USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 0 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 65 THR OG1 : rot -50:sc= -1.18! USER MOD Set 1.2: A 85 TYR OH : rot 70:sc= -5.21! USER MOD Set 2.1: A 15 ASN :FLIP amide:sc= -0.548 F(o=-3.3,f=-2.1) USER MOD Set 2.2: A 81 MET CE :methyl 176:sc= -1.54 (180deg=-1.64) USER MOD Set 3.1: A 28 SER OG : rot -62:sc= 1.68 USER MOD Set 3.2: A 77 TYR OH : rot 48:sc= -1.16! USER MOD Set 4.1: A 8 ASN : amide:sc= -1.21! C(o=-1.7!,f=-3.4!) USER MOD Set 4.2: A 88 THR OG1 : rot 180:sc= -0.503 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 9 HIS :FLIP no HE2:sc= -2.6 F(o=-4.2!,f=-2.6) USER MOD Single : A 10 THR OG1 : rot 160:sc= -2.51! USER MOD Single : A 12 TYR OH : rot 57:sc= 0.00425 USER MOD Single : A 14 ASN : amide:sc= -1.2 K(o=-1.2,f=-5!) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 161:sc=-0.00326 (180deg=-0.115) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -156:sc= 0.381 (180deg=-0.637) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.0237 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 GLN : amide:sc=-0.00666 K(o=-0.0067,f=-1.2) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -149:sc= -0.201 (180deg=-0.902) USER MOD Single : A 50 MET CE :methyl -114:sc= -17.3! (180deg=-28.7!) USER MOD Single : A 53 GLN : amide:sc= -0.752 X(o=-0.75,f=-1.1) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 170:sc= -1.87! USER MOD Single : A 66 ASN :FLIP amide:sc= 0 F(o=-0.93,f=0) USER MOD Single : A 70 SER OG : rot 120:sc= -0.338 USER MOD Single : A 71 MET CE :methyl -131:sc= -6.73! (180deg=-11.6!) USER MOD Single : A 72 GLN :FLIP amide:sc= -1.09 F(o=-2.5!,f=-1.1) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN :FLIP amide:sc= -5.84! C(o=-6.7!,f=-5.8!) USER MOD Single : A 87 LYS NZ :NH3+ 176:sc= 0.0454 (180deg=0.027) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -157:sc= -0.0699 (180deg=-0.53) USER MOD Single : A 96 MET CE :methyl -157:sc= -1.53 (180deg=-2.36!) USER MOD Single : A 97 LYS NZ :NH3+ -167:sc= -0.931 (180deg=-1.21) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 161:sc= -1.14 (180deg=-2.1!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -3.51! C(o=-3.5!,f=-8.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -22.802 8.734 -34.236 1.00 0.00 N ATOM 2 CA ALA A 1 -23.520 9.850 -33.560 1.00 0.00 C ATOM 3 C ALA A 1 -22.961 10.037 -32.148 1.00 0.00 C ATOM 4 O ALA A 1 -23.402 9.406 -31.208 1.00 0.00 O ATOM 5 CB ALA A 1 -25.012 9.521 -33.480 1.00 0.00 C ATOM 0 H1 ALA A 1 -23.182 8.607 -35.196 1.00 0.00 H new ATOM 0 H2 ALA A 1 -21.788 8.957 -34.292 1.00 0.00 H new ATOM 0 H3 ALA A 1 -22.934 7.857 -33.693 1.00 0.00 H new ATOM 0 HA ALA A 1 -23.381 10.769 -34.129 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -25.539 10.337 -32.985 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -25.410 9.389 -34.486 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -25.152 8.602 -32.911 1.00 0.00 H new ATOM 6 N VAL A 2 -21.994 10.898 -31.991 1.00 0.00 N ATOM 7 CA VAL A 2 -21.408 11.124 -30.640 1.00 0.00 C ATOM 8 C VAL A 2 -20.572 9.896 -30.246 1.00 0.00 C ATOM 9 O VAL A 2 -20.824 8.803 -30.712 1.00 0.00 O ATOM 10 CB VAL A 2 -22.549 11.378 -29.630 1.00 0.00 C ATOM 11 CG1 VAL A 2 -22.688 10.219 -28.631 1.00 0.00 C ATOM 12 CG2 VAL A 2 -22.261 12.669 -28.859 1.00 0.00 C ATOM 0 H VAL A 2 -21.584 11.455 -32.740 1.00 0.00 H new ATOM 0 HA VAL A 2 -20.755 11.997 -30.644 1.00 0.00 H new ATOM 0 HB VAL A 2 -23.482 11.462 -30.188 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -23.500 10.433 -27.936 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -22.905 9.297 -29.171 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -21.757 10.103 -28.076 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -23.064 12.853 -28.145 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -21.316 12.571 -28.325 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -22.199 13.504 -29.557 1.00 0.00 H new ATOM 13 N PRO A 3 -19.602 10.119 -29.397 1.00 0.00 N ATOM 14 CA PRO A 3 -18.708 9.053 -28.917 1.00 0.00 C ATOM 15 C PRO A 3 -19.406 8.217 -27.844 1.00 0.00 C ATOM 16 O PRO A 3 -19.273 8.464 -26.661 1.00 0.00 O ATOM 17 CB PRO A 3 -17.517 9.818 -28.334 1.00 0.00 C ATOM 18 CG PRO A 3 -18.032 11.238 -28.000 1.00 0.00 C ATOM 19 CD PRO A 3 -19.307 11.454 -28.838 1.00 0.00 C ATOM 0 HA PRO A 3 -18.412 8.353 -29.699 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -17.137 9.323 -27.441 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -16.695 9.861 -29.049 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -18.248 11.331 -26.936 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -17.279 11.989 -28.240 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -20.130 11.820 -28.224 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -19.146 12.189 -29.626 1.00 0.00 H new ATOM 20 N GLU A 4 -20.147 7.227 -28.252 1.00 0.00 N ATOM 21 CA GLU A 4 -20.853 6.365 -27.262 1.00 0.00 C ATOM 22 C GLU A 4 -19.825 5.683 -26.359 1.00 0.00 C ATOM 23 O GLU A 4 -18.653 6.006 -26.385 1.00 0.00 O ATOM 24 CB GLU A 4 -21.669 5.300 -28.001 1.00 0.00 C ATOM 25 CG GLU A 4 -23.161 5.556 -27.780 1.00 0.00 C ATOM 26 CD GLU A 4 -23.946 4.270 -28.054 1.00 0.00 C ATOM 27 OE1 GLU A 4 -24.153 3.963 -29.216 1.00 0.00 O ATOM 28 OE2 GLU A 4 -24.325 3.616 -27.096 1.00 0.00 O ATOM 0 H GLU A 4 -20.295 6.976 -29.229 1.00 0.00 H new ATOM 0 HA GLU A 4 -21.521 6.978 -26.657 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -21.439 5.324 -29.066 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -21.402 4.307 -27.640 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -23.336 5.891 -26.757 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -23.506 6.353 -28.439 1.00 0.00 H new ATOM 29 N THR A 5 -20.250 4.743 -25.560 1.00 0.00 N ATOM 30 CA THR A 5 -19.301 4.045 -24.660 1.00 0.00 C ATOM 31 C THR A 5 -18.239 3.324 -25.497 1.00 0.00 C ATOM 32 O THR A 5 -18.161 3.495 -26.697 1.00 0.00 O ATOM 33 CB THR A 5 -20.079 3.030 -23.825 1.00 0.00 C ATOM 34 OG1 THR A 5 -21.445 3.418 -23.766 1.00 0.00 O ATOM 35 CG2 THR A 5 -19.504 2.984 -22.412 1.00 0.00 C ATOM 0 H THR A 5 -21.219 4.430 -25.495 1.00 0.00 H new ATOM 0 HA THR A 5 -18.808 4.763 -24.005 1.00 0.00 H new ATOM 0 HB THR A 5 -19.998 2.044 -24.282 1.00 0.00 H new ATOM 0 HG1 THR A 5 -21.947 2.767 -23.232 1.00 0.00 H new ATOM 0 HG21 THR A 5 -20.060 2.260 -21.817 1.00 0.00 H new ATOM 0 HG22 THR A 5 -18.455 2.690 -22.455 1.00 0.00 H new ATOM 0 HG23 THR A 5 -19.586 3.970 -21.954 1.00 0.00 H new ATOM 36 N ARG A 6 -17.419 2.521 -24.873 1.00 0.00 N ATOM 37 CA ARG A 6 -16.362 1.796 -25.637 1.00 0.00 C ATOM 38 C ARG A 6 -16.388 0.308 -25.268 1.00 0.00 C ATOM 39 O ARG A 6 -16.892 -0.061 -24.224 1.00 0.00 O ATOM 40 CB ARG A 6 -14.991 2.383 -25.294 1.00 0.00 C ATOM 41 CG ARG A 6 -15.083 3.910 -25.241 1.00 0.00 C ATOM 42 CD ARG A 6 -15.367 4.357 -23.805 1.00 0.00 C ATOM 43 NE ARG A 6 -15.359 5.847 -23.738 1.00 0.00 N ATOM 44 CZ ARG A 6 -14.290 6.477 -23.331 1.00 0.00 C ATOM 45 NH1 ARG A 6 -13.172 6.359 -23.993 1.00 0.00 N ATOM 46 NH2 ARG A 6 -14.340 7.225 -22.263 1.00 0.00 N ATOM 0 H ARG A 6 -17.435 2.336 -23.870 1.00 0.00 H new ATOM 0 HA ARG A 6 -16.549 1.906 -26.705 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -14.649 1.996 -24.334 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -14.257 2.079 -26.040 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -14.151 4.353 -25.593 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -15.873 4.260 -25.905 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -16.333 3.973 -23.477 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -14.615 3.948 -23.130 1.00 0.00 H new ATOM 0 HE ARG A 6 -16.189 6.374 -24.010 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -13.133 5.775 -24.828 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -12.337 6.851 -23.675 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -15.214 7.318 -21.746 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -13.505 7.717 -21.945 1.00 0.00 H new ATOM 47 N PRO A 7 -15.839 -0.502 -26.139 1.00 0.00 N ATOM 48 CA PRO A 7 -15.775 -1.961 -25.945 1.00 0.00 C ATOM 49 C PRO A 7 -14.654 -2.323 -24.971 1.00 0.00 C ATOM 50 O PRO A 7 -13.690 -1.600 -24.820 1.00 0.00 O ATOM 51 CB PRO A 7 -15.485 -2.499 -27.347 1.00 0.00 C ATOM 52 CG PRO A 7 -14.852 -1.333 -28.141 1.00 0.00 C ATOM 53 CD PRO A 7 -15.233 -0.036 -27.403 1.00 0.00 C ATOM 0 HA PRO A 7 -16.687 -2.378 -25.518 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -14.807 -3.352 -27.303 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -16.401 -2.844 -27.827 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -13.769 -1.444 -28.194 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -15.221 -1.318 -29.166 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -14.359 0.589 -27.219 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -15.935 0.561 -27.985 1.00 0.00 H new ATOM 54 N ASN A 8 -14.779 -3.436 -24.301 1.00 0.00 N ATOM 55 CA ASN A 8 -13.724 -3.834 -23.330 1.00 0.00 C ATOM 56 C ASN A 8 -13.685 -5.355 -23.189 1.00 0.00 C ATOM 57 O ASN A 8 -13.233 -5.881 -22.194 1.00 0.00 O ATOM 58 CB ASN A 8 -14.030 -3.192 -21.978 1.00 0.00 C ATOM 59 CG ASN A 8 -13.002 -3.649 -20.945 1.00 0.00 C ATOM 60 OD1 ASN A 8 -11.882 -3.975 -21.287 1.00 0.00 O ATOM 61 ND2 ASN A 8 -13.337 -3.684 -19.685 1.00 0.00 N ATOM 0 H ASN A 8 -15.563 -4.083 -24.384 1.00 0.00 H new ATOM 0 HA ASN A 8 -12.752 -3.495 -23.687 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.011 -2.106 -22.068 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.033 -3.467 -21.653 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.659 -3.985 -18.985 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.277 -3.410 -19.399 1.00 0.00 H new ATOM 62 N HIS A 9 -14.149 -6.055 -24.188 1.00 0.00 N ATOM 63 CA HIS A 9 -14.140 -7.554 -24.153 1.00 0.00 C ATOM 64 C HIS A 9 -15.304 -8.089 -23.308 1.00 0.00 C ATOM 65 O HIS A 9 -15.644 -9.255 -23.384 1.00 0.00 O ATOM 66 CB HIS A 9 -12.817 -8.054 -23.565 1.00 0.00 C ATOM 67 CG HIS A 9 -12.726 -9.545 -23.740 1.00 0.00 C ATOM 68 ND1 HIS A 9 -13.534 -10.443 -24.390 1.00 0.00 N flip ATOM 69 CD2 HIS A 9 -11.697 -10.292 -23.187 1.00 0.00 C flip ATOM 70 CE1 HIS A 9 -13.018 -11.727 -24.246 1.00 0.00 C flip ATOM 71 NE2 HIS A 9 -11.912 -11.579 -23.513 1.00 0.00 N flip ATOM 0 H HIS A 9 -14.540 -5.651 -25.039 1.00 0.00 H new ATOM 0 HA HIS A 9 -14.251 -7.918 -25.174 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -11.978 -7.566 -24.061 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -12.755 -7.796 -22.508 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -14.384 -10.205 -24.901 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -10.874 -9.910 -22.602 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -13.425 -12.646 -24.642 1.00 0.00 H new ATOM 72 N THR A 10 -15.915 -7.267 -22.500 1.00 0.00 N ATOM 73 CA THR A 10 -17.039 -7.765 -21.660 1.00 0.00 C ATOM 74 C THR A 10 -18.060 -6.649 -21.431 1.00 0.00 C ATOM 75 O THR A 10 -17.713 -5.488 -21.338 1.00 0.00 O ATOM 76 CB THR A 10 -16.486 -8.227 -20.309 1.00 0.00 C ATOM 77 OG1 THR A 10 -15.471 -9.198 -20.522 1.00 0.00 O ATOM 78 CG2 THR A 10 -17.613 -8.831 -19.472 1.00 0.00 C ATOM 0 H THR A 10 -15.687 -6.279 -22.386 1.00 0.00 H new ATOM 0 HA THR A 10 -17.528 -8.595 -22.170 1.00 0.00 H new ATOM 0 HB THR A 10 -16.064 -7.374 -19.777 1.00 0.00 H new ATOM 0 HG1 THR A 10 -14.905 -9.260 -19.724 1.00 0.00 H new ATOM 0 HG21 THR A 10 -17.217 -9.159 -18.511 1.00 0.00 H new ATOM 0 HG22 THR A 10 -18.387 -8.081 -19.309 1.00 0.00 H new ATOM 0 HG23 THR A 10 -18.040 -9.684 -19.999 1.00 0.00 H new ATOM 79 N ILE A 11 -19.318 -6.990 -21.323 1.00 0.00 N ATOM 80 CA ILE A 11 -20.348 -5.937 -21.083 1.00 0.00 C ATOM 81 C ILE A 11 -20.976 -6.142 -19.705 1.00 0.00 C ATOM 82 O ILE A 11 -20.877 -7.200 -19.117 1.00 0.00 O ATOM 83 CB ILE A 11 -21.436 -5.998 -22.159 1.00 0.00 C ATOM 84 CG1 ILE A 11 -22.396 -7.157 -21.866 1.00 0.00 C ATOM 85 CG2 ILE A 11 -20.789 -6.199 -23.529 1.00 0.00 C ATOM 86 CD1 ILE A 11 -23.259 -7.438 -23.099 1.00 0.00 C ATOM 0 H ILE A 11 -19.674 -7.943 -21.390 1.00 0.00 H new ATOM 0 HA ILE A 11 -19.869 -4.959 -21.126 1.00 0.00 H new ATOM 0 HB ILE A 11 -21.996 -5.063 -22.156 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -21.832 -8.049 -21.594 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -23.031 -6.910 -21.015 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -21.564 -6.242 -24.294 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -20.117 -5.367 -23.740 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -20.224 -7.131 -23.531 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -23.940 -8.262 -22.886 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -23.835 -6.547 -23.351 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -22.618 -7.705 -23.939 1.00 0.00 H new ATOM 87 N TYR A 12 -21.625 -5.137 -19.187 1.00 0.00 N ATOM 88 CA TYR A 12 -22.261 -5.278 -17.851 1.00 0.00 C ATOM 89 C TYR A 12 -23.777 -5.355 -18.018 1.00 0.00 C ATOM 90 O TYR A 12 -24.366 -4.630 -18.795 1.00 0.00 O ATOM 91 CB TYR A 12 -21.902 -4.073 -16.979 1.00 0.00 C ATOM 92 CG TYR A 12 -21.934 -4.487 -15.528 1.00 0.00 C ATOM 93 CD1 TYR A 12 -23.131 -4.934 -14.957 1.00 0.00 C ATOM 94 CD2 TYR A 12 -20.768 -4.429 -14.755 1.00 0.00 C ATOM 95 CE1 TYR A 12 -23.164 -5.324 -13.614 1.00 0.00 C ATOM 96 CE2 TYR A 12 -20.800 -4.819 -13.411 1.00 0.00 C ATOM 97 CZ TYR A 12 -21.999 -5.266 -12.840 1.00 0.00 C ATOM 98 OH TYR A 12 -22.031 -5.649 -11.514 1.00 0.00 O ATOM 0 H TYR A 12 -21.742 -4.226 -19.631 1.00 0.00 H new ATOM 0 HA TYR A 12 -21.900 -6.188 -17.372 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -20.912 -3.700 -17.242 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -22.606 -3.259 -17.154 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -24.030 -4.978 -15.554 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -19.844 -4.084 -15.195 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -24.088 -5.670 -13.174 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -19.901 -4.775 -12.814 1.00 0.00 H new ATOM 0 HH TYR A 12 -22.364 -6.568 -11.447 1.00 0.00 H new ATOM 99 N ILE A 13 -24.413 -6.234 -17.296 1.00 0.00 N ATOM 100 CA ILE A 13 -25.891 -6.367 -17.409 1.00 0.00 C ATOM 101 C ILE A 13 -26.529 -6.071 -16.047 1.00 0.00 C ATOM 102 O ILE A 13 -26.159 -6.645 -15.042 1.00 0.00 O ATOM 103 CB ILE A 13 -26.230 -7.797 -17.852 1.00 0.00 C ATOM 104 CG1 ILE A 13 -26.076 -7.905 -19.371 1.00 0.00 C ATOM 105 CG2 ILE A 13 -27.669 -8.140 -17.463 1.00 0.00 C ATOM 106 CD1 ILE A 13 -27.056 -6.949 -20.053 1.00 0.00 C ATOM 0 H ILE A 13 -23.971 -6.868 -16.630 1.00 0.00 H new ATOM 0 HA ILE A 13 -26.278 -5.661 -18.144 1.00 0.00 H new ATOM 0 HB ILE A 13 -25.552 -8.494 -17.360 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -25.054 -7.663 -19.662 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -26.265 -8.929 -19.694 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -27.900 -9.157 -17.782 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -27.781 -8.065 -16.381 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -28.353 -7.444 -17.948 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -26.946 -7.026 -21.135 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -28.076 -7.212 -19.772 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -26.845 -5.927 -19.739 1.00 0.00 H new ATOM 107 N ASN A 14 -27.486 -5.183 -16.008 1.00 0.00 N ATOM 108 CA ASN A 14 -28.147 -4.855 -14.713 1.00 0.00 C ATOM 109 C ASN A 14 -29.625 -4.545 -14.956 1.00 0.00 C ATOM 110 O ASN A 14 -30.024 -3.400 -15.040 1.00 0.00 O ATOM 111 CB ASN A 14 -27.466 -3.636 -14.087 1.00 0.00 C ATOM 112 CG ASN A 14 -27.959 -3.457 -12.649 1.00 0.00 C ATOM 113 OD1 ASN A 14 -28.555 -4.353 -12.084 1.00 0.00 O ATOM 114 ND2 ASN A 14 -27.732 -2.332 -12.028 1.00 0.00 N ATOM 0 H ASN A 14 -27.838 -4.671 -16.817 1.00 0.00 H new ATOM 0 HA ASN A 14 -28.062 -5.706 -14.037 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -26.384 -3.765 -14.098 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -27.686 -2.743 -14.672 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -28.055 -2.205 -11.069 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -27.232 -1.580 -12.502 1.00 0.00 H new ATOM 115 N ASN A 15 -30.443 -5.555 -15.065 1.00 0.00 N ATOM 116 CA ASN A 15 -31.896 -5.319 -15.299 1.00 0.00 C ATOM 117 C ASN A 15 -32.626 -6.663 -15.330 1.00 0.00 C ATOM 118 O ASN A 15 -33.590 -6.842 -16.048 1.00 0.00 O ATOM 119 CB ASN A 15 -32.091 -4.598 -16.636 1.00 0.00 C ATOM 120 CG ASN A 15 -31.832 -5.572 -17.787 1.00 0.00 C ATOM 121 OD1 ASN A 15 -32.842 -6.089 -18.429 1.00 0.00 O flip ATOM 122 ND2 ASN A 15 -30.696 -5.866 -18.105 1.00 0.00 N flip ATOM 0 H ASN A 15 -30.168 -6.535 -15.002 1.00 0.00 H new ATOM 0 HA ASN A 15 -32.300 -4.702 -14.496 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -33.104 -4.202 -16.703 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -31.411 -3.749 -16.705 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -29.905 -5.462 -17.603 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -30.534 -6.517 -18.874 1.00 0.00 H new ATOM 123 N LEU A 16 -32.168 -7.611 -14.561 1.00 0.00 N ATOM 124 CA LEU A 16 -32.825 -8.947 -14.547 1.00 0.00 C ATOM 125 C LEU A 16 -33.773 -9.044 -13.349 1.00 0.00 C ATOM 126 O LEU A 16 -33.468 -8.589 -12.265 1.00 0.00 O ATOM 127 CB LEU A 16 -31.753 -10.031 -14.435 1.00 0.00 C ATOM 128 CG LEU A 16 -31.076 -10.227 -15.792 1.00 0.00 C ATOM 129 CD1 LEU A 16 -32.135 -10.525 -16.854 1.00 0.00 C ATOM 130 CD2 LEU A 16 -30.320 -8.951 -16.174 1.00 0.00 C ATOM 0 H LEU A 16 -31.364 -7.517 -13.940 1.00 0.00 H new ATOM 0 HA LEU A 16 -33.394 -9.083 -15.467 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -31.013 -9.749 -13.686 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -32.202 -10.967 -14.103 1.00 0.00 H new ATOM 0 HG LEU A 16 -30.377 -11.061 -15.730 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -31.651 -10.665 -17.821 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -32.676 -11.432 -16.584 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -32.834 -9.691 -16.915 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -29.837 -9.090 -17.141 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -31.020 -8.118 -16.234 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -29.564 -8.736 -15.419 1.00 0.00 H new ATOM 131 N ASN A 17 -34.918 -9.641 -13.537 1.00 0.00 N ATOM 132 CA ASN A 17 -35.881 -9.777 -12.412 1.00 0.00 C ATOM 133 C ASN A 17 -35.141 -10.296 -11.183 1.00 0.00 C ATOM 134 O ASN A 17 -34.142 -10.979 -11.289 1.00 0.00 O ATOM 135 CB ASN A 17 -36.982 -10.768 -12.797 1.00 0.00 C ATOM 136 CG ASN A 17 -38.283 -10.009 -13.068 1.00 0.00 C ATOM 137 OD1 ASN A 17 -38.797 -9.333 -12.200 1.00 0.00 O ATOM 138 ND2 ASN A 17 -38.842 -10.096 -14.244 1.00 0.00 N ATOM 0 H ASN A 17 -35.227 -10.041 -14.423 1.00 0.00 H new ATOM 0 HA ASN A 17 -36.328 -8.807 -12.193 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -36.686 -11.330 -13.683 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -37.131 -11.491 -11.995 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -39.711 -9.596 -14.434 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -38.410 -10.664 -14.973 1.00 0.00 H new ATOM 139 N GLU A 18 -35.615 -9.975 -10.016 1.00 0.00 N ATOM 140 CA GLU A 18 -34.929 -10.449 -8.785 1.00 0.00 C ATOM 141 C GLU A 18 -35.599 -11.731 -8.291 1.00 0.00 C ATOM 142 O GLU A 18 -35.888 -11.880 -7.120 1.00 0.00 O ATOM 143 CB GLU A 18 -35.025 -9.369 -7.713 1.00 0.00 C ATOM 144 CG GLU A 18 -33.796 -8.464 -7.806 1.00 0.00 C ATOM 145 CD GLU A 18 -33.890 -7.357 -6.753 1.00 0.00 C ATOM 146 OE1 GLU A 18 -34.878 -6.642 -6.760 1.00 0.00 O ATOM 147 OE2 GLU A 18 -32.972 -7.244 -5.959 1.00 0.00 O ATOM 0 H GLU A 18 -36.447 -9.406 -9.860 1.00 0.00 H new ATOM 0 HA GLU A 18 -33.881 -10.654 -9.001 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -35.935 -8.784 -7.849 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -35.083 -9.824 -6.724 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -32.889 -9.049 -7.653 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -33.729 -8.027 -8.802 1.00 0.00 H new ATOM 148 N LYS A 19 -35.846 -12.660 -9.173 1.00 0.00 N ATOM 149 CA LYS A 19 -36.493 -13.929 -8.749 1.00 0.00 C ATOM 150 C LYS A 19 -36.045 -15.075 -9.656 1.00 0.00 C ATOM 151 O LYS A 19 -36.631 -16.139 -9.661 1.00 0.00 O ATOM 152 CB LYS A 19 -38.013 -13.780 -8.829 1.00 0.00 C ATOM 153 CG LYS A 19 -38.459 -12.630 -7.926 1.00 0.00 C ATOM 154 CD LYS A 19 -39.973 -12.445 -8.044 1.00 0.00 C ATOM 155 CE LYS A 19 -40.674 -13.281 -6.971 1.00 0.00 C ATOM 156 NZ LYS A 19 -42.138 -13.317 -7.249 1.00 0.00 N ATOM 0 H LYS A 19 -35.627 -12.594 -10.167 1.00 0.00 H new ATOM 0 HA LYS A 19 -36.200 -14.151 -7.723 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -38.317 -13.588 -9.858 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -38.497 -14.707 -8.522 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -38.187 -12.840 -6.891 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -37.947 -11.711 -8.210 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -40.232 -11.393 -7.927 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -40.311 -12.748 -9.035 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -40.270 -14.293 -6.961 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -40.490 -12.855 -5.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -42.616 -13.885 -6.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -42.517 -12.349 -7.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -42.304 -13.743 -8.183 1.00 0.00 H new ATOM 157 N ILE A 20 -35.008 -14.873 -10.419 1.00 0.00 N ATOM 158 CA ILE A 20 -34.527 -15.957 -11.316 1.00 0.00 C ATOM 159 C ILE A 20 -33.464 -16.778 -10.587 1.00 0.00 C ATOM 160 O ILE A 20 -32.758 -16.279 -9.733 1.00 0.00 O ATOM 161 CB ILE A 20 -33.933 -15.345 -12.584 1.00 0.00 C ATOM 162 CG1 ILE A 20 -34.936 -14.363 -13.189 1.00 0.00 C ATOM 163 CG2 ILE A 20 -33.638 -16.453 -13.594 1.00 0.00 C ATOM 164 CD1 ILE A 20 -34.263 -13.004 -13.375 1.00 0.00 C ATOM 0 H ILE A 20 -34.474 -14.005 -10.460 1.00 0.00 H new ATOM 0 HA ILE A 20 -35.359 -16.605 -11.590 1.00 0.00 H new ATOM 0 HB ILE A 20 -33.009 -14.821 -12.338 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -35.296 -14.737 -14.147 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -35.805 -14.265 -12.538 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -33.214 -16.017 -14.499 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -32.927 -17.158 -13.163 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -34.562 -16.975 -13.841 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -34.976 -12.301 -13.806 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -33.924 -12.630 -12.409 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -33.408 -13.110 -14.043 1.00 0.00 H new ATOM 165 N LYS A 21 -33.348 -18.034 -10.909 1.00 0.00 N ATOM 166 CA LYS A 21 -32.339 -18.889 -10.228 1.00 0.00 C ATOM 167 C LYS A 21 -31.074 -18.984 -11.084 1.00 0.00 C ATOM 168 O LYS A 21 -31.132 -19.236 -12.271 1.00 0.00 O ATOM 169 CB LYS A 21 -32.919 -20.290 -10.013 1.00 0.00 C ATOM 170 CG LYS A 21 -33.688 -20.326 -8.692 1.00 0.00 C ATOM 171 CD LYS A 21 -32.702 -20.452 -7.530 1.00 0.00 C ATOM 172 CE LYS A 21 -33.005 -21.724 -6.736 1.00 0.00 C ATOM 173 NZ LYS A 21 -32.693 -22.917 -7.573 1.00 0.00 N ATOM 0 H LYS A 21 -33.910 -18.507 -11.617 1.00 0.00 H new ATOM 0 HA LYS A 21 -32.086 -18.447 -9.264 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -33.581 -20.552 -10.839 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -32.118 -21.029 -10.000 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -34.283 -19.420 -8.581 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -34.382 -21.166 -8.686 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -31.680 -20.482 -7.908 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -32.776 -19.580 -6.881 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -32.414 -21.744 -5.821 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -34.054 -21.739 -6.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -32.585 -23.751 -6.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -33.468 -23.080 -8.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -31.808 -22.753 -8.095 1.00 0.00 H new ATOM 174 N LYS A 22 -29.930 -18.781 -10.486 1.00 0.00 N ATOM 175 CA LYS A 22 -28.657 -18.858 -11.256 1.00 0.00 C ATOM 176 C LYS A 22 -28.702 -20.059 -12.202 1.00 0.00 C ATOM 177 O LYS A 22 -29.486 -20.970 -12.025 1.00 0.00 O ATOM 178 CB LYS A 22 -27.485 -19.019 -10.285 1.00 0.00 C ATOM 179 CG LYS A 22 -26.949 -17.640 -9.888 1.00 0.00 C ATOM 180 CD LYS A 22 -28.061 -16.826 -9.226 1.00 0.00 C ATOM 181 CE LYS A 22 -27.683 -15.345 -9.238 1.00 0.00 C ATOM 182 NZ LYS A 22 -28.652 -14.578 -8.404 1.00 0.00 N ATOM 0 H LYS A 22 -29.824 -18.565 -9.495 1.00 0.00 H new ATOM 0 HA LYS A 22 -28.528 -17.944 -11.836 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -27.808 -19.563 -9.398 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -26.694 -19.607 -10.750 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -26.108 -17.749 -9.203 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -26.577 -17.116 -10.769 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -29.002 -16.977 -9.756 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -28.214 -17.165 -8.201 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -26.672 -15.214 -8.853 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -27.687 -14.966 -10.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -28.395 -13.570 -8.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -29.611 -14.694 -8.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -28.627 -14.934 -7.427 1.00 0.00 H new ATOM 183 N ASP A 23 -27.865 -20.060 -13.205 1.00 0.00 N ATOM 184 CA ASP A 23 -27.845 -21.192 -14.173 1.00 0.00 C ATOM 185 C ASP A 23 -28.978 -21.028 -15.190 1.00 0.00 C ATOM 186 O ASP A 23 -29.036 -21.725 -16.184 1.00 0.00 O ATOM 187 CB ASP A 23 -28.013 -22.517 -13.424 1.00 0.00 C ATOM 188 CG ASP A 23 -27.439 -23.654 -14.269 1.00 0.00 C ATOM 189 OD1 ASP A 23 -26.831 -23.363 -15.286 1.00 0.00 O ATOM 190 OD2 ASP A 23 -27.619 -24.799 -13.886 1.00 0.00 O ATOM 0 H ASP A 23 -27.190 -19.319 -13.395 1.00 0.00 H new ATOM 0 HA ASP A 23 -26.890 -21.194 -14.698 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -27.503 -22.471 -12.462 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -29.068 -22.699 -13.217 1.00 0.00 H new ATOM 191 N GLU A 24 -29.873 -20.106 -14.959 1.00 0.00 N ATOM 192 CA GLU A 24 -30.990 -19.893 -15.921 1.00 0.00 C ATOM 193 C GLU A 24 -30.896 -18.472 -16.474 1.00 0.00 C ATOM 194 O GLU A 24 -30.994 -18.250 -17.665 1.00 0.00 O ATOM 195 CB GLU A 24 -32.331 -20.081 -15.208 1.00 0.00 C ATOM 196 CG GLU A 24 -33.276 -20.881 -16.107 1.00 0.00 C ATOM 197 CD GLU A 24 -34.550 -21.228 -15.335 1.00 0.00 C ATOM 198 OE1 GLU A 24 -34.961 -20.423 -14.517 1.00 0.00 O ATOM 199 OE2 GLU A 24 -35.094 -22.293 -15.578 1.00 0.00 O ATOM 0 H GLU A 24 -29.878 -19.491 -14.145 1.00 0.00 H new ATOM 0 HA GLU A 24 -30.920 -20.614 -16.735 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -32.183 -20.602 -14.262 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -32.769 -19.111 -14.972 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -33.524 -20.302 -16.997 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -32.785 -21.793 -16.447 1.00 0.00 H new ATOM 200 N LEU A 25 -30.698 -17.506 -15.619 1.00 0.00 N ATOM 201 CA LEU A 25 -30.587 -16.103 -16.097 1.00 0.00 C ATOM 202 C LEU A 25 -29.503 -16.021 -17.174 1.00 0.00 C ATOM 203 O LEU A 25 -29.558 -15.194 -18.061 1.00 0.00 O ATOM 204 CB LEU A 25 -30.205 -15.198 -14.923 1.00 0.00 C ATOM 205 CG LEU A 25 -30.220 -13.740 -15.377 1.00 0.00 C ATOM 206 CD1 LEU A 25 -31.649 -13.332 -15.735 1.00 0.00 C ATOM 207 CD2 LEU A 25 -29.702 -12.850 -14.244 1.00 0.00 C ATOM 0 H LEU A 25 -30.609 -17.630 -14.611 1.00 0.00 H new ATOM 0 HA LEU A 25 -31.541 -15.780 -16.513 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -30.903 -15.340 -14.098 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -29.215 -15.464 -14.552 1.00 0.00 H new ATOM 0 HG LEU A 25 -29.581 -13.624 -16.252 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -31.660 -12.291 -16.059 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -32.018 -13.967 -16.541 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -32.290 -13.446 -14.861 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -29.712 -11.809 -14.566 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -30.342 -12.965 -13.369 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -28.683 -13.141 -13.989 1.00 0.00 H new ATOM 208 N LYS A 26 -28.513 -16.871 -17.099 1.00 0.00 N ATOM 209 CA LYS A 26 -27.420 -16.838 -18.114 1.00 0.00 C ATOM 210 C LYS A 26 -27.860 -17.574 -19.379 1.00 0.00 C ATOM 211 O LYS A 26 -27.545 -17.172 -20.481 1.00 0.00 O ATOM 212 CB LYS A 26 -26.167 -17.515 -17.554 1.00 0.00 C ATOM 213 CG LYS A 26 -26.164 -17.431 -16.026 1.00 0.00 C ATOM 214 CD LYS A 26 -24.738 -17.180 -15.533 1.00 0.00 C ATOM 215 CE LYS A 26 -23.945 -18.487 -15.578 1.00 0.00 C ATOM 216 NZ LYS A 26 -24.091 -19.200 -14.278 1.00 0.00 N ATOM 0 H LYS A 26 -28.414 -17.586 -16.379 1.00 0.00 H new ATOM 0 HA LYS A 26 -27.198 -15.798 -18.354 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -26.136 -18.558 -17.869 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -25.274 -17.034 -17.954 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -26.822 -16.628 -15.694 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -26.550 -18.357 -15.599 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -24.254 -16.427 -16.155 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -24.757 -16.789 -14.516 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -24.305 -19.116 -16.392 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -22.893 -18.280 -15.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -23.552 -20.089 -14.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -23.728 -18.600 -13.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -25.095 -19.409 -14.108 1.00 0.00 H new ATOM 217 N LYS A 27 -28.579 -18.653 -19.234 1.00 0.00 N ATOM 218 CA LYS A 27 -29.030 -19.413 -20.434 1.00 0.00 C ATOM 219 C LYS A 27 -29.880 -18.507 -21.328 1.00 0.00 C ATOM 220 O LYS A 27 -30.173 -18.839 -22.460 1.00 0.00 O ATOM 221 CB LYS A 27 -29.859 -20.621 -19.992 1.00 0.00 C ATOM 222 CG LYS A 27 -28.964 -21.606 -19.236 1.00 0.00 C ATOM 223 CD LYS A 27 -28.762 -22.866 -20.080 1.00 0.00 C ATOM 224 CE LYS A 27 -28.569 -24.073 -19.159 1.00 0.00 C ATOM 225 NZ LYS A 27 -27.759 -23.671 -17.976 1.00 0.00 N ATOM 0 H LYS A 27 -28.873 -19.041 -18.338 1.00 0.00 H new ATOM 0 HA LYS A 27 -28.159 -19.756 -20.993 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -30.681 -20.297 -19.354 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -30.302 -21.109 -20.860 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -28.001 -21.144 -19.017 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -29.418 -21.865 -18.280 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -29.624 -23.024 -20.728 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -27.893 -22.747 -20.728 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -29.537 -24.456 -18.837 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -28.070 -24.879 -19.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -27.289 -24.508 -17.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -27.041 -22.977 -18.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -28.380 -23.247 -17.258 1.00 0.00 H new ATOM 226 N SER A 28 -30.285 -17.369 -20.833 1.00 0.00 N ATOM 227 CA SER A 28 -31.119 -16.454 -21.660 1.00 0.00 C ATOM 228 C SER A 28 -30.232 -15.412 -22.345 1.00 0.00 C ATOM 229 O SER A 28 -30.500 -15.000 -23.457 1.00 0.00 O ATOM 230 CB SER A 28 -32.142 -15.753 -20.766 1.00 0.00 C ATOM 231 OG SER A 28 -31.460 -14.994 -19.776 1.00 0.00 O ATOM 0 H SER A 28 -30.074 -17.035 -19.893 1.00 0.00 H new ATOM 0 HA SER A 28 -31.638 -17.033 -22.424 1.00 0.00 H new ATOM 0 HB2 SER A 28 -32.779 -15.102 -21.365 1.00 0.00 H new ATOM 0 HB3 SER A 28 -32.793 -16.488 -20.293 1.00 0.00 H new ATOM 0 HG SER A 28 -30.926 -15.594 -19.214 1.00 0.00 H new ATOM 232 N LEU A 29 -29.174 -14.982 -21.709 1.00 0.00 N ATOM 233 CA LEU A 29 -28.290 -13.973 -22.364 1.00 0.00 C ATOM 234 C LEU A 29 -27.356 -14.698 -23.329 1.00 0.00 C ATOM 235 O LEU A 29 -26.756 -14.103 -24.201 1.00 0.00 O ATOM 236 CB LEU A 29 -27.436 -13.233 -21.328 1.00 0.00 C ATOM 237 CG LEU A 29 -28.185 -13.070 -20.004 1.00 0.00 C ATOM 238 CD1 LEU A 29 -27.276 -13.540 -18.865 1.00 0.00 C ATOM 239 CD2 LEU A 29 -28.531 -11.594 -19.797 1.00 0.00 C ATOM 0 H LEU A 29 -28.886 -15.281 -20.777 1.00 0.00 H new ATOM 0 HA LEU A 29 -28.915 -13.249 -22.887 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -26.509 -13.782 -21.159 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -27.160 -12.252 -21.715 1.00 0.00 H new ATOM 0 HG LEU A 29 -29.102 -13.659 -20.019 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -27.797 -13.429 -17.914 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -27.015 -14.588 -19.016 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -26.367 -12.938 -18.853 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -29.065 -11.474 -18.854 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -27.614 -11.005 -19.772 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -29.161 -11.249 -20.617 1.00 0.00 H new ATOM 240 N TYR A 30 -27.224 -15.983 -23.165 1.00 0.00 N ATOM 241 CA TYR A 30 -26.323 -16.764 -24.052 1.00 0.00 C ATOM 242 C TYR A 30 -27.023 -17.043 -25.385 1.00 0.00 C ATOM 243 O TYR A 30 -26.411 -17.005 -26.435 1.00 0.00 O ATOM 244 CB TYR A 30 -25.985 -18.088 -23.370 1.00 0.00 C ATOM 245 CG TYR A 30 -24.510 -18.361 -23.501 1.00 0.00 C ATOM 246 CD1 TYR A 30 -23.995 -18.854 -24.705 1.00 0.00 C ATOM 247 CD2 TYR A 30 -23.659 -18.127 -22.416 1.00 0.00 C ATOM 248 CE1 TYR A 30 -22.626 -19.115 -24.825 1.00 0.00 C ATOM 249 CE2 TYR A 30 -22.289 -18.389 -22.535 1.00 0.00 C ATOM 250 CZ TYR A 30 -21.773 -18.884 -23.739 1.00 0.00 C ATOM 251 OH TYR A 30 -20.422 -19.142 -23.856 1.00 0.00 O ATOM 0 H TYR A 30 -27.705 -16.529 -22.450 1.00 0.00 H new ATOM 0 HA TYR A 30 -25.411 -16.197 -24.239 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -26.266 -18.049 -22.318 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -26.557 -18.898 -23.822 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -24.654 -19.033 -25.541 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -24.058 -17.745 -21.488 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -22.227 -19.494 -25.754 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -21.630 -18.209 -21.698 1.00 0.00 H new ATOM 0 HH TYR A 30 -19.973 -18.926 -23.012 1.00 0.00 H new ATOM 252 N ALA A 31 -28.297 -17.328 -25.356 1.00 0.00 N ATOM 253 CA ALA A 31 -29.019 -17.613 -26.628 1.00 0.00 C ATOM 254 C ALA A 31 -29.576 -16.309 -27.202 1.00 0.00 C ATOM 255 O ALA A 31 -30.655 -16.276 -27.759 1.00 0.00 O ATOM 256 CB ALA A 31 -30.168 -18.586 -26.359 1.00 0.00 C ATOM 0 H ALA A 31 -28.866 -17.376 -24.511 1.00 0.00 H new ATOM 0 HA ALA A 31 -28.329 -18.059 -27.344 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -30.695 -18.793 -27.290 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -29.770 -19.516 -25.953 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -30.859 -18.143 -25.642 1.00 0.00 H new ATOM 257 N ILE A 32 -28.847 -15.235 -27.071 1.00 0.00 N ATOM 258 CA ILE A 32 -29.335 -13.936 -27.611 1.00 0.00 C ATOM 259 C ILE A 32 -28.142 -13.087 -28.051 1.00 0.00 C ATOM 260 O ILE A 32 -28.153 -12.478 -29.102 1.00 0.00 O ATOM 261 CB ILE A 32 -30.132 -13.198 -26.526 1.00 0.00 C ATOM 262 CG1 ILE A 32 -31.089 -12.204 -27.192 1.00 0.00 C ATOM 263 CG2 ILE A 32 -29.185 -12.446 -25.585 1.00 0.00 C ATOM 264 CD1 ILE A 32 -32.067 -11.651 -26.153 1.00 0.00 C ATOM 0 H ILE A 32 -27.936 -15.201 -26.614 1.00 0.00 H new ATOM 0 HA ILE A 32 -29.982 -14.116 -28.470 1.00 0.00 H new ATOM 0 HB ILE A 32 -30.698 -13.925 -25.944 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -30.524 -11.388 -27.644 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -31.637 -12.696 -27.996 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -29.766 -11.928 -24.822 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -28.508 -13.155 -25.107 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -28.606 -11.720 -26.155 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -32.745 -10.945 -26.632 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -32.642 -12.471 -25.722 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -31.512 -11.143 -25.365 1.00 0.00 H new ATOM 265 N PHE A 33 -27.116 -13.036 -27.249 1.00 0.00 N ATOM 266 CA PHE A 33 -25.929 -12.218 -27.617 1.00 0.00 C ATOM 267 C PHE A 33 -25.110 -12.940 -28.686 1.00 0.00 C ATOM 268 O PHE A 33 -24.423 -12.328 -29.479 1.00 0.00 O ATOM 269 CB PHE A 33 -25.040 -12.041 -26.397 1.00 0.00 C ATOM 270 CG PHE A 33 -25.607 -11.028 -25.444 1.00 0.00 C ATOM 271 CD1 PHE A 33 -26.264 -9.886 -25.914 1.00 0.00 C ATOM 272 CD2 PHE A 33 -25.463 -11.243 -24.074 1.00 0.00 C ATOM 273 CE1 PHE A 33 -26.780 -8.958 -25.003 1.00 0.00 C ATOM 274 CE2 PHE A 33 -25.978 -10.320 -23.163 1.00 0.00 C ATOM 275 CZ PHE A 33 -26.638 -9.175 -23.627 1.00 0.00 C ATOM 0 H PHE A 33 -27.048 -13.525 -26.356 1.00 0.00 H new ATOM 0 HA PHE A 33 -26.273 -11.253 -27.990 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -24.926 -12.998 -25.887 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -24.045 -11.728 -26.713 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -26.372 -9.721 -26.976 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -24.952 -12.125 -23.717 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -27.288 -8.075 -25.361 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -25.868 -10.488 -22.102 1.00 0.00 H new ATOM 0 HZ PHE A 33 -27.037 -8.460 -22.923 1.00 0.00 H new ATOM 276 N SER A 34 -25.155 -14.240 -28.690 1.00 0.00 N ATOM 277 CA SER A 34 -24.358 -15.021 -29.678 1.00 0.00 C ATOM 278 C SER A 34 -24.532 -14.463 -31.098 1.00 0.00 C ATOM 279 O SER A 34 -23.737 -14.743 -31.973 1.00 0.00 O ATOM 280 CB SER A 34 -24.804 -16.480 -29.635 1.00 0.00 C ATOM 281 OG SER A 34 -24.550 -17.088 -30.894 1.00 0.00 O ATOM 0 H SER A 34 -25.713 -14.801 -28.047 1.00 0.00 H new ATOM 0 HA SER A 34 -23.303 -14.944 -29.416 1.00 0.00 H new ATOM 0 HB2 SER A 34 -24.270 -17.012 -28.847 1.00 0.00 H new ATOM 0 HB3 SER A 34 -25.866 -16.540 -29.397 1.00 0.00 H new ATOM 0 HG SER A 34 -24.834 -18.025 -30.868 1.00 0.00 H new ATOM 282 N GLN A 35 -25.545 -13.674 -31.347 1.00 0.00 N ATOM 283 CA GLN A 35 -25.714 -13.122 -32.727 1.00 0.00 C ATOM 284 C GLN A 35 -24.791 -11.919 -32.912 1.00 0.00 C ATOM 285 O GLN A 35 -24.174 -11.750 -33.945 1.00 0.00 O ATOM 286 CB GLN A 35 -27.159 -12.680 -32.983 1.00 0.00 C ATOM 287 CG GLN A 35 -27.897 -12.421 -31.666 1.00 0.00 C ATOM 288 CD GLN A 35 -29.302 -11.891 -31.963 1.00 0.00 C ATOM 289 OE1 GLN A 35 -30.278 -12.595 -31.792 1.00 0.00 O ATOM 290 NE2 GLN A 35 -29.449 -10.671 -32.403 1.00 0.00 N ATOM 0 H GLN A 35 -26.252 -13.391 -30.669 1.00 0.00 H new ATOM 0 HA GLN A 35 -25.462 -13.911 -33.435 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -27.164 -11.775 -33.590 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -27.682 -13.448 -33.552 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -27.959 -13.341 -31.085 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -27.345 -11.700 -31.063 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -28.631 -10.079 -32.547 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -30.382 -10.310 -32.603 1.00 0.00 H new ATOM 291 N PHE A 36 -24.689 -11.084 -31.918 1.00 0.00 N ATOM 292 CA PHE A 36 -23.810 -9.897 -32.026 1.00 0.00 C ATOM 293 C PHE A 36 -22.396 -10.350 -32.364 1.00 0.00 C ATOM 294 O PHE A 36 -21.613 -9.618 -32.936 1.00 0.00 O ATOM 295 CB PHE A 36 -23.822 -9.186 -30.693 1.00 0.00 C ATOM 296 CG PHE A 36 -25.227 -8.740 -30.412 1.00 0.00 C ATOM 297 CD1 PHE A 36 -25.877 -7.867 -31.288 1.00 0.00 C ATOM 298 CD2 PHE A 36 -25.885 -9.219 -29.282 1.00 0.00 C ATOM 299 CE1 PHE A 36 -27.192 -7.474 -31.031 1.00 0.00 C ATOM 300 CE2 PHE A 36 -27.198 -8.825 -29.020 1.00 0.00 C ATOM 301 CZ PHE A 36 -27.856 -7.953 -29.895 1.00 0.00 C ATOM 0 H PHE A 36 -25.182 -11.177 -31.030 1.00 0.00 H new ATOM 0 HA PHE A 36 -24.160 -9.225 -32.810 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -23.469 -9.851 -29.904 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -23.148 -8.330 -30.713 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -25.363 -7.497 -32.163 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -25.379 -9.895 -28.609 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -27.697 -6.801 -31.708 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -27.707 -9.193 -28.141 1.00 0.00 H new ATOM 0 HZ PHE A 36 -28.873 -7.650 -29.695 1.00 0.00 H new ATOM 302 N GLY A 37 -22.065 -11.560 -32.013 1.00 0.00 N ATOM 303 CA GLY A 37 -20.700 -12.072 -32.313 1.00 0.00 C ATOM 304 C GLY A 37 -20.583 -13.519 -31.844 1.00 0.00 C ATOM 305 O GLY A 37 -20.632 -14.444 -32.630 1.00 0.00 O ATOM 0 H GLY A 37 -22.680 -12.216 -31.532 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -20.504 -12.009 -33.383 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -19.952 -11.456 -31.815 1.00 0.00 H new ATOM 306 N GLN A 38 -20.432 -13.724 -30.566 1.00 0.00 N ATOM 307 CA GLN A 38 -20.313 -15.113 -30.048 1.00 0.00 C ATOM 308 C GLN A 38 -20.064 -15.086 -28.539 1.00 0.00 C ATOM 309 O GLN A 38 -18.939 -15.009 -28.085 1.00 0.00 O ATOM 310 CB GLN A 38 -19.146 -15.817 -30.743 1.00 0.00 C ATOM 311 CG GLN A 38 -19.475 -17.303 -30.913 1.00 0.00 C ATOM 312 CD GLN A 38 -18.369 -17.981 -31.723 1.00 0.00 C ATOM 313 OE1 GLN A 38 -17.760 -17.367 -32.577 1.00 0.00 O ATOM 314 NE2 GLN A 38 -18.082 -19.233 -31.493 1.00 0.00 N ATOM 0 H GLN A 38 -20.386 -12.990 -29.859 1.00 0.00 H new ATOM 0 HA GLN A 38 -21.239 -15.651 -30.249 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.959 -15.361 -31.715 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -18.235 -15.700 -30.156 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -19.570 -17.779 -29.937 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -20.434 -17.419 -31.419 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -18.592 -19.750 -30.777 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -17.348 -19.695 -32.030 1.00 0.00 H new ATOM 315 N ILE A 39 -21.108 -15.163 -27.760 1.00 0.00 N ATOM 316 CA ILE A 39 -20.943 -15.163 -26.281 1.00 0.00 C ATOM 317 C ILE A 39 -19.813 -16.128 -25.924 1.00 0.00 C ATOM 318 O ILE A 39 -19.622 -17.136 -26.574 1.00 0.00 O ATOM 319 CB ILE A 39 -22.250 -15.631 -25.642 1.00 0.00 C ATOM 320 CG1 ILE A 39 -23.308 -14.555 -25.833 1.00 0.00 C ATOM 321 CG2 ILE A 39 -22.054 -15.873 -24.150 1.00 0.00 C ATOM 322 CD1 ILE A 39 -22.746 -13.217 -25.361 1.00 0.00 C ATOM 0 H ILE A 39 -22.072 -15.226 -28.087 1.00 0.00 H new ATOM 0 HA ILE A 39 -20.702 -14.164 -25.917 1.00 0.00 H new ATOM 0 HB ILE A 39 -22.564 -16.561 -26.116 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -23.597 -14.493 -26.882 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -24.206 -14.806 -25.269 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -22.994 -16.206 -23.709 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -21.293 -16.639 -24.003 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -21.736 -14.948 -23.670 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -23.498 -12.439 -25.494 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -22.478 -13.286 -24.307 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -21.860 -12.968 -25.945 1.00 0.00 H new ATOM 323 N LEU A 40 -19.052 -15.832 -24.910 1.00 0.00 N ATOM 324 CA LEU A 40 -17.934 -16.746 -24.546 1.00 0.00 C ATOM 325 C LEU A 40 -17.903 -16.982 -23.036 1.00 0.00 C ATOM 326 O LEU A 40 -17.122 -17.773 -22.547 1.00 0.00 O ATOM 327 CB LEU A 40 -16.606 -16.133 -24.992 1.00 0.00 C ATOM 328 CG LEU A 40 -15.980 -17.014 -26.074 1.00 0.00 C ATOM 329 CD1 LEU A 40 -15.495 -18.322 -25.448 1.00 0.00 C ATOM 330 CD2 LEU A 40 -17.028 -17.322 -27.147 1.00 0.00 C ATOM 0 H LEU A 40 -19.153 -15.005 -24.322 1.00 0.00 H new ATOM 0 HA LEU A 40 -18.087 -17.701 -25.048 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -16.768 -15.126 -25.376 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -15.929 -16.045 -24.142 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.137 -16.492 -26.526 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.049 -18.951 -26.219 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -14.751 -18.105 -24.681 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -16.339 -18.844 -24.997 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -16.584 -17.950 -27.920 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -17.870 -17.845 -26.694 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -17.377 -16.391 -27.593 1.00 0.00 H new ATOM 331 N ASP A 41 -18.737 -16.316 -22.282 1.00 0.00 N ATOM 332 CA ASP A 41 -18.715 -16.542 -20.811 1.00 0.00 C ATOM 333 C ASP A 41 -19.661 -15.572 -20.106 1.00 0.00 C ATOM 334 O ASP A 41 -19.234 -14.603 -19.508 1.00 0.00 O ATOM 335 CB ASP A 41 -17.294 -16.334 -20.285 1.00 0.00 C ATOM 336 CG ASP A 41 -16.935 -17.469 -19.327 1.00 0.00 C ATOM 337 OD1 ASP A 41 -16.623 -18.546 -19.805 1.00 0.00 O ATOM 338 OD2 ASP A 41 -16.984 -17.245 -18.128 1.00 0.00 O ATOM 0 H ASP A 41 -19.421 -15.637 -22.615 1.00 0.00 H new ATOM 0 HA ASP A 41 -19.041 -17.562 -20.609 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -16.588 -16.307 -21.115 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -17.221 -15.375 -19.773 1.00 0.00 H new ATOM 339 N ILE A 42 -20.937 -15.835 -20.141 1.00 0.00 N ATOM 340 CA ILE A 42 -21.890 -14.941 -19.438 1.00 0.00 C ATOM 341 C ILE A 42 -22.011 -15.432 -17.998 1.00 0.00 C ATOM 342 O ILE A 42 -22.241 -16.599 -17.756 1.00 0.00 O ATOM 343 CB ILE A 42 -23.257 -14.992 -20.115 1.00 0.00 C ATOM 344 CG1 ILE A 42 -23.075 -15.091 -21.632 1.00 0.00 C ATOM 345 CG2 ILE A 42 -24.021 -13.717 -19.776 1.00 0.00 C ATOM 346 CD1 ILE A 42 -24.435 -14.951 -22.320 1.00 0.00 C ATOM 0 H ILE A 42 -21.358 -16.628 -20.625 1.00 0.00 H new ATOM 0 HA ILE A 42 -21.532 -13.912 -19.466 1.00 0.00 H new ATOM 0 HB ILE A 42 -23.812 -15.862 -19.764 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -22.398 -14.311 -21.979 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -22.620 -16.047 -21.893 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -25.000 -13.741 -20.254 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -24.147 -13.644 -18.696 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -23.463 -12.852 -20.135 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -24.305 -15.021 -23.400 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -25.098 -15.747 -21.981 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -24.872 -13.984 -22.069 1.00 0.00 H new ATOM 347 N LEU A 43 -21.832 -14.572 -17.038 1.00 0.00 N ATOM 348 CA LEU A 43 -21.914 -15.043 -15.627 1.00 0.00 C ATOM 349 C LEU A 43 -22.658 -14.034 -14.753 1.00 0.00 C ATOM 350 O LEU A 43 -22.513 -12.835 -14.892 1.00 0.00 O ATOM 351 CB LEU A 43 -20.500 -15.246 -15.073 1.00 0.00 C ATOM 352 CG LEU A 43 -19.511 -14.339 -15.811 1.00 0.00 C ATOM 353 CD1 LEU A 43 -18.500 -13.775 -14.813 1.00 0.00 C ATOM 354 CD2 LEU A 43 -18.770 -15.152 -16.876 1.00 0.00 C ATOM 0 H LEU A 43 -21.636 -13.579 -17.163 1.00 0.00 H new ATOM 0 HA LEU A 43 -22.462 -15.985 -15.612 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -20.483 -15.023 -14.006 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -20.203 -16.289 -15.186 1.00 0.00 H new ATOM 0 HG LEU A 43 -20.053 -13.522 -16.287 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -17.795 -13.129 -15.336 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -19.024 -13.199 -14.051 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -17.959 -14.595 -14.340 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -18.066 -14.507 -17.402 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -18.228 -15.968 -16.399 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -19.488 -15.560 -17.587 1.00 0.00 H new ATOM 355 N VAL A 44 -23.445 -14.529 -13.837 1.00 0.00 N ATOM 356 CA VAL A 44 -24.201 -13.635 -12.918 1.00 0.00 C ATOM 357 C VAL A 44 -23.726 -13.885 -11.482 1.00 0.00 C ATOM 358 O VAL A 44 -22.743 -14.563 -11.259 1.00 0.00 O ATOM 359 CB VAL A 44 -25.699 -13.942 -13.034 1.00 0.00 C ATOM 360 CG1 VAL A 44 -26.065 -14.113 -14.510 1.00 0.00 C ATOM 361 CG2 VAL A 44 -26.027 -15.236 -12.279 1.00 0.00 C ATOM 0 H VAL A 44 -23.597 -15.526 -13.686 1.00 0.00 H new ATOM 0 HA VAL A 44 -24.029 -12.591 -13.182 1.00 0.00 H new ATOM 0 HB VAL A 44 -26.269 -13.120 -12.602 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -27.129 -14.332 -14.598 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -25.837 -13.194 -15.050 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -25.489 -14.935 -14.935 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -27.093 -15.448 -12.366 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -25.457 -16.061 -12.706 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -25.765 -15.120 -11.227 1.00 0.00 H new ATOM 362 N SER A 45 -24.410 -13.351 -10.508 1.00 0.00 N ATOM 363 CA SER A 45 -23.983 -13.573 -9.097 1.00 0.00 C ATOM 364 C SER A 45 -25.151 -13.271 -8.156 1.00 0.00 C ATOM 365 O SER A 45 -26.089 -12.587 -8.514 1.00 0.00 O ATOM 366 CB SER A 45 -22.807 -12.653 -8.767 1.00 0.00 C ATOM 367 OG SER A 45 -21.723 -13.433 -8.277 1.00 0.00 O ATOM 0 H SER A 45 -25.242 -12.773 -10.626 1.00 0.00 H new ATOM 0 HA SER A 45 -23.676 -14.611 -8.970 1.00 0.00 H new ATOM 0 HB2 SER A 45 -22.501 -12.102 -9.656 1.00 0.00 H new ATOM 0 HB3 SER A 45 -23.105 -11.915 -8.022 1.00 0.00 H new ATOM 0 HG SER A 45 -20.967 -12.846 -8.066 1.00 0.00 H new ATOM 368 N ARG A 46 -25.104 -13.779 -6.956 1.00 0.00 N ATOM 369 CA ARG A 46 -26.213 -13.522 -5.997 1.00 0.00 C ATOM 370 C ARG A 46 -25.747 -12.528 -4.929 1.00 0.00 C ATOM 371 O ARG A 46 -26.002 -12.701 -3.753 1.00 0.00 O ATOM 372 CB ARG A 46 -26.624 -14.836 -5.330 1.00 0.00 C ATOM 373 CG ARG A 46 -25.425 -15.430 -4.589 1.00 0.00 C ATOM 374 CD ARG A 46 -24.816 -16.558 -5.424 1.00 0.00 C ATOM 375 NE ARG A 46 -23.494 -16.940 -4.851 1.00 0.00 N ATOM 376 CZ ARG A 46 -22.736 -17.802 -5.472 1.00 0.00 C ATOM 377 NH1 ARG A 46 -21.950 -17.404 -6.435 1.00 0.00 N ATOM 378 NH2 ARG A 46 -22.764 -19.061 -5.129 1.00 0.00 N ATOM 0 H ARG A 46 -24.346 -14.360 -6.599 1.00 0.00 H new ATOM 0 HA ARG A 46 -27.066 -13.104 -6.531 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -27.445 -14.662 -4.634 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -26.986 -15.539 -6.080 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -24.679 -14.657 -4.404 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -25.737 -15.811 -3.617 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -25.483 -17.420 -5.433 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -24.697 -16.236 -6.459 1.00 0.00 H new ATOM 0 HE ARG A 46 -23.181 -16.527 -3.972 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -21.928 -16.420 -6.702 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -21.357 -18.077 -6.921 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -23.378 -19.371 -4.376 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -22.172 -19.735 -5.614 1.00 0.00 H new ATOM 379 N SER A 47 -25.067 -11.487 -5.330 1.00 0.00 N ATOM 380 CA SER A 47 -24.586 -10.482 -4.340 1.00 0.00 C ATOM 381 C SER A 47 -25.455 -9.225 -4.429 1.00 0.00 C ATOM 382 O SER A 47 -26.219 -9.052 -5.358 1.00 0.00 O ATOM 383 CB SER A 47 -23.131 -10.121 -4.646 1.00 0.00 C ATOM 384 OG SER A 47 -22.287 -10.693 -3.656 1.00 0.00 O ATOM 0 H SER A 47 -24.824 -11.290 -6.301 1.00 0.00 H new ATOM 0 HA SER A 47 -24.652 -10.899 -3.335 1.00 0.00 H new ATOM 0 HB2 SER A 47 -22.853 -10.489 -5.634 1.00 0.00 H new ATOM 0 HB3 SER A 47 -23.009 -9.038 -4.663 1.00 0.00 H new ATOM 0 HG SER A 47 -21.354 -10.465 -3.850 1.00 0.00 H new ATOM 385 N LEU A 48 -25.345 -8.346 -3.471 1.00 0.00 N ATOM 386 CA LEU A 48 -26.165 -7.102 -3.502 1.00 0.00 C ATOM 387 C LEU A 48 -25.792 -6.280 -4.736 1.00 0.00 C ATOM 388 O LEU A 48 -26.598 -6.076 -5.623 1.00 0.00 O ATOM 389 CB LEU A 48 -25.899 -6.281 -2.239 1.00 0.00 C ATOM 390 CG LEU A 48 -27.220 -6.026 -1.512 1.00 0.00 C ATOM 391 CD1 LEU A 48 -28.098 -5.102 -2.358 1.00 0.00 C ATOM 392 CD2 LEU A 48 -27.944 -7.356 -1.293 1.00 0.00 C ATOM 0 H LEU A 48 -24.723 -8.436 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 48 -27.222 -7.364 -3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -25.208 -6.813 -1.585 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -25.426 -5.334 -2.500 1.00 0.00 H new ATOM 0 HG LEU A 48 -27.021 -5.556 -0.549 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -29.040 -4.920 -1.840 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -27.582 -4.155 -2.517 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -28.298 -5.572 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -28.886 -7.176 -0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -28.144 -7.825 -2.257 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -27.319 -8.016 -0.691 1.00 0.00 H new ATOM 393 N LYS A 49 -24.576 -5.813 -4.806 1.00 0.00 N ATOM 394 CA LYS A 49 -24.156 -5.013 -5.989 1.00 0.00 C ATOM 395 C LYS A 49 -24.171 -5.908 -7.232 1.00 0.00 C ATOM 396 O LYS A 49 -24.059 -5.442 -8.348 1.00 0.00 O ATOM 397 CB LYS A 49 -22.743 -4.469 -5.761 1.00 0.00 C ATOM 398 CG LYS A 49 -22.793 -3.324 -4.745 1.00 0.00 C ATOM 399 CD LYS A 49 -21.405 -2.695 -4.612 1.00 0.00 C ATOM 400 CE LYS A 49 -21.533 -1.293 -4.012 1.00 0.00 C ATOM 401 NZ LYS A 49 -22.251 -0.406 -4.969 1.00 0.00 N ATOM 0 H LYS A 49 -23.857 -5.951 -4.096 1.00 0.00 H new ATOM 0 HA LYS A 49 -24.843 -4.179 -6.133 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -22.091 -5.263 -5.398 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -22.322 -4.116 -6.702 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -23.515 -2.572 -5.064 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -23.128 -3.697 -3.777 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.772 -3.316 -3.978 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.924 -2.641 -5.589 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -22.073 -1.339 -3.067 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -20.545 -0.887 -3.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -21.909 0.570 -4.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -22.074 -0.729 -5.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -23.272 -0.439 -4.773 1.00 0.00 H new ATOM 402 N MET A 50 -24.312 -7.193 -7.041 1.00 0.00 N ATOM 403 CA MET A 50 -24.341 -8.127 -8.202 1.00 0.00 C ATOM 404 C MET A 50 -25.678 -8.872 -8.202 1.00 0.00 C ATOM 405 O MET A 50 -25.725 -10.085 -8.266 1.00 0.00 O ATOM 406 CB MET A 50 -23.197 -9.139 -8.060 1.00 0.00 C ATOM 407 CG MET A 50 -22.301 -9.125 -9.307 1.00 0.00 C ATOM 408 SD MET A 50 -23.302 -9.098 -10.821 1.00 0.00 S ATOM 409 CE MET A 50 -24.392 -10.492 -10.436 1.00 0.00 C ATOM 0 H MET A 50 -24.409 -7.636 -6.127 1.00 0.00 H new ATOM 0 HA MET A 50 -24.225 -7.572 -9.133 1.00 0.00 H new ATOM 0 HB2 MET A 50 -22.603 -8.902 -7.177 1.00 0.00 H new ATOM 0 HB3 MET A 50 -23.606 -10.138 -7.911 1.00 0.00 H new ATOM 0 HG2 MET A 50 -21.649 -8.252 -9.282 1.00 0.00 H new ATOM 0 HG3 MET A 50 -21.657 -10.004 -9.307 1.00 0.00 H new ATOM 0 HE1 MET A 50 -24.201 -11.307 -11.135 1.00 0.00 H new ATOM 0 HE2 MET A 50 -24.200 -10.834 -9.419 1.00 0.00 H new ATOM 0 HE3 MET A 50 -25.432 -10.176 -10.522 1.00 0.00 H new ATOM 410 N ARG A 51 -26.770 -8.158 -8.112 1.00 0.00 N ATOM 411 CA ARG A 51 -28.101 -8.828 -8.090 1.00 0.00 C ATOM 412 C ARG A 51 -28.681 -8.902 -9.504 1.00 0.00 C ATOM 413 O ARG A 51 -28.967 -7.897 -10.124 1.00 0.00 O ATOM 414 CB ARG A 51 -29.054 -8.034 -7.194 1.00 0.00 C ATOM 415 CG ARG A 51 -29.698 -8.974 -6.174 1.00 0.00 C ATOM 416 CD ARG A 51 -29.843 -8.253 -4.833 1.00 0.00 C ATOM 417 NE ARG A 51 -30.556 -9.138 -3.870 1.00 0.00 N ATOM 418 CZ ARG A 51 -30.277 -10.411 -3.826 1.00 0.00 C ATOM 419 NH1 ARG A 51 -29.056 -10.801 -3.584 1.00 0.00 N ATOM 420 NH2 ARG A 51 -31.216 -11.294 -4.026 1.00 0.00 N ATOM 0 H ARG A 51 -26.796 -7.140 -8.053 1.00 0.00 H new ATOM 0 HA ARG A 51 -27.981 -9.839 -7.702 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -28.511 -7.240 -6.681 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -29.824 -7.554 -7.799 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -30.675 -9.300 -6.531 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -29.088 -9.869 -6.053 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -28.861 -7.988 -4.442 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -30.395 -7.322 -4.966 1.00 0.00 H new ATOM 0 HE ARG A 51 -31.262 -8.748 -3.245 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -28.321 -10.111 -3.430 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -28.836 -11.796 -3.549 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -32.170 -10.989 -4.217 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -30.996 -12.289 -3.991 1.00 0.00 H new ATOM 421 N GLY A 52 -28.864 -10.091 -10.011 1.00 0.00 N ATOM 422 CA GLY A 52 -29.436 -10.244 -11.379 1.00 0.00 C ATOM 423 C GLY A 52 -28.523 -9.581 -12.409 1.00 0.00 C ATOM 424 O GLY A 52 -28.893 -9.397 -13.551 1.00 0.00 O ATOM 0 H GLY A 52 -28.641 -10.965 -9.535 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -29.555 -11.301 -11.615 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -30.428 -9.794 -11.419 1.00 0.00 H new ATOM 425 N GLN A 53 -27.332 -9.230 -12.021 1.00 0.00 N ATOM 426 CA GLN A 53 -26.397 -8.590 -12.986 1.00 0.00 C ATOM 427 C GLN A 53 -25.488 -9.662 -13.578 1.00 0.00 C ATOM 428 O GLN A 53 -25.226 -10.674 -12.963 1.00 0.00 O ATOM 429 CB GLN A 53 -25.545 -7.550 -12.262 1.00 0.00 C ATOM 430 CG GLN A 53 -26.239 -6.187 -12.308 1.00 0.00 C ATOM 431 CD GLN A 53 -25.826 -5.368 -11.083 1.00 0.00 C ATOM 432 OE1 GLN A 53 -26.053 -5.776 -9.961 1.00 0.00 O ATOM 433 NE2 GLN A 53 -25.223 -4.222 -11.250 1.00 0.00 N ATOM 0 H GLN A 53 -26.964 -9.358 -11.078 1.00 0.00 H new ATOM 0 HA GLN A 53 -26.964 -8.102 -13.779 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -25.387 -7.853 -11.227 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -24.562 -7.484 -12.728 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -25.967 -5.658 -13.222 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -27.321 -6.317 -12.325 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -25.032 -3.879 -12.191 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -24.943 -3.670 -10.439 1.00 0.00 H new ATOM 434 N ALA A 54 -25.002 -9.457 -14.770 1.00 0.00 N ATOM 435 CA ALA A 54 -24.113 -10.484 -15.376 1.00 0.00 C ATOM 436 C ALA A 54 -23.151 -9.832 -16.375 1.00 0.00 C ATOM 437 O ALA A 54 -23.457 -8.827 -16.984 1.00 0.00 O ATOM 438 CB ALA A 54 -24.963 -11.532 -16.097 1.00 0.00 C ATOM 0 H ALA A 54 -25.179 -8.633 -15.344 1.00 0.00 H new ATOM 0 HA ALA A 54 -23.533 -10.960 -14.586 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -24.312 -12.285 -16.541 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -25.635 -12.009 -15.384 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -25.548 -11.050 -16.880 1.00 0.00 H new ATOM 439 N PHE A 55 -21.990 -10.407 -16.552 1.00 0.00 N ATOM 440 CA PHE A 55 -21.005 -9.833 -17.515 1.00 0.00 C ATOM 441 C PHE A 55 -20.930 -10.733 -18.754 1.00 0.00 C ATOM 442 O PHE A 55 -20.814 -11.939 -18.645 1.00 0.00 O ATOM 443 CB PHE A 55 -19.616 -9.758 -16.865 1.00 0.00 C ATOM 444 CG PHE A 55 -19.749 -9.631 -15.366 1.00 0.00 C ATOM 445 CD1 PHE A 55 -19.875 -8.365 -14.778 1.00 0.00 C ATOM 446 CD2 PHE A 55 -19.748 -10.780 -14.563 1.00 0.00 C ATOM 447 CE1 PHE A 55 -19.999 -8.250 -13.389 1.00 0.00 C ATOM 448 CE2 PHE A 55 -19.873 -10.663 -13.178 1.00 0.00 C ATOM 449 CZ PHE A 55 -19.999 -9.399 -12.588 1.00 0.00 C ATOM 0 H PHE A 55 -21.681 -11.251 -16.070 1.00 0.00 H new ATOM 0 HA PHE A 55 -21.324 -8.830 -17.798 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -19.042 -10.651 -17.112 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -19.066 -8.905 -17.262 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -19.876 -7.479 -15.396 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -19.651 -11.756 -15.016 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -20.095 -7.275 -12.934 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -19.873 -11.549 -12.560 1.00 0.00 H new ATOM 0 HZ PHE A 55 -20.096 -9.310 -11.516 1.00 0.00 H new ATOM 450 N VAL A 56 -20.993 -10.162 -19.930 1.00 0.00 N ATOM 451 CA VAL A 56 -20.920 -10.999 -21.164 1.00 0.00 C ATOM 452 C VAL A 56 -19.482 -11.034 -21.681 1.00 0.00 C ATOM 453 O VAL A 56 -18.990 -10.061 -22.217 1.00 0.00 O ATOM 454 CB VAL A 56 -21.799 -10.404 -22.264 1.00 0.00 C ATOM 455 CG1 VAL A 56 -21.898 -11.394 -23.428 1.00 0.00 C ATOM 456 CG2 VAL A 56 -23.192 -10.135 -21.715 1.00 0.00 C ATOM 0 H VAL A 56 -21.091 -9.159 -20.088 1.00 0.00 H new ATOM 0 HA VAL A 56 -21.263 -12.003 -20.914 1.00 0.00 H new ATOM 0 HB VAL A 56 -21.358 -9.470 -22.612 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -22.525 -10.971 -24.213 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -20.902 -11.590 -23.825 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -22.338 -12.327 -23.076 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -23.817 -9.711 -22.501 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -23.632 -11.069 -21.366 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -23.126 -9.432 -20.885 1.00 0.00 H new ATOM 457 N ILE A 57 -18.807 -12.144 -21.548 1.00 0.00 N ATOM 458 CA ILE A 57 -17.411 -12.221 -22.064 1.00 0.00 C ATOM 459 C ILE A 57 -17.463 -12.638 -23.535 1.00 0.00 C ATOM 460 O ILE A 57 -17.598 -13.802 -23.855 1.00 0.00 O ATOM 461 CB ILE A 57 -16.619 -13.251 -21.257 1.00 0.00 C ATOM 462 CG1 ILE A 57 -16.792 -12.960 -19.766 1.00 0.00 C ATOM 463 CG2 ILE A 57 -15.137 -13.151 -21.619 1.00 0.00 C ATOM 464 CD1 ILE A 57 -16.241 -11.568 -19.461 1.00 0.00 C ATOM 0 H ILE A 57 -19.159 -12.994 -21.108 1.00 0.00 H new ATOM 0 HA ILE A 57 -16.920 -11.252 -21.969 1.00 0.00 H new ATOM 0 HB ILE A 57 -16.984 -14.253 -21.484 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -17.845 -13.016 -19.492 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -16.268 -13.710 -19.173 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -14.572 -13.885 -21.044 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -15.008 -13.347 -22.684 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -14.773 -12.150 -21.388 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -16.361 -11.354 -18.399 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -15.183 -11.530 -19.721 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -16.785 -10.825 -20.045 1.00 0.00 H new ATOM 465 N PHE A 58 -17.378 -11.695 -24.435 1.00 0.00 N ATOM 466 CA PHE A 58 -17.449 -12.038 -25.886 1.00 0.00 C ATOM 467 C PHE A 58 -16.096 -12.542 -26.381 1.00 0.00 C ATOM 468 O PHE A 58 -15.058 -12.018 -26.028 1.00 0.00 O ATOM 469 CB PHE A 58 -17.833 -10.793 -26.685 1.00 0.00 C ATOM 470 CG PHE A 58 -19.301 -10.503 -26.506 1.00 0.00 C ATOM 471 CD1 PHE A 58 -19.734 -9.711 -25.436 1.00 0.00 C ATOM 472 CD2 PHE A 58 -20.229 -11.023 -27.414 1.00 0.00 C ATOM 473 CE1 PHE A 58 -21.098 -9.442 -25.274 1.00 0.00 C ATOM 474 CE2 PHE A 58 -21.592 -10.755 -27.252 1.00 0.00 C ATOM 475 CZ PHE A 58 -22.026 -9.964 -26.182 1.00 0.00 C ATOM 0 H PHE A 58 -17.263 -10.703 -24.229 1.00 0.00 H new ATOM 0 HA PHE A 58 -18.196 -12.820 -26.023 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -17.241 -9.940 -26.353 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.609 -10.944 -27.741 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -19.017 -9.308 -24.736 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -19.893 -11.632 -28.240 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -21.434 -8.832 -24.449 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -22.309 -11.158 -27.952 1.00 0.00 H new ATOM 0 HZ PHE A 58 -23.078 -9.756 -26.057 1.00 0.00 H new ATOM 476 N LYS A 59 -16.100 -13.543 -27.220 1.00 0.00 N ATOM 477 CA LYS A 59 -14.813 -14.061 -27.757 1.00 0.00 C ATOM 478 C LYS A 59 -14.052 -12.901 -28.401 1.00 0.00 C ATOM 479 O LYS A 59 -12.844 -12.929 -28.531 1.00 0.00 O ATOM 480 CB LYS A 59 -15.094 -15.136 -28.810 1.00 0.00 C ATOM 481 CG LYS A 59 -13.909 -16.100 -28.885 1.00 0.00 C ATOM 482 CD LYS A 59 -14.371 -17.436 -29.471 1.00 0.00 C ATOM 483 CE LYS A 59 -13.330 -17.941 -30.471 1.00 0.00 C ATOM 484 NZ LYS A 59 -12.165 -18.504 -29.733 1.00 0.00 N ATOM 0 H LYS A 59 -16.936 -14.021 -27.554 1.00 0.00 H new ATOM 0 HA LYS A 59 -14.220 -14.496 -26.952 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -16.003 -15.680 -28.555 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.261 -14.673 -29.782 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.119 -15.674 -29.503 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -13.488 -16.253 -27.891 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -14.510 -18.166 -28.674 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.336 -17.315 -29.964 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -13.769 -18.703 -31.115 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -13.005 -17.126 -31.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.457 -18.848 -30.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -11.742 -17.765 -29.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -12.482 -19.293 -29.134 1.00 0.00 H new ATOM 485 N GLU A 60 -14.759 -11.878 -28.802 1.00 0.00 N ATOM 486 CA GLU A 60 -14.095 -10.705 -29.438 1.00 0.00 C ATOM 487 C GLU A 60 -14.614 -9.418 -28.790 1.00 0.00 C ATOM 488 O GLU A 60 -15.732 -9.357 -28.318 1.00 0.00 O ATOM 489 CB GLU A 60 -14.412 -10.693 -30.936 1.00 0.00 C ATOM 490 CG GLU A 60 -14.488 -12.132 -31.449 1.00 0.00 C ATOM 491 CD GLU A 60 -14.830 -12.126 -32.940 1.00 0.00 C ATOM 492 OE1 GLU A 60 -14.247 -11.330 -33.658 1.00 0.00 O ATOM 493 OE2 GLU A 60 -15.669 -12.917 -33.338 1.00 0.00 O ATOM 0 H GLU A 60 -15.773 -11.805 -28.715 1.00 0.00 H new ATOM 0 HA GLU A 60 -13.016 -10.772 -29.298 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -15.357 -10.181 -31.115 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.643 -10.142 -31.478 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.537 -12.638 -31.286 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -15.244 -12.688 -30.894 1.00 0.00 H new ATOM 494 N VAL A 61 -13.809 -8.391 -28.758 1.00 0.00 N ATOM 495 CA VAL A 61 -14.252 -7.111 -28.135 1.00 0.00 C ATOM 496 C VAL A 61 -15.336 -6.457 -28.997 1.00 0.00 C ATOM 497 O VAL A 61 -16.294 -5.905 -28.494 1.00 0.00 O ATOM 498 CB VAL A 61 -13.056 -6.164 -28.019 1.00 0.00 C ATOM 499 CG1 VAL A 61 -13.328 -5.127 -26.928 1.00 0.00 C ATOM 500 CG2 VAL A 61 -11.803 -6.966 -27.657 1.00 0.00 C ATOM 0 H VAL A 61 -12.862 -8.383 -29.137 1.00 0.00 H new ATOM 0 HA VAL A 61 -14.658 -7.316 -27.145 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.902 -5.657 -28.972 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.475 -4.453 -26.846 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.220 -4.555 -27.184 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.483 -5.633 -25.975 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -10.951 -6.292 -27.574 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.958 -7.473 -26.705 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -11.607 -7.705 -28.434 1.00 0.00 H new ATOM 501 N SER A 62 -15.190 -6.507 -30.293 1.00 0.00 N ATOM 502 CA SER A 62 -16.208 -5.882 -31.185 1.00 0.00 C ATOM 503 C SER A 62 -17.570 -6.549 -30.969 1.00 0.00 C ATOM 504 O SER A 62 -18.605 -5.958 -31.205 1.00 0.00 O ATOM 505 CB SER A 62 -15.775 -6.050 -32.644 1.00 0.00 C ATOM 506 OG SER A 62 -16.603 -7.018 -33.279 1.00 0.00 O ATOM 0 H SER A 62 -14.409 -6.954 -30.773 1.00 0.00 H new ATOM 0 HA SER A 62 -16.292 -4.821 -30.950 1.00 0.00 H new ATOM 0 HB2 SER A 62 -15.846 -5.096 -33.167 1.00 0.00 H new ATOM 0 HB3 SER A 62 -14.732 -6.362 -32.691 1.00 0.00 H new ATOM 0 HG SER A 62 -16.326 -7.123 -34.213 1.00 0.00 H new ATOM 507 N SER A 63 -17.580 -7.776 -30.530 1.00 0.00 N ATOM 508 CA SER A 63 -18.875 -8.480 -30.309 1.00 0.00 C ATOM 509 C SER A 63 -19.564 -7.921 -29.059 1.00 0.00 C ATOM 510 O SER A 63 -20.774 -7.969 -28.929 1.00 0.00 O ATOM 511 CB SER A 63 -18.613 -9.974 -30.124 1.00 0.00 C ATOM 512 OG SER A 63 -18.147 -10.521 -31.350 1.00 0.00 O ATOM 0 H SER A 63 -16.747 -8.323 -30.314 1.00 0.00 H new ATOM 0 HA SER A 63 -19.522 -8.326 -31.172 1.00 0.00 H new ATOM 0 HB2 SER A 63 -17.875 -10.131 -29.338 1.00 0.00 H new ATOM 0 HB3 SER A 63 -19.526 -10.480 -29.810 1.00 0.00 H new ATOM 0 HG SER A 63 -17.825 -11.434 -31.199 1.00 0.00 H new ATOM 513 N ALA A 64 -18.808 -7.383 -28.141 1.00 0.00 N ATOM 514 CA ALA A 64 -19.423 -6.820 -26.912 1.00 0.00 C ATOM 515 C ALA A 64 -20.165 -5.554 -27.278 1.00 0.00 C ATOM 516 O ALA A 64 -21.188 -5.244 -26.726 1.00 0.00 O ATOM 517 CB ALA A 64 -18.333 -6.461 -25.901 1.00 0.00 C ATOM 0 H ALA A 64 -17.792 -7.310 -28.192 1.00 0.00 H new ATOM 0 HA ALA A 64 -20.099 -7.556 -26.478 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -18.792 -6.049 -25.002 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -17.768 -7.356 -25.642 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -17.661 -5.722 -26.337 1.00 0.00 H new ATOM 518 N THR A 65 -19.629 -4.816 -28.197 1.00 0.00 N ATOM 519 CA THR A 65 -20.253 -3.548 -28.610 1.00 0.00 C ATOM 520 C THR A 65 -21.567 -3.810 -29.346 1.00 0.00 C ATOM 521 O THR A 65 -22.486 -3.022 -29.288 1.00 0.00 O ATOM 522 CB THR A 65 -19.283 -2.838 -29.541 1.00 0.00 C ATOM 523 OG1 THR A 65 -18.198 -2.317 -28.789 1.00 0.00 O ATOM 524 CG2 THR A 65 -19.996 -1.708 -30.267 1.00 0.00 C ATOM 0 H THR A 65 -18.765 -5.046 -28.688 1.00 0.00 H new ATOM 0 HA THR A 65 -20.471 -2.938 -27.733 1.00 0.00 H new ATOM 0 HB THR A 65 -18.905 -3.549 -30.276 1.00 0.00 H new ATOM 0 HG1 THR A 65 -18.543 -1.805 -28.028 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.295 -1.204 -30.932 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.822 -2.115 -30.851 1.00 0.00 H new ATOM 0 HG23 THR A 65 -20.383 -0.995 -29.539 1.00 0.00 H new ATOM 525 N ASN A 66 -21.655 -4.895 -30.053 1.00 0.00 N ATOM 526 CA ASN A 66 -22.905 -5.188 -30.803 1.00 0.00 C ATOM 527 C ASN A 66 -24.007 -5.593 -29.827 1.00 0.00 C ATOM 528 O ASN A 66 -25.154 -5.224 -29.981 1.00 0.00 O ATOM 529 CB ASN A 66 -22.646 -6.335 -31.771 1.00 0.00 C ATOM 530 CG ASN A 66 -22.036 -5.790 -33.063 1.00 0.00 C ATOM 531 OD1 ASN A 66 -21.161 -4.823 -32.999 1.00 0.00 O flip ATOM 532 ND2 ASN A 66 -22.356 -6.248 -34.141 1.00 0.00 N flip ATOM 0 H ASN A 66 -20.917 -5.593 -30.146 1.00 0.00 H new ATOM 0 HA ASN A 66 -23.217 -4.300 -31.352 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -21.972 -7.062 -31.317 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -23.578 -6.857 -31.989 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -23.039 -7.003 -34.192 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -21.941 -5.877 -34.996 1.00 0.00 H new ATOM 533 N ALA A 67 -23.671 -6.358 -28.829 1.00 0.00 N ATOM 534 CA ALA A 67 -24.707 -6.797 -27.850 1.00 0.00 C ATOM 535 C ALA A 67 -25.047 -5.657 -26.901 1.00 0.00 C ATOM 536 O ALA A 67 -26.154 -5.522 -26.428 1.00 0.00 O ATOM 537 CB ALA A 67 -24.154 -7.947 -27.012 1.00 0.00 C ATOM 0 H ALA A 67 -22.727 -6.699 -28.647 1.00 0.00 H new ATOM 0 HA ALA A 67 -25.596 -7.106 -28.400 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.909 -8.271 -26.295 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -23.893 -8.780 -27.665 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -23.265 -7.613 -26.477 1.00 0.00 H new ATOM 538 N LEU A 68 -24.070 -4.873 -26.596 1.00 0.00 N ATOM 539 CA LEU A 68 -24.235 -3.750 -25.639 1.00 0.00 C ATOM 540 C LEU A 68 -24.967 -2.580 -26.302 1.00 0.00 C ATOM 541 O LEU A 68 -25.710 -1.860 -25.666 1.00 0.00 O ATOM 542 CB LEU A 68 -22.806 -3.392 -25.194 1.00 0.00 C ATOM 543 CG LEU A 68 -22.571 -1.913 -24.889 1.00 0.00 C ATOM 544 CD1 LEU A 68 -22.783 -1.052 -26.134 1.00 0.00 C ATOM 545 CD2 LEU A 68 -23.454 -1.428 -23.756 1.00 0.00 C ATOM 0 H LEU A 68 -23.129 -4.962 -26.980 1.00 0.00 H new ATOM 0 HA LEU A 68 -24.849 -4.013 -24.777 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -22.563 -3.973 -24.304 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -22.111 -3.700 -25.975 1.00 0.00 H new ATOM 0 HG LEU A 68 -21.533 -1.813 -24.572 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -22.609 -0.005 -25.886 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -22.086 -1.361 -26.913 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -23.805 -1.175 -26.492 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -23.258 -0.372 -23.568 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -24.501 -1.560 -24.029 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -23.238 -2.003 -22.855 1.00 0.00 H new ATOM 546 N ARG A 69 -24.750 -2.374 -27.570 1.00 0.00 N ATOM 547 CA ARG A 69 -25.419 -1.236 -28.266 1.00 0.00 C ATOM 548 C ARG A 69 -26.711 -1.693 -28.954 1.00 0.00 C ATOM 549 O ARG A 69 -27.543 -0.884 -29.318 1.00 0.00 O ATOM 550 CB ARG A 69 -24.468 -0.664 -29.320 1.00 0.00 C ATOM 551 CG ARG A 69 -24.322 -1.663 -30.470 1.00 0.00 C ATOM 552 CD ARG A 69 -25.180 -1.212 -31.654 1.00 0.00 C ATOM 553 NE ARG A 69 -24.756 0.150 -32.084 1.00 0.00 N ATOM 554 CZ ARG A 69 -23.489 0.464 -32.103 1.00 0.00 C ATOM 555 NH1 ARG A 69 -22.660 -0.204 -32.859 1.00 0.00 N ATOM 556 NH2 ARG A 69 -23.050 1.445 -31.363 1.00 0.00 N ATOM 0 H ARG A 69 -24.139 -2.943 -28.156 1.00 0.00 H new ATOM 0 HA ARG A 69 -25.670 -0.477 -27.525 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -24.852 0.285 -29.695 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -23.494 -0.461 -28.875 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -23.277 -1.735 -30.772 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -24.629 -2.657 -30.143 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -25.076 -1.915 -32.481 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -26.233 -1.205 -31.372 1.00 0.00 H new ATOM 0 HE ARG A 69 -25.456 0.837 -32.364 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -23.002 -0.972 -33.436 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.670 0.043 -32.873 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -23.697 1.966 -30.770 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -22.060 1.691 -31.377 1.00 0.00 H new ATOM 557 N SER A 70 -26.887 -2.970 -29.156 1.00 0.00 N ATOM 558 CA SER A 70 -28.125 -3.446 -29.843 1.00 0.00 C ATOM 559 C SER A 70 -29.242 -3.689 -28.827 1.00 0.00 C ATOM 560 O SER A 70 -30.244 -3.003 -28.814 1.00 0.00 O ATOM 561 CB SER A 70 -27.827 -4.749 -30.580 1.00 0.00 C ATOM 562 OG SER A 70 -28.823 -4.968 -31.569 1.00 0.00 O ATOM 0 H SER A 70 -26.233 -3.702 -28.878 1.00 0.00 H new ATOM 0 HA SER A 70 -28.449 -2.682 -30.550 1.00 0.00 H new ATOM 0 HB2 SER A 70 -26.842 -4.700 -31.044 1.00 0.00 H new ATOM 0 HB3 SER A 70 -27.807 -5.582 -29.877 1.00 0.00 H new ATOM 0 HG SER A 70 -28.403 -5.008 -32.453 1.00 0.00 H new ATOM 563 N MET A 71 -29.081 -4.667 -27.982 1.00 0.00 N ATOM 564 CA MET A 71 -30.135 -4.965 -26.973 1.00 0.00 C ATOM 565 C MET A 71 -30.409 -3.713 -26.141 1.00 0.00 C ATOM 566 O MET A 71 -31.416 -3.617 -25.471 1.00 0.00 O ATOM 567 CB MET A 71 -29.667 -6.100 -26.057 1.00 0.00 C ATOM 568 CG MET A 71 -29.014 -7.201 -26.895 1.00 0.00 C ATOM 569 SD MET A 71 -29.517 -8.821 -26.262 1.00 0.00 S ATOM 570 CE MET A 71 -31.231 -8.772 -26.843 1.00 0.00 C ATOM 0 H MET A 71 -28.263 -5.275 -27.946 1.00 0.00 H new ATOM 0 HA MET A 71 -31.049 -5.270 -27.483 1.00 0.00 H new ATOM 0 HB2 MET A 71 -28.957 -5.719 -25.323 1.00 0.00 H new ATOM 0 HB3 MET A 71 -30.513 -6.505 -25.502 1.00 0.00 H new ATOM 0 HG2 MET A 71 -29.308 -7.100 -27.940 1.00 0.00 H new ATOM 0 HG3 MET A 71 -27.929 -7.105 -26.858 1.00 0.00 H new ATOM 0 HE1 MET A 71 -31.900 -9.044 -26.026 1.00 0.00 H new ATOM 0 HE2 MET A 71 -31.470 -7.766 -27.188 1.00 0.00 H new ATOM 0 HE3 MET A 71 -31.357 -9.477 -27.665 1.00 0.00 H new ATOM 571 N GLN A 72 -29.520 -2.755 -26.184 1.00 0.00 N ATOM 572 CA GLN A 72 -29.722 -1.499 -25.405 1.00 0.00 C ATOM 573 C GLN A 72 -31.201 -1.109 -25.439 1.00 0.00 C ATOM 574 O GLN A 72 -31.669 -0.488 -26.373 1.00 0.00 O ATOM 575 CB GLN A 72 -28.888 -0.386 -26.036 1.00 0.00 C ATOM 576 CG GLN A 72 -28.804 0.797 -25.071 1.00 0.00 C ATOM 577 CD GLN A 72 -27.355 0.984 -24.624 1.00 0.00 C ATOM 578 OE1 GLN A 72 -26.656 -0.058 -24.267 1.00 0.00 O flip ATOM 579 NE2 GLN A 72 -26.851 2.090 -24.603 1.00 0.00 N flip ATOM 0 H GLN A 72 -28.658 -2.790 -26.729 1.00 0.00 H new ATOM 0 HA GLN A 72 -29.414 -1.652 -24.371 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -27.888 -0.753 -26.267 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -29.337 -0.070 -26.978 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -29.166 1.703 -25.556 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -29.443 0.621 -24.206 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -27.397 2.905 -24.882 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -25.882 2.203 -24.306 1.00 0.00 H new ATOM 580 N GLY A 73 -31.942 -1.483 -24.434 1.00 0.00 N ATOM 581 CA GLY A 73 -33.394 -1.150 -24.413 1.00 0.00 C ATOM 582 C GLY A 73 -34.169 -2.276 -25.099 1.00 0.00 C ATOM 583 O GLY A 73 -35.078 -2.039 -25.869 1.00 0.00 O ATOM 0 H GLY A 73 -31.605 -2.005 -23.625 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -33.738 -1.027 -23.386 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -33.571 -0.204 -24.924 1.00 0.00 H new ATOM 584 N PHE A 74 -33.811 -3.501 -24.825 1.00 0.00 N ATOM 585 CA PHE A 74 -34.520 -4.647 -25.462 1.00 0.00 C ATOM 586 C PHE A 74 -35.474 -5.289 -24.448 1.00 0.00 C ATOM 587 O PHE A 74 -35.349 -5.075 -23.259 1.00 0.00 O ATOM 588 CB PHE A 74 -33.500 -5.689 -25.925 1.00 0.00 C ATOM 589 CG PHE A 74 -33.542 -5.793 -27.430 1.00 0.00 C ATOM 590 CD1 PHE A 74 -33.625 -4.633 -28.210 1.00 0.00 C ATOM 591 CD2 PHE A 74 -33.498 -7.049 -28.048 1.00 0.00 C ATOM 592 CE1 PHE A 74 -33.666 -4.729 -29.606 1.00 0.00 C ATOM 593 CE2 PHE A 74 -33.539 -7.144 -29.444 1.00 0.00 C ATOM 594 CZ PHE A 74 -33.623 -5.985 -30.223 1.00 0.00 C ATOM 0 H PHE A 74 -33.058 -3.758 -24.187 1.00 0.00 H new ATOM 0 HA PHE A 74 -35.087 -4.286 -26.320 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -32.500 -5.407 -25.596 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -33.722 -6.657 -25.476 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -33.657 -3.664 -27.734 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -33.432 -7.944 -27.448 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -33.731 -3.834 -30.207 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -33.506 -8.113 -29.920 1.00 0.00 H new ATOM 0 HZ PHE A 74 -33.655 -6.059 -31.300 1.00 0.00 H new ATOM 595 N PRO A 75 -36.397 -6.065 -24.956 1.00 0.00 N ATOM 596 CA PRO A 75 -37.391 -6.766 -24.124 1.00 0.00 C ATOM 597 C PRO A 75 -36.759 -8.001 -23.476 1.00 0.00 C ATOM 598 O PRO A 75 -36.754 -9.078 -24.040 1.00 0.00 O ATOM 599 CB PRO A 75 -38.479 -7.164 -25.125 1.00 0.00 C ATOM 600 CG PRO A 75 -37.804 -7.181 -26.519 1.00 0.00 C ATOM 601 CD PRO A 75 -36.535 -6.316 -26.406 1.00 0.00 C ATOM 0 HA PRO A 75 -37.778 -6.158 -23.306 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -38.892 -8.143 -24.881 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -39.306 -6.454 -25.102 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -37.553 -8.200 -26.815 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -38.476 -6.784 -27.280 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -35.663 -6.834 -26.806 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -36.636 -5.385 -26.964 1.00 0.00 H new ATOM 602 N PHE A 76 -36.221 -7.850 -22.297 1.00 0.00 N ATOM 603 CA PHE A 76 -35.582 -9.007 -21.615 1.00 0.00 C ATOM 604 C PHE A 76 -36.044 -9.070 -20.156 1.00 0.00 C ATOM 605 O PHE A 76 -35.772 -8.186 -19.370 1.00 0.00 O ATOM 606 CB PHE A 76 -34.063 -8.840 -21.662 1.00 0.00 C ATOM 607 CG PHE A 76 -33.417 -10.196 -21.777 1.00 0.00 C ATOM 608 CD1 PHE A 76 -33.554 -10.939 -22.955 1.00 0.00 C ATOM 609 CD2 PHE A 76 -32.685 -10.714 -20.703 1.00 0.00 C ATOM 610 CE1 PHE A 76 -32.957 -12.199 -23.060 1.00 0.00 C ATOM 611 CE2 PHE A 76 -32.088 -11.973 -20.807 1.00 0.00 C ATOM 612 CZ PHE A 76 -32.224 -12.716 -21.986 1.00 0.00 C ATOM 0 H PHE A 76 -36.197 -6.973 -21.777 1.00 0.00 H new ATOM 0 HA PHE A 76 -35.868 -9.930 -22.120 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -33.780 -8.216 -22.510 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -33.713 -8.333 -20.763 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -34.121 -10.539 -23.783 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -32.581 -10.141 -19.794 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -33.062 -12.773 -23.969 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -31.522 -12.373 -19.979 1.00 0.00 H new ATOM 0 HZ PHE A 76 -31.763 -13.689 -22.067 1.00 0.00 H new ATOM 613 N TYR A 77 -36.735 -10.115 -19.795 1.00 0.00 N ATOM 614 CA TYR A 77 -37.218 -10.259 -18.391 1.00 0.00 C ATOM 615 C TYR A 77 -38.217 -9.146 -18.060 1.00 0.00 C ATOM 616 O TYR A 77 -38.394 -8.780 -16.914 1.00 0.00 O ATOM 617 CB TYR A 77 -36.032 -10.200 -17.424 1.00 0.00 C ATOM 618 CG TYR A 77 -35.255 -11.486 -17.535 1.00 0.00 C ATOM 619 CD1 TYR A 77 -34.741 -11.885 -18.771 1.00 0.00 C ATOM 620 CD2 TYR A 77 -35.057 -12.281 -16.403 1.00 0.00 C ATOM 621 CE1 TYR A 77 -34.025 -13.081 -18.877 1.00 0.00 C ATOM 622 CE2 TYR A 77 -34.341 -13.479 -16.506 1.00 0.00 C ATOM 623 CZ TYR A 77 -33.824 -13.880 -17.745 1.00 0.00 C ATOM 624 OH TYR A 77 -33.117 -15.062 -17.850 1.00 0.00 O ATOM 0 H TYR A 77 -36.988 -10.883 -20.417 1.00 0.00 H new ATOM 0 HA TYR A 77 -37.717 -11.223 -18.286 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -35.392 -9.350 -17.662 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -36.384 -10.058 -16.402 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -34.897 -11.270 -19.645 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -35.456 -11.971 -15.449 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -33.627 -13.389 -19.833 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -34.187 -14.094 -15.631 1.00 0.00 H new ATOM 0 HH TYR A 77 -32.289 -14.904 -18.349 1.00 0.00 H new ATOM 625 N ASP A 78 -38.882 -8.614 -19.053 1.00 0.00 N ATOM 626 CA ASP A 78 -39.884 -7.540 -18.796 1.00 0.00 C ATOM 627 C ASP A 78 -39.184 -6.202 -18.543 1.00 0.00 C ATOM 628 O ASP A 78 -39.804 -5.237 -18.142 1.00 0.00 O ATOM 629 CB ASP A 78 -40.717 -7.911 -17.567 1.00 0.00 C ATOM 630 CG ASP A 78 -42.202 -7.719 -17.877 1.00 0.00 C ATOM 631 OD1 ASP A 78 -42.589 -6.597 -18.161 1.00 0.00 O ATOM 632 OD2 ASP A 78 -42.929 -8.699 -17.826 1.00 0.00 O ATOM 0 H ASP A 78 -38.773 -8.878 -20.032 1.00 0.00 H new ATOM 0 HA ASP A 78 -40.527 -7.442 -19.671 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -40.525 -8.946 -17.284 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -40.429 -7.290 -16.719 1.00 0.00 H new ATOM 633 N LYS A 79 -37.904 -6.133 -18.767 1.00 0.00 N ATOM 634 CA LYS A 79 -37.181 -4.850 -18.530 1.00 0.00 C ATOM 635 C LYS A 79 -36.278 -4.541 -19.729 1.00 0.00 C ATOM 636 O LYS A 79 -35.957 -5.421 -20.502 1.00 0.00 O ATOM 637 CB LYS A 79 -36.331 -4.981 -17.266 1.00 0.00 C ATOM 638 CG LYS A 79 -37.181 -5.580 -16.142 1.00 0.00 C ATOM 639 CD LYS A 79 -36.712 -5.029 -14.794 1.00 0.00 C ATOM 640 CE LYS A 79 -37.928 -4.676 -13.935 1.00 0.00 C ATOM 641 NZ LYS A 79 -37.655 -5.041 -12.517 1.00 0.00 N ATOM 0 H LYS A 79 -37.327 -6.904 -19.102 1.00 0.00 H new ATOM 0 HA LYS A 79 -37.900 -4.040 -18.405 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -35.466 -5.615 -17.460 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -35.950 -4.004 -16.968 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -38.232 -5.338 -16.299 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -37.099 -6.667 -16.150 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -36.094 -5.767 -14.283 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -36.092 -4.145 -14.946 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -38.145 -3.611 -14.012 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -38.809 -5.208 -14.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -38.481 -4.802 -11.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -37.468 -6.062 -12.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -36.825 -4.515 -12.177 1.00 0.00 H new ATOM 642 N PRO A 80 -35.892 -3.294 -19.848 1.00 0.00 N ATOM 643 CA PRO A 80 -35.024 -2.837 -20.946 1.00 0.00 C ATOM 644 C PRO A 80 -33.580 -3.273 -20.693 1.00 0.00 C ATOM 645 O PRO A 80 -33.003 -2.982 -19.665 1.00 0.00 O ATOM 646 CB PRO A 80 -35.158 -1.312 -20.903 1.00 0.00 C ATOM 647 CG PRO A 80 -35.629 -0.957 -19.474 1.00 0.00 C ATOM 648 CD PRO A 80 -36.279 -2.229 -18.898 1.00 0.00 C ATOM 0 HA PRO A 80 -35.300 -3.250 -21.916 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -34.206 -0.832 -21.129 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -35.875 -0.964 -21.646 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -34.789 -0.637 -18.857 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -36.342 -0.132 -19.494 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -35.917 -2.441 -17.892 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -37.362 -2.128 -18.832 1.00 0.00 H new ATOM 649 N MET A 81 -32.997 -3.979 -21.623 1.00 0.00 N ATOM 650 CA MET A 81 -31.596 -4.448 -21.438 1.00 0.00 C ATOM 651 C MET A 81 -30.659 -3.254 -21.252 1.00 0.00 C ATOM 652 O MET A 81 -30.077 -2.757 -22.196 1.00 0.00 O ATOM 653 CB MET A 81 -31.159 -5.248 -22.667 1.00 0.00 C ATOM 654 CG MET A 81 -32.059 -6.475 -22.820 1.00 0.00 C ATOM 655 SD MET A 81 -31.038 -7.968 -22.854 1.00 0.00 S ATOM 656 CE MET A 81 -30.311 -7.777 -21.208 1.00 0.00 C ATOM 0 H MET A 81 -33.432 -4.251 -22.504 1.00 0.00 H new ATOM 0 HA MET A 81 -31.549 -5.079 -20.551 1.00 0.00 H new ATOM 0 HB2 MET A 81 -31.219 -4.626 -23.560 1.00 0.00 H new ATOM 0 HB3 MET A 81 -30.119 -5.557 -22.563 1.00 0.00 H new ATOM 0 HG2 MET A 81 -32.768 -6.525 -21.994 1.00 0.00 H new ATOM 0 HG3 MET A 81 -32.643 -6.399 -23.737 1.00 0.00 H new ATOM 0 HE1 MET A 81 -29.687 -8.642 -20.983 1.00 0.00 H new ATOM 0 HE2 MET A 81 -29.702 -6.873 -21.182 1.00 0.00 H new ATOM 0 HE3 MET A 81 -31.106 -7.700 -20.466 1.00 0.00 H new ATOM 657 N ARG A 82 -30.490 -2.807 -20.040 1.00 0.00 N ATOM 658 CA ARG A 82 -29.569 -1.665 -19.793 1.00 0.00 C ATOM 659 C ARG A 82 -28.136 -2.189 -19.866 1.00 0.00 C ATOM 660 O ARG A 82 -27.566 -2.601 -18.874 1.00 0.00 O ATOM 661 CB ARG A 82 -29.836 -1.084 -18.402 1.00 0.00 C ATOM 662 CG ARG A 82 -29.399 0.380 -18.365 1.00 0.00 C ATOM 663 CD ARG A 82 -30.501 1.255 -18.962 1.00 0.00 C ATOM 664 NE ARG A 82 -30.170 2.689 -18.737 1.00 0.00 N ATOM 665 CZ ARG A 82 -29.968 3.478 -19.756 1.00 0.00 C ATOM 666 NH1 ARG A 82 -29.176 3.106 -20.723 1.00 0.00 N ATOM 667 NH2 ARG A 82 -30.560 4.640 -19.807 1.00 0.00 N ATOM 0 H ARG A 82 -30.949 -3.183 -19.211 1.00 0.00 H new ATOM 0 HA ARG A 82 -29.724 -0.883 -20.536 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -30.896 -1.164 -18.161 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -29.294 -1.655 -17.648 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -29.194 0.684 -17.338 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -28.473 0.509 -18.926 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -30.600 1.056 -20.029 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -31.460 1.015 -18.503 1.00 0.00 H new ATOM 0 HE ARG A 82 -30.101 3.054 -17.787 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -28.714 2.198 -20.683 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -29.019 3.724 -21.519 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -31.180 4.930 -19.051 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -30.403 5.258 -20.603 1.00 0.00 H new ATOM 668 N ILE A 83 -27.554 -2.203 -21.034 1.00 0.00 N ATOM 669 CA ILE A 83 -26.171 -2.733 -21.161 1.00 0.00 C ATOM 670 C ILE A 83 -25.159 -1.604 -21.019 1.00 0.00 C ATOM 671 O ILE A 83 -25.356 -0.503 -21.491 1.00 0.00 O ATOM 672 CB ILE A 83 -25.990 -3.392 -22.527 1.00 0.00 C ATOM 673 CG1 ILE A 83 -27.239 -4.201 -22.880 1.00 0.00 C ATOM 674 CG2 ILE A 83 -24.777 -4.326 -22.486 1.00 0.00 C ATOM 675 CD1 ILE A 83 -27.366 -4.290 -24.398 1.00 0.00 C ATOM 0 H ILE A 83 -27.976 -1.871 -21.901 1.00 0.00 H new ATOM 0 HA ILE A 83 -26.009 -3.468 -20.372 1.00 0.00 H new ATOM 0 HB ILE A 83 -25.834 -2.620 -23.280 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -27.174 -5.200 -22.449 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -28.125 -3.728 -22.456 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -24.647 -4.797 -23.461 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -23.884 -3.752 -22.238 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -24.935 -5.095 -21.730 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -28.255 -4.866 -24.656 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -27.450 -3.287 -24.816 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -26.484 -4.781 -24.809 1.00 0.00 H new ATOM 676 N GLN A 84 -24.063 -1.892 -20.383 1.00 0.00 N ATOM 677 CA GLN A 84 -22.994 -0.876 -20.206 1.00 0.00 C ATOM 678 C GLN A 84 -21.685 -1.632 -20.039 1.00 0.00 C ATOM 679 O GLN A 84 -21.474 -2.294 -19.042 1.00 0.00 O ATOM 680 CB GLN A 84 -23.240 0.002 -18.965 1.00 0.00 C ATOM 681 CG GLN A 84 -24.519 -0.418 -18.229 1.00 0.00 C ATOM 682 CD GLN A 84 -24.213 -1.580 -17.285 1.00 0.00 C ATOM 683 OE1 GLN A 84 -24.875 -2.698 -17.412 1.00 0.00 O flip ATOM 684 NE2 GLN A 84 -23.367 -1.469 -16.419 1.00 0.00 N flip ATOM 0 H GLN A 84 -23.859 -2.803 -19.972 1.00 0.00 H new ATOM 0 HA GLN A 84 -22.974 -0.213 -21.071 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -22.388 -0.073 -18.289 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -23.317 1.047 -19.266 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -24.919 0.425 -17.666 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -25.284 -0.713 -18.948 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -22.850 -0.595 -16.320 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -23.174 -2.250 -15.791 1.00 0.00 H new ATOM 685 N TYR A 85 -20.826 -1.562 -21.024 1.00 0.00 N ATOM 686 CA TYR A 85 -19.523 -2.297 -20.965 1.00 0.00 C ATOM 687 C TYR A 85 -19.064 -2.437 -19.510 1.00 0.00 C ATOM 688 O TYR A 85 -19.099 -1.495 -18.744 1.00 0.00 O ATOM 689 CB TYR A 85 -18.477 -1.546 -21.781 1.00 0.00 C ATOM 690 CG TYR A 85 -18.950 -1.429 -23.216 1.00 0.00 C ATOM 691 CD1 TYR A 85 -19.737 -0.336 -23.607 1.00 0.00 C ATOM 692 CD2 TYR A 85 -18.582 -2.397 -24.167 1.00 0.00 C ATOM 693 CE1 TYR A 85 -20.142 -0.201 -24.930 1.00 0.00 C ATOM 694 CE2 TYR A 85 -19.004 -2.271 -25.494 1.00 0.00 C ATOM 695 CZ TYR A 85 -19.780 -1.166 -25.879 1.00 0.00 C ATOM 696 OH TYR A 85 -20.180 -1.018 -27.190 1.00 0.00 O ATOM 0 H TYR A 85 -20.972 -1.021 -21.876 1.00 0.00 H new ATOM 0 HA TYR A 85 -19.652 -3.295 -21.384 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -18.312 -0.555 -21.358 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -17.523 -2.072 -21.742 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -20.030 0.404 -22.877 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.973 -3.239 -23.872 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -20.737 0.650 -25.227 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -18.734 -3.022 -26.221 1.00 0.00 H new ATOM 0 HH TYR A 85 -19.695 -0.271 -27.598 1.00 0.00 H new ATOM 697 N ALA A 86 -18.664 -3.616 -19.119 1.00 0.00 N ATOM 698 CA ALA A 86 -18.238 -3.834 -17.713 1.00 0.00 C ATOM 699 C ALA A 86 -16.973 -3.060 -17.419 1.00 0.00 C ATOM 700 O ALA A 86 -16.192 -2.752 -18.299 1.00 0.00 O ATOM 701 CB ALA A 86 -17.981 -5.325 -17.491 1.00 0.00 C ATOM 0 H ALA A 86 -18.615 -4.440 -19.718 1.00 0.00 H new ATOM 0 HA ALA A 86 -19.027 -3.486 -17.046 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -17.668 -5.491 -16.460 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -18.895 -5.885 -17.687 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -17.196 -5.664 -18.167 1.00 0.00 H new ATOM 702 N LYS A 87 -16.742 -2.783 -16.171 1.00 0.00 N ATOM 703 CA LYS A 87 -15.504 -2.076 -15.787 1.00 0.00 C ATOM 704 C LYS A 87 -14.428 -3.140 -15.598 1.00 0.00 C ATOM 705 O LYS A 87 -13.570 -3.030 -14.745 1.00 0.00 O ATOM 706 CB LYS A 87 -15.723 -1.314 -14.477 1.00 0.00 C ATOM 707 CG LYS A 87 -15.918 -2.308 -13.331 1.00 0.00 C ATOM 708 CD LYS A 87 -16.974 -1.771 -12.362 1.00 0.00 C ATOM 709 CE LYS A 87 -18.317 -2.453 -12.633 1.00 0.00 C ATOM 710 NZ LYS A 87 -19.123 -1.609 -13.562 1.00 0.00 N ATOM 0 H LYS A 87 -17.364 -3.019 -15.398 1.00 0.00 H new ATOM 0 HA LYS A 87 -15.211 -1.355 -16.551 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.868 -0.670 -14.272 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -16.596 -0.667 -14.563 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.229 -3.276 -13.724 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -14.975 -2.465 -12.807 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -16.664 -1.953 -11.333 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -17.073 -0.692 -12.479 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -18.155 -3.439 -13.068 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -18.857 -2.602 -11.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -20.007 -2.102 -13.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -19.345 -0.703 -13.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -18.579 -1.433 -14.431 1.00 0.00 H new ATOM 711 N THR A 88 -14.493 -4.184 -16.394 1.00 0.00 N ATOM 712 CA THR A 88 -13.519 -5.288 -16.295 1.00 0.00 C ATOM 713 C THR A 88 -13.948 -6.244 -15.183 1.00 0.00 C ATOM 714 O THR A 88 -13.606 -6.071 -14.030 1.00 0.00 O ATOM 715 CB THR A 88 -12.147 -4.727 -15.991 1.00 0.00 C ATOM 716 OG1 THR A 88 -11.934 -3.551 -16.761 1.00 0.00 O ATOM 717 CG2 THR A 88 -11.101 -5.775 -16.345 1.00 0.00 C ATOM 0 H THR A 88 -15.200 -4.307 -17.119 1.00 0.00 H new ATOM 0 HA THR A 88 -13.482 -5.829 -17.240 1.00 0.00 H new ATOM 0 HB THR A 88 -12.071 -4.475 -14.933 1.00 0.00 H new ATOM 0 HG1 THR A 88 -11.046 -3.187 -16.563 1.00 0.00 H new ATOM 0 HG21 THR A 88 -10.107 -5.383 -16.131 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.272 -6.674 -15.753 1.00 0.00 H new ATOM 0 HG23 THR A 88 -11.174 -6.019 -17.405 1.00 0.00 H new ATOM 718 N ASP A 89 -14.702 -7.252 -15.523 1.00 0.00 N ATOM 719 CA ASP A 89 -15.165 -8.219 -14.494 1.00 0.00 C ATOM 720 C ASP A 89 -14.488 -9.570 -14.720 1.00 0.00 C ATOM 721 O ASP A 89 -14.895 -10.578 -14.179 1.00 0.00 O ATOM 722 CB ASP A 89 -16.675 -8.389 -14.611 1.00 0.00 C ATOM 723 CG ASP A 89 -17.374 -7.117 -14.128 1.00 0.00 C ATOM 724 OD1 ASP A 89 -17.630 -7.021 -12.938 1.00 0.00 O ATOM 725 OD2 ASP A 89 -17.639 -6.261 -14.954 1.00 0.00 O ATOM 0 H ASP A 89 -15.018 -7.447 -16.473 1.00 0.00 H new ATOM 0 HA ASP A 89 -14.910 -7.846 -13.502 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -16.949 -8.596 -15.646 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -17.002 -9.243 -14.018 1.00 0.00 H new ATOM 726 N SER A 90 -13.463 -9.598 -15.518 1.00 0.00 N ATOM 727 CA SER A 90 -12.761 -10.886 -15.782 1.00 0.00 C ATOM 728 C SER A 90 -12.408 -11.550 -14.451 1.00 0.00 C ATOM 729 O SER A 90 -12.467 -12.755 -14.313 1.00 0.00 O ATOM 730 CB SER A 90 -11.485 -10.623 -16.583 1.00 0.00 C ATOM 731 OG SER A 90 -10.984 -11.855 -17.086 1.00 0.00 O ATOM 0 H SER A 90 -13.078 -8.786 -16.001 1.00 0.00 H new ATOM 0 HA SER A 90 -13.412 -11.545 -16.356 1.00 0.00 H new ATOM 0 HB2 SER A 90 -11.693 -9.939 -17.406 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.737 -10.144 -15.951 1.00 0.00 H new ATOM 0 HG SER A 90 -10.167 -11.690 -17.601 1.00 0.00 H new ATOM 732 N ASP A 91 -12.056 -10.780 -13.459 1.00 0.00 N ATOM 733 CA ASP A 91 -11.728 -11.389 -12.142 1.00 0.00 C ATOM 734 C ASP A 91 -12.970 -12.130 -11.652 1.00 0.00 C ATOM 735 O ASP A 91 -12.902 -13.237 -11.150 1.00 0.00 O ATOM 736 CB ASP A 91 -11.354 -10.291 -11.144 1.00 0.00 C ATOM 737 CG ASP A 91 -9.988 -10.603 -10.529 1.00 0.00 C ATOM 738 OD1 ASP A 91 -9.739 -11.761 -10.240 1.00 0.00 O ATOM 739 OD2 ASP A 91 -9.213 -9.676 -10.356 1.00 0.00 O ATOM 0 H ASP A 91 -11.982 -9.764 -13.503 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.885 -12.074 -12.236 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.326 -9.323 -11.645 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.110 -10.223 -10.362 1.00 0.00 H new ATOM 740 N ILE A 92 -14.113 -11.525 -11.816 1.00 0.00 N ATOM 741 CA ILE A 92 -15.370 -12.165 -11.394 1.00 0.00 C ATOM 742 C ILE A 92 -15.566 -13.452 -12.196 1.00 0.00 C ATOM 743 O ILE A 92 -16.205 -14.383 -11.749 1.00 0.00 O ATOM 744 CB ILE A 92 -16.514 -11.204 -11.682 1.00 0.00 C ATOM 745 CG1 ILE A 92 -16.478 -10.042 -10.691 1.00 0.00 C ATOM 746 CG2 ILE A 92 -17.833 -11.943 -11.548 1.00 0.00 C ATOM 747 CD1 ILE A 92 -17.495 -8.983 -11.120 1.00 0.00 C ATOM 0 H ILE A 92 -14.221 -10.600 -12.232 1.00 0.00 H new ATOM 0 HA ILE A 92 -15.342 -12.404 -10.331 1.00 0.00 H new ATOM 0 HB ILE A 92 -16.412 -10.813 -12.694 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -16.707 -10.398 -9.687 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -15.478 -9.610 -10.655 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -18.656 -11.259 -11.753 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -17.861 -12.769 -12.259 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -17.930 -12.333 -10.535 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -17.473 -8.151 -10.416 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -17.245 -8.621 -12.117 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -18.493 -9.421 -11.133 1.00 0.00 H new ATOM 748 N ILE A 93 -14.999 -13.522 -13.373 1.00 0.00 N ATOM 749 CA ILE A 93 -15.136 -14.754 -14.181 1.00 0.00 C ATOM 750 C ILE A 93 -14.382 -15.843 -13.438 1.00 0.00 C ATOM 751 O ILE A 93 -14.834 -16.965 -13.324 1.00 0.00 O ATOM 752 CB ILE A 93 -14.544 -14.525 -15.584 1.00 0.00 C ATOM 753 CG1 ILE A 93 -15.672 -14.161 -16.554 1.00 0.00 C ATOM 754 CG2 ILE A 93 -13.841 -15.791 -16.084 1.00 0.00 C ATOM 755 CD1 ILE A 93 -15.766 -12.640 -16.686 1.00 0.00 C ATOM 0 H ILE A 93 -14.450 -12.777 -13.802 1.00 0.00 H new ATOM 0 HA ILE A 93 -16.180 -15.037 -14.314 1.00 0.00 H new ATOM 0 HB ILE A 93 -13.817 -13.715 -15.531 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -15.485 -14.610 -17.530 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -16.619 -14.564 -16.194 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -13.429 -15.610 -17.077 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -13.035 -16.054 -15.399 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -14.558 -16.610 -16.132 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -16.569 -12.384 -17.377 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -15.973 -12.202 -15.710 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -14.822 -12.249 -17.066 1.00 0.00 H new ATOM 756 N ALA A 94 -13.243 -15.507 -12.904 1.00 0.00 N ATOM 757 CA ALA A 94 -12.488 -16.519 -12.145 1.00 0.00 C ATOM 758 C ALA A 94 -13.163 -16.692 -10.791 1.00 0.00 C ATOM 759 O ALA A 94 -12.861 -17.606 -10.049 1.00 0.00 O ATOM 760 CB ALA A 94 -11.029 -16.105 -11.977 1.00 0.00 C ATOM 0 H ALA A 94 -12.812 -14.584 -12.963 1.00 0.00 H new ATOM 0 HA ALA A 94 -12.488 -17.465 -12.687 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -10.496 -16.871 -11.413 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.568 -15.990 -12.958 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -10.979 -15.158 -11.440 1.00 0.00 H new ATOM 761 N LYS A 95 -14.105 -15.837 -10.476 1.00 0.00 N ATOM 762 CA LYS A 95 -14.836 -15.979 -9.214 1.00 0.00 C ATOM 763 C LYS A 95 -15.717 -17.192 -9.368 1.00 0.00 C ATOM 764 O LYS A 95 -15.853 -17.991 -8.464 1.00 0.00 O ATOM 765 CB LYS A 95 -15.665 -14.731 -8.935 1.00 0.00 C ATOM 766 CG LYS A 95 -16.037 -14.680 -7.452 1.00 0.00 C ATOM 767 CD LYS A 95 -15.384 -13.457 -6.806 1.00 0.00 C ATOM 768 CE LYS A 95 -13.870 -13.666 -6.731 1.00 0.00 C ATOM 769 NZ LYS A 95 -13.565 -14.750 -5.756 1.00 0.00 N ATOM 0 H LYS A 95 -14.389 -15.046 -11.054 1.00 0.00 H new ATOM 0 HA LYS A 95 -14.156 -16.099 -8.371 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -15.101 -13.839 -9.209 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -16.567 -14.738 -9.546 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -17.120 -14.630 -7.339 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -15.706 -15.590 -6.951 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -15.610 -12.562 -7.386 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -15.790 -13.300 -5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -13.479 -13.927 -7.715 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -13.379 -12.741 -6.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -12.590 -14.641 -5.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -14.225 -14.692 -4.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -13.666 -15.674 -6.222 1.00 0.00 H new ATOM 770 N MET A 96 -16.238 -17.407 -10.552 1.00 0.00 N ATOM 771 CA MET A 96 -17.002 -18.655 -10.766 1.00 0.00 C ATOM 772 C MET A 96 -16.073 -19.779 -10.290 1.00 0.00 C ATOM 773 O MET A 96 -16.518 -20.839 -9.925 1.00 0.00 O ATOM 774 CB MET A 96 -17.326 -18.835 -12.246 1.00 0.00 C ATOM 775 CG MET A 96 -18.572 -18.018 -12.601 1.00 0.00 C ATOM 776 SD MET A 96 -18.187 -16.254 -12.503 1.00 0.00 S ATOM 777 CE MET A 96 -19.748 -15.721 -11.761 1.00 0.00 C ATOM 0 H MET A 96 -16.166 -16.784 -11.356 1.00 0.00 H new ATOM 0 HA MET A 96 -17.951 -18.648 -10.229 1.00 0.00 H new ATOM 0 HB2 MET A 96 -16.482 -18.513 -12.855 1.00 0.00 H new ATOM 0 HB3 MET A 96 -17.495 -19.889 -12.466 1.00 0.00 H new ATOM 0 HG2 MET A 96 -18.912 -18.271 -13.605 1.00 0.00 H new ATOM 0 HG3 MET A 96 -19.386 -18.262 -11.918 1.00 0.00 H new ATOM 0 HE1 MET A 96 -19.911 -14.665 -11.976 1.00 0.00 H new ATOM 0 HE2 MET A 96 -20.568 -16.307 -12.178 1.00 0.00 H new ATOM 0 HE3 MET A 96 -19.708 -15.870 -10.682 1.00 0.00 H new ATOM 778 N LYS A 97 -14.774 -19.470 -10.267 1.00 0.00 N ATOM 779 CA LYS A 97 -13.692 -20.374 -9.780 1.00 0.00 C ATOM 780 C LYS A 97 -14.077 -21.820 -9.830 1.00 0.00 C ATOM 781 O LYS A 97 -13.544 -22.592 -10.601 1.00 0.00 O ATOM 782 CB LYS A 97 -13.376 -19.967 -8.349 1.00 0.00 C ATOM 783 CG LYS A 97 -12.185 -20.771 -7.822 1.00 0.00 C ATOM 784 CD LYS A 97 -11.042 -20.715 -8.833 1.00 0.00 C ATOM 785 CE LYS A 97 -11.126 -21.927 -9.759 1.00 0.00 C ATOM 786 NZ LYS A 97 -9.751 -22.362 -10.135 1.00 0.00 N ATOM 0 H LYS A 97 -14.422 -18.569 -10.590 1.00 0.00 H new ATOM 0 HA LYS A 97 -12.824 -20.271 -10.431 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.152 -18.901 -8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -14.247 -20.135 -7.715 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -11.857 -20.368 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -12.480 -21.806 -7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -11.100 -19.795 -9.414 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.083 -20.705 -8.315 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -11.653 -22.741 -9.262 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -11.697 -21.676 -10.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.804 -23.034 -10.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.191 -21.534 -10.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.297 -22.822 -9.320 1.00 0.00 H new ATOM 787 N GLY A 98 -14.985 -22.167 -9.001 1.00 0.00 N ATOM 788 CA GLY A 98 -15.486 -23.583 -8.938 1.00 0.00 C ATOM 789 C GLY A 98 -15.374 -24.214 -10.332 1.00 0.00 C ATOM 790 O GLY A 98 -15.037 -25.370 -10.485 1.00 0.00 O ATOM 0 H GLY A 98 -15.427 -21.531 -8.338 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -14.904 -24.157 -8.217 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.522 -23.601 -8.598 1.00 0.00 H new ATOM 791 N THR A 99 -15.607 -23.423 -11.347 1.00 0.00 N ATOM 792 CA THR A 99 -15.468 -23.914 -12.745 1.00 0.00 C ATOM 793 C THR A 99 -14.162 -23.344 -13.313 1.00 0.00 C ATOM 794 O THR A 99 -13.449 -24.004 -14.042 1.00 0.00 O ATOM 795 CB THR A 99 -16.650 -23.429 -13.583 1.00 0.00 C ATOM 796 OG1 THR A 99 -16.266 -23.356 -14.949 1.00 0.00 O ATOM 797 CG2 THR A 99 -17.076 -22.046 -13.095 1.00 0.00 C ATOM 0 H THR A 99 -15.891 -22.447 -11.263 1.00 0.00 H new ATOM 0 HA THR A 99 -15.451 -25.004 -12.767 1.00 0.00 H new ATOM 0 HB THR A 99 -17.483 -24.125 -13.481 1.00 0.00 H new ATOM 0 HG1 THR A 99 -17.025 -23.046 -15.486 1.00 0.00 H new ATOM 0 HG21 THR A 99 -17.919 -21.694 -13.689 1.00 0.00 H new ATOM 0 HG22 THR A 99 -17.370 -22.105 -12.047 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.243 -21.351 -13.200 1.00 0.00 H new ATOM 798 N PHE A 100 -13.832 -22.123 -12.957 1.00 0.00 N ATOM 799 CA PHE A 100 -12.560 -21.516 -13.449 1.00 0.00 C ATOM 800 C PHE A 100 -11.406 -22.444 -13.075 1.00 0.00 C ATOM 801 O PHE A 100 -11.459 -23.137 -12.079 1.00 0.00 O ATOM 802 CB PHE A 100 -12.340 -20.149 -12.792 1.00 0.00 C ATOM 803 CG PHE A 100 -11.539 -19.278 -13.729 1.00 0.00 C ATOM 804 CD1 PHE A 100 -12.161 -18.666 -14.822 1.00 0.00 C ATOM 805 CD2 PHE A 100 -10.170 -19.085 -13.504 1.00 0.00 C ATOM 806 CE1 PHE A 100 -11.416 -17.861 -15.692 1.00 0.00 C ATOM 807 CE2 PHE A 100 -9.424 -18.282 -14.375 1.00 0.00 C ATOM 808 CZ PHE A 100 -10.048 -17.670 -15.467 1.00 0.00 C ATOM 0 H PHE A 100 -14.390 -21.525 -12.348 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.611 -21.384 -14.530 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -13.298 -19.680 -12.568 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -11.814 -20.267 -11.845 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -13.217 -18.815 -14.995 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.690 -19.556 -12.659 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -11.896 -17.388 -16.536 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -8.368 -18.135 -14.204 1.00 0.00 H new ATOM 0 HZ PHE A 100 -9.473 -17.049 -16.138 1.00 0.00 H new ATOM 809 N VAL A 101 -10.368 -22.480 -13.858 1.00 0.00 N ATOM 810 CA VAL A 101 -9.235 -23.373 -13.526 1.00 0.00 C ATOM 811 C VAL A 101 -8.126 -22.563 -12.853 1.00 0.00 C ATOM 812 O VAL A 101 -7.764 -21.498 -13.312 1.00 0.00 O ATOM 813 CB VAL A 101 -8.719 -23.989 -14.813 1.00 0.00 C ATOM 814 CG1 VAL A 101 -7.548 -24.921 -14.499 1.00 0.00 C ATOM 815 CG2 VAL A 101 -9.849 -24.780 -15.469 1.00 0.00 C ATOM 0 H VAL A 101 -10.258 -21.931 -14.710 1.00 0.00 H new ATOM 0 HA VAL A 101 -9.559 -24.158 -12.843 1.00 0.00 H new ATOM 0 HB VAL A 101 -8.378 -23.206 -15.490 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -7.177 -25.364 -15.424 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.749 -24.353 -14.022 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -7.882 -25.711 -13.827 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -9.490 -25.228 -16.396 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.183 -25.566 -14.792 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -10.682 -24.111 -15.688 1.00 0.00 H new ATOM 816 N GLU A 102 -7.607 -23.056 -11.757 1.00 0.00 N ATOM 817 CA GLU A 102 -6.540 -22.337 -11.025 1.00 0.00 C ATOM 818 C GLU A 102 -5.625 -21.598 -12.005 1.00 0.00 C ATOM 819 O GLU A 102 -5.293 -20.446 -11.811 1.00 0.00 O ATOM 820 CB GLU A 102 -5.715 -23.339 -10.216 1.00 0.00 C ATOM 821 CG GLU A 102 -5.397 -24.561 -11.079 1.00 0.00 C ATOM 822 CD GLU A 102 -3.909 -24.563 -11.436 1.00 0.00 C ATOM 823 OE1 GLU A 102 -3.479 -23.643 -12.113 1.00 0.00 O ATOM 824 OE2 GLU A 102 -3.223 -25.484 -11.026 1.00 0.00 O ATOM 0 H GLU A 102 -7.888 -23.942 -11.338 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.000 -21.610 -10.356 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -4.791 -22.872 -9.875 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.266 -23.644 -9.326 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -5.654 -25.475 -10.543 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -5.999 -24.544 -11.987 1.00 0.00 H new ATOM 825 N ARG A 103 -5.216 -22.255 -13.054 1.00 0.00 N ATOM 826 CA ARG A 103 -4.322 -21.601 -14.042 1.00 0.00 C ATOM 827 C ARG A 103 -3.854 -22.641 -15.064 1.00 0.00 C ATOM 828 O ARG A 103 -4.526 -23.622 -15.314 1.00 0.00 O ATOM 829 CB ARG A 103 -3.115 -21.019 -13.309 1.00 0.00 C ATOM 830 CG ARG A 103 -2.874 -19.587 -13.781 1.00 0.00 C ATOM 831 CD ARG A 103 -1.405 -19.434 -14.162 1.00 0.00 C ATOM 832 NE ARG A 103 -0.833 -18.243 -13.470 1.00 0.00 N ATOM 833 CZ ARG A 103 -0.493 -18.320 -12.211 1.00 0.00 C ATOM 834 NH1 ARG A 103 0.328 -19.253 -11.815 1.00 0.00 N ATOM 835 NH2 ARG A 103 -0.975 -17.463 -11.350 1.00 0.00 N ATOM 0 H ARG A 103 -5.465 -23.221 -13.268 1.00 0.00 H new ATOM 0 HA ARG A 103 -4.855 -20.803 -14.559 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -3.288 -21.034 -12.233 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -2.232 -21.629 -13.499 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.511 -19.359 -14.636 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -3.135 -18.881 -12.992 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -0.851 -20.330 -13.884 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.308 -19.322 -15.242 1.00 0.00 H new ATOM 0 HE ARG A 103 -0.707 -17.368 -13.980 1.00 0.00 H new ATOM 0 HH11 ARG A 103 0.704 -19.921 -12.488 1.00 0.00 H new ATOM 0 HH12 ARG A 103 0.594 -19.314 -10.832 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -1.617 -16.734 -11.661 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -0.709 -17.523 -10.367 1.00 0.00 H new ATOM 836 N ASP A 104 -2.709 -22.439 -15.656 1.00 0.00 N ATOM 837 CA ASP A 104 -2.207 -23.423 -16.657 1.00 0.00 C ATOM 838 C ASP A 104 -1.409 -24.516 -15.941 1.00 0.00 C ATOM 839 O ASP A 104 -1.594 -24.764 -14.767 1.00 0.00 O ATOM 840 CB ASP A 104 -1.306 -22.709 -17.667 1.00 0.00 C ATOM 841 CG ASP A 104 0.023 -22.347 -17.003 1.00 0.00 C ATOM 842 OD1 ASP A 104 0.928 -23.165 -17.046 1.00 0.00 O ATOM 843 OD2 ASP A 104 0.115 -21.257 -16.461 1.00 0.00 O ATOM 0 H ASP A 104 -2.100 -21.637 -15.491 1.00 0.00 H new ATOM 0 HA ASP A 104 -3.051 -23.873 -17.180 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -1.130 -23.351 -18.530 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -1.797 -21.808 -18.035 1.00 0.00 H new ATOM 844 N ARG A 105 -0.522 -25.172 -16.639 1.00 0.00 N ATOM 845 CA ARG A 105 0.283 -26.245 -15.997 1.00 0.00 C ATOM 846 C ARG A 105 1.720 -26.195 -16.522 1.00 0.00 C ATOM 847 O ARG A 105 2.668 -26.345 -15.777 1.00 0.00 O ATOM 848 CB ARG A 105 -0.331 -27.609 -16.320 1.00 0.00 C ATOM 849 CG ARG A 105 -1.617 -27.794 -15.511 1.00 0.00 C ATOM 850 CD ARG A 105 -1.815 -29.278 -15.195 1.00 0.00 C ATOM 851 NE ARG A 105 -0.840 -29.697 -14.149 1.00 0.00 N ATOM 852 CZ ARG A 105 -0.639 -30.966 -13.915 1.00 0.00 C ATOM 853 NH1 ARG A 105 -1.652 -31.762 -13.709 1.00 0.00 N ATOM 854 NH2 ARG A 105 0.578 -31.439 -13.889 1.00 0.00 N ATOM 0 H ARG A 105 -0.321 -25.010 -17.626 1.00 0.00 H new ATOM 0 HA ARG A 105 0.287 -26.095 -14.917 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -0.546 -27.680 -17.386 1.00 0.00 H new ATOM 0 HB3 ARG A 105 0.377 -28.404 -16.084 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.563 -27.219 -14.587 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -2.470 -27.414 -16.073 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -2.834 -29.455 -14.850 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -1.676 -29.875 -16.097 1.00 0.00 H new ATOM 0 HE ARG A 105 -0.330 -28.993 -13.616 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -2.603 -31.393 -13.731 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -1.493 -32.753 -13.526 1.00 0.00 H new ATOM 0 HH21 ARG A 105 1.370 -30.817 -14.051 1.00 0.00 H new ATOM 0 HH22 ARG A 105 0.736 -32.430 -13.706 1.00 0.00 H new ATOM 855 N LYS A 106 1.890 -25.984 -17.798 1.00 0.00 N ATOM 856 CA LYS A 106 3.267 -25.927 -18.364 1.00 0.00 C ATOM 857 C LYS A 106 3.422 -24.657 -19.201 1.00 0.00 C ATOM 858 O LYS A 106 2.466 -24.138 -19.741 1.00 0.00 O ATOM 859 CB LYS A 106 3.509 -27.153 -19.245 1.00 0.00 C ATOM 860 CG LYS A 106 3.316 -28.424 -18.413 1.00 0.00 C ATOM 861 CD LYS A 106 4.055 -29.586 -19.078 1.00 0.00 C ATOM 862 CE LYS A 106 3.588 -29.725 -20.528 1.00 0.00 C ATOM 863 NZ LYS A 106 2.279 -30.435 -20.564 1.00 0.00 N ATOM 0 H LYS A 106 1.137 -25.849 -18.472 1.00 0.00 H new ATOM 0 HA LYS A 106 3.993 -25.917 -17.551 1.00 0.00 H new ATOM 0 HB2 LYS A 106 2.819 -27.150 -20.089 1.00 0.00 H new ATOM 0 HB3 LYS A 106 4.518 -27.125 -19.657 1.00 0.00 H new ATOM 0 HG2 LYS A 106 3.693 -28.270 -17.402 1.00 0.00 H new ATOM 0 HG3 LYS A 106 2.255 -28.656 -18.325 1.00 0.00 H new ATOM 0 HD2 LYS A 106 5.131 -29.413 -19.046 1.00 0.00 H new ATOM 0 HD3 LYS A 106 3.865 -30.511 -18.533 1.00 0.00 H new ATOM 0 HE2 LYS A 106 3.492 -28.741 -20.986 1.00 0.00 H new ATOM 0 HE3 LYS A 106 4.328 -30.276 -21.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 1.962 -30.529 -21.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 2.385 -31.380 -20.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 1.575 -29.892 -20.024 1.00 0.00 H new ATOM 864 N ARG A 107 4.620 -24.151 -19.307 1.00 0.00 N ATOM 865 CA ARG A 107 4.840 -22.912 -20.105 1.00 0.00 C ATOM 866 C ARG A 107 4.148 -21.737 -19.415 1.00 0.00 C ATOM 867 O ARG A 107 3.030 -21.385 -19.738 1.00 0.00 O ATOM 868 CB ARG A 107 4.263 -23.097 -21.509 1.00 0.00 C ATOM 869 CG ARG A 107 5.399 -23.372 -22.495 1.00 0.00 C ATOM 870 CD ARG A 107 6.301 -22.141 -22.591 1.00 0.00 C ATOM 871 NE ARG A 107 7.721 -22.550 -22.400 1.00 0.00 N ATOM 872 CZ ARG A 107 8.557 -21.749 -21.798 1.00 0.00 C ATOM 873 NH1 ARG A 107 8.214 -21.168 -20.679 1.00 0.00 N ATOM 874 NH2 ARG A 107 9.735 -21.527 -22.313 1.00 0.00 N ATOM 0 H ARG A 107 5.457 -24.543 -18.875 1.00 0.00 H new ATOM 0 HA ARG A 107 5.909 -22.711 -20.180 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.553 -23.924 -21.516 1.00 0.00 H new ATOM 0 HB3 ARG A 107 3.715 -22.204 -21.809 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.978 -24.235 -22.167 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.992 -23.615 -23.476 1.00 0.00 H new ATOM 0 HD2 ARG A 107 6.177 -21.661 -23.562 1.00 0.00 H new ATOM 0 HD3 ARG A 107 6.017 -21.409 -21.835 1.00 0.00 H new ATOM 0 HE ARG A 107 8.040 -23.457 -22.740 1.00 0.00 H new ATOM 0 HH11 ARG A 107 7.293 -21.341 -20.276 1.00 0.00 H new ATOM 0 HH12 ARG A 107 8.867 -20.542 -20.208 1.00 0.00 H new ATOM 0 HH21 ARG A 107 10.003 -21.980 -23.187 1.00 0.00 H new ATOM 0 HH22 ARG A 107 10.388 -20.901 -21.842 1.00 0.00 H new ATOM 875 N GLU A 108 4.801 -21.132 -18.463 1.00 0.00 N ATOM 876 CA GLU A 108 4.182 -19.986 -17.745 1.00 0.00 C ATOM 877 C GLU A 108 4.296 -18.718 -18.597 1.00 0.00 C ATOM 878 O GLU A 108 5.368 -18.184 -18.794 1.00 0.00 O ATOM 879 CB GLU A 108 4.912 -19.776 -16.418 1.00 0.00 C ATOM 880 CG GLU A 108 6.396 -19.520 -16.686 1.00 0.00 C ATOM 881 CD GLU A 108 6.741 -18.077 -16.314 1.00 0.00 C ATOM 882 OE1 GLU A 108 6.061 -17.527 -15.463 1.00 0.00 O ATOM 883 OE2 GLU A 108 7.679 -17.547 -16.886 1.00 0.00 O ATOM 0 H GLU A 108 5.739 -21.383 -18.151 1.00 0.00 H new ATOM 0 HA GLU A 108 3.129 -20.198 -17.559 1.00 0.00 H new ATOM 0 HB2 GLU A 108 4.478 -18.932 -15.882 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.793 -20.653 -15.782 1.00 0.00 H new ATOM 0 HG2 GLU A 108 7.006 -20.212 -16.105 1.00 0.00 H new ATOM 0 HG3 GLU A 108 6.623 -19.700 -17.737 1.00 0.00 H new ATOM 884 N LYS A 109 3.193 -18.231 -19.100 1.00 0.00 N ATOM 885 CA LYS A 109 3.232 -16.996 -19.934 1.00 0.00 C ATOM 886 C LYS A 109 1.994 -16.147 -19.636 1.00 0.00 C ATOM 887 O LYS A 109 1.230 -16.445 -18.739 1.00 0.00 O ATOM 888 CB LYS A 109 3.248 -17.377 -21.417 1.00 0.00 C ATOM 889 CG LYS A 109 1.920 -18.038 -21.791 1.00 0.00 C ATOM 890 CD LYS A 109 2.157 -19.517 -22.097 1.00 0.00 C ATOM 891 CE LYS A 109 2.215 -19.725 -23.612 1.00 0.00 C ATOM 892 NZ LYS A 109 2.845 -18.538 -24.257 1.00 0.00 N ATOM 0 H LYS A 109 2.266 -18.636 -18.969 1.00 0.00 H new ATOM 0 HA LYS A 109 4.131 -16.426 -19.700 1.00 0.00 H new ATOM 0 HB2 LYS A 109 3.409 -16.490 -22.029 1.00 0.00 H new ATOM 0 HB3 LYS A 109 4.075 -18.058 -21.619 1.00 0.00 H new ATOM 0 HG2 LYS A 109 1.207 -17.934 -20.973 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.485 -17.541 -22.658 1.00 0.00 H new ATOM 0 HD2 LYS A 109 3.088 -19.849 -21.638 1.00 0.00 H new ATOM 0 HD3 LYS A 109 1.357 -20.120 -21.667 1.00 0.00 H new ATOM 0 HE2 LYS A 109 2.787 -20.624 -23.844 1.00 0.00 H new ATOM 0 HE3 LYS A 109 1.210 -19.876 -24.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 3.176 -18.795 -25.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.147 -17.771 -24.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.652 -18.219 -23.684 1.00 0.00 H new ATOM 893 N ARG A 110 1.787 -15.094 -20.377 1.00 0.00 N ATOM 894 CA ARG A 110 0.594 -14.233 -20.126 1.00 0.00 C ATOM 895 C ARG A 110 -0.563 -14.694 -21.014 1.00 0.00 C ATOM 896 O ARG A 110 -0.368 -15.120 -22.135 1.00 0.00 O ATOM 897 CB ARG A 110 0.936 -12.777 -20.451 1.00 0.00 C ATOM 898 CG ARG A 110 2.331 -12.445 -19.917 1.00 0.00 C ATOM 899 CD ARG A 110 2.624 -10.961 -20.148 1.00 0.00 C ATOM 900 NE ARG A 110 3.879 -10.584 -19.439 1.00 0.00 N ATOM 901 CZ ARG A 110 4.160 -9.325 -19.236 1.00 0.00 C ATOM 902 NH1 ARG A 110 3.514 -8.400 -19.890 1.00 0.00 N ATOM 903 NH2 ARG A 110 5.089 -8.993 -18.381 1.00 0.00 N ATOM 0 H ARG A 110 2.389 -14.792 -21.143 1.00 0.00 H new ATOM 0 HA ARG A 110 0.304 -14.313 -19.078 1.00 0.00 H new ATOM 0 HB2 ARG A 110 0.901 -12.617 -21.529 1.00 0.00 H new ATOM 0 HB3 ARG A 110 0.197 -12.111 -20.005 1.00 0.00 H new ATOM 0 HG2 ARG A 110 2.390 -12.677 -18.854 1.00 0.00 H new ATOM 0 HG3 ARG A 110 3.080 -13.057 -20.419 1.00 0.00 H new ATOM 0 HD2 ARG A 110 2.723 -10.761 -21.215 1.00 0.00 H new ATOM 0 HD3 ARG A 110 1.793 -10.355 -19.786 1.00 0.00 H new ATOM 0 HE ARG A 110 4.518 -11.309 -19.112 1.00 0.00 H new ATOM 0 HH11 ARG A 110 2.790 -8.660 -20.560 1.00 0.00 H new ATOM 0 HH12 ARG A 110 3.733 -7.416 -19.732 1.00 0.00 H new ATOM 0 HH21 ARG A 110 5.595 -9.717 -17.871 1.00 0.00 H new ATOM 0 HH22 ARG A 110 5.308 -8.010 -18.223 1.00 0.00 H new ATOM 904 N LYS A 111 -1.770 -14.613 -20.521 1.00 0.00 N ATOM 905 CA LYS A 111 -2.938 -15.047 -21.338 1.00 0.00 C ATOM 906 C LYS A 111 -2.866 -14.393 -22.721 1.00 0.00 C ATOM 907 O LYS A 111 -2.263 -13.351 -22.881 1.00 0.00 O ATOM 908 CB LYS A 111 -4.234 -14.622 -20.644 1.00 0.00 C ATOM 909 CG LYS A 111 -4.264 -15.189 -19.222 1.00 0.00 C ATOM 910 CD LYS A 111 -4.375 -14.040 -18.217 1.00 0.00 C ATOM 911 CE LYS A 111 -5.790 -14.003 -17.639 1.00 0.00 C ATOM 912 NZ LYS A 111 -5.974 -12.747 -16.859 1.00 0.00 N ATOM 0 H LYS A 111 -1.997 -14.265 -19.589 1.00 0.00 H new ATOM 0 HA LYS A 111 -2.921 -16.132 -21.446 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.303 -13.535 -20.614 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.095 -14.981 -21.208 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.108 -15.869 -19.108 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.360 -15.768 -19.031 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.647 -14.171 -17.416 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -4.145 -13.093 -18.705 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -6.524 -14.056 -18.443 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -5.956 -14.869 -16.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -6.936 -12.721 -16.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -5.282 -12.715 -16.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.833 -11.927 -17.483 1.00 0.00 H new ATOM 913 N PRO A 112 -3.487 -15.033 -23.681 1.00 0.00 N ATOM 914 CA PRO A 112 -3.521 -14.547 -25.071 1.00 0.00 C ATOM 915 C PRO A 112 -4.566 -13.437 -25.222 1.00 0.00 C ATOM 916 O PRO A 112 -5.569 -13.601 -25.886 1.00 0.00 O ATOM 917 CB PRO A 112 -3.926 -15.786 -25.873 1.00 0.00 C ATOM 918 CG PRO A 112 -4.644 -16.733 -24.881 1.00 0.00 C ATOM 919 CD PRO A 112 -4.208 -16.304 -23.467 1.00 0.00 C ATOM 0 HA PRO A 112 -2.573 -14.121 -25.401 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -4.585 -15.516 -26.698 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -3.052 -16.270 -26.308 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -5.726 -16.661 -24.991 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -4.373 -17.771 -25.072 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -5.067 -16.169 -22.809 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -3.566 -17.053 -23.004 1.00 0.00 H new ATOM 920 N LYS A 113 -4.338 -12.307 -24.610 1.00 0.00 N ATOM 921 CA LYS A 113 -5.316 -11.190 -24.716 1.00 0.00 C ATOM 922 C LYS A 113 -4.587 -9.859 -24.521 1.00 0.00 C ATOM 923 O LYS A 113 -3.628 -9.770 -23.781 1.00 0.00 O ATOM 924 CB LYS A 113 -6.390 -11.349 -23.636 1.00 0.00 C ATOM 925 CG LYS A 113 -7.669 -11.905 -24.265 1.00 0.00 C ATOM 926 CD LYS A 113 -7.957 -13.297 -23.696 1.00 0.00 C ATOM 927 CE LYS A 113 -8.531 -14.190 -24.798 1.00 0.00 C ATOM 928 NZ LYS A 113 -8.914 -15.509 -24.220 1.00 0.00 N ATOM 0 H LYS A 113 -3.515 -12.110 -24.041 1.00 0.00 H new ATOM 0 HA LYS A 113 -5.786 -11.207 -25.699 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -6.036 -12.019 -22.853 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -6.592 -10.387 -23.165 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -8.506 -11.237 -24.062 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -7.560 -11.959 -25.348 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -7.042 -13.735 -23.298 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -8.662 -13.224 -22.868 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -9.400 -13.713 -25.251 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -7.794 -14.328 -25.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -9.304 -16.116 -24.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -8.075 -15.964 -23.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -9.631 -15.369 -23.480 1.00 0.00 H new ATOM 929 N SER A 114 -5.031 -8.825 -25.179 1.00 0.00 N ATOM 930 CA SER A 114 -4.359 -7.503 -25.028 1.00 0.00 C ATOM 931 C SER A 114 -4.788 -6.862 -23.707 1.00 0.00 C ATOM 932 O SER A 114 -5.958 -6.634 -23.469 1.00 0.00 O ATOM 933 CB SER A 114 -4.757 -6.593 -26.190 1.00 0.00 C ATOM 934 OG SER A 114 -4.100 -7.028 -27.374 1.00 0.00 O ATOM 0 H SER A 114 -5.829 -8.837 -25.814 1.00 0.00 H new ATOM 0 HA SER A 114 -3.278 -7.642 -25.030 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.838 -6.615 -26.331 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.486 -5.561 -25.968 1.00 0.00 H new ATOM 0 HG SER A 114 -4.354 -6.448 -28.121 1.00 0.00 H new ATOM 935 N GLN A 115 -3.853 -6.572 -22.845 1.00 0.00 N ATOM 936 CA GLN A 115 -4.210 -5.948 -21.540 1.00 0.00 C ATOM 937 C GLN A 115 -3.607 -4.545 -21.462 1.00 0.00 C ATOM 938 O GLN A 115 -4.240 -3.565 -21.802 1.00 0.00 O ATOM 939 CB GLN A 115 -3.659 -6.805 -20.398 1.00 0.00 C ATOM 940 CG GLN A 115 -4.765 -7.717 -19.862 1.00 0.00 C ATOM 941 CD GLN A 115 -5.463 -8.413 -21.031 1.00 0.00 C ATOM 942 OE1 GLN A 115 -4.943 -9.360 -21.587 1.00 0.00 O ATOM 943 NE2 GLN A 115 -6.627 -7.980 -21.431 1.00 0.00 N ATOM 0 H GLN A 115 -2.857 -6.740 -22.988 1.00 0.00 H new ATOM 0 HA GLN A 115 -5.295 -5.881 -21.454 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -2.819 -7.404 -20.751 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -3.282 -6.166 -19.600 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -4.343 -8.458 -19.183 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -5.486 -7.134 -19.289 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -7.063 -7.185 -20.964 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -7.101 -8.437 -22.211 1.00 0.00 H new ATOM 944 N GLU A 116 -2.384 -4.439 -21.017 1.00 0.00 N ATOM 945 CA GLU A 116 -1.740 -3.099 -20.918 1.00 0.00 C ATOM 946 C GLU A 116 -0.221 -3.269 -20.864 1.00 0.00 C ATOM 947 O GLU A 116 0.470 -2.265 -20.924 1.00 0.00 O ATOM 948 CB GLU A 116 -2.222 -2.392 -19.649 1.00 0.00 C ATOM 949 CG GLU A 116 -1.680 -3.121 -18.418 1.00 0.00 C ATOM 950 CD GLU A 116 -2.840 -3.743 -17.638 1.00 0.00 C ATOM 951 OE1 GLU A 116 -3.502 -4.606 -18.190 1.00 0.00 O ATOM 952 OE2 GLU A 116 -3.046 -3.345 -16.504 1.00 0.00 O ATOM 953 OXT GLU A 116 0.226 -4.400 -20.764 1.00 0.00 O ATOM 0 H GLU A 116 -1.804 -5.223 -20.718 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.008 -2.501 -21.789 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -1.885 -1.355 -19.648 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -3.312 -2.373 -19.623 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -0.976 -3.896 -18.722 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.133 -2.425 -17.782 1.00 0.00 H new TER 954 GLU A 116