 -24.590 -8.831 1.00 0.00 C ATOM 1647 CG ASP A 106 4.681 -25.319 -9.465 1.00 0.00 C ATOM 1648 OD1 ASP A 106 5.500 -25.900 -8.714 1.00 0.00 O1- ATOM 1649 OD2 ASP A 106 4.788 -25.335 -10.715 1.00 0.00 O ATOM 0 H ASP A 106 1.886 -22.957 -7.937 1.00 0.00 H new ATOM 0 HA ASP A 106 4.613 -23.428 -7.405 1.00 0.00 H new ATOM 0 HB2 ASP A 106 3.046 -25.211 -8.052 1.00 0.00 H new ATOM 0 HB3 ASP A 106 2.714 -24.423 -9.581 1.00 0.00 H new ATOM 1654 N LYS A 107 3.990 -21.752 -10.181 1.00 0.00 N ATOM 1655 CA LYS A 107 4.589 -20.800 -11.120 1.00 0.00 C ATOM 1656 C LYS A 107 5.410 -19.762 -10.354 1.00 0.00 C ATOM 1657 O LYS A 107 6.503 -19.403 -10.784 1.00 0.00 O ATOM 1658 CB LYS A 107 3.499 -20.125 -11.970 1.00 0.00 C ATOM 1659 CG LYS A 107 4.120 -19.138 -12.976 1.00 0.00 C ATOM 1660 CD LYS A 107 3.097 -18.413 -13.862 1.00 0.00 C ATOM 1661 CE LYS A 107 2.263 -19.295 -14.812 1.00 0.00 C ATOM 1662 NZ LYS A 107 3.065 -20.141 -15.761 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.978 -21.837 -10.273 1.00 0.00 H new ATOM 0 HA LYS A 107 5.255 -21.337 -11.796 1.00 0.00 H new ATOM 0 HB2 LYS A 107 2.927 -20.884 -12.504 1.00 0.00 H new ATOM 0 HB3 LYS A 107 2.800 -19.597 -11.321 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.700 -18.395 -12.428 1.00 0.00 H new ATOM 0 HG3 LYS A 107 4.818 -19.679 -13.615 1.00 0.00 H new ATOM 0 HD2 LYS A 107 2.412 -17.866 -13.214 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.628 -17.673 -14.461 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.629 -19.949 -14.213 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.601 -18.653 -15.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.421 -20.698 -16.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.651 -19.528 -16.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 3.678 -20.784 -15.220 1.00 0.00 H new ATOM 1676 N LEU A 108 4.878 -19.251 -9.244 1.00 0.00 N ATOM 1677 CA LEU A 108 5.441 -18.090 -8.574 1.00 0.00 C ATOM 1678 C LEU A 108 6.673 -18.360 -7.733 1.00 0.00 C ATOM 1679 O LEU A 108 7.452 -17.425 -7.548 1.00 0.00 O ATOM 1680 CB LEU A 108 4.369 -17.400 -7.721 1.00 0.00 C ATOM 1681 CG LEU A 108 3.717 -16.222 -8.445 1.00 0.00 C ATOM 1682 CD1 LEU A 108 2.658 -15.640 -7.519 1.00 0.00 C ATOM 1683 CD2 LEU A 108 4.726 -15.118 -8.764 1.00 0.00 C ATOM 0 H LEU A 108 4.048 -19.632 -8.789 1.00 0.00 H new ATOM 0 HA LEU A 108 5.780 -17.438 -9.379 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.602 -18.125 -7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.818 -17.048 -6.792 1.00 0.00 H new ATOM 0 HG LEU A 108 3.297 -16.581 -9.384 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.172 -14.795 -8.007 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.914 -16.404 -7.291 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.128 -15.304 -6.595 1.00 0.00 H new ATOM 0 HD21 LEU A 108 4.221 -14.301 -9.278 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.165 -14.748 -7.838 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.513 -15.518 -9.404 1.00 0.00 H new ATOM 1695 N SER A 109 6.881 -19.571 -7.223 1.00 0.00 N ATOM 1696 CA SER A 109 7.971 -19.819 -6.282 1.00 0.00 C ATOM 1697 C SER A 109 9.345 -19.471 -6.878 1.00 0.00 C ATOM 1698 O SER A 109 10.224 -18.975 -6.169 1.00 0.00 O ATOM 1699 CB SER A 109 7.948 -21.287 -5.841 1.00 0.00 C ATOM 1700 OG SER A 109 6.651 -21.668 -5.411 1.00 0.00 O ATOM 0 H SER A 109 6.315 -20.390 -7.443 1.00 0.00 H new ATOM 0 HA SER A 109 7.817 -19.169 -5.421 1.00 0.00 H new ATOM 0 HB2 SER A 109 8.263 -21.924 -6.668 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.663 -21.439 -5.032 1.00 0.00 H new ATOM 0 HG SER A 109 6.661 -22.609 -5.136 1.00 0.00 H new ATOM 1706 N THR A 110 9.518 -19.662 -8.188 1.00 0.00 N ATOM 1707 CA THR A 110 10.764 -19.399 -8.903 1.00 0.00 C ATOM 1708 C THR A 110 10.858 -17.938 -9.377 1.00 0.00 C ATOM 1709 O THR A 110 11.927 -17.491 -9.796 1.00 0.00 O ATOM 1710 CB THR A 110 10.877 -20.432 -10.039 1.00 0.00 C ATOM 1711 OG1 THR A 110 9.665 -20.473 -10.776 1.00 0.00 O ATOM 1712 CG2 THR A 110 11.116 -21.836 -9.463 1.00 0.00 C ATOM 0 H THR A 110 8.776 -20.012 -8.794 1.00 0.00 H new ATOM 0 HA THR A 110 11.621 -19.516 -8.240 1.00 0.00 H new ATOM 0 HB THR A 110 11.709 -20.139 -10.679 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.743 -21.131 -11.498 1.00 0.00 H new ATOM 0 HG21 THR A 110 11.194 -22.555 -10.278 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.041 -21.840 -8.886 1.00 0.00 H new ATOM 0 HG23 THR A 110 10.283 -22.110 -8.815 1.00 0.00 H new ATOM 1720 N LYS A 111 9.765 -17.160 -9.274 1.00 0.00 N ATOM 1721 CA LYS A 111 9.744 -15.722 -9.548 1.00 0.00 C ATOM 1722 C LYS A 111 10.243 -14.916 -8.343 1.00 0.00 C ATOM 1723 O LYS A 111 10.461 -13.714 -8.472 1.00 0.00 O ATOM 1724 CB LYS A 111 8.336 -15.272 -9.996 1.00 0.00 C ATOM 1725 CG LYS A 111 7.796 -16.009 -11.236 1.00 0.00 C ATOM 1726 CD LYS A 111 8.663 -15.911 -12.501 1.00 0.00 C ATOM 1727 CE LYS A 111 8.878 -14.455 -12.953 1.00 0.00 C ATOM 1728 NZ LYS A 111 9.662 -14.366 -14.216 1.00 0.00 N1+ ATOM 0 H LYS A 111 8.856 -17.527 -8.992 1.00 0.00 H new ATOM 0 HA LYS A 111 10.432 -15.523 -10.370 1.00 0.00 H new ATOM 0 HB2 LYS A 111 7.641 -15.420 -9.170 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.359 -14.203 -10.206 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.672 -17.062 -10.984 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.805 -15.617 -11.466 1.00 0.00 H new ATOM 0 HD2 LYS A 111 9.630 -16.377 -12.312 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.190 -16.473 -13.307 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.910 -13.974 -13.094 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.396 -13.905 -12.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.738 -13.371 -14.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.614 -14.755 -14.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.182 -14.910 -14.961 1.00 0.00 H new ATOM 1742 N GLY A 112 10.423 -15.557 -7.185 1.00 0.00 N ATOM 1743 CA GLY A 112 11.092 -14.961 -6.036 1.00 0.00 C ATOM 1744 C GLY A 112 10.219 -13.942 -5.313 1.00 0.00 C ATOM 1745 O GLY A 112 10.737 -12.945 -4.807 1.00 0.00 O ATOM 0 H GLY A 112 10.104 -16.512 -7.022 1.00 0.00 H new ATOM 0 HA2 GLY A 112 11.379 -15.748 -5.339 1.00 0.00 H new ATOM 0 HA3 GLY A 112 12.011 -14.477 -6.366 1.00 0.00 H new ATOM 1749 N VAL A 113 8.897 -14.147 -5.287 1.00 0.00 N ATOM 1750 CA VAL A 113 7.990 -13.376 -4.453 1.00 0.00 C ATOM 1751 C VAL A 113 8.080 -13.842 -2.992 1.00 0.00 C ATOM 1752 O VAL A 113 8.801 -14.789 -2.663 1.00 0.00 O ATOM 1753 CB VAL A 113 6.564 -13.468 -5.020 1.00 0.00 C ATOM 1754 CG1 VAL A 113 6.515 -12.838 -6.419 1.00 0.00 C ATOM 1755 CG2 VAL A 113 6.001 -14.894 -5.011 1.00 0.00 C ATOM 0 H VAL A 113 8.431 -14.859 -5.850 1.00 0.00 H new ATOM 0 HA VAL A 113 8.278 -12.325 -4.463 1.00 0.00 H new ATOM 0 HB VAL A 113 5.911 -12.900 -4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.501 -12.907 -6.814 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.810 -11.790 -6.357 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.199 -13.369 -7.081 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.992 -14.889 -5.424 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.637 -15.540 -5.615 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.973 -15.267 -3.987 1.00 0.00 H new ATOM 1765 N LYS A 114 7.292 -13.201 -2.127 1.00 0.00 N ATOM 1766 CA LYS A 114 7.059 -13.619 -0.745 1.00 0.00 C ATOM 1767 C LYS A 114 5.584 -13.951 -0.642 1.00 0.00 C ATOM 1768 O LYS A 114 4.782 -13.149 -1.111 1.00 0.00 O ATOM 1769 CB LYS A 114 7.458 -12.480 0.210 1.00 0.00 C ATOM 1770 CG LYS A 114 7.573 -12.958 1.672 1.00 0.00 C ATOM 1771 CD LYS A 114 6.395 -12.510 2.554 1.00 0.00 C ATOM 1772 CE LYS A 114 6.371 -13.222 3.924 1.00 0.00 C ATOM 1773 NZ LYS A 114 7.579 -12.959 4.765 1.00 0.00 N1+ ATOM 0 H LYS A 114 6.784 -12.352 -2.377 1.00 0.00 H new ATOM 0 HA LYS A 114 7.656 -14.488 -0.469 1.00 0.00 H new ATOM 0 HB2 LYS A 114 8.411 -12.058 -0.109 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.719 -11.681 0.148 1.00 0.00 H new ATOM 0 HG2 LYS A 114 7.636 -14.046 1.687 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.502 -12.579 2.099 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.453 -11.433 2.710 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.459 -12.707 2.031 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.483 -12.905 4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 114 6.280 -14.296 3.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.342 -13.103 5.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 8.341 -13.612 4.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 7.895 -11.979 4.621 1.00 0.00 H new ATOM 1787 N PHE A 115 5.206 -15.067 -0.029 1.00 0.00 N ATOM 1788 CA PHE A 115 3.798 -15.437 0.081 1.00 0.00 C ATOM 1789 C PHE A 115 3.236 -14.974 1.420 1.00 0.00 C ATOM 1790 O PHE A 115 3.940 -14.999 2.429 1.00 0.00 O ATOM 1791 CB PHE A 115 3.612 -16.940 -0.158 1.00 0.00 C ATOM 1792 CG PHE A 115 4.016 -17.388 -1.555 1.00 0.00 C ATOM 1793 CD1 PHE A 115 3.325 -16.879 -2.675 1.00 0.00 C ATOM 1794 CD2 PHE A 115 5.064 -18.309 -1.740 1.00 0.00 C ATOM 1795 CE1 PHE A 115 3.663 -17.311 -3.968 1.00 0.00 C ATOM 1796 CE2 PHE A 115 5.404 -18.736 -3.037 1.00 0.00 C ATOM 1797 CZ PHE A 115 4.696 -18.249 -4.147 1.00 0.00 C ATOM 0 H PHE A 115 5.852 -15.730 0.399 1.00 0.00 H new ATOM 0 HA PHE A 115 3.228 -14.929 -0.697 1.00 0.00 H new ATOM 0 HB2 PHE A 115 4.200 -17.492 0.576 1.00 0.00 H new ATOM 0 HB3 PHE A 115 2.567 -17.200 0.010 1.00 0.00 H new ATOM 0 HD1 PHE A 115 2.535 -16.156 -2.538 1.00 0.00 H new ATOM 0 HD2 PHE A 115 5.607 -18.688 -0.887 1.00 0.00 H new ATOM 0 HE1 PHE A 115 3.130 -16.923 -4.824 1.00 0.00 H new ATOM 0 HE2 PHE A 115 6.211 -19.440 -3.179 1.00 0.00 H new ATOM 0 HZ PHE A 115 4.945 -18.595 -5.139 1.00 0.00 H new ATOM 1807 N VAL A 116 1.966 -14.568 1.429 1.00 0.00 N ATOM 1808 CA VAL A 116 1.197 -14.248 2.628 1.00 0.00 C ATOM 1809 C VAL A 116 -0.162 -14.939 2.528 1.00 0.00 C ATOM 1810 O VAL A 116 -0.618 -15.269 1.431 1.00 0.00 O ATOM 1811 CB VAL A 116 1.082 -12.718 2.833 1.00 0.00 C ATOM 1812 CG1 VAL A 116 2.470 -12.089 3.031 1.00 0.00 C ATOM 1813 CG2 VAL A 116 0.368 -11.976 1.694 1.00 0.00 C ATOM 0 H VAL A 116 1.427 -14.449 0.571 1.00 0.00 H new ATOM 0 HA VAL A 116 1.711 -14.620 3.514 1.00 0.00 H new ATOM 0 HB VAL A 116 0.468 -12.603 3.726 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.365 -11.013 3.173 1.00 0.00 H new ATOM 0 HG12 VAL A 116 2.946 -12.526 3.909 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.085 -12.280 2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.332 -10.910 1.920 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.911 -12.131 0.762 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.647 -12.359 1.590 1.00 0.00 H new ATOM 1823 N GLY A 117 -0.830 -15.120 3.665 1.00 0.00 N ATOM 1824 CA GLY A 117 -2.206 -15.576 3.700 1.00 0.00 C ATOM 1825 C GLY A 117 -2.358 -17.084 3.569 1.00 0.00 C ATOM 1826 O GLY A 117 -3.351 -17.529 2.998 1.00 0.00 O ATOM 0 H GLY A 117 -0.426 -14.953 4.587 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -2.661 -15.255 4.637 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.759 -15.093 2.894 1.00 0.00 H new ATOM 1830 N TYR A 118 -1.424 -17.881 4.087 1.00 0.00 N ATOM 1831 CA TYR A 118 -1.619 -19.329 4.192 1.00 0.00 C ATOM 1832 C TYR A 118 -2.817 -19.621 5.122 1.00 0.00 C ATOM 1833 O TYR A 118 -3.102 -18.837 6.031 1.00 0.00 O ATOM 1834 CB TYR A 118 -0.323 -19.992 4.681 1.00 0.00 C ATOM 1835 CG TYR A 118 0.824 -20.144 3.681 1.00 0.00 C ATOM 1836 CD1 TYR A 118 0.825 -19.519 2.412 1.00 0.00 C ATOM 1837 CD2 TYR A 118 1.918 -20.954 4.042 1.00 0.00 C ATOM 1838 CE1 TYR A 118 1.882 -19.737 1.512 1.00 0.00 C ATOM 1839 CE2 TYR A 118 2.999 -21.140 3.162 1.00 0.00 C ATOM 1840 CZ TYR A 118 2.982 -20.540 1.883 1.00 0.00 C ATOM 1841 OH TYR A 118 4.009 -20.723 1.007 1.00 0.00 O ATOM 0 H TYR A 118 -0.526 -17.550 4.440 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.851 -19.752 3.215 1.00 0.00 H new ATOM 0 HB2 TYR A 118 0.047 -19.417 5.530 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -0.575 -20.985 5.054 1.00 0.00 H new ATOM 0 HD1 TYR A 118 0.008 -18.870 2.133 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.927 -21.439 5.007 1.00 0.00 H new ATOM 0 HE1 TYR A 118 1.853 -19.287 0.530 1.00 0.00 H new ATOM 0 HE2 TYR A 118 3.843 -21.742 3.464 1.00 0.00 H new ATOM 0 HH TYR A 118 4.688 -21.300 1.415 1.00 0.00 H new ATOM 1851 N TRP A 119 -3.527 -20.733 4.884 1.00 0.00 N ATOM 1852 CA TRP A 119 -4.797 -21.066 5.541 1.00 0.00 C ATOM 1853 C TRP A 119 -4.752 -22.543 5.977 1.00 0.00 C ATOM 1854 O TRP A 119 -4.266 -23.353 5.182 1.00 0.00 O ATOM 1855 CB TRP A 119 -5.944 -20.774 4.559 1.00 0.00 C ATOM 1856 CG TRP A 119 -7.263 -20.378 5.149 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -7.727 -19.111 5.188 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -8.299 -21.181 5.795 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -8.945 -19.071 5.830 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -9.313 -20.311 6.293 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -8.476 -22.553 6.035 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -10.390 -20.769 7.064 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -9.554 -23.033 6.800 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -10.504 -22.143 7.330 1.00 0.00 C ATOM 0 H TRP A 119 -3.227 -21.441 4.214 1.00 0.00 H new ATOM 0 HA TRP A 119 -4.962 -20.463 6.434 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -5.621 -19.978 3.888 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -6.100 -21.663 3.947 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -7.217 -18.253 4.776 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.504 -18.226 5.947 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -7.768 -23.256 5.622 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -11.122 -20.075 7.448 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -9.653 -24.093 6.982 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -11.316 -22.513 7.938 1.00 0.00 H new ATOM 1875 N PRO A 120 -5.197 -22.921 7.193 1.00 0.00 N ATOM 1876 CA PRO A 120 -5.029 -24.276 7.717 1.00 0.00 C ATOM 1877 C PRO A 120 -5.822 -25.325 6.946 1.00 0.00 C ATOM 1878 O PRO A 120 -7.034 -25.199 6.785 1.00 0.00 O ATOM 1879 CB PRO A 120 -5.454 -24.231 9.191 1.00 0.00 C ATOM 1880 CG PRO A 120 -5.294 -22.761 9.560 1.00 0.00 C ATOM 1881 CD PRO A 120 -5.679 -22.056 8.261 1.00 0.00 C ATOM 0 HA PRO A 120 -3.988 -24.581 7.607 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -6.482 -24.569 9.323 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -4.826 -24.871 9.810 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -5.945 -22.476 10.386 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -4.274 -22.526 9.863 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.758 -21.915 8.196 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.224 -21.067 8.201 1.00 0.00 H new ATOM 1889 N THR A 121 -5.171 -26.416 6.550 1.00 0.00 N ATOM 1890 CA THR A 121 -5.898 -27.541 5.940 1.00 0.00 C ATOM 1891 C THR A 121 -6.827 -28.276 6.932 1.00 0.00 C ATOM 1892 O THR A 121 -7.656 -29.090 6.515 1.00 0.00 O ATOM 1893 CB THR A 121 -4.919 -28.517 5.274 1.00 0.00 C ATOM 1894 OG1 THR A 121 -3.892 -28.911 6.155 1.00 0.00 O ATOM 1895 CG2 THR A 121 -4.258 -27.900 4.044 1.00 0.00 C ATOM 0 H THR A 121 -4.163 -26.551 6.635 1.00 0.00 H new ATOM 0 HA THR A 121 -6.549 -27.115 5.177 1.00 0.00 H new ATOM 0 HB THR A 121 -5.515 -29.383 4.986 1.00 0.00 H new ATOM 0 HG1 THR A 121 -3.815 -29.888 6.152 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.572 -28.621 3.600 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.023 -27.631 3.316 1.00 0.00 H new ATOM 0 HG23 THR A 121 -3.706 -27.007 4.337 1.00 0.00 H new ATOM 1903 N GLU A 122 -6.679 -28.034 8.240 1.00 0.00 N ATOM 1904 CA GLU A 122 -7.395 -28.734 9.293 1.00 0.00 C ATOM 1905 C GLU A 122 -8.908 -28.518 9.152 1.00 0.00 C ATOM 1906 O GLU A 122 -9.383 -27.402 8.925 1.00 0.00 O ATOM 1907 CB GLU A 122 -6.907 -28.275 10.677 1.00 0.00 C ATOM 1908 CG GLU A 122 -5.432 -28.618 10.930 1.00 0.00 C ATOM 1909 CD GLU A 122 -5.012 -28.254 12.366 1.00 0.00 C ATOM 1910 OE1 GLU A 122 -4.561 -27.105 12.598 1.00 0.00 O1- ATOM 1911 OE2 GLU A 122 -5.118 -29.115 13.273 1.00 0.00 O ATOM 0 H GLU A 122 -6.038 -27.325 8.596 1.00 0.00 H new ATOM 0 HA GLU A 122 -7.192 -29.800 9.196 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -7.046 -27.198 10.768 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.521 -28.741 11.447 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -5.269 -29.682 10.760 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -4.804 -28.082 10.218 1.00 0.00 H new ATOM 1918 N GLY A 123 -9.658 -29.607 9.324 1.00 0.00 N ATOM 1919 CA GLY A 123 -11.119 -29.622 9.355 1.00 0.00 C ATOM 1920 C GLY A 123 -11.777 -29.674 7.970 1.00 0.00 C ATOM 1921 O GLY A 123 -12.990 -29.889 7.890 1.00 0.00 O ATOM 0 H GLY A 123 -9.250 -30.534 9.450 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -11.450 -30.484 9.935 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.469 -28.732 9.878 1.00 0.00 H new ATOM 1925 N TYR A 124 -11.005 -29.522 6.891 1.00 0.00 N ATOM 1926 CA TYR A 124 -11.476 -29.698 5.522 1.00 0.00 C ATOM 1927 C TYR A 124 -11.207 -31.140 5.075 1.00 0.00 C ATOM 1928 O TYR A 124 -10.239 -31.767 5.516 1.00 0.00 O ATOM 1929 CB TYR A 124 -10.809 -28.681 4.587 1.00 0.00 C ATOM 1930 CG TYR A 124 -11.481 -27.318 4.587 1.00 0.00 C ATOM 1931 CD1 TYR A 124 -11.375 -26.469 5.706 1.00 0.00 C ATOM 1932 CD2 TYR A 124 -12.257 -26.915 3.483 1.00 0.00 C ATOM 1933 CE1 TYR A 124 -12.058 -25.241 5.729 1.00 0.00 C ATOM 1934 CE2 TYR A 124 -12.954 -25.695 3.505 1.00 0.00 C ATOM 1935 CZ TYR A 124 -12.852 -24.847 4.628 1.00 0.00 C ATOM 1936 OH TYR A 124 -13.529 -23.661 4.638 1.00 0.00 O ATOM 0 H TYR A 124 -10.019 -29.269 6.949 1.00 0.00 H new ATOM 0 HA TYR A 124 -12.550 -29.518 5.479 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -9.766 -28.562 4.879 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -10.812 -29.078 3.572 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -10.767 -26.763 6.549 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -12.317 -27.550 2.611 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -11.976 -24.596 6.591 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -13.567 -25.407 2.664 1.00 0.00 H new ATOM 0 HH TYR A 124 -14.021 -23.558 3.797 1.00 0.00 H new ATOM 1946 N GLU A 125 -12.044 -31.649 4.169 1.00 0.00 N ATOM 1947 CA GLU A 125 -11.903 -32.960 3.548 1.00 0.00 C ATOM 1948 C GLU A 125 -11.691 -32.731 2.053 1.00 0.00 C ATOM 1949 O GLU A 125 -12.578 -32.230 1.358 1.00 0.00 O ATOM 1950 CB GLU A 125 -13.143 -33.829 3.819 1.00 0.00 C ATOM 1951 CG GLU A 125 -13.159 -34.405 5.242 1.00 0.00 C ATOM 1952 CD GLU A 125 -12.298 -35.675 5.367 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -11.049 -35.573 5.427 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -12.867 -36.793 5.421 1.00 0.00 O ATOM 0 H GLU A 125 -12.864 -31.140 3.839 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.053 -33.499 3.967 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -14.042 -33.233 3.662 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -13.174 -34.647 3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -12.795 -33.652 5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -14.186 -34.635 5.527 1.00 0.00 H new ATOM 1961 N PHE A 126 -10.490 -33.053 1.574 1.00 0.00 N ATOM 1962 CA PHE A 126 -10.057 -32.831 0.201 1.00 0.00 C ATOM 1963 C PHE A 126 -8.928 -33.805 -0.147 1.00 0.00 C ATOM 1964 O PHE A 126 -8.411 -34.498 0.735 1.00 0.00 O ATOM 1965 CB PHE A 126 -9.601 -31.368 0.017 1.00 0.00 C ATOM 1966 CG PHE A 126 -8.328 -31.026 0.771 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -8.385 -30.732 2.145 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -7.079 -31.086 0.120 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -7.202 -30.541 2.878 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -5.896 -30.900 0.855 1.00 0.00 C ATOM 1971 CZ PHE A 126 -5.954 -30.641 2.236 1.00 0.00 C ATOM 0 H PHE A 126 -9.771 -33.489 2.152 1.00 0.00 H new ATOM 0 HA PHE A 126 -10.892 -33.012 -0.476 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -9.447 -31.176 -1.045 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -10.399 -30.704 0.349 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -9.342 -30.653 2.639 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -7.031 -31.275 -0.942 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -7.250 -30.318 3.934 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -4.939 -30.956 0.358 1.00 0.00 H new ATOM 0 HZ PHE A 126 -5.043 -30.519 2.803 1.00 0.00 H new ATOM 1981 N THR A 127 -8.543 -33.851 -1.424 1.00 0.00 N ATOM 1982 CA THR A 127 -7.448 -34.691 -1.898 1.00 0.00 C ATOM 1983 C THR A 127 -6.573 -33.982 -2.949 1.00 0.00 C ATOM 1984 O THR A 127 -5.456 -34.439 -3.194 1.00 0.00 O ATOM 1985 CB THR A 127 -8.043 -36.048 -2.344 1.00 0.00 C ATOM 1986 OG1 THR A 127 -7.063 -37.052 -2.560 1.00 0.00 O ATOM 1987 CG2 THR A 127 -8.925 -35.942 -3.593 1.00 0.00 C ATOM 0 H THR A 127 -8.987 -33.302 -2.160 1.00 0.00 H new ATOM 0 HA THR A 127 -6.741 -34.889 -1.093 1.00 0.00 H new ATOM 0 HB THR A 127 -8.664 -36.345 -1.499 1.00 0.00 H new ATOM 0 HG1 THR A 127 -6.224 -36.634 -2.847 1.00 0.00 H new ATOM 0 HG21 THR A 127 -9.310 -36.928 -3.851 1.00 0.00 H new ATOM 0 HG22 THR A 127 -9.758 -35.268 -3.394 1.00 0.00 H new ATOM 0 HG23 THR A 127 -8.335 -35.554 -4.423 1.00 0.00 H new ATOM 1995 N SER A 128 -7.019 -32.857 -3.536 1.00 0.00 N ATOM 1996 CA SER A 128 -6.238 -32.073 -4.497 1.00 0.00 C ATOM 1997 C SER A 128 -4.849 -31.712 -3.923 1.00 0.00 C ATOM 1998 O SER A 128 -4.795 -31.039 -2.890 1.00 0.00 O ATOM 1999 CB SER A 128 -7.031 -30.802 -4.821 1.00 0.00 C ATOM 2000 OG SER A 128 -8.345 -31.145 -5.218 1.00 0.00 O ATOM 0 H SER A 128 -7.943 -32.466 -3.351 1.00 0.00 H new ATOM 0 HA SER A 128 -6.070 -32.658 -5.401 1.00 0.00 H new ATOM 0 HB2 SER A 128 -7.064 -30.150 -3.948 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.535 -30.245 -5.616 1.00 0.00 H new ATOM 0 HG SER A 128 -8.338 -31.438 -6.153 1.00 0.00 H new ATOM 2006 N PRO A 129 -3.725 -32.132 -4.548 1.00 0.00 N ATOM 2007 CA PRO A 129 -2.400 -31.970 -3.949 1.00 0.00 C ATOM 2008 C PRO A 129 -1.716 -30.646 -4.322 1.00 0.00 C ATOM 2009 O PRO A 129 -0.906 -30.153 -3.538 1.00 0.00 O ATOM 2010 CB PRO A 129 -1.604 -33.188 -4.420 1.00 0.00 C ATOM 2011 CG PRO A 129 -2.183 -33.463 -5.806 1.00 0.00 C ATOM 2012 CD PRO A 129 -3.659 -33.091 -5.649 1.00 0.00 C ATOM 0 HA PRO A 129 -2.468 -31.919 -2.862 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -0.535 -32.979 -4.464 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -1.736 -34.039 -3.752 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -1.695 -32.861 -6.573 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -2.059 -34.507 -6.094 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -4.050 -32.655 -6.568 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -4.262 -33.973 -5.433 1.00 0.00 H new ATOM 2020 N LYS A 130 -2.035 -30.037 -5.478 1.00 0.00 N ATOM 2021 CA LYS A 130 -1.335 -28.827 -5.941 1.00 0.00 C ATOM 2022 C LYS A 130 -1.344 -27.689 -4.907 1.00 0.00 C ATOM 2023 O LYS A 130 -0.298 -27.067 -4.728 1.00 0.00 O ATOM 2024 CB LYS A 130 -1.867 -28.309 -7.286 1.00 0.00 C ATOM 2025 CG LYS A 130 -1.650 -29.319 -8.414 1.00 0.00 C ATOM 2026 CD LYS A 130 -1.918 -28.656 -9.771 1.00 0.00 C ATOM 2027 CE LYS A 130 -1.963 -29.719 -10.873 1.00 0.00 C ATOM 2028 NZ LYS A 130 -3.265 -30.442 -10.903 1.00 0.00 N1+ ATOM 0 H LYS A 130 -2.770 -30.362 -6.106 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.302 -29.146 -6.080 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -2.931 -28.090 -7.195 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -1.369 -27.373 -7.537 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -0.629 -29.699 -8.381 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -2.313 -30.174 -8.280 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.862 -28.113 -9.739 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -1.138 -27.927 -9.989 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.790 -29.246 -11.839 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.155 -30.434 -10.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.324 -31.015 -11.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.336 -31.063 -10.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -4.045 -29.754 -10.889 1.00 0.00 H new ATOM 2042 N PRO A 131 -2.477 -27.355 -4.253 1.00 0.00 N ATOM 2043 CA PRO A 131 -2.561 -26.172 -3.407 1.00 0.00 C ATOM 2044 C PRO A 131 -2.103 -26.428 -1.975 1.00 0.00 C ATOM 2045 O PRO A 131 -2.405 -25.600 -1.129 1.00 0.00 O ATOM 2046 CB PRO A 131 -4.026 -25.737 -3.474 1.00 0.00 C ATOM 2047 CG PRO A 131 -4.751 -27.077 -3.554 1.00 0.00 C ATOM 2048 CD PRO A 131 -3.811 -27.933 -4.394 1.00 0.00 C ATOM 0 HA PRO A 131 -1.888 -25.391 -3.760 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -4.322 -25.165 -2.595 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -4.227 -25.112 -4.344 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -4.912 -27.507 -2.566 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -5.731 -26.977 -4.022 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.822 -28.968 -4.053 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -4.122 -27.938 -5.439 1.00 0.00 H new ATOM 2056 N VAL A 132 -1.435 -27.536 -1.643 1.00 0.00 N ATOM 2057 CA VAL A 132 -1.014 -27.781 -0.271 1.00 0.00 C ATOM 2058 C VAL A 132 0.476 -28.099 -0.204 1.00 0.00 C ATOM 2059 O VAL A 132 1.044 -28.719 -1.105 1.00 0.00 O ATOM 2060 CB VAL A 132 -1.901 -28.829 0.424 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -3.298 -28.258 0.698 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -2.045 -30.147 -0.351 1.00 0.00 C ATOM 0 H VAL A 132 -1.178 -28.270 -2.304 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.156 -26.862 0.298 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.388 -29.063 1.357 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.910 -29.014 1.190 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -3.214 -27.384 1.343 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -3.765 -27.970 -0.244 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -2.685 -30.830 0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.490 -29.949 -1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -1.062 -30.599 -0.485 1.00 0.00 H new ATOM 2072 N ILE A 133 1.094 -27.663 0.893 1.00 0.00 N ATOM 2073 CA ILE A 133 2.451 -27.999 1.292 1.00 0.00 C ATOM 2074 C ILE A 133 2.397 -29.039 2.400 1.00 0.00 C ATOM 2075 O ILE A 133 1.339 -29.250 3.001 1.00 0.00 O ATOM 2076 CB ILE A 133 3.225 -26.733 1.739 1.00 0.00 C ATOM 2077 CG1 ILE A 133 2.491 -25.990 2.892 1.00 0.00 C ATOM 2078 CG2 ILE A 133 3.532 -25.889 0.493 1.00 0.00 C ATOM 2079 CD1 ILE A 133 3.143 -24.662 3.287 1.00 0.00 C ATOM 0 H ILE A 133 0.637 -27.037 1.556 1.00 0.00 H new ATOM 0 HA ILE A 133 2.989 -28.416 0.441 1.00 0.00 H new ATOM 0 HB ILE A 133 4.185 -26.994 2.185 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.460 -25.803 2.592 1.00 0.00 H new ATOM 0 HG13 ILE A 133 2.456 -26.640 3.766 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.077 -24.992 0.786 1.00 0.00 H new ATOM 0 HG22 ILE A 133 4.138 -26.472 -0.201 1.00 0.00 H new ATOM 0 HG23 ILE A 133 2.599 -25.604 0.008 1.00 0.00 H new ATOM 0 HD11 ILE A 133 2.574 -24.204 4.096 1.00 0.00 H new ATOM 0 HD12 ILE A 133 4.165 -24.843 3.619 1.00 0.00 H new ATOM 0 HD13 ILE A 133 3.154 -23.992 2.427 1.00 0.00 H new ATOM 2091 N ALA A 134 3.561 -29.616 2.715 1.00 0.00 N ATOM 2092 CA ALA A 134 3.789 -30.442 3.896 1.00 0.00 C ATOM 2093 C ALA A 134 2.840 -31.644 3.995 1.00 0.00 C ATOM 2094 O ALA A 134 2.473 -32.094 5.082 1.00 0.00 O ATOM 2095 CB ALA A 134 3.765 -29.508 5.099 1.00 0.00 C ATOM 0 H ALA A 134 4.394 -29.515 2.135 1.00 0.00 H new ATOM 0 HA ALA A 134 4.762 -30.930 3.841 1.00 0.00 H new ATOM 0 HB1 ALA A 134 3.932 -30.083 6.010 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.550 -28.759 4.994 1.00 0.00 H new ATOM 0 HB3 ALA A 134 2.796 -29.012 5.155 1.00 0.00 H new ATOM 2101 N ASP A 135 2.445 -32.140 2.824 1.00 0.00 N ATOM 2102 CA ASP A 135 1.485 -33.230 2.611 1.00 0.00 C ATOM 2103 C ASP A 135 0.146 -32.938 3.306 1.00 0.00 C ATOM 2104 O ASP A 135 -0.500 -33.817 3.883 1.00 0.00 O ATOM 2105 CB ASP A 135 2.108 -34.596 2.950 1.00 0.00 C ATOM 2106 CG ASP A 135 1.205 -35.776 2.535 1.00 0.00 C ATOM 2107 OD1 ASP A 135 0.669 -35.772 1.397 1.00 0.00 O ATOM 2108 OD2 ASP A 135 1.081 -36.749 3.319 1.00 0.00 O1- ATOM 0 H ASP A 135 2.806 -31.772 1.944 1.00 0.00 H new ATOM 0 HA ASP A 135 1.242 -33.288 1.550 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.072 -34.687 2.449 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.300 -34.649 4.022 1.00 0.00 H new ATOM 2113 N GLY A 136 -0.270 -31.667 3.251 1.00 0.00 N ATOM 2114 CA GLY A 136 -1.537 -31.194 3.783 1.00 0.00 C ATOM 2115 C GLY A 136 -1.360 -30.572 5.164 1.00 0.00 C ATOM 2116 O GLY A 136 -1.766 -31.174 6.161 1.00 0.00 O ATOM 0 H GLY A 136 0.285 -30.926 2.823 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -1.968 -30.459 3.103 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -2.241 -32.024 3.843 1.00 0.00 H new ATOM 2120 N GLN A 137 -0.744 -29.381 5.215 1.00 0.00 N ATOM 2121 CA GLN A 137 -0.728 -28.539 6.417 1.00 0.00 C ATOM 2122 C GLN A 137 -1.369 -27.180 6.139 1.00 0.00 C ATOM 2123 O GLN A 137 -2.204 -26.717 6.918 1.00 0.00 O ATOM 2124 CB GLN A 137 0.676 -28.345 6.997 1.00 0.00 C ATOM 2125 CG GLN A 137 1.325 -29.674 7.374 1.00 0.00 C ATOM 2126 CD GLN A 137 0.660 -30.427 8.532 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -0.011 -29.853 9.390 1.00 0.00 O ATOM 2128 NE2 GLN A 137 0.858 -31.736 8.598 1.00 0.00 N ATOM 0 H GLN A 137 -0.244 -28.976 4.424 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.314 -29.072 7.166 1.00 0.00 H new ATOM 0 HB2 GLN A 137 1.302 -27.829 6.268 1.00 0.00 H new ATOM 0 HB3 GLN A 137 0.620 -27.706 7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 137 1.326 -30.320 6.496 1.00 0.00 H new ATOM 0 HG3 GLN A 137 2.367 -29.489 7.635 1.00 0.00 H new ATOM 0 HE21 GLN A 137 1.415 -32.204 7.883 1.00 0.00 H new ATOM 0 HE22 GLN A 137 0.453 -32.275 9.363 1.00 0.00 H new ATOM 2137 N LEU A 138 -0.971 -26.516 5.042 1.00 0.00 N ATOM 2138 CA LEU A 138 -1.520 -25.209 4.664 1.00 0.00 C ATOM 2139 C LEU A 138 -1.920 -25.222 3.195 1.00 0.00 C ATOM 2140 O LEU A 138 -1.174 -25.747 2.371 1.00 0.00 O ATOM 2141 CB LEU A 138 -0.512 -24.062 4.903 1.00 0.00 C ATOM 2142 CG LEU A 138 -0.170 -23.651 6.353 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -1.431 -23.386 7.181 1.00 0.00 C ATOM 2144 CD2 LEU A 138 0.734 -24.637 7.096 1.00 0.00 C ATOM 0 H LEU A 138 -0.264 -26.869 4.397 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.391 -25.030 5.294 1.00 0.00 H new ATOM 0 HB2 LEU A 138 0.421 -24.337 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.893 -23.178 4.392 1.00 0.00 H new ATOM 0 HG LEU A 138 0.398 -22.727 6.243 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.148 -23.100 8.194 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.004 -22.580 6.723 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.040 -24.289 7.216 1.00 0.00 H new ATOM 0 HD21 LEU A 138 0.922 -24.269 8.105 1.00 0.00 H new ATOM 0 HD22 LEU A 138 0.245 -25.610 7.150 1.00 0.00 H new ATOM 0 HD23 LEU A 138 1.680 -24.736 6.564 1.00 0.00 H new ATOM 2156 N PHE A 139 -3.036 -24.565 2.861 1.00 0.00 N ATOM 2157 CA PHE A 139 -3.569 -24.406 1.495 1.00 0.00 C ATOM 2158 C PHE A 139 -2.832 -23.380 0.620 1.00 0.00 C ATOM 2159 O PHE A 139 -3.385 -22.848 -0.341 1.00 0.00 O ATOM 2160 CB PHE A 139 -5.050 -24.020 1.554 1.00 0.00 C ATOM 2161 CG PHE A 139 -6.028 -25.041 2.076 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -6.241 -26.233 1.362 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -6.842 -24.727 3.178 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -7.261 -27.113 1.757 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -7.888 -25.586 3.550 1.00 0.00 C ATOM 2166 CZ PHE A 139 -8.089 -26.784 2.843 1.00 0.00 C ATOM 0 H PHE A 139 -3.620 -24.109 3.562 1.00 0.00 H new ATOM 0 HA PHE A 139 -3.418 -25.377 1.022 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -5.138 -23.127 2.173 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -5.363 -23.742 0.547 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -5.621 -26.472 0.511 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -6.662 -23.822 3.740 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -7.409 -28.042 1.226 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -8.535 -25.328 4.375 1.00 0.00 H new ATOM 0 HZ PHE A 139 -8.883 -27.454 3.136 1.00 0.00 H new ATOM 2176 N VAL A 140 -1.609 -23.045 1.014 1.00 0.00 N ATOM 2177 CA VAL A 140 -0.713 -22.042 0.410 1.00 0.00 C ATOM 2178 C VAL A 140 -1.373 -20.662 0.149 1.00 0.00 C ATOM 2179 O VAL A 140 -0.791 -19.802 -0.510 1.00 0.00 O ATOM 2180 CB VAL A 140 0.051 -22.608 -0.813 1.00 0.00 C ATOM 2181 CG1 VAL A 140 0.668 -23.975 -0.485 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -0.742 -22.737 -2.126 1.00 0.00 C ATOM 0 H VAL A 140 -1.178 -23.495 1.822 1.00 0.00 H new ATOM 0 HA VAL A 140 0.037 -21.825 1.171 1.00 0.00 H new ATOM 0 HB VAL A 140 0.809 -21.847 -1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 140 1.199 -24.353 -1.358 1.00 0.00 H new ATOM 0 HG12 VAL A 140 1.365 -23.870 0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -0.122 -24.674 -0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -0.095 -23.144 -2.903 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -1.591 -23.403 -1.974 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -1.102 -21.755 -2.432 1.00 0.00 H new ATOM 2192 N GLY A 141 -2.578 -20.424 0.674 1.00 0.00 N ATOM 2193 CA GLY A 141 -3.434 -19.296 0.363 1.00 0.00 C ATOM 2194 C GLY A 141 -4.808 -19.528 0.995 1.00 0.00 C ATOM 2195 O GLY A 141 -5.038 -20.592 1.572 1.00 0.00 O ATOM 0 H GLY A 141 -2.996 -21.050 1.362 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.995 -18.374 0.743 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.530 -19.182 -0.717 1.00 0.00 H new ATOM 2199 N LEU A 142 -5.720 -18.556 0.909 1.00 0.00 N ATOM 2200 CA LEU A 142 -7.052 -18.639 1.523 1.00 0.00 C ATOM 2201 C LEU A 142 -7.955 -19.630 0.796 1.00 0.00 C ATOM 2202 O LEU A 142 -7.993 -19.679 -0.435 1.00 0.00 O ATOM 2203 CB LEU A 142 -7.677 -17.241 1.678 1.00 0.00 C ATOM 2204 CG LEU A 142 -9.213 -17.066 1.600 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -9.866 -17.440 2.933 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -9.598 -15.609 1.314 1.00 0.00 C ATOM 0 H LEU A 142 -5.556 -17.683 0.408 1.00 0.00 H new ATOM 0 HA LEU A 142 -6.936 -19.039 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -7.355 -16.847 2.642 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.239 -16.603 0.910 1.00 0.00 H new ATOM 0 HG LEU A 142 -9.558 -17.715 0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.946 -17.310 2.858 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -9.641 -18.480 3.169 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -9.477 -16.796 3.722 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -10.683 -15.522 1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -9.218 -14.969 2.110 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -9.167 -15.299 0.362 1.00 0.00 H new ATOM 2218 N ALA A 143 -8.731 -20.354 1.604 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.765 -21.281 1.201 1.00 0.00 C ATOM 2220 C ALA A 143 -11.139 -20.615 1.315 1.00 0.00 C ATOM 2221 O ALA A 143 -11.474 -20.084 2.371 1.00 0.00 O ATOM 2222 CB ALA A 143 -9.681 -22.476 2.156 1.00 0.00 C ATOM 0 H ALA A 143 -8.641 -20.298 2.618 1.00 0.00 H new ATOM 0 HA ALA A 143 -9.630 -21.595 0.166 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.445 -23.207 1.892 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.696 -22.936 2.078 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -9.842 -22.136 3.179 1.00 0.00 H new ATOM 2228 N LEU A 144 -11.954 -20.686 0.262 1.00 0.00 N ATOM 2229 CA LEU A 144 -13.372 -20.326 0.291 1.00 0.00 C ATOM 2230 C LEU A 144 -14.144 -21.567 -0.141 1.00 0.00 C ATOM 2231 O LEU A 144 -13.718 -22.250 -1.071 1.00 0.00 O ATOM 2232 CB LEU A 144 -13.692 -19.150 -0.656 1.00 0.00 C ATOM 2233 CG LEU A 144 -12.964 -17.823 -0.402 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -13.321 -16.824 -1.510 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -13.351 -17.220 0.950 1.00 0.00 C ATOM 0 H LEU A 144 -11.640 -21.002 -0.655 1.00 0.00 H new ATOM 0 HA LEU A 144 -13.651 -20.000 1.293 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -13.469 -19.467 -1.675 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -14.764 -18.961 -0.608 1.00 0.00 H new ATOM 0 HG LEU A 144 -11.893 -18.025 -0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -12.804 -15.881 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -13.015 -17.227 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -14.397 -16.653 -1.513 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.817 -16.281 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -14.425 -17.033 0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -13.088 -17.915 1.747 1.00 0.00 H new ATOM 2247 N ASP A 145 -15.294 -21.836 0.475 1.00 0.00 N ATOM 2248 CA ASP A 145 -16.174 -22.933 0.086 1.00 0.00 C ATOM 2249 C ASP A 145 -17.618 -22.536 0.364 1.00 0.00 C ATOM 2250 O ASP A 145 -18.266 -22.995 1.310 1.00 0.00 O ATOM 2251 CB ASP A 145 -15.784 -24.243 0.774 1.00 0.00 C ATOM 2252 CG ASP A 145 -16.604 -25.433 0.252 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -17.589 -25.268 -0.506 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -16.258 -26.572 0.630 1.00 0.00 O ATOM 0 H ASP A 145 -15.643 -21.293 1.265 1.00 0.00 H new ATOM 0 HA ASP A 145 -16.067 -23.119 -0.983 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -14.723 -24.435 0.613 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -15.931 -24.145 1.850 1.00 0.00 H new ATOM 2259 N GLU A 146 -18.105 -21.604 -0.457 1.00 0.00 N ATOM 2260 CA GLU A 146 -19.482 -21.129 -0.387 1.00 0.00 C ATOM 2261 C GLU A 146 -20.459 -22.261 -0.750 1.00 0.00 C ATOM 2262 O GLU A 146 -21.591 -22.274 -0.266 1.00 0.00 O ATOM 2263 CB GLU A 146 -19.617 -19.904 -1.307 1.00 0.00 C ATOM 2264 CG GLU A 146 -20.926 -19.140 -1.087 1.00 0.00 C ATOM 2265 CD GLU A 146 -21.021 -17.910 -2.007 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -20.553 -16.812 -1.619 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -21.591 -18.026 -3.118 1.00 0.00 O ATOM 0 H GLU A 146 -17.552 -21.158 -1.189 1.00 0.00 H new ATOM 0 HA GLU A 146 -19.737 -20.824 0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -18.776 -19.232 -1.136 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -19.560 -20.227 -2.346 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -21.771 -19.802 -1.274 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -20.994 -18.824 -0.046 1.00 0.00 H new ATOM 2274 N THR A 147 -20.028 -23.245 -1.551 1.00 0.00 N ATOM 2275 CA THR A 147 -20.864 -24.374 -1.933 1.00 0.00 C ATOM 2276 C THR A 147 -21.290 -25.167 -0.695 1.00 0.00 C ATOM 2277 O THR A 147 -22.468 -25.525 -0.573 1.00 0.00 O ATOM 2278 CB THR A 147 -20.119 -25.259 -2.952 1.00 0.00 C ATOM 2279 OG1 THR A 147 -19.724 -24.460 -4.061 1.00 0.00 O ATOM 2280 CG2 THR A 147 -20.996 -26.423 -3.431 1.00 0.00 C ATOM 0 H THR A 147 -19.089 -23.274 -1.948 1.00 0.00 H new ATOM 0 HA THR A 147 -21.772 -24.005 -2.411 1.00 0.00 H new ATOM 0 HB THR A 147 -19.241 -25.685 -2.466 1.00 0.00 H new ATOM 0 HG1 THR A 147 -19.248 -25.017 -4.712 1.00 0.00 H new ATOM 0 HG21 THR A 147 -20.440 -27.026 -4.148 1.00 0.00 H new ATOM 0 HG22 THR A 147 -21.278 -27.041 -2.578 1.00 0.00 H new ATOM 0 HG23 THR A 147 -21.894 -26.030 -3.907 1.00 0.00 H new ATOM 2288 N ASN A 148 -20.361 -25.438 0.225 1.00 0.00 N ATOM 2289 CA ASN A 148 -20.628 -26.316 1.361 1.00 0.00 C ATOM 2290 C ASN A 148 -21.072 -25.520 2.588 1.00 0.00 C ATOM 2291 O ASN A 148 -21.930 -26.005 3.323 1.00 0.00 O ATOM 2292 CB ASN A 148 -19.431 -27.217 1.706 1.00 0.00 C ATOM 2293 CG ASN A 148 -19.159 -28.245 0.610 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -19.432 -29.427 0.778 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -18.660 -27.812 -0.526 1.00 0.00 N ATOM 0 H ASN A 148 -19.414 -25.059 0.203 1.00 0.00 H new ATOM 0 HA ASN A 148 -21.446 -26.969 1.057 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -18.544 -26.601 1.855 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -19.623 -27.732 2.647 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -18.492 -28.465 -1.291 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -18.440 -26.823 -0.642 1.00 0.00 H new ATOM 2302 N GLN A 149 -20.498 -24.331 2.832 1.00 0.00 N ATOM 2303 CA GLN A 149 -20.751 -23.574 4.057 1.00 0.00 C ATOM 2304 C GLN A 149 -20.664 -22.062 3.813 1.00 0.00 C ATOM 2305 O GLN A 149 -19.815 -21.369 4.377 1.00 0.00 O ATOM 2306 CB GLN A 149 -19.859 -24.108 5.200 1.00 0.00 C ATOM 2307 CG GLN A 149 -18.338 -24.081 4.952 1.00 0.00 C ATOM 2308 CD GLN A 149 -17.533 -24.744 6.078 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -18.065 -25.316 7.026 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -16.212 -24.677 6.006 1.00 0.00 N ATOM 0 H GLN A 149 -19.852 -23.875 2.188 1.00 0.00 H new ATOM 0 HA GLN A 149 -21.779 -23.730 4.384 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -20.069 -23.526 6.098 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -20.153 -25.136 5.411 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -18.120 -24.587 4.011 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -18.012 -23.047 4.841 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -15.767 -24.203 5.220 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -15.639 -25.100 6.737 1.00 0.00 H new ATOM 2319 N TYR A 150 -21.597 -21.543 3.008 1.00 0.00 N ATOM 2320 CA TYR A 150 -21.746 -20.114 2.705 1.00 0.00 C ATOM 2321 C TYR A 150 -21.783 -19.226 3.956 1.00 0.00 C ATOM 2322 O TYR A 150 -21.376 -18.064 3.897 1.00 0.00 O ATOM 2323 CB TYR A 150 -23.016 -19.888 1.864 1.00 0.00 C ATOM 2324 CG TYR A 150 -24.293 -20.491 2.428 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -25.041 -19.794 3.398 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -24.733 -21.756 1.982 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -26.211 -20.360 3.932 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -25.904 -22.326 2.511 1.00 0.00 C ATOM 2329 CZ TYR A 150 -26.649 -21.629 3.492 1.00 0.00 C ATOM 2330 OH TYR A 150 -27.793 -22.163 4.015 1.00 0.00 O ATOM 0 H TYR A 150 -22.290 -22.122 2.535 1.00 0.00 H new ATOM 0 HA TYR A 150 -20.860 -19.820 2.142 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -23.164 -18.815 1.744 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -22.849 -20.300 0.869 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -24.714 -18.821 3.732 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -24.168 -22.288 1.231 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -26.776 -19.824 4.680 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -26.235 -23.295 2.169 1.00 0.00 H new ATOM 0 HH TYR A 150 -27.960 -23.039 3.610 1.00 0.00 H new ATOM 2340 N ASP A 151 -22.244 -19.755 5.096 1.00 0.00 N ATOM 2341 CA ASP A 151 -22.336 -19.001 6.346 1.00 0.00 C ATOM 2342 C ASP A 151 -20.961 -18.537 6.847 1.00 0.00 C ATOM 2343 O ASP A 151 -20.873 -17.473 7.465 1.00 0.00 O ATOM 2344 CB ASP A 151 -23.024 -19.859 7.412 1.00 0.00 C ATOM 2345 CG ASP A 151 -23.183 -19.081 8.730 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -23.999 -18.128 8.777 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -22.533 -19.450 9.736 1.00 0.00 O ATOM 0 H ASP A 151 -22.564 -20.720 5.175 1.00 0.00 H new ATOM 0 HA ASP A 151 -22.926 -18.105 6.152 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -24.003 -20.176 7.052 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -22.441 -20.763 7.588 1.00 0.00 H new ATOM 2352 N LEU A 152 -19.882 -19.283 6.551 1.00 0.00 N ATOM 2353 CA LEU A 152 -18.524 -18.911 6.959 1.00 0.00 C ATOM 2354 C LEU A 152 -17.773 -18.146 5.876 1.00 0.00 C ATOM 2355 O LEU A 152 -16.694 -17.644 6.174 1.00 0.00 O ATOM 2356 CB LEU A 152 -17.677 -20.110 7.427 1.00 0.00 C ATOM 2357 CG LEU A 152 -18.096 -20.820 8.723 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -18.509 -19.857 9.843 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -19.158 -21.893 8.468 1.00 0.00 C ATOM 0 H LEU A 152 -19.930 -20.155 6.025 1.00 0.00 H new ATOM 0 HA LEU A 152 -18.669 -18.250 7.814 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -17.672 -20.850 6.626 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -16.650 -19.767 7.550 1.00 0.00 H new ATOM 0 HG LEU A 152 -17.201 -21.325 9.086 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -18.792 -20.428 10.727 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -17.673 -19.202 10.086 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -19.356 -19.256 9.512 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -19.426 -22.371 9.410 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -20.043 -21.432 8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -18.762 -22.641 7.782 1.00 0.00 H new ATOM 2371 N SER A 153 -18.260 -18.047 4.638 1.00 0.00 N ATOM 2372 CA SER A 153 -17.481 -17.465 3.547 1.00 0.00 C ATOM 2373 C SER A 153 -17.128 -15.999 3.831 1.00 0.00 C ATOM 2374 O SER A 153 -15.994 -15.591 3.595 1.00 0.00 O ATOM 2375 CB SER A 153 -18.247 -17.644 2.231 1.00 0.00 C ATOM 2376 OG SER A 153 -18.607 -19.011 2.085 1.00 0.00 O ATOM 0 H SER A 153 -19.191 -18.363 4.367 1.00 0.00 H new ATOM 0 HA SER A 153 -16.528 -17.988 3.460 1.00 0.00 H new ATOM 0 HB2 SER A 153 -19.139 -17.018 2.227 1.00 0.00 H new ATOM 0 HB3 SER A 153 -17.630 -17.326 1.391 1.00 0.00 H new ATOM 0 HG SER A 153 -18.206 -19.369 1.266 1.00 0.00 H new ATOM 2382 N ASP A 154 -18.045 -15.235 4.430 1.00 0.00 N ATOM 2383 CA ASP A 154 -17.786 -13.848 4.823 1.00 0.00 C ATOM 2384 C ASP A 154 -16.670 -13.781 5.864 1.00 0.00 C ATOM 2385 O ASP A 154 -15.747 -12.981 5.741 1.00 0.00 O ATOM 2386 CB ASP A 154 -19.062 -13.215 5.381 1.00 0.00 C ATOM 2387 CG ASP A 154 -18.783 -11.803 5.924 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -18.650 -10.865 5.102 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -18.732 -11.622 7.166 1.00 0.00 O ATOM 0 H ASP A 154 -18.985 -15.560 4.656 1.00 0.00 H new ATOM 0 HA ASP A 154 -17.468 -13.293 3.941 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -19.820 -13.165 4.599 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -19.466 -13.842 6.176 1.00 0.00 H new ATOM 2394 N GLU A 155 -16.719 -14.683 6.843 1.00 0.00 N ATOM 2395 CA GLU A 155 -15.771 -14.768 7.946 1.00 0.00 C ATOM 2396 C GLU A 155 -14.389 -15.195 7.442 1.00 0.00 C ATOM 2397 O GLU A 155 -13.373 -14.626 7.839 1.00 0.00 O ATOM 2398 CB GLU A 155 -16.376 -15.692 9.021 1.00 0.00 C ATOM 2399 CG GLU A 155 -15.397 -16.069 10.138 1.00 0.00 C ATOM 2400 CD GLU A 155 -16.115 -16.541 11.418 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -16.760 -15.710 12.101 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -15.997 -17.736 11.780 1.00 0.00 O ATOM 0 H GLU A 155 -17.445 -15.398 6.889 1.00 0.00 H new ATOM 0 HA GLU A 155 -15.604 -13.795 8.407 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -17.243 -15.201 9.462 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -16.735 -16.603 8.543 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -14.734 -16.859 9.785 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -14.770 -15.209 10.373 1.00 0.00 H new ATOM 2409 N ARG A 156 -14.349 -16.152 6.511 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.132 -16.583 5.822 1.00 0.00 C ATOM 2411 C ARG A 156 -12.478 -15.403 5.107 1.00 0.00 C ATOM 2412 O ARG A 156 -11.265 -15.254 5.224 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.466 -17.706 4.818 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.131 -19.138 5.262 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.026 -19.748 6.346 1.00 0.00 C ATOM 2416 NE ARG A 156 -13.737 -19.233 7.705 1.00 0.00 N ATOM 2417 CZ ARG A 156 -13.758 -19.932 8.856 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -14.149 -21.203 8.876 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -13.380 -19.352 9.990 1.00 0.00 N ATOM 0 H ARG A 156 -15.181 -16.659 6.209 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.428 -16.969 6.559 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.531 -17.658 4.593 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.934 -17.503 3.888 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.170 -19.784 4.385 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.102 -19.151 5.623 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.069 -19.545 6.103 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.903 -20.831 6.342 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.497 -18.244 7.776 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.438 -21.661 8.012 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -14.160 -21.720 9.755 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -13.075 -18.379 9.988 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.395 -19.880 10.863 1.00 0.00 H new ATOM 2433 N ILE A 157 -13.240 -14.568 4.393 1.00 0.00 N ATOM 2434 CA ILE A 157 -12.666 -13.409 3.703 1.00 0.00 C ATOM 2435 C ILE A 157 -12.167 -12.427 4.768 1.00 0.00 C ATOM 2436 O ILE A 157 -10.997 -12.061 4.750 1.00 0.00 O ATOM 2437 CB ILE A 157 -13.686 -12.762 2.728 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -14.180 -13.731 1.624 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -13.045 -11.556 2.012 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -15.528 -13.325 1.013 1.00 0.00 C ATOM 0 H ILE A 157 -14.248 -14.672 4.278 1.00 0.00 H new ATOM 0 HA ILE A 157 -11.827 -13.719 3.079 1.00 0.00 H new ATOM 0 HB ILE A 157 -14.535 -12.469 3.346 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -13.432 -13.780 0.833 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -14.267 -14.733 2.043 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -13.770 -11.110 1.331 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -12.738 -10.815 2.751 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -12.174 -11.889 1.448 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -15.813 -14.047 0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -16.289 -13.303 1.793 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -15.441 -12.336 0.564 1.00 0.00 H new ATOM 2452 N GLN A 158 -13.037 -12.004 5.687 1.00 0.00 N ATOM 2453 CA GLN A 158 -12.811 -10.934 6.647 1.00 0.00 C ATOM 2454 C GLN A 158 -11.499 -11.106 7.394 1.00 0.00 C ATOM 2455 O GLN A 158 -10.564 -10.322 7.210 1.00 0.00 O ATOM 2456 CB GLN A 158 -14.032 -10.904 7.588 1.00 0.00 C ATOM 2457 CG GLN A 158 -14.113 -9.744 8.581 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.088 -9.741 9.719 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.261 -10.412 10.732 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.017 -8.978 9.586 1.00 0.00 N ATOM 0 H GLN A 158 -13.962 -12.422 5.783 1.00 0.00 H new ATOM 0 HA GLN A 158 -12.714 -9.976 6.136 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -14.933 -10.888 6.974 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -14.047 -11.836 8.153 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -14.007 -8.812 8.025 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -15.110 -9.742 9.021 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -11.886 -8.426 8.738 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -11.321 -8.942 10.331 1.00 0.00 H new ATOM 2469 N SER A 159 -11.447 -12.119 8.243 1.00 0.00 N ATOM 2470 CA SER A 159 -10.318 -12.330 9.144 1.00 0.00 C ATOM 2471 C SER A 159 -9.009 -12.554 8.373 1.00 0.00 C ATOM 2472 O SER A 159 -7.953 -12.086 8.802 1.00 0.00 O ATOM 2473 CB SER A 159 -10.634 -13.508 10.077 1.00 0.00 C ATOM 2474 OG SER A 159 -11.935 -13.383 10.646 1.00 0.00 O ATOM 0 H SER A 159 -12.183 -12.819 8.330 1.00 0.00 H new ATOM 0 HA SER A 159 -10.170 -11.431 9.743 1.00 0.00 H new ATOM 0 HB2 SER A 159 -10.566 -14.443 9.521 1.00 0.00 H new ATOM 0 HB3 SER A 159 -9.890 -13.555 10.872 1.00 0.00 H new ATOM 0 HG SER A 159 -12.218 -12.445 10.613 1.00 0.00 H new ATOM 2480 N TRP A 160 -9.073 -13.190 7.198 1.00 0.00 N ATOM 2481 CA TRP A 160 -7.917 -13.369 6.326 1.00 0.00 C ATOM 2482 C TRP A 160 -7.431 -12.037 5.788 1.00 0.00 C ATOM 2483 O TRP A 160 -6.239 -11.766 5.823 1.00 0.00 O ATOM 2484 CB TRP A 160 -8.290 -14.301 5.177 1.00 0.00 C ATOM 2485 CG TRP A 160 -7.156 -14.594 4.261 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -6.182 -15.483 4.528 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -6.862 -14.049 2.938 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -5.359 -15.596 3.429 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -5.717 -14.720 2.429 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -7.472 -13.095 2.098 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -5.213 -14.482 1.146 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -6.986 -12.853 0.797 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.854 -13.541 0.324 1.00 0.00 C ATOM 0 H TRP A 160 -9.933 -13.595 6.828 1.00 0.00 H new ATOM 0 HA TRP A 160 -7.105 -13.811 6.904 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -8.667 -15.238 5.587 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.103 -13.853 4.605 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -6.064 -16.022 5.456 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.579 -16.250 3.364 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -8.326 -12.540 2.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -4.343 -15.015 0.792 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -7.485 -12.137 0.161 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -5.478 -13.346 -0.670 1.00 0.00 H new ATOM 2504 N CYS A 161 -8.340 -11.178 5.337 1.00 0.00 N ATOM 2505 CA CYS A 161 -7.996 -9.862 4.815 1.00 0.00 C ATOM 2506 C CYS A 161 -7.277 -9.035 5.880 1.00 0.00 C ATOM 2507 O CYS A 161 -6.268 -8.407 5.570 1.00 0.00 O ATOM 2508 CB CYS A 161 -9.272 -9.159 4.338 1.00 0.00 C ATOM 2509 SG CYS A 161 -9.855 -9.943 2.821 1.00 0.00 S ATOM 0 H CYS A 161 -9.340 -11.377 5.324 1.00 0.00 H new ATOM 0 HA CYS A 161 -7.317 -9.972 3.970 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -10.041 -9.215 5.108 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -9.074 -8.102 4.161 1.00 0.00 H new ATOM 0 HG CYS A 161 -10.493 -11.037 3.115 1.00 0.00 H new ATOM 2515 N GLU A 162 -7.735 -9.072 7.135 1.00 0.00 N ATOM 2516 CA GLU A 162 -7.030 -8.395 8.219 1.00 0.00 C ATOM 2517 C GLU A 162 -5.636 -8.982 8.396 1.00 0.00 C ATOM 2518 O GLU A 162 -4.659 -8.256 8.560 1.00 0.00 O ATOM 2519 CB GLU A 162 -7.794 -8.450 9.543 1.00 0.00 C ATOM 2520 CG GLU A 162 -9.010 -7.527 9.510 1.00 0.00 C ATOM 2521 CD GLU A 162 -9.573 -7.321 10.927 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -10.135 -8.284 11.502 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -9.471 -6.191 11.463 1.00 0.00 O ATOM 0 H GLU A 162 -8.584 -9.560 7.420 1.00 0.00 H new ATOM 0 HA GLU A 162 -6.950 -7.346 7.935 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.114 -9.473 9.740 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -7.134 -8.159 10.360 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -8.731 -6.565 9.080 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -9.779 -7.953 8.866 1.00 0.00 H new ATOM 2530 N GLN A 163 -5.523 -10.303 8.333 1.00 0.00 N ATOM 2531 CA GLN A 163 -4.268 -10.989 8.547 1.00 0.00 C ATOM 2532 C GLN A 163 -3.280 -10.616 7.458 1.00 0.00 C ATOM 2533 O GLN A 163 -2.171 -10.209 7.784 1.00 0.00 O ATOM 2534 CB GLN A 163 -4.504 -12.501 8.636 1.00 0.00 C ATOM 2535 CG GLN A 163 -3.180 -13.260 8.842 1.00 0.00 C ATOM 2536 CD GLN A 163 -3.380 -14.771 8.712 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -3.240 -15.523 9.675 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -3.724 -15.240 7.516 1.00 0.00 N ATOM 0 H GLN A 163 -6.306 -10.925 8.131 1.00 0.00 H new ATOM 0 HA GLN A 163 -3.833 -10.676 9.496 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -5.183 -12.718 9.461 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -4.989 -12.850 7.724 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -2.447 -12.923 8.108 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -2.775 -13.028 9.827 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -3.835 -14.600 6.730 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -3.877 -16.240 7.385 1.00 0.00 H new ATOM 2547 N ILE A 164 -3.659 -10.716 6.184 1.00 0.00 N ATOM 2548 CA ILE A 164 -2.717 -10.464 5.105 1.00 0.00 C ATOM 2549 C ILE A 164 -2.256 -9.019 5.161 1.00 0.00 C ATOM 2550 O ILE A 164 -1.078 -8.788 4.940 1.00 0.00 O ATOM 2551 CB ILE A 164 -3.259 -10.865 3.715 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -4.487 -10.073 3.219 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -3.597 -12.359 3.695 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -4.806 -10.278 1.732 1.00 0.00 C ATOM 0 H ILE A 164 -4.600 -10.967 5.881 1.00 0.00 H new ATOM 0 HA ILE A 164 -1.852 -11.110 5.256 1.00 0.00 H new ATOM 0 HB ILE A 164 -2.450 -10.619 3.028 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -5.356 -10.364 3.809 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -4.319 -9.011 3.401 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -3.978 -12.633 2.711 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -2.699 -12.938 3.910 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -4.355 -12.571 4.450 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.682 -9.688 1.463 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -3.955 -9.960 1.130 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -5.008 -11.333 1.545 1.00 0.00 H new ATOM 2566 N LEU A 165 -3.128 -8.062 5.498 1.00 0.00 N ATOM 2567 CA LEU A 165 -2.755 -6.649 5.549 1.00 0.00 C ATOM 2568 C LEU A 165 -1.737 -6.409 6.661 1.00 0.00 C ATOM 2569 O LEU A 165 -0.834 -5.596 6.488 1.00 0.00 O ATOM 2570 CB LEU A 165 -4.019 -5.769 5.600 1.00 0.00 C ATOM 2571 CG LEU A 165 -4.452 -5.211 6.971 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -3.718 -3.904 7.295 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -5.959 -4.942 6.966 1.00 0.00 C ATOM 0 H LEU A 165 -4.102 -8.245 5.740 1.00 0.00 H new ATOM 0 HA LEU A 165 -2.241 -6.350 4.635 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -3.867 -4.925 4.928 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -4.849 -6.351 5.198 1.00 0.00 H new ATOM 0 HG LEU A 165 -4.201 -5.953 7.729 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -4.044 -3.535 8.267 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -2.644 -4.086 7.318 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -3.944 -3.161 6.530 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -6.261 -4.548 7.936 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -6.196 -4.215 6.189 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -6.494 -5.871 6.769 1.00 0.00 H new ATOM 2585 N ASN A 166 -1.831 -7.165 7.754 1.00 0.00 N ATOM 2586 CA ASN A 166 -0.834 -7.107 8.821 1.00 0.00 C ATOM 2587 C ASN A 166 0.454 -7.713 8.296 1.00 0.00 C ATOM 2588 O ASN A 166 1.473 -7.039 8.235 1.00 0.00 O ATOM 2589 CB ASN A 166 -1.253 -7.884 10.081 1.00 0.00 C ATOM 2590 CG ASN A 166 -2.173 -7.098 11.000 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -1.725 -6.278 11.796 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -3.471 -7.330 10.917 1.00 0.00 N ATOM 0 H ASN A 166 -2.589 -7.826 7.924 1.00 0.00 H new ATOM 0 HA ASN A 166 -0.717 -6.061 9.106 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -1.753 -8.805 9.781 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -0.359 -8.172 10.634 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -4.119 -6.824 11.520 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -3.825 -8.015 10.249 1.00 0.00 H new ATOM 2599 N GLU A 167 0.391 -8.975 7.883 1.00 0.00 N ATOM 2600 CA GLU A 167 1.510 -9.828 7.561 1.00 0.00 C ATOM 2601 C GLU A 167 2.339 -9.265 6.395 1.00 0.00 C ATOM 2602 O GLU A 167 3.567 -9.353 6.413 1.00 0.00 O ATOM 2603 CB GLU A 167 0.875 -11.216 7.351 1.00 0.00 C ATOM 2604 CG GLU A 167 1.781 -12.183 6.627 1.00 0.00 C ATOM 2605 CD GLU A 167 1.278 -13.632 6.724 1.00 0.00 C ATOM 2606 OE1 GLU A 167 0.370 -14.008 5.948 1.00 0.00 O ATOM 2607 OE2 GLU A 167 1.804 -14.401 7.564 1.00 0.00 O1- ATOM 0 H GLU A 167 -0.503 -9.451 7.759 1.00 0.00 H new ATOM 0 HA GLU A 167 2.266 -9.894 8.344 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.607 -11.636 8.321 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -0.050 -11.103 6.786 1.00 0.00 H new ATOM 0 HG2 GLU A 167 1.854 -11.895 5.578 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.786 -12.120 7.045 1.00 0.00 H new ATOM 2614 N MET A 168 1.697 -8.608 5.427 1.00 0.00 N ATOM 2615 CA MET A 168 2.378 -7.910 4.341 1.00 0.00 C ATOM 2616 C MET A 168 3.050 -6.630 4.828 1.00 0.00 C ATOM 2617 O MET A 168 4.127 -6.275 4.358 1.00 0.00 O ATOM 2618 CB MET A 168 1.398 -7.657 3.182 1.00 0.00 C ATOM 2619 CG MET A 168 0.327 -6.579 3.378 1.00 0.00 C ATOM 2620 SD MET A 168 -0.822 -6.460 1.975 1.00 0.00 S ATOM 2621 CE MET A 168 -1.893 -7.928 2.072 1.00 0.00 C ATOM 0 H MET A 168 0.680 -8.546 5.377 1.00 0.00 H new ATOM 0 HA MET A 168 3.180 -8.546 3.966 1.00 0.00 H new ATOM 0 HB2 MET A 168 1.982 -7.393 2.300 1.00 0.00 H new ATOM 0 HB3 MET A 168 0.892 -8.596 2.960 1.00 0.00 H new ATOM 0 HG2 MET A 168 -0.237 -6.795 4.285 1.00 0.00 H new ATOM 0 HG3 MET A 168 0.812 -5.614 3.526 1.00 0.00 H new ATOM 0 HE1 MET A 168 -2.281 -8.161 1.081 1.00 0.00 H new ATOM 0 HE2 MET A 168 -1.317 -8.775 2.444 1.00 0.00 H new ATOM 0 HE3 MET A 168 -2.723 -7.728 2.749 1.00 0.00 H new ATOM 2631 N ALA A 169 2.433 -5.947 5.787 1.00 0.00 N ATOM 2632 CA ALA A 169 2.940 -4.689 6.284 1.00 0.00 C ATOM 2633 C ALA A 169 4.150 -4.881 7.190 1.00 0.00 C ATOM 2634 O ALA A 169 5.104 -4.114 7.085 1.00 0.00 O ATOM 2635 CB ALA A 169 1.825 -3.913 6.978 1.00 0.00 C ATOM 0 H ALA A 169 1.570 -6.256 6.235 1.00 0.00 H new ATOM 0 HA ALA A 169 3.287 -4.101 5.434 1.00 0.00 H new ATOM 0 HB1 ALA A 169 2.217 -2.966 7.349 1.00 0.00 H new ATOM 0 HB2 ALA A 169 1.020 -3.719 6.269 1.00 0.00 H new ATOM 0 HB3 ALA A 169 1.440 -4.498 7.813 1.00 0.00 H new ATOM 2641 N GLU A 170 4.155 -5.926 8.024 1.00 0.00 N ATOM 2642 CA GLU A 170 5.290 -6.203 8.908 1.00 0.00 C ATOM 2643 C GLU A 170 6.546 -6.471 8.073 1.00 0.00 C ATOM 2644 O GLU A 170 7.670 -6.193 8.495 1.00 0.00 O ATOM 2645 CB GLU A 170 5.074 -7.441 9.800 1.00 0.00 C ATOM 2646 CG GLU A 170 3.663 -7.657 10.332 1.00 0.00 C ATOM 2647 CD GLU A 170 3.655 -8.543 11.593 1.00 0.00 C ATOM 2648 OE1 GLU A 170 3.555 -9.788 11.465 1.00 0.00 O1- ATOM 2649 OE2 GLU A 170 3.731 -7.995 12.721 1.00 0.00 O ATOM 0 H GLU A 170 3.387 -6.592 8.105 1.00 0.00 H new ATOM 0 HA GLU A 170 5.396 -5.323 9.543 1.00 0.00 H new ATOM 0 HB2 GLU A 170 5.364 -8.325 9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 170 5.752 -7.372 10.650 1.00 0.00 H new ATOM 0 HG2 GLU A 170 3.210 -6.693 10.563 1.00 0.00 H new ATOM 0 HG3 GLU A 170 3.050 -8.120 9.559 1.00 0.00 H new ATOM 2656 N HIS A 171 6.332 -7.045 6.886 1.00 0.00 N ATOM 2657 CA HIS A 171 7.376 -7.483 5.985 1.00 0.00 C ATOM 2658 C HIS A 171 8.048 -6.301 5.278 1.00 0.00 C ATOM 2659 O HIS A 171 9.254 -6.343 5.020 1.00 0.00 O ATOM 2660 CB HIS A 171 6.732 -8.475 5.018 1.00 0.00 C ATOM 2661 CG HIS A 171 7.736 -9.109 4.091 1.00 0.00 C ATOM 2662 ND1 HIS A 171 8.639 -10.117 4.439 1.00 0.00 N ATOM 2663 CD2 HIS A 171 7.965 -8.726 2.805 1.00 0.00 C ATOM 2664 CE1 HIS A 171 9.423 -10.281 3.355 1.00 0.00 C ATOM 2665 NE2 HIS A 171 9.025 -9.475 2.355 1.00 0.00 N ATOM 0 H HIS A 171 5.394 -7.219 6.524 1.00 0.00 H new ATOM 0 HA HIS A 171 8.186 -7.971 6.527 1.00 0.00 H new ATOM 0 HB2 HIS A 171 6.224 -9.254 5.586 1.00 0.00 H new ATOM 0 HB3 HIS A 171 5.971 -7.962 4.429 1.00 0.00 H new ATOM 0 HD2 HIS A 171 7.420 -7.979 2.247 1.00 0.00 H new ATOM 0 HE1 HIS A 171 10.256 -10.966 3.297 1.00 0.00 H new ATOM 0 HE2 HIS A 171 9.438 -9.428 1.424 1.00 0.00 H new ATOM 2673 N TYR A 172 7.293 -5.230 5.006 1.00 0.00 N ATOM 2674 CA TYR A 172 7.829 -3.978 4.480 1.00 0.00 C ATOM 2675 C TYR A 172 8.381 -3.054 5.577 1.00 0.00 C ATOM 2676 O TYR A 172 9.224 -2.201 5.274 1.00 0.00 O ATOM 2677 CB TYR A 172 6.775 -3.242 3.634 1.00 0.00 C ATOM 2678 CG TYR A 172 6.756 -3.643 2.166 1.00 0.00 C ATOM 2679 CD1 TYR A 172 7.880 -3.395 1.354 1.00 0.00 C ATOM 2680 CD2 TYR A 172 5.614 -4.239 1.603 1.00 0.00 C ATOM 2681 CE1 TYR A 172 7.876 -3.768 -0.001 1.00 0.00 C ATOM 2682 CE2 TYR A 172 5.588 -4.587 0.239 1.00 0.00 C ATOM 2683 CZ TYR A 172 6.733 -4.377 -0.565 1.00 0.00 C ATOM 2684 OH TYR A 172 6.753 -4.762 -1.874 1.00 0.00 O ATOM 0 H TYR A 172 6.283 -5.212 5.148 1.00 0.00 H new ATOM 0 HA TYR A 172 8.671 -4.248 3.843 1.00 0.00 H new ATOM 0 HB2 TYR A 172 5.790 -3.427 4.062 1.00 0.00 H new ATOM 0 HB3 TYR A 172 6.956 -2.169 3.703 1.00 0.00 H new ATOM 0 HD1 TYR A 172 8.751 -2.915 1.776 1.00 0.00 H new ATOM 0 HD2 TYR A 172 4.750 -4.431 2.222 1.00 0.00 H new ATOM 0 HE1 TYR A 172 8.748 -3.589 -0.612 1.00 0.00 H new ATOM 0 HE2 TYR A 172 4.695 -5.014 -0.193 1.00 0.00 H new ATOM 0 HH TYR A 172 5.855 -5.046 -2.145 1.00 0.00 H new ATOM 2694 N ALA A 173 7.904 -3.180 6.822 1.00 0.00 N ATOM 2695 CA ALA A 173 8.319 -2.331 7.934 1.00 0.00 C ATOM 2696 C ALA A 173 9.825 -2.476 8.190 1.00 0.00 C ATOM 2697 O ALA A 173 10.481 -1.444 8.466 1.00 0.00 O ATOM 2698 CB ALA A 173 7.521 -2.663 9.199 1.00 0.00 C ATOM 2699 OXT ALA A 173 10.349 -3.614 8.153 1.00 0.00 O1- ATOM 0 H ALA A 173 7.212 -3.883 7.083 1.00 0.00 H new ATOM 0 HA ALA A 173 8.114 -1.294 7.666 1.00 0.00 H new ATOM 0 HB1 ALA A 173 7.847 -2.018 10.015 1.00 0.00 H new ATOM 0 HB2 ALA A 173 6.459 -2.503 9.012 1.00 0.00 H new ATOM 0 HB3 ALA A 173 7.688 -3.705 9.472 1.00 0.00 H new TER 2705 ALA A 173